diff --git a/src/chilife/MolSys.py b/src/chilife/MolSys.py index d70ae9c..142a43e 100644 --- a/src/chilife/MolSys.py +++ b/src/chilife/MolSys.py @@ -569,9 +569,14 @@ def write_cif(self, filename, use_bio_ccd: bool = True): else: local_ccd[res.resname] = res_to_ccd(res) + # Keep the per-residue CCD view for polymer-link detection in struct_conn emission before + # join_ccd_info flattens it into the CIF table form. + per_res_ccd = local_ccd ccd_list = sorted(local_ccd.keys()) local_ccd = chilife.io.join_ccd_info(ccd_list, local_ccd) + struct_conn_data = chilife.io.struct_conn_from_bonds(self, ccd_data=per_res_ccd) + cif_data = { self.name: { "entry": {"id": self.name}, @@ -659,6 +664,9 @@ def write_cif(self, filename, use_bio_ccd: bool = True): } } + if struct_conn_data is not None: + cif_data[self.name]["struct_conn"] = struct_conn_data + # Delete empty entries del_list = [] for k1, v1 in cif_data[self.name].items(): @@ -929,6 +937,14 @@ def __init__( self.elements = self.atypes self.bfactors = self.bs + # Map to atom index by chain, residue, insertion code, atom name, and altloc code. + self.crina = { + (str(c), str(r), str(i), str(n), str(a)): ii + for ii, (c, r, i, n, a) in enumerate( + zip(self.chains, self.resnums, self.icodes, self.names, self.altLocs) + ) + } + self._bonds = None self._bond_types = None self._bond_mask = np.array([], dtype=bool) @@ -1135,6 +1151,14 @@ def from_cif(cls, file_name): name=name, use_ccd=ccd_data, ) + + # Parse inter-residue bonds from the _struct_conn loop (covale, disulf, metalc). + struct_conn = cif_data.get("struct_conn") + if struct_conn is not None: + sc_bonds, sc_types = chilife.io.parse_struct_conn_bonds(msys, struct_conn) + if len(sc_bonds) > 0: + msys.add_bonds(sc_bonds, bond_type=sc_types) + msys._cif_data = cif_data return msys @@ -2627,6 +2651,11 @@ def struct_to_cif_atom_site(struct): ).tolist() occupancy = np.tile(struct.occupancies.astype(str), n_frames).tolist() B_iso_or_equiv = np.tile(struct.bs.astype(str), n_frames).tolist() + formal_charge = np.tile( + [f"{charge:.0f}" if not np.isnan(charge) else "?" for charge in struct.charges], + n_frames, + ).tolist() + auth_seq_id = np.tile(struct.resnums.astype(str), n_frames).tolist() auth_asym_id = np.tile(struct.chains, n_frames).tolist() pdbx_PDB_model_num = np.concatenate( @@ -2651,11 +2680,12 @@ def struct_to_cif_atom_site(struct): "label_entity_id": label_entity_id, "label_seq_id": label_seq_id, "pdbx_PDB_ins_code": pdbx_PDB_ins_code, - "cartn_x": cartn_x, - "cartn_y": cartn_y, - "cartn_z": cartn_z, + "Cartn_x": cartn_x, + "Cartn_y": cartn_y, + "Cartn_z": cartn_z, "occupancy": occupancy, "B_iso_or_equiv": B_iso_or_equiv, + "pdbx_formal_charge": formal_charge, "auth_seq_id": auth_seq_id, "auth_asym_id": auth_asym_id, "pdbx_PDB_model_num": pdbx_PDB_model_num, diff --git a/src/chilife/Topology.py b/src/chilife/Topology.py index 2853fc0..38c299e 100644 --- a/src/chilife/Topology.py +++ b/src/chilife/Topology.py @@ -422,14 +422,21 @@ def bonds_from_ccd_data(molsys, ccd_data): if "chem_comp" in ccd_data[res.resname]: res_ccd_data = ccd_data[res.resname]["chem_comp"] - if ( - pres := res.previous_residue() - ) is not None and "link type" in res_ccd_data: - link_type = res_ccd_data["link type"] + linkage_key = ( + "type" + if "type" in res_ccd_data + else "link type" + if "link_type" in res_ccd_data + else None + ) + if (pres := res.previous_residue()) is not None and linkage_key: + link_type = res_ccd_data["type"].lower() if link_type in POLYMER_LINKAGE_TYPES: a1, a2, btype, bchiral = POLYMER_LINKAGE_TYPES[link_type] i1 = pres.ix[pres.names == a1].flat[0] i2 = res.ix[res.names == a2].flat[0] + if i1 == 0 and i2 == 1255: + print("break") bonds.append([i1, i2]) bond_types.append(btype) bond_chiral.append(bchiral) @@ -477,4 +484,8 @@ def numpyify_ccd(ccd_data): # Linkage data is atom name of the previous residue followed by atom name of the current residue followed by bond type -POLYMER_LINKAGE_TYPES = {"L-peptide linking": ["C", "N", BondType.SINGLE, "N"]} +POLYMER_LINKAGE_TYPES = { + "l-peptide linking": ["C", "N", BondType.SINGLE, "N"], + "peptide linking": ["C", "N", BondType.SINGLE, "N"], + "d-peptide linking": ["C", "N", BondType.SINGLE, "N"], +} diff --git a/src/chilife/__init__.py b/src/chilife/__init__.py index 63fe186..a0a5aba 100644 --- a/src/chilife/__init__.py +++ b/src/chilife/__init__.py @@ -44,4 +44,4 @@ # SpinLabel = SpinLabel.SpinLabel # dSpinLabel = dSpinLabel.dSpinLabel -__version__ = "1.2.1" +__version__ = "1.2.2" diff --git a/src/chilife/io.py b/src/chilife/io.py index 8988ca7..ee3b383 100644 --- a/src/chilife/io.py +++ b/src/chilife/io.py @@ -38,7 +38,7 @@ from .alignment_methods import local_mx from .IntrinsicLabel import IntrinsicLabel from .MolSys import MolecularSystemBase, MolSys -from .Topology import BondType +from .Topology import BondType, POLYMER_LINKAGE_TYPES from .MolSysIC import MolSysIC from .pdb_utils import parse_connect, sort_pdb @@ -61,6 +61,74 @@ "pdbx_stereo_config", ) +STRUCT_CONN_KEYS = ( + "id", + "conn_type_id", + "pdbx_leaving_atom_flag", + "pdbx_PDB_id", + "ptnr1_label_asym_id", + "ptnr1_label_comp_id", + "ptnr1_label_seq_id", + "ptnr1_label_atom_id", + "pdbx_ptnr1_label_alt_id", + "pdbx_ptnr1_PDB_ins_code", + "pdbx_ptnr1_standard_comp_id", + "ptnr1_symmetry", + "ptnr2_label_asym_id", + "ptnr2_label_comp_id", + "ptnr2_label_seq_id", + "ptnr2_label_atom_id", + "pdbx_ptnr2_label_alt_id", + "pdbx_ptnr2_PDB_ins_code", + "ptnr1_auth_asym_id", + "ptnr1_auth_comp_id", + "ptnr1_auth_seq_id", + "ptnr2_auth_asym_id", + "ptnr2_auth_comp_id", + "ptnr2_auth_seq_id", + "ptnr2_symmetry", + "pdbx_ptnr3_label_atom_id", + "pdbx_ptnr3_label_seq_id", + "pdbx_ptnr3_label_comp_id", + "pdbx_ptnr3_label_asym_id", + "pdbx_ptnr3_label_alt_id", + "pdbx_ptnr3_PDB_ins_code", + "details", + "pdbx_dist_value", + "pdbx_value_order", + "pdbx_role", +) + +# CIF `_struct_conn.conn_type_id` values that are treated as bonds in chiLife. +STRUCT_CONN_BOND_TYPES = ("covale", "disulf", "metalc") + +# Element symbols treated as "non-metals" for picking the `covale` vs `metalc` +# conn_type_id on write. Everything else resolves to `metalc`. +NONMETAL_ELEMENTS = frozenset( + { + "H", + "D", + "C", + "N", + "O", + "P", + "S", + "SE", + "F", + "CL", + "BR", + "I", + "B", + "AT", + "HE", + "NE", + "AR", + "KR", + "XE", + "RN", + } +) + CIF_BOND_TO_XL = { "arom": BondType.AROMATIC, "delo": BondType.DELOCALIZED, @@ -1708,6 +1776,191 @@ def create_ccd_dicts(cif_data): return ccd_data +def parse_struct_conn_bonds(molsys, struct_conn): + """ + Parse the ``_struct_conn`` loop of a cif file into inter-residue bonds on a ``MolSys``. + + Only rows whose ``conn_type_id`` is in :data:`STRUCT_CONN_BOND_TYPES` (``covale``, ``disulf``, + ``metalc``) are kept. Rows whose ``ptnr*_symmetry`` is anything other than ``1_555`` / ``.`` / + ``?`` are skipped (inter-molecular symmetry-mate contacts are not real bonds inside this + asymmetric unit). Rows whose partners cannot be resolved to an atom in ``molsys`` are also + skipped. + + Partners are resolved using the ``auth`` chain/resnum fields (matching + :attr:`MolSys.chains` / :attr:`MolSys.resnums`) together with the insertion code, atom name, + and alternate-location fields (matching :attr:`MolSys.icodes`, :attr:`MolSys.names`, and + :attr:`MolSys.altlocs`). + + Parameters + ---------- + molsys : MolSys + The molecular system the bonds should be resolved against. + struct_conn : dict + ``struct_conn`` sub-dictionary from :func:`~read_cif` (keys map to tuples/lists of values, + or to scalars when the CIF loop only has a single row). + + Returns + ------- + bonds : np.ndarray + ``(N, 2)`` array of atom indices into ``molsys``. Empty when no rows resolve. + bond_types : np.ndarray + ``(N,)`` array of :class:`~chilife.Topology.BondType` values, one per bond. + """ + + conn_types = struct_conn.get("conn_type_id", ()) + n_rows = len(conn_types) + if n_rows == 0: + return np.empty((0, 2), dtype=int), np.empty((0,), dtype=object) + + bonds, bond_types = [], [] + for row in range(n_rows): + ctype = str(conn_types[row]).lower() + if ctype not in STRUCT_CONN_BOND_TYPES: + continue + + collapse_values = (None, ".", "?") + c = struct_conn["ptnr1_auth_asym_id"][row] + r = struct_conn["ptnr1_auth_seq_id"][row] + i = struct_conn["pdbx_ptnr1_PDB_ins_code"][row] + n = struct_conn["ptnr1_label_atom_id"][row] + a = struct_conn["pdbx_ptnr1_label_alt_id"][row] + crina1 = tuple(x if x not in collapse_values else "" for x in (c, r, i, n, a)) + + c = struct_conn["ptnr2_auth_asym_id"][row] + r = struct_conn["ptnr2_auth_seq_id"][row] + i = struct_conn["pdbx_ptnr2_PDB_ins_code"][row] + n = struct_conn["ptnr2_label_atom_id"][row] + a = struct_conn["pdbx_ptnr2_label_alt_id"][row] + crina2 = tuple(x if x not in collapse_values else "" for x in (c, r, i, n, a)) + + i1, i2 = molsys.crina.get(crina1, None), molsys.crina.get(crina2, None) + + if i1 is None or i2 is None: + continue + + order_key = struct_conn["pdbx_value_order"][row] + btype = CIF_BOND_TO_XL.get(order_key, BondType.UNSPECIFIED) + bonds.append(sorted([i1, i2])) + bond_types.append(btype) + + return np.array(bonds, dtype=int), np.array(bond_types, dtype=object) + + +def struct_conn_from_bonds(molsys, ccd_data=None): + """ + Build a cif ``_struct_conn`` loop dict from the inter-residue bonds on a ``MolSys``. + + Only bonds whose two atoms belong to different residues are emitted, and the auto-inferred + polymer peptide link (``C`` -> ``N`` between consecutive residues whose previous residue has a + ``chem_comp.type`` in :data:`chilife.Topology.POLYMER_LINKAGE_TYPES`) is excluded so that a + round-trip through :meth:`MolSys.from_cif` / :meth:`MolSys.write_cif` stays idempotent (the + peptide link is re-inferred on read from the polymer sequence via + :func:`~chilife.Topology.bonds_from_ccd_data`). + + Parameters + ---------- + molsys : MolSys + The molecular system to read bonds from. + ccd_data : dict | None + Per-residue CCD dict keyed by residue name (as consumed by + :func:`~chilife.Topology.bonds_from_ccd_data`) used to look up ``chem_comp.type`` when + deciding whether a bond is an implicit polymer peptide link. Falls back to + ``chilife.bio_ccd`` when not provided. + + Returns + ------- + struct_conn : dict | None + Dict keyed by :data:`STRUCT_CONN_KEYS`, mapping each column name to a list of string values + (one per bond). Returns ``None`` when no inter-residue bonds are present. + """ + if molsys.bonds is None or len(molsys.bonds) == 0: + return None + + counters = {} + rows = defaultdict(list) + for (b1, b2), btype in zip(molsys.bonds, molsys.bond_types): + if molsys.resindices[b1] == molsys.resindices[b2]: + continue + + elif molsys.segindices[b1] == molsys.segindices[b2] and abs(molsys.resnums[b1] - molsys.resnums[b2]) == 1: + continue + + else: + conn_type = _classify_struct_conn(molsys, b1, b2) + counters[conn_type] = counters.get(conn_type, 0) + 1 + bond_id = f"{conn_type}{counters[conn_type]}" + value_order = XL_BOND_TO_CIF.get(btype, "?") + + if value_order in ("metalc", "disulf"): + value_order = "?" + + rows["id"].append(bond_id) + rows["conn_type_id"].append(conn_type) + rows["pdbx_leaving_atom_flag"].append("?") + rows["pdbx_PDB_id"].append("?") + _append_partner(rows, molsys, b1, which=1) + _append_partner(rows, molsys, b2, which=2) + rows["pdbx_ptnr3_label_atom_id"].append("?") + rows["pdbx_ptnr3_label_seq_id"].append("?") + rows["pdbx_ptnr3_label_comp_id"].append("?") + rows["pdbx_ptnr3_label_asym_id"].append("?") + rows["pdbx_ptnr3_label_alt_id"].append("?") + rows["pdbx_ptnr3_PDB_ins_code"].append("?") + rows["details"].append("?") + rows["pdbx_dist_value"].append("?") + rows["pdbx_value_order"].append(value_order) + rows["pdbx_role"].append("?") + + + if not rows["id"]: + return None + + return rows + + +def _classify_struct_conn(molsys, i1, i2): + """Pick the CIF ``conn_type_id`` for the bond between atoms ``i1`` and ``i2``.""" + n1 = str(molsys.names[i1]).strip() + n2 = str(molsys.names[i2]).strip() + r1 = str(molsys.resnames[i1]).strip() + r2 = str(molsys.resnames[i2]).strip() + if r1 == "CYS" and r2 == "CYS" and n1 == "SG" and n2 == "SG": + return "disulf" + + e1 = str(molsys.atypes[i1]).strip().upper() + e2 = str(molsys.atypes[i2]).strip().upper() + if e1 not in NONMETAL_ELEMENTS or e2 not in NONMETAL_ELEMENTS: + return "metalc" + return "covale" + + +def _append_partner(rows, molsys, idx, which): + """Append a single partner's struct_conn fields to ``rows`` for atom index ``idx``.""" + seg = str(molsys.segids[idx]) + chain = str(molsys.chains[idx]) + resname = str(molsys.resnames[idx]) + resnum = str(int(molsys.resnums[idx])) + label_seq = str(int(molsys.resindices[idx]) + 1) + name = str(molsys.names[idx]).strip() + altloc_raw = str(molsys.altlocs[idx]).strip() + altloc = altloc_raw if altloc_raw else "?" + icode_raw = str(molsys.icodes[idx]).strip() + icode = icode_raw if icode_raw else "?" + + rows[f"ptnr{which}_label_asym_id"].append(chain) + rows[f"ptnr{which}_label_comp_id"].append(resname) + rows[f"ptnr{which}_label_seq_id"].append(label_seq) + rows[f"ptnr{which}_label_atom_id"].append(name) + rows[f"pdbx_ptnr{which}_label_alt_id"].append(altloc) + rows[f"pdbx_ptnr{which}_PDB_ins_code"].append(icode) + if which == 1: + rows["pdbx_ptnr1_standard_comp_id"].append("?") + rows[f"ptnr{which}_symmetry"].append("1_555") + rows[f"ptnr{which}_auth_asym_id"].append(chain) + rows[f"ptnr{which}_auth_comp_id"].append(resname) + rows[f"ptnr{which}_auth_seq_id"].append(resnum) + + def write_cif(file_name, cif_data): """ Function to write a CIF file from cif_data as read by :func:`~read_cif` diff --git a/tests/test_MolSys.py b/tests/test_MolSys.py index 390c4f7..9afe617 100644 --- a/tests/test_MolSys.py +++ b/tests/test_MolSys.py @@ -707,5 +707,100 @@ def test_write_sdf(): def test_use_ccd(): mol = MolSys.from_pdb("test_data/7o1o.pdb", use_ccd=chilife.bio_ccd) - assert len(mol.bonds) == 5508 + assert len(mol.bonds) == 5863 assert chilife.BondType.DOUBLE in mol.bond_types + + +def test_from_cif_struct_conn(): + """Inter-residue bonds recorded in `_struct_conn` (metalc in 7o1o) should land on MolSys.""" + mol = MolSys.from_cif("test_data/7o1o.cif") + + def _atom_idx(chain, resnum, atom_name): + matches = np.argwhere( + (mol.chains == chain) + & (mol.resnums == resnum) + & (np.char.strip(mol.names.astype(str)) == atom_name) + ).flatten() + assert len(matches) == 1, f"ambiguous/missing atom {chain} {resnum} {atom_name}" + return int(matches[0]) + + # Expected metalc bonds from tests/test_data/7o1o.cif (ptnr1 -> ptnr2). + expected = [ + (_atom_idx("A", 63, "SG"), _atom_idx("A", 415, "FE2")), + (_atom_idx("A", 67, "SG"), _atom_idx("A", 415, "FE3")), + (_atom_idx("A", 70, "SG"), _atom_idx("A", 415, "FE1")), + (_atom_idx("A", 401, "N"), _atom_idx("A", 402, "FE")), + (_atom_idx("A", 401, "SG"), _atom_idx("A", 402, "FE")), + (_atom_idx("A", 401, "OXT"), _atom_idx("A", 402, "FE")), + (_atom_idx("A", 408, "N"), _atom_idx("A", 415, "FE4")), + (_atom_idx("A", 408, "OXT"), _atom_idx("A", 415, "FE4")), + ] + + bond_set = {tuple(b) for b in mol.bonds.tolist()} + for i1, i2 in expected: + assert tuple((i1, i2)) in bond_set + + +def test_write_cif_emits_struct_conn(): + """An explicit cross-residue bond added to a MolSys shows up in the written _struct_conn loop.""" + mol = MolSys.from_cif("test_data/2jvc.cif") + + i1 = int(np.argwhere(mol.names == "N").flatten()[0]) + i2 = int(np.argwhere(mol.names == "C").flatten()[-1]) + expected_conn = "covale" + + assert mol.resindices[i1] != mol.resindices[i2] + mol.add_bond([i1, i2], bond_type=chilife.BondType.SINGLE) + + mol.write_cif("test_cif_sc.cif") + + with open("test_cif_sc.cif", "r") as f: + content = f.read() + + assert "_struct_conn.id" in content + # Verify the expected conn_type_id shows up on a data line (not a key line). + data_lines = [ + ln + for ln in content.splitlines() + if ln.startswith(expected_conn) and "_struct_conn" not in ln + ] + assert len(data_lines) == 1 + assert data_lines[0] == "covale1 covale ? ? A GLY 1 N ? ? ? 1_555 A GLY 1 A VAL 82 C ? ? 1_555 A VAL 82 ? ? ? ? ? ? ? ? sing ?" + os.remove("test_cif_sc.cif") + + +def test_struct_conn_skips_polymer_link(): + """The auto-inferred polymer peptide C-N bond must not be emitted into _struct_conn.""" + mol = MolSys.from_cif("test_data/2jvc.cif") + mol.write_cif("test_cif_poly.cif") + try: + with open("test_cif_poly.cif", "r") as f: + content = f.read() + # If there are no struct_conn rows at all, the loop should be absent entirely (the + # write_cif `del_list` path drops empty entries). + if "_struct_conn.id" in content: + data_lines = [ + ln + for ln in content.splitlines() + if ( + ln.startswith("covale") + or ln.startswith("disulf") + or ln.startswith("metalc") + ) + and "_struct_conn" not in ln + ] + # Each data line must not be a simple backbone C-N pair between consecutive residues. + for ln in data_lines: + parts = ln.split() + # columns: id conn_type flag pdbxid asym1 comp1 seq1 atom1 alt1 icode1 std sym1 + # asym2 comp2 seq2 atom2 alt2 icode2 auth_a1 auth_c1 auth_s1 + # auth_a2 auth_c2 auth_s2 sym2 ... + atom1, atom2 = parts[7], parts[15] + auth_s1, auth_s2 = int(parts[20]), int(parts[23]) + is_backbone = {atom1, atom2} == {"C", "N"} + is_consecutive = abs(auth_s1 - auth_s2) == 1 + assert not (is_backbone and is_consecutive), ( + f"polymer peptide link leaked into struct_conn: {ln}" + ) + finally: + os.remove("test_cif_poly.cif") diff --git a/tests/test_data/write_cif.cif b/tests/test_data/write_cif.cif index e8c0708..0f8125c 100644 --- a/tests/test_data/write_cif.cif +++ b/tests/test_data/write_cif.cif @@ -1,13679 +1,13680 @@ -data_N -# -_entry.id N -# -loop_ -_atom_type.symbol -C -H -N -O -S -# -loop_ -_audit_author.name -_audit_author.pdbx_ordinal -chiLife 1 -'Maxx Tessmer' 2 -'Stefan Stoll' 3 -# -_citation.book_publisher ? -_citation.country US -_citation.id primary -_citation.journal_full 'PLoS Computational Biology' -_citation.journal_id_ISSN 1553-734X -_citation.journal_volume 19 -_citation.journal_issue 3 -_citation.journal_page_first e1010834 -_citation.journal_page_last e1010834 -_citation.title -'chiLife: An open-source Python package for in silico spin labeling and integrative protein modeling' -_citation.year 2023 -# -loop_ -_citation_author.citation_id -_citation_author.name -_citation_author.ordinal -primary 'Maxx Tessmer' 1 -primary 'Stefan Stoll' 2 -# -loop_ -_entity.id -_entity.pdbx_description -_entity.type -1 . polymer -# -loop_ -_entity_poly.entity_id -_entity_poly.pdbx_strand_id -_entity_poly.pdbx_type -1 A1 polypeptide -# -loop_ -_entity_poly_seq.entity_id -_entity_poly_seq.hetero -_entity_poly_seq.mon_id -_entity_poly_seq.num -1 n GLY 1 -1 n PRO 2 -1 n LEU 3 -1 n GLY 4 -1 n SER 5 -1 n MET 6 -1 n GLN 7 -1 n ILE 8 -1 n PHE 9 -1 n VAL 10 -1 n LYS 11 -1 n THR 12 -1 n LEU 13 -1 n THR 14 -1 n GLY 15 -1 n LYS 16 -1 n THR 17 -1 n ILE 18 -1 n THR 19 -1 n ILE 20 -1 n ASP 21 -1 n VAL 22 -1 n ASP 23 -1 n HIS 24 -1 n ALA 25 -1 n ASP 26 -1 n THR 27 -1 n VAL 28 -1 n GLY 29 -1 n ALA 30 -1 n VAL 31 -1 n LYS 32 -1 n ALA 33 -1 n LYS 34 -1 n ILE 35 -1 n TYR 36 -1 n ASP 37 -1 n LYS 38 -1 n GLU 39 -1 n GLY 40 -1 n ILE 41 -1 n PRO 42 -1 n PRO 43 -1 n ASP 44 -1 n GLN 45 -1 n GLN 46 -1 n ARG 47 -1 n LEU 48 -1 n ILE 49 -1 n PHE 50 -1 n GLY 51 -1 n GLY 52 -1 n LYS 53 -1 n GLN 54 -1 n LEU 55 -1 n GLU 56 -1 n ASP 57 -1 n SER 58 -1 n ASN 59 -1 n ALA 60 -1 n MET 61 -1 n SER 62 -1 n ASP 63 -1 n TYR 64 -1 n ASN 65 -1 n VAL 66 -1 n GLN 67 -1 n LYS 68 -1 n GLU 69 -1 n SER 70 -1 n THR 71 -1 n LEU 72 -1 n HIS 73 -1 n LEU 74 -1 n VAL 75 -1 n LEU 76 -1 n ARG 77 -1 n LEU 78 -1 n ARG 79 -1 n GLY 80 -1 n GLY 81 -1 n VAL 82 -# -_ma_data.content_type model_coordinates -_ma_data.name Model -# -loop_ -_pdbx_poly_seq_scheme.asym_id -_pdbx_poly_seq_scheme.auth_seq_num -_pdbx_poly_seq_scheme.entity_id -_pdbx_poly_seq_scheme.hetero -_pdbx_poly_seq_scheme.mon_id -_pdbx_poly_seq_scheme.pdb_ins_code -_pdbx_poly_seq_scheme.pdb_seq_num -_pdbx_poly_seq_scheme.pdb_strand_id -_pdbx_poly_seq_scheme.seq_id -A1 1 1 n GLY . 1 A1 1 -A1 2 1 n PRO . 2 A1 2 -A1 3 1 n LEU . 3 A1 3 -A1 4 1 n GLY . 4 A1 4 -A1 5 1 n SER . 5 A1 5 -A1 6 1 n MET . 6 A1 6 -A1 7 1 n GLN . 7 A1 7 -A1 8 1 n ILE . 8 A1 8 -A1 9 1 n PHE . 9 A1 9 -A1 10 1 n VAL . 10 A1 10 -A1 11 1 n LYS . 11 A1 11 -A1 12 1 n THR . 12 A1 12 -A1 13 1 n LEU . 13 A1 13 -A1 14 1 n THR . 14 A1 14 -A1 15 1 n GLY . 15 A1 15 -A1 16 1 n LYS . 16 A1 16 -A1 17 1 n THR . 17 A1 17 -A1 18 1 n ILE . 18 A1 18 -A1 19 1 n THR . 19 A1 19 -A1 20 1 n ILE . 20 A1 20 -A1 21 1 n ASP . 21 A1 21 -A1 22 1 n VAL . 22 A1 22 -A1 23 1 n ASP . 23 A1 23 -A1 24 1 n HIS . 24 A1 24 -A1 25 1 n ALA . 25 A1 25 -A1 26 1 n ASP . 26 A1 26 -A1 27 1 n THR . 27 A1 27 -A1 28 1 n VAL . 28 A1 28 -A1 29 1 n GLY . 29 A1 29 -A1 30 1 n ALA . 30 A1 30 -A1 31 1 n VAL . 31 A1 31 -A1 32 1 n LYS . 32 A1 32 -A1 33 1 n ALA . 33 A1 33 -A1 34 1 n LYS . 34 A1 34 -A1 35 1 n ILE . 35 A1 35 -A1 36 1 n TYR . 36 A1 36 -A1 37 1 n ASP . 37 A1 37 -A1 38 1 n LYS . 38 A1 38 -A1 39 1 n GLU . 39 A1 39 -A1 40 1 n GLY . 40 A1 40 -A1 41 1 n ILE . 41 A1 41 -A1 42 1 n PRO . 42 A1 42 -A1 43 1 n PRO . 43 A1 43 -A1 44 1 n ASP . 44 A1 44 -A1 45 1 n GLN . 45 A1 45 -A1 46 1 n GLN . 46 A1 46 -A1 47 1 n ARG . 47 A1 47 -A1 48 1 n LEU . 48 A1 48 -A1 49 1 n ILE . 49 A1 49 -A1 50 1 n PHE . 50 A1 50 -A1 51 1 n GLY . 51 A1 51 -A1 52 1 n GLY . 52 A1 52 -A1 53 1 n LYS . 53 A1 53 -A1 54 1 n GLN . 54 A1 54 -A1 55 1 n LEU . 55 A1 55 -A1 56 1 n GLU . 56 A1 56 -A1 57 1 n ASP . 57 A1 57 -A1 58 1 n SER . 58 A1 58 -A1 59 1 n ASN . 59 A1 59 -A1 60 1 n ALA . 60 A1 60 -A1 61 1 n MET . 61 A1 61 -A1 62 1 n SER . 62 A1 62 -A1 63 1 n ASP . 63 A1 63 -A1 64 1 n TYR . 64 A1 64 -A1 65 1 n ASN . 65 A1 65 -A1 66 1 n VAL . 66 A1 66 -A1 67 1 n GLN . 67 A1 67 -A1 68 1 n LYS . 68 A1 68 -A1 69 1 n GLU . 69 A1 69 -A1 70 1 n SER . 70 A1 70 -A1 71 1 n THR . 71 A1 71 -A1 72 1 n LEU . 72 A1 72 -A1 73 1 n HIS . 73 A1 73 -A1 74 1 n LEU . 74 A1 74 -A1 75 1 n VAL . 75 A1 75 -A1 76 1 n LEU . 76 A1 76 -A1 77 1 n ARG . 77 A1 77 -A1 78 1 n LEU . 78 A1 78 -A1 79 1 n ARG . 79 A1 79 -A1 80 1 n GLY . 80 A1 80 -A1 81 1 n GLY . 81 A1 81 -A1 82 1 n VAL . 82 A1 82 -# -_software.classification 'model building' -_software.date 2023-03-31 -_software.description 'Protein modeling' -_software.name chiLife -_software.pdbx_ordinal 1 -_software.type 'python package' -_software.version 1.2.0dev2 -# -loop_ -_struct_asym.entity_id -_struct_asym.id -1 A1 -# -loop_ -_atom_site.group_PDB -_atom_site.id -_atom_site.type_symbol -_atom_site.label_atom_id -_atom_site.label_alt_id -_atom_site.label_comp_id -_atom_site.label_asym_id -_atom_site.label_entity_id -_atom_site.label_seq_id -_atom_site.pdbx_PDB_ins_code -_atom_site.cartn_x -_atom_site.cartn_y -_atom_site.cartn_z -_atom_site.occupancy -_atom_site.B_iso_or_equiv -_atom_site.auth_seq_id -_atom_site.auth_asym_id -_atom_site.pdbx_PDB_model_num -ATOM 1 N N . GLY A1 1 1 ? 1.33 0.0 0.0 1.0 13.0 1 A 1 -ATOM 2 C CA . GLY A1 1 1 ? 2.071 0.001 -1.247 1.0 45.03 1 A 1 -ATOM 3 C C . GLY A1 1 1 ? 1.548 1.028 -2.232 1.0 65.21 1 A 1 -ATOM 4 O O . GLY A1 1 1 ? 0.779 1.922 -1.88 1.0 33.34 1 A 1 -ATOM 5 H H1 . GLY A1 1 1 ? 1.811 -0.001 0.854 1.0 52.4 1 A 1 -ATOM 6 H HA2 . GLY A1 1 1 ? 3.109 0.215 -1.037 1.0 14.15 1 A 1 -ATOM 7 H HA3 . GLY A1 1 1 ? 2.001 -0.979 -1.696 1.0 34.23 1 A 1 -ATOM 8 N N . PRO A1 1 2 ? 1.972 0.907 -3.499 1.0 55.32 2 A 1 -ATOM 9 C CA . PRO A1 1 2 ? 1.554 1.825 -4.564 1.0 21.43 2 A 1 -ATOM 10 C C . PRO A1 1 2 ? 0.085 1.652 -4.934 1.0 41.45 2 A 1 -ATOM 11 O O . PRO A1 1 2 ? -0.585 0.739 -4.451 1.0 62.42 2 A 1 -ATOM 12 C CB . PRO A1 1 2 ? 2.452 1.434 -5.74 1.0 51.45 2 A 1 -ATOM 13 C CG . PRO A1 1 2 ? 2.814 0.012 -5.485 1.0 43.11 2 A 1 -ATOM 14 C CD . PRO A1 1 2 ? 2.889 -0.134 -3.99 1.0 64.14 2 A 1 -ATOM 15 H HA . PRO A1 1 2 ? 1.738 2.855 -4.295 1.0 31.54 2 A 1 -ATOM 16 H HB2 . PRO A1 1 2 ? 1.904 1.543 -6.666 1.0 42.4 2 A 1 -ATOM 17 H HB3 . PRO A1 1 2 ? 3.326 2.068 -5.756 1.0 62.54 2 A 1 -ATOM 18 H HG2 . PRO A1 1 2 ? 2.053 -0.639 -5.888 1.0 3.22 2 A 1 -ATOM 19 H HG3 . PRO A1 1 2 ? 3.773 -0.208 -5.931 1.0 51.14 2 A 1 -ATOM 20 H HD2 . PRO A1 1 2 ? 2.555 -1.116 -3.69 1.0 11.0 2 A 1 -ATOM 21 H HD3 . PRO A1 1 2 ? 3.896 0.046 -3.644 1.0 24.12 2 A 1 -ATOM 22 N N . LEU A1 1 3 ? -0.41 2.535 -5.795 1.0 34.12 3 A 1 -ATOM 23 C CA . LEU A1 1 3 ? -1.801 2.48 -6.231 1.0 54.03 3 A 1 -ATOM 24 C C . LEU A1 1 3 ? -2.068 3.503 -7.331 1.0 63.21 3 A 1 -ATOM 25 O O . LEU A1 1 3 ? -1.295 4.441 -7.521 1.0 11.24 3 A 1 -ATOM 26 C CB . LEU A1 1 3 ? -2.738 2.731 -5.048 1.0 60.12 3 A 1 -ATOM 27 C CG . LEU A1 1 3 ? -3.691 1.589 -4.692 1.0 64.13 3 A 1 -ATOM 28 C CD1 . LEU A1 1 3 ? -3.952 1.559 -3.194 1.0 62.25 3 A 1 -ATOM 29 C CD2 . LEU A1 1 3 ? -4.997 1.725 -5.461 1.0 0.12 3 A 1 -ATOM 30 H H . LEU A1 1 3 ? 0.172 3.24 -6.145 1.0 52.35 3 A 1 -ATOM 31 H HA . LEU A1 1 3 ? -1.987 1.491 -6.623 1.0 43.13 3 A 1 -ATOM 32 H HB2 . LEU A1 1 3 ? -2.128 2.935 -4.181 1.0 74.24 3 A 1 -ATOM 33 H HB3 . LEU A1 1 3 ? -3.335 3.602 -5.279 1.0 72.41 3 A 1 -ATOM 34 H HG . LEU A1 1 3 ? -3.235 0.648 -4.97 1.0 43.5 3 A 1 -ATOM 35 H HD11 . LEU A1 1 3 ? -3.269 2.23 -2.696 1.0 50.45 3 A 1 -ATOM 36 H HD12 . LEU A1 1 3 ? -3.805 0.555 -2.824 1.0 4.34 3 A 1 -ATOM 37 H HD13 . LEU A1 1 3 ? -4.968 1.868 -3.0 1.0 54.42 3 A 1 -ATOM 38 H HD21 . LEU A1 1 3 ? -4.854 1.389 -6.477 1.0 23.33 3 A 1 -ATOM 39 H HD22 . LEU A1 1 3 ? -5.306 2.76 -5.464 1.0 1.01 3 A 1 -ATOM 40 H HD23 . LEU A1 1 3 ? -5.758 1.124 -4.985 1.0 75.24 3 A 1 -ATOM 41 N N . GLY A1 1 4 ? -3.169 3.315 -8.053 1.0 4.21 4 A 1 -ATOM 42 C CA . GLY A1 1 4 ? -3.519 4.23 -9.123 1.0 43.34 4 A 1 -ATOM 43 C C . GLY A1 1 4 ? -4.943 4.041 -9.606 1.0 32.24 4 A 1 -ATOM 44 O O . GLY A1 1 4 ? -5.239 3.091 -10.33 1.0 73.31 4 A 1 -ATOM 45 H H . GLY A1 1 4 ? -3.748 2.549 -7.857 1.0 2.13 4 A 1 -ATOM 46 H HA2 . GLY A1 1 4 ? -3.401 5.243 -8.769 1.0 53.5 4 A 1 -ATOM 47 H HA3 . GLY A1 1 4 ? -2.846 4.07 -9.953 1.0 61.41 4 A 1 -ATOM 48 N N . SER A1 1 5 ? -5.828 4.946 -9.202 1.0 14.33 5 A 1 -ATOM 49 C CA . SER A1 1 5 ? -7.231 4.871 -9.593 1.0 12.42 5 A 1 -ATOM 50 C C . SER A1 1 5 ? -7.919 6.221 -9.411 1.0 43.22 5 A 1 -ATOM 51 O O . SER A1 1 5 ? -7.815 6.846 -8.356 1.0 33.52 5 A 1 -ATOM 52 C CB . SER A1 1 5 ? -7.955 3.803 -8.771 1.0 72.02 5 A 1 -ATOM 53 O OG . SER A1 1 5 ? -7.409 2.518 -9.012 1.0 21.35 5 A 1 -ATOM 54 H H . SER A1 1 5 ? -5.531 5.681 -8.625 1.0 31.12 5 A 1 -ATOM 55 H HA . SER A1 1 5 ? -7.27 4.598 -10.637 1.0 12.32 5 A 1 -ATOM 56 H HB2 . SER A1 1 5 ? -7.857 4.032 -7.721 1.0 41.01 5 A 1 -ATOM 57 H HB3 . SER A1 1 5 ? -9.001 3.793 -9.041 1.0 74.13 5 A 1 -ATOM 58 H HG . SER A1 1 5 ? -7.616 1.939 -8.275 1.0 33.45 5 A 1 -ATOM 59 N N . MET A1 1 6 ? -8.62 6.665 -10.449 1.0 14.01 6 A 1 -ATOM 60 C CA . MET A1 1 6 ? -9.326 7.94 -10.404 1.0 54.33 6 A 1 -ATOM 61 C C . MET A1 1 6 ? -10.558 7.912 -11.304 1.0 31.44 6 A 1 -ATOM 62 O O . MET A1 1 6 ? -10.47 7.561 -12.48 1.0 1.11 6 A 1 -ATOM 63 C CB . MET A1 1 6 ? -8.396 9.078 -10.83 1.0 70.21 6 A 1 -ATOM 64 C CG . MET A1 1 6 ? -7.818 8.9 -12.225 1.0 25.05 6 A 1 -ATOM 65 S SD . MET A1 1 6 ? -6.019 8.776 -12.22 1.0 3.44 6 A 1 -ATOM 66 C CE . MET A1 1 6 ? -5.791 7.175 -11.45 1.0 13.21 6 A 1 -ATOM 67 H H . MET A1 1 6 ? -8.666 6.122 -11.264 1.0 2.32 6 A 1 -ATOM 68 H HA . MET A1 1 6 ? -9.643 8.108 -9.386 1.0 5.22 6 A 1 -ATOM 69 H HB2 . MET A1 1 6 ? -8.948 10.006 -10.808 1.0 62.43 6 A 1 -ATOM 70 H HB3 . MET A1 1 6 ? -7.577 9.139 -10.129 1.0 63.34 6 A 1 -ATOM 71 H HG2 . MET A1 1 6 ? -8.224 7.998 -12.657 1.0 33.13 6 A 1 -ATOM 72 H HG3 . MET A1 1 6 ? -8.105 9.747 -12.829 1.0 12.41 6 A 1 -ATOM 73 H HE1 . MET A1 1 6 ? -5.835 7.283 -10.376 1.0 12.23 6 A 1 -ATOM 74 H HE2 . MET A1 1 6 ? -6.572 6.504 -11.776 1.0 52.54 6 A 1 -ATOM 75 H HE3 . MET A1 1 6 ? -4.83 6.773 -11.733 1.0 2.41 6 A 1 -ATOM 76 N N . GLN A1 1 7 ? -11.704 8.282 -10.742 1.0 13.12 7 A 1 -ATOM 77 C CA . GLN A1 1 7 ? -12.953 8.297 -11.494 1.0 13.2 7 A 1 -ATOM 78 C C . GLN A1 1 7 ? -13.209 9.674 -12.097 1.0 42.42 7 A 1 -ATOM 79 O O . GLN A1 1 7 ? -12.659 10.676 -11.637 1.0 71.33 7 A 1 -ATOM 80 C CB . GLN A1 1 7 ? -14.122 7.898 -10.591 1.0 42.01 7 A 1 -ATOM 81 C CG . GLN A1 1 7 ? -13.784 6.78 -9.618 1.0 12.34 7 A 1 -ATOM 82 C CD . GLN A1 1 7 ? -13.385 7.298 -8.25 1.0 44.31 7 A 1 -ATOM 83 O OE1 . GLN A1 1 7 ? -13.361 8.507 -8.014 1.0 33.44 7 A 1 -ATOM 84 N NE2 . GLN A1 1 7 ? -13.067 6.385 -7.34 1.0 73.32 7 A 1 -ATOM 85 H H . GLN A1 1 7 ? -11.71 8.551 -9.8 1.0 71.21 7 A 1 -ATOM 86 H HA . GLN A1 1 7 ? -12.867 7.578 -12.294 1.0 62.03 7 A 1 -ATOM 87 H HB2 . GLN A1 1 7 ? -14.432 8.761 -10.022 1.0 13.25 7 A 1 -ATOM 88 H HB3 . GLN A1 1 7 ? -14.944 7.57 -11.21 1.0 41.42 7 A 1 -ATOM 89 H HG2 . GLN A1 1 7 ? -14.65 6.144 -9.505 1.0 43.33 7 A 1 -ATOM 90 H HG3 . GLN A1 1 7 ? -12.965 6.204 -10.022 1.0 33.21 7 A 1 -ATOM 91 H HE21 . GLN A1 1 7 ? -13.107 5.44 -7.6 1.0 52.01 7 A 1 -ATOM 92 H HE22 . GLN A1 1 7 ? -12.804 6.691 -6.448 1.0 55.43 7 A 1 -ATOM 93 N N . ILE A1 1 8 ? -14.045 9.717 -13.129 1.0 12.12 8 A 1 -ATOM 94 C CA . ILE A1 1 8 ? -14.374 10.972 -13.794 1.0 64.2 8 A 1 -ATOM 95 C C . ILE A1 1 8 ? -15.883 11.149 -13.919 1.0 0.33 8 A 1 -ATOM 96 O O . ILE A1 1 8 ? -16.637 10.176 -13.9 1.0 11.35 8 A 1 -ATOM 97 C CB . ILE A1 1 8 ? -13.742 11.048 -15.196 1.0 65.34 8 A 1 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.943 9.776 -15.489 1.0 72.33 8 A 1 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.851 12.276 -15.31 1.0 55.24 8 A 1 -ATOM 100 C CD1 . ILE A1 1 8 ? -12.441 9.692 -16.914 1.0 11.02 8 A 1 -ATOM 101 H H . ILE A1 1 8 ? -14.452 8.885 -13.449 1.0 43.45 8 A 1 -ATOM 102 H HA . ILE A1 1 8 ? -13.975 11.779 -13.197 1.0 41.41 8 A 1 -ATOM 103 H HB . ILE A1 1 8 ? -14.536 11.14 -15.921 1.0 13.24 8 A 1 -ATOM 104 H HG12 . ILE A1 1 8 ? -12.088 9.736 -14.834 1.0 4.11 8 A 1 -ATOM 105 H HG13 . ILE A1 1 8 ? -13.571 8.916 -15.307 1.0 33.41 8 A 1 -ATOM 106 H HG21 . ILE A1 1 8 ? -13.465 13.153 -15.455 1.0 12.11 8 A 1 -ATOM 107 H HG22 . ILE A1 1 8 ? -12.274 12.387 -14.405 1.0 14.43 8 A 1 -ATOM 108 H HG23 . ILE A1 1 8 ? -12.184 12.161 -16.151 1.0 53.13 8 A 1 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.638 10.626 -17.42 1.0 4.51 8 A 1 -ATOM 110 H HD12 . ILE A1 1 8 ? -11.378 9.503 -16.911 1.0 22.53 8 A 1 -ATOM 111 H HD13 . ILE A1 1 8 ? -12.949 8.891 -17.429 1.0 32.23 8 A 1 -ATOM 112 N N . PHE A1 1 9 ? -16.318 12.398 -14.048 1.0 44.42 9 A 1 -ATOM 113 C CA . PHE A1 1 9 ? -17.738 12.704 -14.177 1.0 45.42 9 A 1 -ATOM 114 C C . PHE A1 1 9 ? -18.066 13.177 -15.59 1.0 62.05 9 A 1 -ATOM 115 O O . PHE A1 1 9 ? -17.464 14.125 -16.096 1.0 33.13 9 A 1 -ATOM 116 C CB . PHE A1 1 9 ? -18.145 13.774 -13.162 1.0 42.3 9 A 1 -ATOM 117 C CG . PHE A1 1 9 ? -19.027 13.253 -12.063 1.0 44.44 9 A 1 -ATOM 118 C CD1 . PHE A1 1 9 ? -20.265 12.703 -12.353 1.0 24.21 9 A 1 -ATOM 119 C CD2 . PHE A1 1 9 ? -18.618 13.315 -10.741 1.0 24.11 9 A 1 -ATOM 120 C CE1 . PHE A1 1 9 ? -21.078 12.222 -11.344 1.0 54.33 9 A 1 -ATOM 121 C CE2 . PHE A1 1 9 ? -19.427 12.836 -9.728 1.0 62.43 9 A 1 -ATOM 122 C CZ . PHE A1 1 9 ? -20.659 12.29 -10.03 1.0 72.21 9 A 1 -ATOM 123 H H . PHE A1 1 9 ? -15.667 13.132 -14.057 1.0 15.35 9 A 1 -ATOM 124 H HA . PHE A1 1 9 ? -18.29 11.8 -13.975 1.0 72.15 9 A 1 -ATOM 125 H HB2 . PHE A1 1 9 ? -17.256 14.185 -12.707 1.0 13.22 9 A 1 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.679 14.561 -13.674 1.0 20.44 9 A 1 -ATOM 127 H HD1 . PHE A1 1 9 ? -20.594 12.65 -13.381 1.0 63.23 9 A 1 -ATOM 128 H HD2 . PHE A1 1 9 ? -17.655 13.742 -10.503 1.0 43.5 9 A 1 -ATOM 129 H HE1 . PHE A1 1 9 ? -22.041 11.796 -11.584 1.0 53.21 9 A 1 -ATOM 130 H HE2 . PHE A1 1 9 ? -19.097 12.89 -8.701 1.0 61.25 9 A 1 -ATOM 131 H HZ . PHE A1 1 9 ? -21.293 11.914 -9.241 1.0 11.33 9 A 1 -ATOM 132 N N . VAL A1 1 10 ? -19.024 12.509 -16.224 1.0 35.51 10 A 1 -ATOM 133 C CA . VAL A1 1 10 ? -19.434 12.859 -17.578 1.0 51.35 10 A 1 -ATOM 134 C C . VAL A1 1 10 ? -20.874 13.36 -17.605 1.0 20.3 10 A 1 -ATOM 135 O O . VAL A1 1 10 ? -21.771 12.734 -17.041 1.0 33.54 10 A 1 -ATOM 136 C CB . VAL A1 1 10 ? -19.302 11.658 -18.534 1.0 1.24 10 A 1 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.919 12.125 -19.929 1.0 43.55 10 A 1 -ATOM 138 C CG2 . VAL A1 1 10 ? -18.285 10.662 -17.998 1.0 70.41 10 A 1 -ATOM 139 H H . VAL A1 1 10 ? -19.467 11.762 -15.769 1.0 13.11 10 A 1 -ATOM 140 H HA . VAL A1 1 10 ? -18.783 13.646 -17.931 1.0 52.2 10 A 1 -ATOM 141 H HB . VAL A1 1 10 ? -20.261 11.165 -18.594 1.0 21.21 10 A 1 -ATOM 142 H HG11 . VAL A1 1 10 ? -17.843 12.2 -20.001 1.0 75.22 10 A 1 -ATOM 143 H HG12 . VAL A1 1 10 ? -19.281 11.416 -20.659 1.0 54.41 10 A 1 -ATOM 144 H HG13 . VAL A1 1 10 ? -19.359 13.094 -20.118 1.0 61.31 10 A 1 -ATOM 145 H HG21 . VAL A1 1 10 ? -18.694 10.157 -17.136 1.0 13.24 10 A 1 -ATOM 146 H HG22 . VAL A1 1 10 ? -18.055 9.937 -18.764 1.0 62.44 10 A 1 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.383 11.184 -17.715 1.0 2.35 10 A 1 -ATOM 148 N N . LYS A1 1 11 ? -21.089 14.493 -18.265 1.0 23.3 11 A 1 -ATOM 149 C CA . LYS A1 1 11 ? -22.42 15.078 -18.368 1.0 10.31 11 A 1 -ATOM 150 C C . LYS A1 1 11 ? -22.966 14.943 -19.786 1.0 22.12 11 A 1 -ATOM 151 O O . LYS A1 1 11 ? -22.436 15.536 -20.726 1.0 63.21 11 A 1 -ATOM 152 C CB . LYS A1 1 11 ? -22.383 16.554 -17.963 1.0 34.41 11 A 1 -ATOM 153 C CG . LYS A1 1 11 ? -23.659 17.308 -18.297 1.0 63.11 11 A 1 -ATOM 154 C CD . LYS A1 1 11 ? -23.539 18.784 -17.958 1.0 3.15 11 A 1 -ATOM 155 C CE . LYS A1 1 11 ? -23.013 19.586 -19.138 1.0 2.52 11 A 1 -ATOM 156 N NZ . LYS A1 1 11 ? -23.113 21.053 -18.9 1.0 51.12 11 A 1 -ATOM 157 H H . LYS A1 1 11 ? -20.333 14.946 -18.695 1.0 4.15 11 A 1 -ATOM 158 H HA . LYS A1 1 11 ? -23.071 14.544 -17.692 1.0 44.21 11 A 1 -ATOM 159 H HB2 . LYS A1 1 11 ? -22.22 16.618 -16.897 1.0 75.01 11 A 1 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.561 17.034 -18.474 1.0 15.43 11 A 1 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.859 17.208 -19.353 1.0 73.24 11 A 1 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.476 16.883 -17.732 1.0 30.03 11 A 1 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.513 19.163 -17.685 1.0 63.51 11 A 1 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.86 18.899 -17.124 1.0 61.22 11 A 1 -ATOM 165 H HE2 . LYS A1 1 11 ? -21.978 19.327 -19.3 1.0 70.24 11 A 1 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.59 19.332 -20.015 1.0 3.13 11 A 1 -ATOM 167 H HZ1 . LYS A1 1 11 ? -23.763 21.483 -19.589 1.0 1.34 11 A 1 -ATOM 168 H HZ2 . LYS A1 1 11 ? -22.177 21.496 -18.999 1.0 61.44 11 A 1 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.47 21.236 -17.941 1.0 12.11 11 A 1 -ATOM 170 N N . THR A1 1 12 ? -24.03 14.16 -19.933 1.0 60.33 12 A 1 -ATOM 171 C CA . THR A1 1 12 ? -24.648 13.947 -21.236 1.0 63.11 12 A 1 -ATOM 172 C C . THR A1 1 12 ? -25.436 15.175 -21.678 1.0 63.2 12 A 1 -ATOM 173 O O . THR A1 1 12 ? -25.789 16.026 -20.861 1.0 23.14 12 A 1 -ATOM 174 C CB . THR A1 1 12 ? -25.587 12.726 -21.22 1.0 13.53 12 A 1 -ATOM 175 O OG1 . THR A1 1 12 ? -26.7 12.976 -20.353 1.0 44.22 12 A 1 -ATOM 176 C CG2 . THR A1 1 12 ? -24.848 11.48 -20.757 1.0 44.25 12 A 1 -ATOM 177 H H . THR A1 1 12 ? -24.407 13.714 -19.146 1.0 50.31 12 A 1 -ATOM 178 H HA . THR A1 1 12 ? -23.86 13.759 -21.952 1.0 15.31 12 A 1 -ATOM 179 H HB . THR A1 1 12 ? -25.953 12.559 -22.223 1.0 3.11 12 A 1 -ATOM 180 H HG1 . THR A1 1 12 ? -27.49 12.577 -20.724 1.0 54.01 12 A 1 -ATOM 181 H HG21 . THR A1 1 12 ? -25.377 11.034 -19.929 1.0 54.24 12 A 1 -ATOM 182 H HG22 . THR A1 1 12 ? -23.85 11.749 -20.443 1.0 51.32 12 A 1 -ATOM 183 H HG23 . THR A1 1 12 ? -24.79 10.773 -21.571 1.0 74.05 12 A 1 -ATOM 184 N N . LEU A1 1 13 ? -25.709 15.261 -22.975 1.0 74.21 13 A 1 -ATOM 185 C CA . LEU A1 1 13 ? -26.457 16.386 -23.526 1.0 74.52 13 A 1 -ATOM 186 C C . LEU A1 1 13 ? -27.837 16.49 -22.883 1.0 25.21 13 A 1 -ATOM 187 O O . LEU A1 1 13 ? -28.479 17.539 -22.932 1.0 11.35 13 A 1 -ATOM 188 C CB . LEU A1 1 13 ? -26.599 16.236 -25.042 1.0 31.51 13 A 1 -ATOM 189 C CG . LEU A1 1 13 ? -27.097 17.47 -25.795 1.0 30.32 13 A 1 -ATOM 190 C CD1 . LEU A1 1 13 ? -25.937 18.392 -26.134 1.0 44.31 13 A 1 -ATOM 191 C CD2 . LEU A1 1 13 ? -27.842 17.06 -27.057 1.0 64.01 13 A 1 -ATOM 192 H H . LEU A1 1 13 ? -25.402 14.552 -23.577 1.0 42.02 13 A 1 -ATOM 193 H HA . LEU A1 1 13 ? -25.904 17.288 -23.312 1.0 34.1 13 A 1 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.631 15.974 -25.44 1.0 62.11 13 A 1 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.294 15.429 -25.23 1.0 43.21 13 A 1 -ATOM 196 H HG . LEU A1 1 13 ? -27.784 18.016 -25.163 1.0 45.4 13 A 1 -ATOM 197 H HD11 . LEU A1 1 13 ? -25.014 17.833 -26.112 1.0 62.23 13 A 1 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.89 19.193 -25.411 1.0 23.44 13 A 1 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.084 18.808 -27.121 1.0 25.55 13 A 1 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.19 16.043 -26.955 1.0 62.14 13 A 1 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.177 17.13 -27.905 1.0 41.34 13 A 1 -ATOM 202 H HD23 . LEU A1 1 13 ? -28.686 17.717 -27.206 1.0 51.42 13 A 1 -ATOM 203 N N . THR A1 1 14 ? -28.286 15.395 -22.278 1.0 31.41 14 A 1 -ATOM 204 C CA . THR A1 1 14 ? -29.588 15.363 -21.624 1.0 30.33 14 A 1 -ATOM 205 C C . THR A1 1 14 ? -29.474 15.746 -20.153 1.0 22.13 14 A 1 -ATOM 206 O O . THR A1 1 14 ? -30.434 15.623 -19.393 1.0 5.31 14 A 1 -ATOM 207 C CB . THR A1 1 14 ? -30.236 13.97 -21.731 1.0 34.54 14 A 1 -ATOM 208 O OG1 . THR A1 1 14 ? -29.473 13.015 -20.985 1.0 3.22 14 A 1 -ATOM 209 C CG2 . THR A1 1 14 ? -30.331 13.527 -23.183 1.0 34.11 14 A 1 -ATOM 210 H H . THR A1 1 14 ? -27.728 14.589 -22.273 1.0 2.31 14 A 1 -ATOM 211 H HA . THR A1 1 14 ? -30.23 16.075 -22.123 1.0 25.44 14 A 1 -ATOM 212 H HB . THR A1 1 14 ? -31.234 14.021 -21.319 1.0 55.24 14 A 1 -ATOM 213 H HG1 . THR A1 1 14 ? -30.068 12.435 -20.504 1.0 24.42 14 A 1 -ATOM 214 H HG21 . THR A1 1 14 ? -30.887 14.261 -23.747 1.0 1.02 14 A 1 -ATOM 215 H HG22 . THR A1 1 14 ? -30.837 12.574 -23.237 1.0 12.23 14 A 1 -ATOM 216 H HG23 . THR A1 1 14 ? -29.338 13.431 -23.596 1.0 12.42 14 A 1 -ATOM 217 N N . GLY A1 1 15 ? -28.293 16.212 -19.757 1.0 61.2 15 A 1 -ATOM 218 C CA . GLY A1 1 15 ? -28.076 16.607 -18.378 1.0 25.44 15 A 1 -ATOM 219 C C . GLY A1 1 15 ? -28.057 15.422 -17.432 1.0 2.34 15 A 1 -ATOM 220 O O . GLY A1 1 15 ? -28.844 15.36 -16.487 1.0 24.03 15 A 1 -ATOM 221 H H . GLY A1 1 15 ? -27.563 16.288 -20.407 1.0 73.22 15 A 1 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.131 17.125 -18.308 1.0 10.15 15 A 1 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.867 17.279 -18.079 1.0 23.53 15 A 1 -ATOM 224 N N . LYS A1 1 16 ? -27.157 14.478 -17.686 1.0 11.21 16 A 1 -ATOM 225 C CA . LYS A1 1 16 ? -27.038 13.289 -16.851 1.0 34.13 16 A 1 -ATOM 226 C C . LYS A1 1 16 ? -25.614 13.132 -16.327 1.0 15.24 16 A 1 -ATOM 227 O O . LYS A1 1 16 ? -24.664 13.025 -17.102 1.0 50.04 16 A 1 -ATOM 228 C CB . LYS A1 1 16 ? -27.442 12.043 -17.642 1.0 31.42 16 A 1 -ATOM 229 C CG . LYS A1 1 16 ? -28.098 10.969 -16.791 1.0 73.35 16 A 1 -ATOM 230 C CD . LYS A1 1 16 ? -27.069 10.023 -16.195 1.0 50.3 16 A 1 -ATOM 231 C CE . LYS A1 1 16 ? -26.406 9.172 -17.267 1.0 52.44 16 A 1 -ATOM 232 N NZ . LYS A1 1 16 ? -26.843 7.75 -17.196 1.0 2.53 16 A 1 -ATOM 233 H H . LYS A1 1 16 ? -26.557 14.584 -18.454 1.0 52.54 16 A 1 -ATOM 234 H HA . LYS A1 1 16 ? -27.707 13.405 -16.012 1.0 34.34 16 A 1 -ATOM 235 H HB2 . LYS A1 1 16 ? -28.136 12.332 -18.417 1.0 44.24 16 A 1 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.559 11.62 -18.1 1.0 12.13 16 A 1 -ATOM 237 H HG2 . LYS A1 1 16 ? -28.645 11.441 -15.989 1.0 3.41 16 A 1 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.78 10.401 -17.408 1.0 74.14 16 A 1 -ATOM 239 H HD2 . LYS A1 1 16 ? -26.31 10.603 -15.691 1.0 63.23 16 A 1 -ATOM 240 H HD3 . LYS A1 1 16 ? -27.559 9.373 -15.484 1.0 14.51 16 A 1 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.666 9.571 -18.236 1.0 44.12 16 A 1 -ATOM 242 H HE3 . LYS A1 1 16 ? -25.335 9.219 -17.134 1.0 75.31 16 A 1 -ATOM 243 H HZ1 . LYS A1 1 16 ? -27.802 7.691 -16.798 1.0 61.55 16 A 1 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.194 7.208 -16.591 1.0 23.15 16 A 1 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.846 7.329 -18.146 1.0 43.23 16 A 1 -ATOM 246 N N . THR A1 1 17 ? -25.473 13.118 -15.005 1.0 33.03 17 A 1 -ATOM 247 C CA . THR A1 1 17 ? -24.166 12.974 -14.377 1.0 61.21 17 A 1 -ATOM 248 C C . THR A1 1 17 ? -23.827 11.506 -14.143 1.0 13.11 17 A 1 -ATOM 249 O O . THR A1 1 17 ? -24.531 10.806 -13.415 1.0 32.24 17 A 1 -ATOM 250 C CB . THR A1 1 17 ? -24.102 13.725 -13.034 1.0 22.54 17 A 1 -ATOM 251 O OG1 . THR A1 1 17 ? -25.414 13.833 -12.47 1.0 24.32 17 A 1 -ATOM 252 C CG2 . THR A1 1 17 ? -23.507 15.113 -13.217 1.0 72.42 17 A 1 -ATOM 253 H H . THR A1 1 17 ? -26.269 13.208 -14.439 1.0 63.53 17 A 1 -ATOM 254 H HA . THR A1 1 17 ? -23.428 13.402 -15.041 1.0 15.15 17 A 1 -ATOM 255 H HB . THR A1 1 17 ? -23.472 13.166 -12.356 1.0 61.22 17 A 1 -ATOM 256 H HG1 . THR A1 1 17 ? -25.36 14.271 -11.617 1.0 54.0 17 A 1 -ATOM 257 H HG21 . THR A1 1 17 ? -24.301 15.844 -13.24 1.0 31.34 17 A 1 -ATOM 258 H HG22 . THR A1 1 17 ? -22.958 15.149 -14.147 1.0 12.24 17 A 1 -ATOM 259 H HG23 . THR A1 1 17 ? -22.84 15.33 -12.396 1.0 74.01 17 A 1 -ATOM 260 N N . ILE A1 1 18 ? -22.746 11.047 -14.764 1.0 21.15 18 A 1 -ATOM 261 C CA . ILE A1 1 18 ? -22.314 9.662 -14.62 1.0 42.23 18 A 1 -ATOM 262 C C . ILE A1 1 18 ? -20.885 9.584 -14.094 1.0 2.02 18 A 1 -ATOM 263 O O . ILE A1 1 18 ? -20.033 10.399 -14.452 1.0 34.24 18 A 1 -ATOM 264 C CB . ILE A1 1 18 ? -22.398 8.905 -15.959 1.0 20.13 18 A 1 -ATOM 265 C CG1 . ILE A1 1 18 ? -21.691 7.552 -15.85 1.0 0.43 18 A 1 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.79 9.738 -17.078 1.0 34.34 18 A 1 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.953 6.637 -17.025 1.0 41.12 18 A 1 -ATOM 268 H H . ILE A1 1 18 ? -22.226 11.654 -15.33 1.0 72.35 18 A 1 -ATOM 269 H HA . ILE A1 1 18 ? -22.973 9.179 -13.914 1.0 33.1 18 A 1 -ATOM 270 H HB . ILE A1 1 18 ? -23.439 8.741 -16.189 1.0 55.23 18 A 1 -ATOM 271 H HG12 . ILE A1 1 18 ? -20.626 7.714 -15.787 1.0 35.45 18 A 1 -ATOM 272 H HG13 . ILE A1 1 18 ? -22.028 7.049 -14.955 1.0 15.51 18 A 1 -ATOM 273 H HG21 . ILE A1 1 18 ? -21.662 9.122 -17.956 1.0 31.24 18 A 1 -ATOM 274 H HG22 . ILE A1 1 18 ? -22.448 10.562 -17.31 1.0 60.32 18 A 1 -ATOM 275 H HG23 . ILE A1 1 18 ? -20.831 10.12 -16.762 1.0 71.44 18 A 1 -ATOM 276 H HD11 . ILE A1 1 18 ? -22.28 7.224 -17.872 1.0 32.31 18 A 1 -ATOM 277 H HD12 . ILE A1 1 18 ? -21.045 6.112 -17.282 1.0 60.24 18 A 1 -ATOM 278 H HD13 . ILE A1 1 18 ? -22.721 5.925 -16.764 1.0 25.35 18 A 1 -ATOM 279 N N . THR A1 1 19 ? -20.627 8.596 -13.242 1.0 42.32 19 A 1 -ATOM 280 C CA . THR A1 1 19 ? -19.301 8.41 -12.666 1.0 41.24 19 A 1 -ATOM 281 C C . THR A1 1 19 ? -18.67 7.109 -13.148 1.0 70.21 19 A 1 -ATOM 282 O O . THR A1 1 19 ? -19.325 6.066 -13.182 1.0 44.42 19 A 1 -ATOM 283 C CB . THR A1 1 19 ? -19.353 8.403 -11.127 1.0 2.4 19 A 1 -ATOM 284 O OG1 . THR A1 1 19 ? -20.631 8.868 -10.678 1.0 22.32 19 A 1 -ATOM 285 C CG2 . THR A1 1 19 ? -18.255 9.281 -10.545 1.0 13.14 19 A 1 -ATOM 286 H H . THR A1 1 19 ? -21.347 7.979 -12.996 1.0 1.15 19 A 1 -ATOM 287 H HA . THR A1 1 19 ? -18.682 9.238 -12.981 1.0 65.43 19 A 1 -ATOM 288 H HB . THR A1 1 19 ? -19.205 7.39 -10.781 1.0 44.24 19 A 1 -ATOM 289 H HG1 . THR A1 1 19 ? -20.846 8.452 -9.839 1.0 60.25 19 A 1 -ATOM 290 H HG21 . THR A1 1 19 ? -18.525 10.32 -10.662 1.0 73.33 19 A 1 -ATOM 291 H HG22 . THR A1 1 19 ? -17.328 9.09 -11.064 1.0 23.45 19 A 1 -ATOM 292 H HG23 . THR A1 1 19 ? -18.134 9.057 -9.495 1.0 51.03 19 A 1 -ATOM 293 N N . ILE A1 1 20 ? -17.396 7.176 -13.519 1.0 2.13 20 A 1 -ATOM 294 C CA . ILE A1 1 20 ? -16.677 6.002 -13.997 1.0 23.24 20 A 1 -ATOM 295 C C . ILE A1 1 20 ? -15.231 6.008 -13.512 1.0 21.51 20 A 1 -ATOM 296 O O . ILE A1 1 20 ? -14.54 7.022 -13.601 1.0 3.54 20 A 1 -ATOM 297 C CB . ILE A1 1 20 ? -16.69 5.92 -15.534 1.0 55.55 20 A 1 -ATOM 298 C CG1 . ILE A1 1 20 ? -16.581 7.32 -16.142 1.0 1.5 20 A 1 -ATOM 299 C CG2 . ILE A1 1 20 ? -17.955 5.225 -16.017 1.0 1.32 20 A 1 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.747 7.368 -17.403 1.0 2.4 20 A 1 -ATOM 301 H H . ILE A1 1 20 ? -16.928 8.036 -13.469 1.0 32.52 20 A 1 -ATOM 302 H HA . ILE A1 1 20 ? -17.173 5.125 -13.605 1.0 40.32 20 A 1 -ATOM 303 H HB . ILE A1 1 20 ? -15.842 5.332 -15.849 1.0 75.22 20 A 1 -ATOM 304 H HG12 . ILE A1 1 20 ? -17.569 7.679 -16.385 1.0 4.24 20 A 1 -ATOM 305 H HG13 . ILE A1 1 20 ? -16.129 7.984 -15.419 1.0 20.02 20 A 1 -ATOM 306 H HG21 . ILE A1 1 20 ? -18.761 5.942 -16.072 1.0 41.11 20 A 1 -ATOM 307 H HG22 . ILE A1 1 20 ? -17.782 4.803 -16.995 1.0 51.34 20 A 1 -ATOM 308 H HG23 . ILE A1 1 20 ? -18.219 4.439 -15.326 1.0 74.34 20 A 1 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.707 6.383 -17.845 1.0 44.23 20 A 1 -ATOM 310 H HD12 . ILE A1 1 20 ? -16.193 8.058 -18.104 1.0 43.31 20 A 1 -ATOM 311 H HD13 . ILE A1 1 20 ? -14.747 7.695 -17.162 1.0 23.14 20 A 1 -ATOM 312 N N . ASP A1 1 21 ? -14.78 4.867 -13.001 1.0 44.41 21 A 1 -ATOM 313 C CA . ASP A1 1 21 ? -13.414 4.739 -12.505 1.0 13.43 21 A 1 -ATOM 314 C C . ASP A1 1 21 ? -12.438 4.504 -13.653 1.0 74.52 21 A 1 -ATOM 315 O O . ASP A1 1 21 ? -12.66 3.64 -14.503 1.0 3.25 21 A 1 -ATOM 316 C CB . ASP A1 1 21 ? -13.321 3.593 -11.496 1.0 40.32 21 A 1 -ATOM 317 C CG . ASP A1 1 21 ? -13.941 2.312 -12.017 1.0 70.32 21 A 1 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.229 1.541 -12.695 1.0 34.41 21 A 1 -ATOM 319 O OD2 . ASP A1 1 21 ? -15.138 2.079 -11.747 1.0 4.34 21 A 1 -ATOM 320 H H . ASP A1 1 21 ? -15.379 4.093 -12.957 1.0 61.24 21 A 1 -ATOM 321 H HA . ASP A1 1 21 ? -13.153 5.663 -12.011 1.0 0.1 21 A 1 -ATOM 322 H HB2 . ASP A1 1 21 ? -12.281 3.403 -11.272 1.0 73.15 21 A 1 -ATOM 323 H HB3 . ASP A1 1 21 ? -13.834 3.878 -10.589 1.0 61.23 21 A 1 -ATOM 324 N N . VAL A1 1 22 ? -11.358 5.278 -13.674 1.0 30.34 22 A 1 -ATOM 325 C CA . VAL A1 1 22 ? -10.348 5.153 -14.718 1.0 1.34 22 A 1 -ATOM 326 C C . VAL A1 1 22 ? -8.946 5.35 -14.152 1.0 61.2 22 A 1 -ATOM 327 O O . VAL A1 1 22 ? -8.779 5.83 -13.031 1.0 34.03 22 A 1 -ATOM 328 C CB . VAL A1 1 22 ? -10.581 6.173 -15.848 1.0 60.13 22 A 1 -ATOM 329 C CG1 . VAL A1 1 22 ? -12.045 6.58 -15.907 1.0 14.0 22 A 1 -ATOM 330 C CG2 . VAL A1 1 22 ? -9.688 7.39 -15.66 1.0 61.12 22 A 1 -ATOM 331 H H . VAL A1 1 22 ? -11.237 5.948 -12.969 1.0 71.0 22 A 1 -ATOM 332 H HA . VAL A1 1 22 ? -10.421 4.16 -15.136 1.0 41.13 22 A 1 -ATOM 333 H HB . VAL A1 1 22 ? -10.323 5.705 -16.787 1.0 23.42 22 A 1 -ATOM 334 H HG11 . VAL A1 1 22 ? -12.666 5.696 -15.88 1.0 3.13 22 A 1 -ATOM 335 H HG12 . VAL A1 1 22 ? -12.278 7.211 -15.062 1.0 11.12 22 A 1 -ATOM 336 H HG13 . VAL A1 1 22 ? -12.232 7.121 -16.823 1.0 2.3 22 A 1 -ATOM 337 H HG21 . VAL A1 1 22 ? -8.666 7.125 -15.886 1.0 43.3 22 A 1 -ATOM 338 H HG22 . VAL A1 1 22 ? -10.011 8.179 -16.323 1.0 71.52 22 A 1 -ATOM 339 H HG23 . VAL A1 1 22 ? -9.754 7.731 -14.637 1.0 24.41 22 A 1 -ATOM 340 N N . ASP A1 1 23 ? -7.94 4.976 -14.935 1.0 73.14 23 A 1 -ATOM 341 C CA . ASP A1 1 23 ? -6.551 5.112 -14.514 1.0 0.33 23 A 1 -ATOM 342 C C . ASP A1 1 23 ? -5.788 6.044 -15.45 1.0 62.12 23 A 1 -ATOM 343 O O . ASP A1 1 23 ? -6.102 6.143 -16.637 1.0 35.34 23 A 1 -ATOM 344 C CB . ASP A1 1 23 ? -5.872 3.743 -14.472 1.0 24.44 23 A 1 -ATOM 345 C CG . ASP A1 1 23 ? -6.694 2.711 -13.725 1.0 11.25 23 A 1 -ATOM 346 O OD1 . ASP A1 1 23 ? -6.853 2.857 -12.494 1.0 71.52 23 A 1 -ATOM 347 O OD2 . ASP A1 1 23 ? -7.179 1.759 -14.37 1.0 54.12 23 A 1 -ATOM 348 H H . ASP A1 1 23 ? -8.137 4.6 -15.819 1.0 71.31 23 A 1 -ATOM 349 H HA . ASP A1 1 23 ? -6.546 5.537 -13.521 1.0 62.03 23 A 1 -ATOM 350 H HB2 . ASP A1 1 23 ? -5.72 3.392 -15.482 1.0 75.32 23 A 1 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.914 3.838 -13.981 1.0 32.1 23 A 1 -ATOM 352 N N . HIS A1 1 24 ? -4.784 6.726 -14.909 1.0 3.42 24 A 1 -ATOM 353 C CA . HIS A1 1 24 ? -3.976 7.651 -15.696 1.0 64.1 24 A 1 -ATOM 354 C C . HIS A1 1 24 ? -3.315 6.932 -16.869 1.0 13.22 24 A 1 -ATOM 355 O O . HIS A1 1 24 ? -2.85 7.566 -17.815 1.0 40.32 24 A 1 -ATOM 356 C CB . HIS A1 1 24 ? -2.909 8.304 -14.817 1.0 43.52 24 A 1 -ATOM 357 C CG . HIS A1 1 24 ? -1.83 7.361 -14.383 1.0 63.23 24 A 1 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.599 7.289 -15.002 1.0 33.23 24 A 1 -ATOM 359 C CD2 . HIS A1 1 24 ? -1.801 6.448 -13.384 1.0 70.35 24 A 1 -ATOM 360 C CE1 . HIS A1 1 24 ? 0.139 6.371 -14.403 1.0 52.22 24 A 1 -ATOM 361 N NE2 . HIS A1 1 24 ? -0.567 5.846 -13.418 1.0 51.1 24 A 1 -ATOM 362 H H . HIS A1 1 24 ? -4.581 6.605 -13.958 1.0 35.01 24 A 1 -ATOM 363 H HA . HIS A1 1 24 ? -4.63 8.417 -16.082 1.0 52.33 24 A 1 -ATOM 364 H HB2 . HIS A1 1 24 ? -2.443 9.11 -15.366 1.0 74.33 24 A 1 -ATOM 365 H HB3 . HIS A1 1 24 ? -3.378 8.704 -13.93 1.0 2.24 24 A 1 -ATOM 366 H HD1 . HIS A1 1 24 ? -0.311 7.829 -15.766 1.0 61.24 24 A 1 -ATOM 367 H HD2 . HIS A1 1 24 ? -2.6 6.231 -12.69 1.0 14.35 24 A 1 -ATOM 368 H HE1 . HIS A1 1 24 ? 1.148 6.097 -14.672 1.0 73.24 24 A 1 -ATOM 369 N N . ALA A1 1 25 ? -3.278 5.606 -16.798 1.0 63.43 25 A 1 -ATOM 370 C CA . ALA A1 1 25 ? -2.676 4.801 -17.854 1.0 43.32 25 A 1 -ATOM 371 C C . ALA A1 1 25 ? -3.689 4.485 -18.949 1.0 33.54 25 A 1 -ATOM 372 O O . ALA A1 1 25 ? -3.408 3.709 -19.863 1.0 12.23 25 A 1 -ATOM 373 C CB . ALA A1 1 25 ? -2.101 3.516 -17.276 1.0 51.34 25 A 1 -ATOM 374 H H . ALA A1 1 25 ? -3.665 5.157 -16.018 1.0 55.41 25 A 1 -ATOM 375 H HA . ALA A1 1 25 ? -1.863 5.369 -18.284 1.0 23.12 25 A 1 -ATOM 376 H HB1 . ALA A1 1 25 ? -1.774 2.875 -18.082 1.0 42.21 25 A 1 -ATOM 377 H HB2 . ALA A1 1 25 ? -1.262 3.752 -16.64 1.0 3.14 25 A 1 -ATOM 378 H HB3 . ALA A1 1 25 ? -2.861 3.01 -16.699 1.0 44.44 25 A 1 -ATOM 379 N N . ASP A1 1 26 ? -4.868 5.088 -18.849 1.0 53.31 26 A 1 -ATOM 380 C CA . ASP A1 1 26 ? -5.924 4.871 -19.831 1.0 71.32 26 A 1 -ATOM 381 C C . ASP A1 1 26 ? -5.969 6.012 -20.843 1.0 31.24 26 A 1 -ATOM 382 O O . ASP A1 1 26 ? -5.057 6.837 -20.905 1.0 53.43 26 A 1 -ATOM 383 C CB . ASP A1 1 26 ? -7.279 4.737 -19.134 1.0 21.1 26 A 1 -ATOM 384 C CG . ASP A1 1 26 ? -7.276 3.662 -18.065 1.0 73.54 26 A 1 -ATOM 385 O OD1 . ASP A1 1 26 ? -6.29 2.899 -17.994 1.0 73.22 26 A 1 -ATOM 386 O OD2 . ASP A1 1 26 ? -8.261 3.582 -17.301 1.0 2.02 26 A 1 -ATOM 387 H H . ASP A1 1 26 ? -5.032 5.696 -18.097 1.0 73.33 26 A 1 -ATOM 388 H HA . ASP A1 1 26 ? -5.706 3.952 -20.354 1.0 35.3 26 A 1 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.532 5.679 -18.669 1.0 71.15 26 A 1 -ATOM 390 H HB3 . ASP A1 1 26 ? -8.031 4.488 -19.868 1.0 51.4 26 A 1 -ATOM 391 N N . THR A1 1 27 ? -7.036 6.052 -21.635 1.0 11.22 27 A 1 -ATOM 392 C CA . THR A1 1 27 ? -7.199 7.09 -22.645 1.0 12.11 27 A 1 -ATOM 393 C C . THR A1 1 27 ? -8.67 7.443 -22.839 1.0 24.55 27 A 1 -ATOM 394 O O . THR A1 1 27 ? -9.556 6.73 -22.368 1.0 14.34 27 A 1 -ATOM 395 C CB . THR A1 1 27 ? -6.605 6.656 -23.998 1.0 24.42 27 A 1 -ATOM 396 O OG1 . THR A1 1 27 ? -6.649 5.229 -24.117 1.0 51.41 27 A 1 -ATOM 397 C CG2 . THR A1 1 27 ? -5.168 7.137 -24.137 1.0 72.22 27 A 1 -ATOM 398 H H . THR A1 1 27 ? -7.729 5.366 -21.537 1.0 1.33 27 A 1 -ATOM 399 H HA . THR A1 1 27 ? -6.669 7.969 -22.308 1.0 54.42 27 A 1 -ATOM 400 H HB . THR A1 1 27 ? -7.194 7.094 -24.79 1.0 51.23 27 A 1 -ATOM 401 H HG1 . THR A1 1 27 ? -7.493 4.966 -24.493 1.0 23.44 27 A 1 -ATOM 402 H HG21 . THR A1 1 27 ? -4.762 6.789 -25.075 1.0 20.21 27 A 1 -ATOM 403 H HG22 . THR A1 1 27 ? -4.577 6.746 -23.322 1.0 40.31 27 A 1 -ATOM 404 H HG23 . THR A1 1 27 ? -5.146 8.216 -24.113 1.0 53.14 27 A 1 -ATOM 405 N N . VAL A1 1 28 ? -8.922 8.546 -23.535 1.0 70.04 28 A 1 -ATOM 406 C CA . VAL A1 1 28 ? -10.286 8.992 -23.793 1.0 40.12 28 A 1 -ATOM 407 C C . VAL A1 1 28 ? -11.089 7.916 -24.516 1.0 43.3 28 A 1 -ATOM 408 O O . VAL A1 1 28 ? -12.207 7.59 -24.12 1.0 51.44 28 A 1 -ATOM 409 C CB . VAL A1 1 28 ? -10.305 10.283 -24.633 1.0 70.14 28 A 1 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.697 10.895 -24.64 1.0 13.41 28 A 1 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.279 11.276 -24.107 1.0 73.55 28 A 1 -ATOM 412 H H . VAL A1 1 28 ? -8.173 9.072 -23.885 1.0 50.23 28 A 1 -ATOM 413 H HA . VAL A1 1 28 ? -10.755 9.2 -22.842 1.0 62.42 28 A 1 -ATOM 414 H HB . VAL A1 1 28 ? -10.042 10.03 -25.65 1.0 52.41 28 A 1 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.764 11.628 -25.431 1.0 72.32 28 A 1 -ATOM 416 H HG12 . VAL A1 1 28 ? -12.431 10.12 -24.802 1.0 75.12 28 A 1 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.884 11.375 -23.69 1.0 43.12 28 A 1 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.563 11.499 -24.884 1.0 22.23 28 A 1 -ATOM 419 H HG22 . VAL A1 1 28 ? -9.78 12.184 -23.807 1.0 21.24 28 A 1 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.767 10.848 -23.257 1.0 51.43 28 A 1 -ATOM 421 N N . GLY A1 1 29 ? -10.509 7.367 -25.579 1.0 51.02 29 A 1 -ATOM 422 C CA . GLY A1 1 29 ? -11.185 6.333 -26.341 1.0 24.21 29 A 1 -ATOM 423 C C . GLY A1 1 29 ? -11.727 5.225 -25.46 1.0 62.32 29 A 1 -ATOM 424 O O . GLY A1 1 29 ? -12.894 4.85 -25.57 1.0 1.41 29 A 1 -ATOM 425 H H . GLY A1 1 29 ? -9.616 7.667 -25.849 1.0 25.44 29 A 1 -ATOM 426 H HA2 . GLY A1 1 29 ? -12.003 6.779 -26.886 1.0 33.14 29 A 1 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.486 5.907 -27.046 1.0 61.11 29 A 1 -ATOM 428 N N . ALA A1 1 30 ? -10.877 4.697 -24.585 1.0 0.3 30 A 1 -ATOM 429 C CA . ALA A1 1 30 ? -11.278 3.626 -23.682 1.0 24.42 30 A 1 -ATOM 430 C C . ALA A1 1 30 ? -12.417 4.072 -22.772 1.0 23.15 30 A 1 -ATOM 431 O O . ALA A1 1 30 ? -13.353 3.315 -22.515 1.0 23.32 30 A 1 -ATOM 432 C CB . ALA A1 1 30 ? -10.089 3.161 -22.854 1.0 4.23 30 A 1 -ATOM 433 H H . ALA A1 1 30 ? -9.959 5.038 -24.545 1.0 13.0 30 A 1 -ATOM 434 H HA . ALA A1 1 30 ? -11.615 2.792 -24.281 1.0 42.35 30 A 1 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.853 2.138 -23.107 1.0 24.3 30 A 1 -ATOM 436 H HB2 . ALA A1 1 30 ? -9.236 3.79 -23.064 1.0 15.25 30 A 1 -ATOM 437 H HB3 . ALA A1 1 30 ? -10.334 3.225 -21.804 1.0 54.13 30 A 1 -ATOM 438 N N . VAL A1 1 31 ? -12.331 5.306 -22.285 1.0 44.02 31 A 1 -ATOM 439 C CA . VAL A1 1 31 ? -13.355 5.853 -21.403 1.0 44.43 31 A 1 -ATOM 440 C C . VAL A1 1 31 ? -14.7 5.947 -22.115 1.0 22.33 31 A 1 -ATOM 441 O O . VAL A1 1 31 ? -15.739 5.605 -21.549 1.0 41.34 31 A 1 -ATOM 442 C CB . VAL A1 1 31 ? -12.962 7.25 -20.886 1.0 42.01 31 A 1 -ATOM 443 C CG1 . VAL A1 1 31 ? -14.098 7.86 -20.079 1.0 61.22 31 A 1 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.689 7.172 -20.056 1.0 34.2 31 A 1 -ATOM 445 H H . VAL A1 1 31 ? -11.56 5.862 -22.526 1.0 33.11 31 A 1 -ATOM 446 H HA . VAL A1 1 31 ? -13.452 5.192 -20.554 1.0 53.53 31 A 1 -ATOM 447 H HB . VAL A1 1 31 ? -12.772 7.887 -21.738 1.0 34.14 31 A 1 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.603 8.606 -20.676 1.0 24.43 31 A 1 -ATOM 449 H HG12 . VAL A1 1 31 ? -14.798 7.086 -19.8 1.0 62.24 31 A 1 -ATOM 450 H HG13 . VAL A1 1 31 ? -13.699 8.322 -19.189 1.0 4.44 31 A 1 -ATOM 451 H HG21 . VAL A1 1 31 ? -11.793 7.792 -19.178 1.0 32.4 31 A 1 -ATOM 452 H HG22 . VAL A1 1 31 ? -11.518 6.149 -19.757 1.0 31.51 31 A 1 -ATOM 453 H HG23 . VAL A1 1 31 ? -10.853 7.519 -20.645 1.0 2.41 31 A 1 -ATOM 454 N N . LYS A1 1 32 ? -14.674 6.411 -23.359 1.0 44.33 32 A 1 -ATOM 455 C CA . LYS A1 1 32 ? -15.89 6.549 -24.151 1.0 33.41 32 A 1 -ATOM 456 C C . LYS A1 1 32 ? -16.633 5.22 -24.242 1.0 33.52 32 A 1 -ATOM 457 O O . LYS A1 1 32 ? -17.858 5.174 -24.136 1.0 55.22 32 A 1 -ATOM 458 C CB . LYS A1 1 32 ? -15.555 7.055 -25.556 1.0 21.43 32 A 1 -ATOM 459 C CG . LYS A1 1 32 ? -16.128 8.428 -25.86 1.0 62.04 32 A 1 -ATOM 460 C CD . LYS A1 1 32 ? -15.045 9.494 -25.869 1.0 13.3 32 A 1 -ATOM 461 C CE . LYS A1 1 32 ? -14.666 9.892 -27.287 1.0 61.02 32 A 1 -ATOM 462 N NZ . LYS A1 1 32 ? -15.772 10.613 -27.976 1.0 10.13 32 A 1 -ATOM 463 H H . LYS A1 1 32 ? -13.814 6.667 -23.756 1.0 0.43 32 A 1 -ATOM 464 H HA . LYS A1 1 32 ? -16.526 7.27 -23.66 1.0 20.21 32 A 1 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.481 7.104 -25.661 1.0 31.13 32 A 1 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.947 6.355 -26.28 1.0 51.43 32 A 1 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.601 8.404 -26.831 1.0 34.55 32 A 1 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.86 8.678 -25.106 1.0 75.31 32 A 1 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.408 10.368 -25.347 1.0 62.53 32 A 1 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.169 9.11 -25.366 1.0 34.24 32 A 1 -ATOM 471 H HE2 . LYS A1 1 32 ? -13.799 10.534 -27.248 1.0 32.35 32 A 1 -ATOM 472 H HE3 . LYS A1 1 32 ? -14.427 8.999 -27.846 1.0 31.14 32 A 1 -ATOM 473 H HZ1 . LYS A1 1 32 ? -15.412 11.483 -28.417 1.0 3.34 32 A 1 -ATOM 474 H HZ2 . LYS A1 1 32 ? -16.514 10.865 -27.292 1.0 11.13 32 A 1 -ATOM 475 H HZ3 . LYS A1 1 32 ? -16.187 10.009 -28.714 1.0 13.55 32 A 1 -ATOM 476 N N . ALA A1 1 33 ? -15.883 4.14 -24.437 1.0 34.21 33 A 1 -ATOM 477 C CA . ALA A1 1 33 ? -16.471 2.81 -24.538 1.0 60.31 33 A 1 -ATOM 478 C C . ALA A1 1 33 ? -17.144 2.406 -23.231 1.0 31.03 33 A 1 -ATOM 479 O O . ALA A1 1 33 ? -18.225 1.817 -23.233 1.0 31.32 33 A 1 -ATOM 480 C CB . ALA A1 1 33 ? -15.408 1.791 -24.923 1.0 54.24 33 A 1 -ATOM 481 H H . ALA A1 1 33 ? -14.912 4.24 -24.513 1.0 43.1 33 A 1 -ATOM 482 H HA . ALA A1 1 33 ? -17.214 2.832 -25.322 1.0 53.01 33 A 1 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.571 1.872 -24.246 1.0 2.33 33 A 1 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.825 0.797 -24.864 1.0 61.23 33 A 1 -ATOM 485 H HB3 . ALA A1 1 33 ? -15.075 1.983 -25.932 1.0 53.23 33 A 1 -ATOM 486 N N . LYS A1 1 34 ? -16.498 2.726 -22.115 1.0 30.14 34 A 1 -ATOM 487 C CA . LYS A1 1 34 ? -17.034 2.397 -20.799 1.0 3.41 34 A 1 -ATOM 488 C C . LYS A1 1 34 ? -18.391 3.059 -20.583 1.0 51.04 34 A 1 -ATOM 489 O O . LYS A1 1 34 ? -19.331 2.426 -20.102 1.0 30.3 34 A 1 -ATOM 490 C CB . LYS A1 1 34 ? -16.06 2.839 -19.704 1.0 63.02 34 A 1 -ATOM 491 C CG . LYS A1 1 34 ? -16.516 2.476 -18.302 1.0 24.43 34 A 1 -ATOM 492 C CD . LYS A1 1 34 ? -16.539 0.97 -18.095 1.0 44.42 34 A 1 -ATOM 493 C CE . LYS A1 1 34 ? -15.138 0.379 -18.15 1.0 34.12 34 A 1 -ATOM 494 N NZ . LYS A1 1 34 ? -14.96 -0.517 -19.326 1.0 13.0 34 A 1 -ATOM 495 H H . LYS A1 1 34 ? -15.64 3.196 -22.177 1.0 65.25 34 A 1 -ATOM 496 H HA . LYS A1 1 34 ? -17.157 1.326 -20.749 1.0 3.22 34 A 1 -ATOM 497 H HB2 . LYS A1 1 34 ? -15.102 2.372 -19.881 1.0 71.03 34 A 1 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.942 3.912 -19.755 1.0 71.12 34 A 1 -ATOM 499 H HG2 . LYS A1 1 34 ? -15.837 2.916 -17.587 1.0 24.23 34 A 1 -ATOM 500 H HG3 . LYS A1 1 34 ? -17.511 2.867 -18.144 1.0 22.21 34 A 1 -ATOM 501 H HD2 . LYS A1 1 34 ? -16.971 0.755 -17.129 1.0 63.43 34 A 1 -ATOM 502 H HD3 . LYS A1 1 34 ? -17.141 0.519 -18.87 1.0 75.33 34 A 1 -ATOM 503 H HE2 . LYS A1 1 34 ? -14.423 1.185 -18.211 1.0 34.14 34 A 1 -ATOM 504 H HE3 . LYS A1 1 34 ? -14.966 -0.188 -17.247 1.0 0.12 34 A 1 -ATOM 505 H HZ1 . LYS A1 1 34 ? -14.378 -0.047 -20.048 1.0 62.42 34 A 1 -ATOM 506 H HZ2 . LYS A1 1 34 ? -15.885 -0.751 -19.74 1.0 14.2 34 A 1 -ATOM 507 H HZ3 . LYS A1 1 34 ? -14.491 -1.398 -19.036 1.0 65.2 34 A 1 -ATOM 508 N N . ILE A1 1 35 ? -18.486 4.334 -20.944 1.0 14.42 35 A 1 -ATOM 509 C CA . ILE A1 1 35 ? -19.73 5.08 -20.792 1.0 22.32 35 A 1 -ATOM 510 C C . ILE A1 1 35 ? -20.818 4.525 -21.704 1.0 74.31 35 A 1 -ATOM 511 O O . ILE A1 1 35 ? -21.992 4.486 -21.335 1.0 33.23 35 A 1 -ATOM 512 C CB . ILE A1 1 35 ? -19.531 6.575 -21.1 1.0 42.5 35 A 1 -ATOM 513 C CG1 . ILE A1 1 35 ? -18.403 7.15 -20.241 1.0 22.04 35 A 1 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.825 7.341 -20.866 1.0 45.14 35 A 1 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.603 6.933 -18.757 1.0 11.1 35 A 1 -ATOM 516 H H . ILE A1 1 35 ? -17.702 4.784 -21.321 1.0 54.44 35 A 1 -ATOM 517 H HA . ILE A1 1 35 ? -20.052 4.984 -19.765 1.0 30.01 35 A 1 -ATOM 518 H HB . ILE A1 1 35 ? -19.266 6.673 -22.142 1.0 2.44 35 A 1 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.472 6.683 -20.521 1.0 3.24 35 A 1 -ATOM 520 H HG13 . ILE A1 1 35 ? -18.334 8.214 -20.415 1.0 0.11 35 A 1 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.709 8.358 -21.212 1.0 65.32 35 A 1 -ATOM 522 H HG22 . ILE A1 1 35 ? -21.627 6.866 -21.411 1.0 43.1 35 A 1 -ATOM 523 H HG23 . ILE A1 1 35 ? -21.056 7.344 -19.812 1.0 75.41 35 A 1 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.863 6.235 -18.392 1.0 43.52 35 A 1 -ATOM 525 H HD12 . ILE A1 1 35 ? -18.496 7.874 -18.237 1.0 71.15 35 A 1 -ATOM 526 H HD13 . ILE A1 1 35 ? -19.59 6.534 -18.581 1.0 74.3 35 A 1 -ATOM 527 N N . TYR A1 1 36 ? -20.421 4.095 -22.896 1.0 62.53 36 A 1 -ATOM 528 C CA . TYR A1 1 36 ? -21.363 3.542 -23.862 1.0 64.44 36 A 1 -ATOM 529 C C . TYR A1 1 36 ? -22.125 2.362 -23.266 1.0 53.42 36 A 1 -ATOM 530 O O . TYR A1 1 36 ? -23.344 2.263 -23.406 1.0 34.33 36 A 1 -ATOM 531 C CB . TYR A1 1 36 ? -20.626 3.1 -25.128 1.0 74.42 36 A 1 -ATOM 532 C CG . TYR A1 1 36 ? -21.029 1.725 -25.614 1.0 43.51 36 A 1 -ATOM 533 C CD1 . TYR A1 1 36 ? -22.27 1.51 -26.2 1.0 62.31 36 A 1 -ATOM 534 C CD2 . TYR A1 1 36 ? -20.167 0.643 -25.488 1.0 22.21 36 A 1 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.642 0.256 -26.645 1.0 25.24 36 A 1 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.53 -0.614 -25.931 1.0 24.41 36 A 1 -ATOM 537 C CZ . TYR A1 1 36 ? -21.768 -0.803 -26.508 1.0 51.0 36 A 1 -ATOM 538 O OH . TYR A1 1 36 ? -22.134 -2.053 -26.951 1.0 31.41 36 A 1 -ATOM 539 H H . TYR A1 1 36 ? -19.472 4.151 -23.133 1.0 42.53 36 A 1 -ATOM 540 H HA . TYR A1 1 36 ? -22.068 4.318 -24.12 1.0 45.34 36 A 1 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.831 3.804 -25.92 1.0 32.41 36 A 1 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.564 3.085 -24.932 1.0 73.31 36 A 1 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.951 2.341 -26.306 1.0 14.41 36 A 1 -ATOM 544 H HD2 . TYR A1 1 36 ? -19.197 0.794 -25.035 1.0 73.43 36 A 1 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.611 0.108 -27.097 1.0 30.0 36 A 1 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.846 -1.444 -25.824 1.0 11.1 36 A 1 -ATOM 547 H HH . TYR A1 1 36 ? -22.413 -2.588 -26.204 1.0 20.21 36 A 1 -ATOM 548 N N . ASP A1 1 37 ? -21.398 1.472 -22.601 1.0 31.31 37 A 1 -ATOM 549 C CA . ASP A1 1 37 ? -22.005 0.299 -21.981 1.0 4.3 37 A 1 -ATOM 550 C C . ASP A1 1 37 ? -22.749 0.683 -20.706 1.0 30.32 37 A 1 -ATOM 551 O O . ASP A1 1 37 ? -23.743 0.054 -20.341 1.0 62.0 37 A 1 -ATOM 552 C CB . ASP A1 1 37 ? -20.935 -0.748 -21.667 1.0 35.43 37 A 1 -ATOM 553 C CG . ASP A1 1 37 ? -20.95 -1.903 -22.649 1.0 34.32 37 A 1 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.986 -2.596 -22.735 1.0 31.12 37 A 1 -ATOM 555 O OD2 . ASP A1 1 37 ? -19.927 -2.114 -23.332 1.0 3.2 37 A 1 -ATOM 556 H H . ASP A1 1 37 ? -20.43 1.606 -22.524 1.0 51.42 37 A 1 -ATOM 557 H HA . ASP A1 1 37 ? -22.71 -0.119 -22.683 1.0 32.24 37 A 1 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.962 -0.282 -21.703 1.0 43.14 37 A 1 -ATOM 559 H HB3 . ASP A1 1 37 ? -21.105 -1.14 -20.675 1.0 34.23 37 A 1 -ATOM 560 N N . LYS A1 1 38 ? -22.261 1.718 -20.031 1.0 33.03 38 A 1 -ATOM 561 C CA . LYS A1 1 38 ? -22.879 2.187 -18.796 1.0 33.5 38 A 1 -ATOM 562 C C . LYS A1 1 38 ? -24.362 2.478 -19.006 1.0 62.1 38 A 1 -ATOM 563 O O . LYS A1 1 38 ? -25.202 2.073 -18.204 1.0 13.24 38 A 1 -ATOM 564 C CB . LYS A1 1 38 ? -22.168 3.444 -18.291 1.0 32.13 38 A 1 -ATOM 565 C CG . LYS A1 1 38 ? -21.459 3.249 -16.962 1.0 11.13 38 A 1 -ATOM 566 C CD . LYS A1 1 38 ? -20.009 2.838 -17.158 1.0 55.11 38 A 1 -ATOM 567 C CE . LYS A1 1 38 ? -19.878 1.336 -17.359 1.0 12.13 38 A 1 -ATOM 568 N NZ . LYS A1 1 38 ? -19.34 0.66 -16.146 1.0 62.42 38 A 1 -ATOM 569 H H . LYS A1 1 38 ? -21.466 2.179 -20.372 1.0 40.1 38 A 1 -ATOM 570 H HA . LYS A1 1 38 ? -22.779 1.405 -18.058 1.0 13.43 38 A 1 -ATOM 571 H HB2 . LYS A1 1 38 ? -21.436 3.748 -19.024 1.0 53.44 38 A 1 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.897 4.233 -18.173 1.0 74.35 38 A 1 -ATOM 573 H HG2 . LYS A1 1 38 ? -21.487 4.177 -16.409 1.0 72.35 38 A 1 -ATOM 574 H HG3 . LYS A1 1 38 ? -21.97 2.479 -16.401 1.0 65.33 38 A 1 -ATOM 575 H HD2 . LYS A1 1 38 ? -19.616 3.342 -18.029 1.0 31.44 38 A 1 -ATOM 576 H HD3 . LYS A1 1 38 ? -19.441 3.127 -16.285 1.0 51.13 38 A 1 -ATOM 577 H HE2 . LYS A1 1 38 ? -20.852 0.93 -17.584 1.0 72.24 38 A 1 -ATOM 578 H HE3 . LYS A1 1 38 ? -19.211 1.154 -18.188 1.0 52.14 38 A 1 -ATOM 579 H HZ1 . LYS A1 1 38 ? -19.073 -0.32 -16.372 1.0 12.21 38 A 1 -ATOM 580 H HZ2 . LYS A1 1 38 ? -20.059 0.648 -15.395 1.0 31.3 38 A 1 -ATOM 581 H HZ3 . LYS A1 1 38 ? -18.5 1.165 -15.798 1.0 72.13 38 A 1 -ATOM 582 N N . GLU A1 1 39 ? -24.674 3.181 -20.09 1.0 74.33 39 A 1 -ATOM 583 C CA . GLU A1 1 39 ? -26.056 3.525 -20.405 1.0 31.43 39 A 1 -ATOM 584 C C . GLU A1 1 39 ? -26.508 2.838 -21.69 1.0 55.55 39 A 1 -ATOM 585 O O . GLU A1 1 39 ? -27.529 2.151 -21.714 1.0 44.25 39 A 1 -ATOM 586 C CB . GLU A1 1 39 ? -26.209 5.041 -20.542 1.0 31.12 39 A 1 -ATOM 587 C CG . GLU A1 1 39 ? -25.077 5.7 -21.312 1.0 22.34 39 A 1 -ATOM 588 C CD . GLU A1 1 39 ? -25.113 7.213 -21.222 1.0 34.02 39 A 1 -ATOM 589 O OE1 . GLU A1 1 39 ? -26.157 7.804 -21.57 1.0 60.52 39 A 1 -ATOM 590 O OE2 . GLU A1 1 39 ? -24.098 7.807 -20.803 1.0 24.54 39 A 1 -ATOM 591 H H . GLU A1 1 39 ? -23.959 3.475 -20.692 1.0 53.12 39 A 1 -ATOM 592 H HA . GLU A1 1 39 ? -26.677 3.182 -19.591 1.0 24.23 39 A 1 -ATOM 593 H HB2 . GLU A1 1 39 ? -27.136 5.252 -21.054 1.0 13.32 39 A 1 -ATOM 594 H HB3 . GLU A1 1 39 ? -26.246 5.477 -19.554 1.0 53.15 39 A 1 -ATOM 595 H HG2 . GLU A1 1 39 ? -24.136 5.354 -20.91 1.0 73.51 39 A 1 -ATOM 596 H HG3 . GLU A1 1 39 ? -25.15 5.413 -22.35 1.0 55.55 39 A 1 -ATOM 597 N N . GLY A1 1 40 ? -25.741 3.031 -22.759 1.0 41.31 40 A 1 -ATOM 598 C CA . GLY A1 1 40 ? -26.079 2.426 -24.034 1.0 23.2 40 A 1 -ATOM 599 C C . GLY A1 1 40 ? -26.15 3.441 -25.157 1.0 54.31 40 A 1 -ATOM 600 O O . GLY A1 1 40 ? -27.115 3.463 -25.922 1.0 62.35 40 A 1 -ATOM 601 H H . GLY A1 1 40 ? -24.939 3.589 -22.681 1.0 1.31 40 A 1 -ATOM 602 H HA2 . GLY A1 1 40 ? -25.331 1.686 -24.278 1.0 42.33 40 A 1 -ATOM 603 H HA3 . GLY A1 1 40 ? -27.038 1.937 -23.944 1.0 42.25 40 A 1 -ATOM 604 N N . ILE A1 1 41 ? -25.129 4.285 -25.256 1.0 11.45 41 A 1 -ATOM 605 C CA . ILE A1 1 41 ? -25.081 5.308 -26.293 1.0 13.21 41 A 1 -ATOM 606 C C . ILE A1 1 41 ? -23.88 5.105 -27.21 1.0 73.14 41 A 1 -ATOM 607 O O . ILE A1 1 41 ? -22.854 4.549 -26.817 1.0 54.03 41 A 1 -ATOM 608 C CB . ILE A1 1 41 ? -25.016 6.722 -25.687 1.0 13.54 41 A 1 -ATOM 609 C CG1 . ILE A1 1 41 ? -23.749 6.882 -24.844 1.0 35.25 41 A 1 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.255 6.996 -24.848 1.0 15.54 41 A 1 -ATOM 611 C CD1 . ILE A1 1 41 ? -22.569 7.419 -25.622 1.0 51.21 41 A 1 -ATOM 612 H H . ILE A1 1 41 ? -24.39 4.218 -24.616 1.0 10.31 41 A 1 -ATOM 613 H HA . ILE A1 1 41 ? -25.986 5.231 -26.879 1.0 22.4 41 A 1 -ATOM 614 H HB . ILE A1 1 41 ? -24.994 7.436 -26.496 1.0 2.22 41 A 1 -ATOM 615 H HG12 . ILE A1 1 41 ? -23.948 7.563 -24.031 1.0 53.25 41 A 1 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.471 5.919 -24.44 1.0 73.21 41 A 1 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.476 6.132 -24.238 1.0 41.34 41 A 1 -ATOM 618 H HG22 . ILE A1 1 41 ? -26.076 7.849 -24.21 1.0 35.01 41 A 1 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.093 7.202 -25.498 1.0 24.24 41 A 1 -ATOM 620 H HD11 . ILE A1 1 41 ? -21.852 6.626 -25.782 1.0 13.35 41 A 1 -ATOM 621 H HD12 . ILE A1 1 41 ? -22.908 7.794 -26.577 1.0 5.02 41 A 1 -ATOM 622 H HD13 . ILE A1 1 41 ? -22.103 8.218 -25.065 1.0 73.01 41 A 1 -ATOM 623 N N . PRO A1 1 42 ? -24.008 5.567 -28.463 1.0 42.01 42 A 1 -ATOM 624 C CA . PRO A1 1 42 ? -22.942 5.45 -29.462 1.0 63.34 42 A 1 -ATOM 625 C C . PRO A1 1 42 ? -21.751 6.348 -29.148 1.0 4.23 42 A 1 -ATOM 626 O O . PRO A1 1 42 ? -21.857 7.575 -29.123 1.0 21.54 42 A 1 -ATOM 627 C CB . PRO A1 1 42 ? -23.621 5.897 -30.759 1.0 63.45 42 A 1 -ATOM 628 C CG . PRO A1 1 42 ? -24.73 6.788 -30.319 1.0 31.23 42 A 1 -ATOM 629 C CD . PRO A1 1 42 ? -25.202 6.24 -29.0 1.0 52.22 42 A 1 -ATOM 630 H HA . PRO A1 1 42 ? -22.604 4.429 -29.564 1.0 60.32 42 A 1 -ATOM 631 H HB2 . PRO A1 1 42 ? -22.909 6.426 -31.377 1.0 50.23 42 A 1 -ATOM 632 H HB3 . PRO A1 1 42 ? -23.995 5.034 -31.29 1.0 64.01 42 A 1 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.365 7.796 -30.197 1.0 0.11 42 A 1 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.531 6.762 -31.043 1.0 1.1 42 A 1 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.518 7.042 -28.35 1.0 11.32 42 A 1 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.006 5.535 -29.151 1.0 34.03 42 A 1 -ATOM 637 N N . PRO A1 1 43 ? -20.588 5.726 -28.902 1.0 1.41 43 A 1 -ATOM 638 C CA . PRO A1 1 43 ? -19.354 6.452 -28.585 1.0 62.53 43 A 1 -ATOM 639 C C . PRO A1 1 43 ? -18.805 7.214 -29.787 1.0 21.35 43 A 1 -ATOM 640 O O . PRO A1 1 43 ? -18.131 8.233 -29.632 1.0 73.42 43 A 1 -ATOM 641 C CB . PRO A1 1 43 ? -18.386 5.341 -28.169 1.0 74.43 43 A 1 -ATOM 642 C CG . PRO A1 1 43 ? -18.893 4.12 -28.857 1.0 42.11 43 A 1 -ATOM 643 C CD . PRO A1 1 43 ? -20.388 4.268 -28.915 1.0 32.53 43 A 1 -ATOM 644 H HA . PRO A1 1 43 ? -19.496 7.135 -27.761 1.0 3.1 43 A 1 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.386 5.591 -28.493 1.0 1.2 43 A 1 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.405 5.225 -27.096 1.0 52.2 43 A 1 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.483 4.064 -29.854 1.0 21.5 43 A 1 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.625 3.241 -28.289 1.0 41.32 43 A 1 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.775 3.833 -29.824 1.0 55.24 43 A 1 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.846 3.809 -28.051 1.0 31.14 43 A 1 -ATOM 651 N N . ASP A1 1 44 ? -19.097 6.714 -30.982 1.0 54.12 44 A 1 -ATOM 652 C CA . ASP A1 1 44 ? -18.634 7.349 -32.21 1.0 51.34 44 A 1 -ATOM 653 C C . ASP A1 1 44 ? -19.502 8.555 -32.559 1.0 65.34 44 A 1 -ATOM 654 O O . ASP A1 1 44 ? -19.12 9.388 -33.38 1.0 41.23 44 A 1 -ATOM 655 C CB . ASP A1 1 44 ? -18.646 6.346 -33.365 1.0 23.35 44 A 1 -ATOM 656 C CG . ASP A1 1 44 ? -17.858 6.834 -34.564 1.0 52.14 44 A 1 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.719 7.31 -34.373 1.0 70.43 44 A 1 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.38 6.74 -35.695 1.0 15.14 44 A 1 -ATOM 659 H H . ASP A1 1 44 ? -19.639 5.899 -31.04 1.0 64.31 44 A 1 -ATOM 660 H HA . ASP A1 1 44 ? -17.621 7.686 -32.048 1.0 72.42 44 A 1 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.213 5.415 -33.028 1.0 64.21 44 A 1 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.666 6.173 -33.672 1.0 74.33 44 A 1 -ATOM 663 N N . GLN A1 1 45 ? -20.67 8.639 -31.931 1.0 24.51 45 A 1 -ATOM 664 C CA . GLN A1 1 45 ? -21.591 9.741 -32.177 1.0 55.1 45 A 1 -ATOM 665 C C . GLN A1 1 45 ? -21.511 10.778 -31.061 1.0 65.33 45 A 1 -ATOM 666 O O . GLN A1 1 45 ? -22.036 11.883 -31.19 1.0 0.12 45 A 1 -ATOM 667 C CB . GLN A1 1 45 ? -23.024 9.218 -32.301 1.0 3.33 45 A 1 -ATOM 668 C CG . GLN A1 1 45 ? -23.396 8.792 -33.711 1.0 71.05 45 A 1 -ATOM 669 C CD . GLN A1 1 45 ? -24.4 7.656 -33.732 1.0 50.21 45 A 1 -ATOM 670 O OE1 . GLN A1 1 45 ? -25.529 7.802 -33.263 1.0 30.33 45 A 1 -ATOM 671 N NE2 . GLN A1 1 45 ? -23.993 6.516 -34.278 1.0 54.11 45 A 1 -ATOM 672 H H . GLN A1 1 45 ? -20.917 7.943 -31.288 1.0 33.14 45 A 1 -ATOM 673 H HA . GLN A1 1 45 ? -21.307 10.209 -33.107 1.0 54.13 45 A 1 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.141 8.367 -31.647 1.0 72.22 45 A 1 -ATOM 675 H HB3 . GLN A1 1 45 ? -23.706 9.996 -31.991 1.0 51.24 45 A 1 -ATOM 676 H HG2 . GLN A1 1 45 ? -23.823 9.638 -34.229 1.0 11.31 45 A 1 -ATOM 677 H HG3 . GLN A1 1 45 ? -22.501 8.472 -34.225 1.0 33.23 45 A 1 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.079 6.473 -34.631 1.0 35.4 45 A 1 -ATOM 679 H HE22 . GLN A1 1 45 ? -24.621 5.765 -34.304 1.0 53.4 45 A 1 -ATOM 680 N N . GLN A1 1 46 ? -20.85 10.412 -29.968 1.0 5.34 46 A 1 -ATOM 681 C CA . GLN A1 1 46 ? -20.701 11.311 -28.829 1.0 54.21 46 A 1 -ATOM 682 C C . GLN A1 1 46 ? -19.3 11.911 -28.788 1.0 23.33 46 A 1 -ATOM 683 O O . GLN A1 1 46 ? -18.343 11.311 -29.278 1.0 42.0 46 A 1 -ATOM 684 C CB . GLN A1 1 46 ? -20.989 10.567 -27.524 1.0 54.1 46 A 1 -ATOM 685 C CG . GLN A1 1 46 ? -19.947 9.516 -27.18 1.0 63.33 46 A 1 -ATOM 686 C CD . GLN A1 1 46 ? -19.004 9.966 -26.081 1.0 73.34 46 A 1 -ATOM 687 O OE1 . GLN A1 1 46 ? -18.04 10.689 -26.332 1.0 62.34 46 A 1 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.279 9.539 -24.854 1.0 52.51 46 A 1 -ATOM 689 H H . GLN A1 1 46 ? -20.453 9.518 -29.925 1.0 61.13 46 A 1 -ATOM 690 H HA . GLN A1 1 46 ? -21.418 12.11 -28.943 1.0 1.54 46 A 1 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.028 11.283 -26.716 1.0 70.34 46 A 1 -ATOM 692 H HB3 . GLN A1 1 46 ? -21.949 10.078 -27.607 1.0 24.41 46 A 1 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.452 8.619 -26.854 1.0 71.34 46 A 1 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.367 9.299 -28.066 1.0 12.44 46 A 1 -ATOM 695 H HE21 . GLN A1 1 46 ? -20.064 8.965 -24.729 1.0 61.21 46 A 1 -ATOM 696 H HE22 . GLN A1 1 46 ? -18.686 9.814 -24.125 1.0 54.41 46 A 1 -ATOM 697 N N . ARG A1 1 47 ? -19.186 13.097 -28.2 1.0 11.31 47 A 1 -ATOM 698 C CA . ARG A1 1 47 ? -17.901 13.779 -28.096 1.0 74.42 47 A 1 -ATOM 699 C C . ARG A1 1 47 ? -17.752 14.453 -26.736 1.0 0.05 47 A 1 -ATOM 700 O O . ARG A1 1 47 ? -18.741 14.723 -26.052 1.0 62.43 47 A 1 -ATOM 701 C CB . ARG A1 1 47 ? -17.759 14.817 -29.21 1.0 53.24 47 A 1 -ATOM 702 C CG . ARG A1 1 47 ? -17.216 14.246 -30.51 1.0 25.13 47 A 1 -ATOM 703 C CD . ARG A1 1 47 ? -18.33 13.969 -31.506 1.0 74.31 47 A 1 -ATOM 704 N NE . ARG A1 1 47 ? -17.828 13.861 -32.873 1.0 72.02 47 A 1 -ATOM 705 C CZ . ARG A1 1 47 ? -18.615 13.767 -33.94 1.0 4.33 47 A 1 -ATOM 706 N NH1 . ARG A1 1 47 ? -19.933 13.769 -33.798 1.0 22.33 47 A 1 -ATOM 707 N NH2 . ARG A1 1 47 ? -18.083 13.673 -35.152 1.0 24.44 47 A 1 -ATOM 708 H H . ARG A1 1 47 ? -19.985 13.525 -27.828 1.0 14.32 47 A 1 -ATOM 709 H HA . ARG A1 1 47 ? -17.123 13.038 -28.205 1.0 52.1 47 A 1 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.729 15.248 -29.411 1.0 12.43 47 A 1 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.09 15.596 -28.877 1.0 31.22 47 A 1 -ATOM 712 H HG2 . ARG A1 1 47 ? -16.528 14.956 -30.945 1.0 2.15 47 A 1 -ATOM 713 H HG3 . ARG A1 1 47 ? -16.697 13.323 -30.297 1.0 3.22 47 A 1 -ATOM 714 H HD2 . ARG A1 1 47 ? -18.814 13.042 -31.236 1.0 62.34 47 A 1 -ATOM 715 H HD3 . ARG A1 1 47 ? -19.047 14.775 -31.458 1.0 4.32 47 A 1 -ATOM 716 H HE . ARG A1 1 47 ? -16.857 13.858 -33.001 1.0 51.12 47 A 1 -ATOM 717 H HH11 . ARG A1 1 47 ? -20.336 13.841 -32.886 1.0 35.02 47 A 1 -ATOM 718 H HH12 . ARG A1 1 47 ? -20.523 13.699 -34.602 1.0 42.25 47 A 1 -ATOM 719 H HH21 . ARG A1 1 47 ? -17.089 13.672 -35.263 1.0 32.54 47 A 1 -ATOM 720 H HH22 . ARG A1 1 47 ? -18.675 13.602 -35.953 1.0 51.04 47 A 1 -ATOM 721 N N . LEU A1 1 48 ? -16.51 14.722 -26.348 1.0 13.42 48 A 1 -ATOM 722 C CA . LEU A1 1 48 ? -16.231 15.365 -25.068 1.0 63.04 48 A 1 -ATOM 723 C C . LEU A1 1 48 ? -15.831 16.824 -25.267 1.0 70.54 48 A 1 -ATOM 724 O O . LEU A1 1 48 ? -15.192 17.172 -26.261 1.0 13.22 48 A 1 -ATOM 725 C CB . LEU A1 1 48 ? -15.119 14.616 -24.331 1.0 73.22 48 A 1 -ATOM 726 C CG . LEU A1 1 48 ? -15.103 13.097 -24.507 1.0 23.01 48 A 1 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.517 12.539 -24.464 1.0 2.23 48 A 1 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.418 12.719 -25.812 1.0 62.5 48 A 1 -ATOM 729 H H . LEU A1 1 48 ? -15.763 14.484 -26.935 1.0 13.1 48 A 1 -ATOM 730 H HA . LEU A1 1 48 ? -17.133 15.329 -24.476 1.0 5.14 48 A 1 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.173 14.999 -24.682 1.0 14.35 48 A 1 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.223 14.827 -23.276 1.0 62.22 48 A 1 -ATOM 733 H HG . LEU A1 1 48 ? -14.544 12.653 -23.694 1.0 74.12 48 A 1 -ATOM 734 H HD11 . LEU A1 1 48 ? -16.909 12.475 -25.467 1.0 72.12 48 A 1 -ATOM 735 H HD12 . LEU A1 1 48 ? -17.143 13.191 -23.873 1.0 51.52 48 A 1 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.502 11.555 -24.018 1.0 50.13 48 A 1 -ATOM 737 H HD21 . LEU A1 1 48 ? -13.722 13.496 -26.092 1.0 32.51 48 A 1 -ATOM 738 H HD22 . LEU A1 1 48 ? -15.161 12.603 -26.588 1.0 4.35 48 A 1 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.886 11.787 -25.682 1.0 44.23 48 A 1 -ATOM 740 N N . ILE A1 1 49 ? -16.209 17.67 -24.316 1.0 13.31 49 A 1 -ATOM 741 C CA . ILE A1 1 49 ? -15.887 19.09 -24.386 1.0 13.25 49 A 1 -ATOM 742 C C . ILE A1 1 49 ? -15.495 19.633 -23.015 1.0 73.24 49 A 1 -ATOM 743 O O . ILE A1 1 49 ? -16.186 19.401 -22.023 1.0 20.41 49 A 1 -ATOM 744 C CB . ILE A1 1 49 ? -17.072 19.91 -24.93 1.0 42.12 49 A 1 -ATOM 745 C CG1 . ILE A1 1 49 ? -16.976 20.037 -26.452 1.0 21.4 49 A 1 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.108 21.285 -24.28 1.0 44.11 49 A 1 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.167 19.458 -27.183 1.0 30.32 49 A 1 -ATOM 748 H H . ILE A1 1 49 ? -16.716 17.332 -23.549 1.0 11.12 49 A 1 -ATOM 749 H HA . ILE A1 1 49 ? -15.052 19.21 -25.061 1.0 31.54 49 A 1 -ATOM 750 H HB . ILE A1 1 49 ? -17.985 19.394 -24.676 1.0 10.22 49 A 1 -ATOM 751 H HG12 . ILE A1 1 49 ? -16.9 21.079 -26.716 1.0 52.53 49 A 1 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.092 19.518 -26.794 1.0 23.14 49 A 1 -ATOM 753 H HG21 . ILE A1 1 49 ? -17.468 21.194 -23.266 1.0 54.41 49 A 1 -ATOM 754 H HG22 . ILE A1 1 49 ? -16.113 21.704 -24.271 1.0 2.4 49 A 1 -ATOM 755 H HG23 . ILE A1 1 49 ? -17.766 21.931 -24.84 1.0 53.42 49 A 1 -ATOM 756 H HD11 . ILE A1 1 49 ? -17.994 19.506 -28.248 1.0 43.14 49 A 1 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.305 18.428 -26.888 1.0 61.33 49 A 1 -ATOM 758 H HD13 . ILE A1 1 49 ? -19.052 20.025 -26.937 1.0 3.14 49 A 1 -ATOM 759 N N . PHE A1 1 50 ? -14.383 20.358 -22.969 1.0 0.44 50 A 1 -ATOM 760 C CA . PHE A1 1 50 ? -13.899 20.936 -21.72 1.0 63.4 50 A 1 -ATOM 761 C C . PHE A1 1 50 ? -13.618 22.427 -21.883 1.0 34.31 50 A 1 -ATOM 762 O O . PHE A1 1 50 ? -12.673 22.821 -22.564 1.0 24.03 50 A 1 -ATOM 763 C CB . PHE A1 1 50 ? -12.631 20.214 -21.258 1.0 1.31 50 A 1 -ATOM 764 C CG . PHE A1 1 50 ? -12.262 20.506 -19.831 1.0 63.44 50 A 1 -ATOM 765 C CD1 . PHE A1 1 50 ? -11.525 21.634 -19.509 1.0 63.22 50 A 1 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.651 19.651 -18.813 1.0 31.12 50 A 1 -ATOM 767 C CE1 . PHE A1 1 50 ? -11.184 21.905 -18.197 1.0 44.05 50 A 1 -ATOM 768 C CE2 . PHE A1 1 50 ? -12.313 19.917 -17.499 1.0 53.14 50 A 1 -ATOM 769 C CZ . PHE A1 1 50 ? -11.578 21.045 -17.191 1.0 64.24 50 A 1 -ATOM 770 H H . PHE A1 1 50 ? -13.875 20.509 -23.794 1.0 32.43 50 A 1 -ATOM 771 H HA . PHE A1 1 50 ? -14.668 20.805 -20.975 1.0 55.42 50 A 1 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.777 19.149 -21.351 1.0 72.21 50 A 1 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.805 20.516 -21.884 1.0 52.42 50 A 1 -ATOM 774 H HD1 . PHE A1 1 50 ? -11.216 22.308 -20.296 1.0 64.41 50 A 1 -ATOM 775 H HD2 . PHE A1 1 50 ? -13.226 18.768 -19.052 1.0 25.0 50 A 1 -ATOM 776 H HE1 . PHE A1 1 50 ? -10.608 22.788 -17.961 1.0 33.34 50 A 1 -ATOM 777 H HE2 . PHE A1 1 50 ? -12.622 19.243 -16.715 1.0 34.14 50 A 1 -ATOM 778 H HZ . PHE A1 1 50 ? -11.313 21.255 -16.166 1.0 42.2 50 A 1 -ATOM 779 N N . GLY A1 1 51 ? -14.449 23.251 -21.252 1.0 53.44 51 A 1 -ATOM 780 C CA . GLY A1 1 51 ? -14.275 24.69 -21.34 1.0 33.5 51 A 1 -ATOM 781 C C . GLY A1 1 51 ? -14.662 25.239 -22.699 1.0 34.32 51 A 1 -ATOM 782 O O . GLY A1 1 51 ? -14.58 26.443 -22.936 1.0 0.02 51 A 1 -ATOM 783 H H . GLY A1 1 51 ? -15.186 22.88 -20.724 1.0 14.34 51 A 1 -ATOM 784 H HA2 . GLY A1 1 51 ? -14.886 25.162 -20.585 1.0 71.3 51 A 1 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.239 24.927 -21.151 1.0 2.33 51 A 1 -ATOM 786 N N . GLY A1 1 52 ? -15.085 24.352 -23.595 1.0 51.33 52 A 1 -ATOM 787 C CA . GLY A1 1 52 ? -15.478 24.774 -24.927 1.0 70.11 52 A 1 -ATOM 788 C C . GLY A1 1 52 ? -14.75 24.011 -26.015 1.0 64.35 52 A 1 -ATOM 789 O O . GLY A1 1 52 ? -15.261 23.856 -27.125 1.0 21.12 52 A 1 -ATOM 790 H H . GLY A1 1 52 ? -15.13 23.404 -23.35 1.0 52.33 52 A 1 -ATOM 791 H HA2 . GLY A1 1 52 ? -16.54 24.62 -25.043 1.0 34.31 52 A 1 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.263 25.827 -25.037 1.0 33.12 52 A 1 -ATOM 793 N N . LYS A1 1 53 ? -13.551 23.533 -25.7 1.0 4.12 53 A 1 -ATOM 794 C CA . LYS A1 1 53 ? -12.749 22.782 -26.659 1.0 20.15 53 A 1 -ATOM 795 C C . LYS A1 1 53 ? -12.996 21.283 -26.519 1.0 12.34 53 A 1 -ATOM 796 O O . LYS A1 1 53 ? -13.229 20.784 -25.418 1.0 53.3 53 A 1 -ATOM 797 C CB . LYS A1 1 53 ? -11.262 23.085 -26.46 1.0 12.13 53 A 1 -ATOM 798 C CG . LYS A1 1 53 ? -10.764 22.793 -25.055 1.0 34.42 53 A 1 -ATOM 799 C CD . LYS A1 1 53 ? -10.214 21.381 -24.941 1.0 44.0 53 A 1 -ATOM 800 C CE . LYS A1 1 53 ? -8.987 21.189 -25.82 1.0 75.53 53 A 1 -ATOM 801 N NZ . LYS A1 1 53 ? -7.89 20.49 -25.096 1.0 61.53 53 A 1 -ATOM 802 H H . LYS A1 1 53 ? -13.196 23.689 -24.799 1.0 32.12 53 A 1 -ATOM 803 H HA . LYS A1 1 53 ? -13.041 23.092 -27.65 1.0 74.23 53 A 1 -ATOM 804 H HB2 . LYS A1 1 53 ? -10.689 22.488 -27.154 1.0 34.02 53 A 1 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.089 24.131 -26.67 1.0 32.22 53 A 1 -ATOM 806 H HG2 . LYS A1 1 53 ? -9.982 23.494 -24.807 1.0 24.24 53 A 1 -ATOM 807 H HG3 . LYS A1 1 53 ? -11.585 22.906 -24.361 1.0 53.0 53 A 1 -ATOM 808 H HD2 . LYS A1 1 53 ? -9.939 21.193 -23.914 1.0 22.42 53 A 1 -ATOM 809 H HD3 . LYS A1 1 53 ? -10.978 20.68 -25.246 1.0 0.05 53 A 1 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.268 20.604 -26.683 1.0 25.2 53 A 1 -ATOM 811 H HE3 . LYS A1 1 53 ? -8.635 22.158 -26.141 1.0 75.24 53 A 1 -ATOM 812 H HZ1 . LYS A1 1 53 ? -6.99 20.989 -25.243 1.0 1.33 53 A 1 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.794 19.515 -25.448 1.0 14.14 53 A 1 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.096 20.46 -24.078 1.0 31.25 53 A 1 -ATOM 815 N N . GLN A1 1 54 ? -12.942 20.572 -27.64 1.0 32.1 54 A 1 -ATOM 816 C CA . GLN A1 1 54 ? -13.16 19.13 -27.641 1.0 3.14 54 A 1 -ATOM 817 C C . GLN A1 1 54 ? -11.927 18.393 -27.126 1.0 14.5 54 A 1 -ATOM 818 O O . GLN A1 1 54 ? -10.818 18.928 -27.147 1.0 22.04 54 A 1 -ATOM 819 C CB . GLN A1 1 54 ? -13.506 18.646 -29.05 1.0 14.03 54 A 1 -ATOM 820 C CG . GLN A1 1 54 ? -14.917 18.093 -29.173 1.0 52.41 54 A 1 -ATOM 821 C CD . GLN A1 1 54 ? -15.451 18.166 -30.59 1.0 44.23 54 A 1 -ATOM 822 O OE1 . GLN A1 1 54 ? -15.44 17.176 -31.322 1.0 25.33 54 A 1 -ATOM 823 N NE2 . GLN A1 1 54 ? -15.922 19.343 -30.986 1.0 63.1 54 A 1 -ATOM 824 H H . GLN A1 1 54 ? -12.752 21.027 -28.486 1.0 52.11 54 A 1 -ATOM 825 H HA . GLN A1 1 54 ? -13.99 18.92 -26.983 1.0 62.04 54 A 1 -ATOM 826 H HB2 . GLN A1 1 54 ? -13.405 19.473 -29.737 1.0 31.24 54 A 1 -ATOM 827 H HB3 . GLN A1 1 54 ? -12.813 17.868 -29.331 1.0 25.42 54 A 1 -ATOM 828 H HG2 . GLN A1 1 54 ? -14.914 17.06 -28.859 1.0 52.11 54 A 1 -ATOM 829 H HG3 . GLN A1 1 54 ? -15.57 18.662 -28.528 1.0 53.52 54 A 1 -ATOM 830 H HE21 . GLN A1 1 54 ? -15.898 20.088 -30.349 1.0 45.55 54 A 1 -ATOM 831 H HE22 . GLN A1 1 54 ? -16.272 19.419 -31.897 1.0 62.42 54 A 1 -ATOM 832 N N . LEU A1 1 55 ? -12.129 17.164 -26.664 1.0 51.34 55 A 1 -ATOM 833 C CA . LEU A1 1 55 ? -11.034 16.353 -26.143 1.0 40.45 55 A 1 -ATOM 834 C C . LEU A1 1 55 ? -10.706 15.207 -27.094 1.0 63.5 55 A 1 -ATOM 835 O O . LEU A1 1 55 ? -11.58 14.422 -27.46 1.0 52.11 55 A 1 -ATOM 836 C CB . LEU A1 1 55 ? -11.395 15.8 -24.764 1.0 25.03 55 A 1 -ATOM 837 C CG . LEU A1 1 55 ? -11.813 16.831 -23.715 1.0 41.33 55 A 1 -ATOM 838 C CD1 . LEU A1 1 55 ? -11.987 16.171 -22.357 1.0 33.24 55 A 1 -ATOM 839 C CD2 . LEU A1 1 55 ? -10.791 17.956 -23.636 1.0 52.23 55 A 1 -ATOM 840 H H . LEU A1 1 55 ? -13.035 16.792 -26.674 1.0 12.34 55 A 1 -ATOM 841 H HA . LEU A1 1 55 ? -10.166 16.989 -26.052 1.0 22.21 55 A 1 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.211 15.106 -24.889 1.0 55.1 55 A 1 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.531 15.272 -24.384 1.0 51.11 55 A 1 -ATOM 844 H HG . LEU A1 1 55 ? -12.763 17.261 -24.001 1.0 72.12 55 A 1 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.135 15.541 -22.151 1.0 32.04 55 A 1 -ATOM 846 H HD12 . LEU A1 1 55 ? -12.886 15.571 -22.36 1.0 44.35 55 A 1 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.066 16.932 -21.594 1.0 32.21 55 A 1 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.191 18.84 -24.111 1.0 33.14 55 A 1 -ATOM 849 H HD22 . LEU A1 1 55 ? -9.885 17.655 -24.141 1.0 72.01 55 A 1 -ATOM 850 H HD23 . LEU A1 1 55 ? -10.571 18.171 -22.6 1.0 74.33 55 A 1 -ATOM 851 N N . GLU A1 1 56 ? -9.439 15.115 -27.488 1.0 12.02 56 A 1 -ATOM 852 C CA . GLU A1 1 56 ? -8.996 14.063 -28.395 1.0 31.33 56 A 1 -ATOM 853 C C . GLU A1 1 56 ? -9.123 12.691 -27.739 1.0 62.51 56 A 1 -ATOM 854 O O . GLU A1 1 56 ? -9.651 12.565 -26.634 1.0 51.02 56 A 1 -ATOM 855 C CB . GLU A1 1 56 ? -7.547 14.304 -28.822 1.0 62.01 56 A 1 -ATOM 856 C CG . GLU A1 1 56 ? -7.281 15.722 -29.299 1.0 21.02 56 A 1 -ATOM 857 C CD . GLU A1 1 56 ? -6.596 15.764 -30.651 1.0 1.0 56 A 1 -ATOM 858 O OE1 . GLU A1 1 56 ? -5.755 14.881 -30.918 1.0 61.34 56 A 1 -ATOM 859 O OE2 . GLU A1 1 56 ? -6.902 16.681 -31.442 1.0 22.01 56 A 1 -ATOM 860 H H . GLU A1 1 56 ? -8.788 15.771 -27.161 1.0 72.43 56 A 1 -ATOM 861 H HA . GLU A1 1 56 ? -9.629 14.09 -29.269 1.0 4.21 56 A 1 -ATOM 862 H HB2 . GLU A1 1 56 ? -6.898 14.1 -27.983 1.0 41.11 56 A 1 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.304 13.625 -29.626 1.0 51.02 56 A 1 -ATOM 864 H HG2 . GLU A1 1 56 ? -8.222 16.246 -29.373 1.0 71.31 56 A 1 -ATOM 865 H HG3 . GLU A1 1 56 ? -6.65 16.219 -28.576 1.0 60.44 56 A 1 -ATOM 866 N N . ASP A1 1 57 ? -8.635 11.665 -28.428 1.0 71.03 57 A 1 -ATOM 867 C CA . ASP A1 1 57 ? -8.693 10.302 -27.914 1.0 63.41 57 A 1 -ATOM 868 C C . ASP A1 1 57 ? -7.701 10.11 -26.771 1.0 21.4 57 A 1 -ATOM 869 O O . ASP A1 1 57 ? -7.874 9.23 -25.927 1.0 43.31 57 A 1 -ATOM 870 C CB . ASP A1 1 57 ? -8.402 9.299 -29.032 1.0 45.31 57 A 1 -ATOM 871 C CG . ASP A1 1 57 ? -9.234 9.557 -30.272 1.0 55.43 57 A 1 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.478 9.52 -30.169 1.0 72.35 57 A 1 -ATOM 873 O OD2 . ASP A1 1 57 ? -8.642 9.796 -31.346 1.0 15.11 57 A 1 -ATOM 874 H H . ASP A1 1 57 ? -8.226 11.829 -29.304 1.0 23.12 57 A 1 -ATOM 875 H HA . ASP A1 1 57 ? -9.691 10.13 -27.54 1.0 62.14 57 A 1 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.358 9.365 -29.303 1.0 24.44 57 A 1 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.616 8.302 -28.677 1.0 64.03 57 A 1 -ATOM 878 N N . SER A1 1 58 ? -6.661 10.938 -26.751 1.0 32.51 58 A 1 -ATOM 879 C CA . SER A1 1 58 ? -5.639 10.856 -25.714 1.0 62.24 58 A 1 -ATOM 880 C C . SER A1 1 58 ? -5.708 12.065 -24.787 1.0 2.12 58 A 1 -ATOM 881 O O . SER A1 1 58 ? -4.882 12.219 -23.888 1.0 12.21 58 A 1 -ATOM 882 C CB . SER A1 1 58 ? -4.249 10.762 -26.346 1.0 65.11 58 A 1 -ATOM 883 O OG . SER A1 1 58 ? -3.273 10.405 -25.382 1.0 34.21 58 A 1 -ATOM 884 H H . SER A1 1 58 ? -6.579 11.618 -27.452 1.0 21.03 58 A 1 -ATOM 885 H HA . SER A1 1 58 ? -5.823 9.963 -25.137 1.0 33.55 58 A 1 -ATOM 886 H HB2 . SER A1 1 58 ? -4.259 10.014 -27.124 1.0 31.42 58 A 1 -ATOM 887 H HB3 . SER A1 1 58 ? -3.984 11.719 -26.771 1.0 40.4 58 A 1 -ATOM 888 H HG . SER A1 1 58 ? -2.763 9.658 -25.704 1.0 10.23 58 A 1 -ATOM 889 N N . ASN A1 1 59 ? -6.699 12.921 -25.013 1.0 35.41 59 A 1 -ATOM 890 C CA . ASN A1 1 59 ? -6.877 14.117 -24.198 1.0 52.34 59 A 1 -ATOM 891 C C . ASN A1 1 59 ? -7.676 13.803 -22.937 1.0 4.01 59 A 1 -ATOM 892 O O . ASN A1 1 59 ? -8.876 14.066 -22.868 1.0 42.21 59 A 1 -ATOM 893 C CB . ASN A1 1 59 ? -7.585 15.208 -25.005 1.0 21.1 59 A 1 -ATOM 894 C CG . ASN A1 1 59 ? -7.348 16.593 -24.436 1.0 14.54 59 A 1 -ATOM 895 O OD1 . ASN A1 1 59 ? -7.828 16.921 -23.35 1.0 24.42 59 A 1 -ATOM 896 N ND2 . ASN A1 1 59 ? -6.606 17.415 -25.169 1.0 14.44 59 A 1 -ATOM 897 H H . ASN A1 1 59 ? -7.327 12.743 -25.745 1.0 5.51 59 A 1 -ATOM 898 H HA . ASN A1 1 59 ? -5.898 14.472 -23.912 1.0 74.51 59 A 1 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.219 15.19 -26.021 1.0 43.43 59 A 1 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.647 15.015 -25.006 1.0 11.21 59 A 1 -ATOM 901 H HD21 . ASN A1 1 59 ? -6.258 17.087 -26.024 1.0 21.33 59 A 1 -ATOM 902 H HD22 . ASN A1 1 59 ? -6.437 18.317 -24.824 1.0 12.0 59 A 1 -ATOM 903 N N . ALA A1 1 60 ? -7.0 13.239 -21.941 1.0 13.11 60 A 1 -ATOM 904 C CA . ALA A1 1 60 ? -7.645 12.892 -20.681 1.0 35.51 60 A 1 -ATOM 905 C C . ALA A1 1 60 ? -6.623 12.418 -19.653 1.0 74.01 60 A 1 -ATOM 906 O O . ALA A1 1 60 ? -6.203 13.182 -18.784 1.0 74.24 60 A 1 -ATOM 907 C CB . ALA A1 1 60 ? -8.704 11.822 -20.907 1.0 64.13 60 A 1 -ATOM 908 H H . ALA A1 1 60 ? -6.045 13.054 -22.056 1.0 31.12 60 A 1 -ATOM 909 H HA . ALA A1 1 60 ? -8.138 13.776 -20.303 1.0 20.01 60 A 1 -ATOM 910 H HB1 . ALA A1 1 60 ? -8.246 10.955 -21.361 1.0 72.33 60 A 1 -ATOM 911 H HB2 . ALA A1 1 60 ? -9.143 11.544 -19.961 1.0 25.02 60 A 1 -ATOM 912 H HB3 . ALA A1 1 60 ? -9.471 12.208 -21.561 1.0 51.02 60 A 1 -ATOM 913 N N . MET A1 1 61 ? -6.228 11.154 -19.758 1.0 21.52 61 A 1 -ATOM 914 C CA . MET A1 1 61 ? -5.254 10.579 -18.837 1.0 32.03 61 A 1 -ATOM 915 C C . MET A1 1 61 ? -3.851 11.099 -19.134 1.0 55.14 61 A 1 -ATOM 916 O O . MET A1 1 61 ? -3.214 11.717 -18.281 1.0 73.23 61 A 1 -ATOM 917 C CB . MET A1 1 61 ? -5.274 9.052 -18.927 1.0 33.12 61 A 1 -ATOM 918 C CG . MET A1 1 61 ? -6.672 8.469 -19.059 1.0 10.31 61 A 1 -ATOM 919 S SD . MET A1 1 61 ? -7.819 9.13 -17.835 1.0 3.45 61 A 1 -ATOM 920 C CE . MET A1 1 61 ? -9.369 9.011 -18.724 1.0 11.34 61 A 1 -ATOM 921 H H . MET A1 1 61 ? -6.599 10.593 -20.471 1.0 44.35 61 A 1 -ATOM 922 H HA . MET A1 1 61 ? -5.53 10.875 -17.836 1.0 14.21 61 A 1 -ATOM 923 H HB2 . MET A1 1 61 ? -4.697 8.746 -19.787 1.0 14.23 61 A 1 -ATOM 924 H HB3 . MET A1 1 61 ? -4.821 8.644 -18.036 1.0 0.24 61 A 1 -ATOM 925 H HG2 . MET A1 1 61 ? -7.051 8.696 -20.044 1.0 62.14 61 A 1 -ATOM 926 H HG3 . MET A1 1 61 ? -6.613 7.398 -18.936 1.0 32.0 61 A 1 -ATOM 927 H HE1 . MET A1 1 61 ? -9.979 9.874 -18.499 1.0 54.23 61 A 1 -ATOM 928 H HE2 . MET A1 1 61 ? -9.174 8.975 -19.785 1.0 64.31 61 A 1 -ATOM 929 H HE3 . MET A1 1 61 ? -9.889 8.114 -18.422 1.0 24.11 61 A 1 -ATOM 930 N N . SER A1 1 62 ? -3.376 10.845 -20.349 1.0 73.15 62 A 1 -ATOM 931 C CA . SER A1 1 62 ? -2.047 11.284 -20.758 1.0 12.22 62 A 1 -ATOM 932 C C . SER A1 1 62 ? -1.912 12.798 -20.63 1.0 13.52 62 A 1 -ATOM 933 O O . SER A1 1 62 ? -0.836 13.313 -20.327 1.0 42.51 62 A 1 -ATOM 934 C CB . SER A1 1 62 ? -1.766 10.856 -22.199 1.0 62.33 62 A 1 -ATOM 935 O OG . SER A1 1 62 ? -0.388 10.583 -22.391 1.0 14.13 62 A 1 -ATOM 936 H H . SER A1 1 62 ? -3.932 10.348 -20.985 1.0 74.25 62 A 1 -ATOM 937 H HA . SER A1 1 62 ? -1.327 10.814 -20.104 1.0 74.15 62 A 1 -ATOM 938 H HB2 . SER A1 1 62 ? -2.331 9.964 -22.424 1.0 54.41 62 A 1 -ATOM 939 H HB3 . SER A1 1 62 ? -2.061 11.649 -22.872 1.0 23.45 62 A 1 -ATOM 940 H HG . SER A1 1 62 ? -0.226 10.389 -23.317 1.0 1.23 62 A 1 -ATOM 941 N N . ASP A1 1 63 ? -3.012 13.506 -20.863 1.0 34.33 63 A 1 -ATOM 942 C CA . ASP A1 1 63 ? -3.019 14.961 -20.773 1.0 10.21 63 A 1 -ATOM 943 C C . ASP A1 1 63 ? -2.648 15.421 -19.366 1.0 63.54 63 A 1 -ATOM 944 O O . ASP A1 1 63 ? -2.19 16.547 -19.171 1.0 31.33 63 A 1 -ATOM 945 C CB . ASP A1 1 63 ? -4.394 15.511 -21.156 1.0 21.1 63 A 1 -ATOM 946 C CG . ASP A1 1 63 ? -4.337 16.963 -21.587 1.0 12.2 63 A 1 -ATOM 947 O OD1 . ASP A1 1 63 ? -3.937 17.811 -20.762 1.0 53.24 63 A 1 -ATOM 948 O OD2 . ASP A1 1 63 ? -4.694 17.252 -22.749 1.0 3.13 63 A 1 -ATOM 949 H H . ASP A1 1 63 ? -3.84 13.037 -21.1 1.0 14.4 63 A 1 -ATOM 950 H HA . ASP A1 1 63 ? -2.284 15.34 -21.467 1.0 72.42 63 A 1 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.793 14.928 -21.973 1.0 63.34 63 A 1 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.056 15.431 -20.306 1.0 44.51 63 A 1 -ATOM 953 N N . TYR A1 1 64 ? -2.849 14.542 -18.39 1.0 43.15 64 A 1 -ATOM 954 C CA . TYR A1 1 64 ? -2.538 14.859 -17.001 1.0 74.44 64 A 1 -ATOM 955 C C . TYR A1 1 64 ? -3.586 15.796 -16.409 1.0 35.31 64 A 1 -ATOM 956 O O . TYR A1 1 64 ? -3.257 16.741 -15.694 1.0 63.11 64 A 1 -ATOM 957 C CB . TYR A1 1 64 ? -1.152 15.496 -16.899 1.0 41.31 64 A 1 -ATOM 958 C CG . TYR A1 1 64 ? -0.104 14.807 -17.744 1.0 35.31 64 A 1 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.224 13.474 -17.528 1.0 10.21 64 A 1 -ATOM 960 C CD2 . TYR A1 1 64 ? 0.556 15.488 -18.759 1.0 61.0 64 A 1 -ATOM 961 C CE1 . TYR A1 1 64 ? 1.181 12.841 -18.297 1.0 31.32 64 A 1 -ATOM 962 C CE2 . TYR A1 1 64 ? 1.513 14.862 -19.534 1.0 3.01 64 A 1 -ATOM 963 C CZ . TYR A1 1 64 ? 1.823 13.539 -19.299 1.0 35.43 64 A 1 -ATOM 964 O OH . TYR A1 1 64 ? 2.775 12.911 -20.068 1.0 23.32 64 A 1 -ATOM 965 H H . TYR A1 1 64 ? -3.216 13.66 -18.609 1.0 10.22 64 A 1 -ATOM 966 H HA . TYR A1 1 64 ? -2.541 13.934 -16.442 1.0 40.51 64 A 1 -ATOM 967 H HB2 . TYR A1 1 64 ? -1.211 16.525 -17.22 1.0 75.32 64 A 1 -ATOM 968 H HB3 . TYR A1 1 64 ? -0.823 15.464 -15.871 1.0 32.34 64 A 1 -ATOM 969 H HD1 . TYR A1 1 64 ? -0.281 12.93 -16.743 1.0 1.35 64 A 1 -ATOM 970 H HD2 . TYR A1 1 64 ? 0.312 16.525 -18.941 1.0 32.41 64 A 1 -ATOM 971 H HE1 . TYR A1 1 64 ? 1.423 11.804 -18.113 1.0 52.21 64 A 1 -ATOM 972 H HE2 . TYR A1 1 64 ? 2.016 15.408 -20.318 1.0 43.14 64 A 1 -ATOM 973 H HH . TYR A1 1 64 ? 3.016 12.076 -19.66 1.0 23.33 64 A 1 -ATOM 974 N N . ASN A1 1 65 ? -4.852 15.525 -16.712 1.0 61.21 65 A 1 -ATOM 975 C CA . ASN A1 1 65 ? -5.95 16.343 -16.21 1.0 70.22 65 A 1 -ATOM 976 C C . ASN A1 1 65 ? -7.038 15.472 -15.59 1.0 21.44 65 A 1 -ATOM 977 O O . ASN A1 1 65 ? -8.109 15.96 -15.229 1.0 22.24 65 A 1 -ATOM 978 C CB . ASN A1 1 65 ? -6.541 17.189 -17.34 1.0 30.31 65 A 1 -ATOM 979 C CG . ASN A1 1 65 ? -7.412 18.317 -16.822 1.0 75.23 65 A 1 -ATOM 980 O OD1 . ASN A1 1 65 ? -7.212 18.812 -15.713 1.0 74.2 65 A 1 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.386 18.728 -17.626 1.0 12.4 65 A 1 -ATOM 982 H H . ASN A1 1 65 ? -5.052 14.757 -17.287 1.0 72.01 65 A 1 -ATOM 983 H HA . ASN A1 1 65 ? -5.554 16.999 -15.45 1.0 43.44 65 A 1 -ATOM 984 H HB2 . ASN A1 1 65 ? -5.736 17.618 -17.919 1.0 12.24 65 A 1 -ATOM 985 H HB3 . ASN A1 1 65 ? -7.141 16.558 -17.978 1.0 73.02 65 A 1 -ATOM 986 H HD21 . ASN A1 1 65 ? -8.487 18.288 -18.496 1.0 23.44 65 A 1 -ATOM 987 H HD22 . ASN A1 1 65 ? -8.964 19.457 -17.317 1.0 32.24 65 A 1 -ATOM 988 N N . VAL A1 1 66 ? -6.755 14.178 -15.468 1.0 11.4 66 A 1 -ATOM 989 C CA . VAL A1 1 66 ? -7.708 13.239 -14.889 1.0 70.45 66 A 1 -ATOM 990 C C . VAL A1 1 66 ? -7.51 13.113 -13.383 1.0 73.11 66 A 1 -ATOM 991 O O . VAL A1 1 66 ? -6.424 12.77 -12.917 1.0 33.12 66 A 1 -ATOM 992 C CB . VAL A1 1 66 ? -7.581 11.844 -15.531 1.0 40.11 66 A 1 -ATOM 993 C CG1 . VAL A1 1 66 ? -6.21 11.249 -15.248 1.0 32.21 66 A 1 -ATOM 994 C CG2 . VAL A1 1 66 ? -8.685 10.925 -15.03 1.0 25.13 66 A 1 -ATOM 995 H H . VAL A1 1 66 ? -5.885 13.849 -15.774 1.0 25.31 66 A 1 -ATOM 996 H HA . VAL A1 1 66 ? -8.704 13.611 -15.082 1.0 44.24 66 A 1 -ATOM 997 H HB . VAL A1 1 66 ? -7.689 11.951 -16.6 1.0 65.05 66 A 1 -ATOM 998 H HG11 . VAL A1 1 66 ? -6.034 10.419 -15.916 1.0 62.5 66 A 1 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.452 12.002 -15.4 1.0 4.5 66 A 1 -ATOM 1000 H HG13 . VAL A1 1 66 ? -6.173 10.901 -14.226 1.0 12.32 66 A 1 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.9 11.151 -13.996 1.0 23.4 66 A 1 -ATOM 1002 H HG22 . VAL A1 1 66 ? -9.574 11.074 -15.624 1.0 64.2 66 A 1 -ATOM 1003 H HG23 . VAL A1 1 66 ? -8.363 9.897 -15.114 1.0 74.31 66 A 1 -ATOM 1004 N N . GLN A1 1 67 ? -8.568 13.392 -12.628 1.0 5.43 67 A 1 -ATOM 1005 C CA . GLN A1 1 67 ? -8.509 13.31 -11.173 1.0 15.5 67 A 1 -ATOM 1006 C C . GLN A1 1 67 ? -9.566 12.349 -10.639 1.0 62.54 67 A 1 -ATOM 1007 O O . GLN A1 1 67 ? -10.355 11.79 -11.402 1.0 44.01 67 A 1 -ATOM 1008 C CB . GLN A1 1 67 ? -8.705 14.696 -10.555 1.0 35.11 67 A 1 -ATOM 1009 C CG . GLN A1 1 67 ? -10.05 15.324 -10.884 1.0 11.21 67 A 1 -ATOM 1010 C CD . GLN A1 1 67 ? -10.464 16.378 -9.876 1.0 34.44 67 A 1 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.496 16.122 -8.671 1.0 41.54 67 A 1 -ATOM 1012 N NE2 . GLN A1 1 67 ? -10.785 17.57 -10.363 1.0 50.51 67 A 1 -ATOM 1013 H H . GLN A1 1 67 ? -9.405 13.66 -13.058 1.0 54.23 67 A 1 -ATOM 1014 H HA . GLN A1 1 67 ? -7.533 12.94 -10.901 1.0 21.13 67 A 1 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.624 14.613 -9.481 1.0 61.05 67 A 1 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.928 15.352 -10.918 1.0 21.05 67 A 1 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.989 15.786 -11.858 1.0 63.24 67 A 1 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.801 14.548 -10.901 1.0 63.02 67 A 1 -ATOM 1019 H HE21 . GLN A1 1 67 ? -10.738 17.701 -11.334 1.0 0.12 67 A 1 -ATOM 1020 H HE22 . GLN A1 1 67 ? -11.057 18.27 -9.734 1.0 72.41 67 A 1 -ATOM 1021 N N . LYS A1 1 68 ? -9.576 12.159 -9.324 1.0 63.33 68 A 1 -ATOM 1022 C CA . LYS A1 1 68 ? -10.535 11.265 -8.687 1.0 34.0 68 A 1 -ATOM 1023 C C . LYS A1 1 68 ? -11.964 11.643 -9.064 1.0 33.21 68 A 1 -ATOM 1024 O O . LYS A1 1 68 ? -12.846 10.787 -9.124 1.0 33.01 68 A 1 -ATOM 1025 C CB . LYS A1 1 68 ? -10.37 11.306 -7.166 1.0 41.41 68 A 1 -ATOM 1026 C CG . LYS A1 1 68 ? -11.212 10.276 -6.434 1.0 61.44 68 A 1 -ATOM 1027 C CD . LYS A1 1 68 ? -10.715 8.863 -6.694 1.0 43.41 68 A 1 -ATOM 1028 C CE . LYS A1 1 68 ? -9.68 8.439 -5.664 1.0 23.43 68 A 1 -ATOM 1029 N NZ . LYS A1 1 68 ? -10.241 8.43 -4.284 1.0 52.05 68 A 1 -ATOM 1030 H H . LYS A1 1 68 ? -8.921 12.633 -8.768 1.0 75.53 68 A 1 -ATOM 1031 H HA . LYS A1 1 68 ? -10.337 10.263 -9.035 1.0 31.4 68 A 1 -ATOM 1032 H HB2 . LYS A1 1 68 ? -9.332 11.13 -6.924 1.0 51.5 68 A 1 -ATOM 1033 H HB3 . LYS A1 1 68 ? -10.652 12.288 -6.812 1.0 62.4 68 A 1 -ATOM 1034 H HG2 . LYS A1 1 68 ? -11.165 10.473 -5.374 1.0 22.33 68 A 1 -ATOM 1035 H HG3 . LYS A1 1 68 ? -12.236 10.355 -6.772 1.0 45.02 68 A 1 -ATOM 1036 H HD2 . LYS A1 1 68 ? -11.551 8.182 -6.649 1.0 14.2 68 A 1 -ATOM 1037 H HD3 . LYS A1 1 68 ? -10.268 8.823 -7.678 1.0 13.53 68 A 1 -ATOM 1038 H HE2 . LYS A1 1 68 ? -9.334 7.446 -5.908 1.0 43.13 68 A 1 -ATOM 1039 H HE3 . LYS A1 1 68 ? -8.85 9.129 -5.701 1.0 63.42 68 A 1 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -11.25 8.178 -4.311 1.0 1.54 68 A 1 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -10.14 9.371 -3.852 1.0 73.32 68 A 1 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.737 7.736 -3.698 1.0 23.44 68 A 1 -ATOM 1043 N N . GLU A1 1 69 ? -12.184 12.929 -9.318 1.0 51.1 69 A 1 -ATOM 1044 C CA . GLU A1 1 69 ? -13.506 13.418 -9.69 1.0 15.41 69 A 1 -ATOM 1045 C C . GLU A1 1 69 ? -13.402 14.711 -10.495 1.0 20.25 69 A 1 -ATOM 1046 O O . GLU A1 1 69 ? -13.245 15.794 -9.931 1.0 55.15 69 A 1 -ATOM 1047 C CB . GLU A1 1 69 ? -14.359 13.65 -8.44 1.0 42.14 69 A 1 -ATOM 1048 C CG . GLU A1 1 69 ? -13.648 14.445 -7.358 1.0 32.44 69 A 1 -ATOM 1049 C CD . GLU A1 1 69 ? -14.544 15.486 -6.715 1.0 60.3 69 A 1 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.769 16.542 -7.342 1.0 52.11 69 A 1 -ATOM 1051 O OE2 . GLU A1 1 69 ? -15.019 15.245 -5.586 1.0 33.22 69 A 1 -ATOM 1052 H H . GLU A1 1 69 ? -11.44 13.563 -9.253 1.0 51.55 69 A 1 -ATOM 1053 H HA . GLU A1 1 69 ? -13.979 12.665 -10.302 1.0 21.13 69 A 1 -ATOM 1054 H HB2 . GLU A1 1 69 ? -15.253 14.186 -8.723 1.0 70.35 69 A 1 -ATOM 1055 H HB3 . GLU A1 1 69 ? -14.64 12.692 -8.029 1.0 25.14 69 A 1 -ATOM 1056 H HG2 . GLU A1 1 69 ? -13.309 13.763 -6.592 1.0 60.54 69 A 1 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.797 14.944 -7.796 1.0 2.43 69 A 1 -ATOM 1058 N N . SER A1 1 70 ? -13.489 14.587 -11.815 1.0 51.41 70 A 1 -ATOM 1059 C CA . SER A1 1 70 ? -13.4 15.744 -12.698 1.0 50.24 70 A 1 -ATOM 1060 C C . SER A1 1 70 ? -14.717 15.968 -13.435 1.0 72.1 70 A 1 -ATOM 1061 O O . SER A1 1 70 ? -15.397 15.016 -13.82 1.0 13.02 70 A 1 -ATOM 1062 C CB . SER A1 1 70 ? -12.264 15.557 -13.706 1.0 75.43 70 A 1 -ATOM 1063 O OG . SER A1 1 70 ? -11.478 16.73 -13.812 1.0 45.33 70 A 1 -ATOM 1064 H H . SER A1 1 70 ? -13.614 13.696 -12.204 1.0 42.55 70 A 1 -ATOM 1065 H HA . SER A1 1 70 ? -13.19 16.611 -12.089 1.0 61.25 70 A 1 -ATOM 1066 H HB2 . SER A1 1 70 ? -11.633 14.742 -13.386 1.0 1.23 70 A 1 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.682 15.328 -14.676 1.0 50.33 70 A 1 -ATOM 1068 H HG . SER A1 1 70 ? -12.049 17.487 -13.96 1.0 14.24 70 A 1 -ATOM 1069 N N . THR A1 1 71 ? -15.072 17.234 -13.628 1.0 52.55 71 A 1 -ATOM 1070 C CA . THR A1 1 71 ? -16.308 17.585 -14.317 1.0 43.33 71 A 1 -ATOM 1071 C C . THR A1 1 71 ? -16.058 17.84 -15.799 1.0 63.44 71 A 1 -ATOM 1072 O O . THR A1 1 71 ? -15.341 18.771 -16.168 1.0 13.52 71 A 1 -ATOM 1073 C CB . THR A1 1 71 ? -16.962 18.834 -13.697 1.0 4.41 71 A 1 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.955 19.785 -13.334 1.0 4.41 71 A 1 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.782 18.463 -12.471 1.0 4.35 71 A 1 -ATOM 1076 H H . THR A1 1 71 ? -14.488 17.949 -13.299 1.0 14.04 71 A 1 -ATOM 1077 H HA . THR A1 1 71 ? -16.994 16.757 -14.215 1.0 24.13 71 A 1 -ATOM 1078 H HB . THR A1 1 71 ? -17.619 19.28 -14.43 1.0 70.41 71 A 1 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.368 20.549 -12.924 1.0 53.11 71 A 1 -ATOM 1080 H HG21 . THR A1 1 71 ? -17.373 17.57 -12.022 1.0 12.42 71 A 1 -ATOM 1081 H HG22 . THR A1 1 71 ? -18.805 18.283 -12.763 1.0 75.2 71 A 1 -ATOM 1082 H HG23 . THR A1 1 71 ? -17.748 19.273 -11.757 1.0 31.12 71 A 1 -ATOM 1083 N N . LEU A1 1 72 ? -16.652 17.007 -16.646 1.0 74.32 72 A 1 -ATOM 1084 C CA . LEU A1 1 72 ? -16.495 17.142 -18.09 1.0 62.12 72 A 1 -ATOM 1085 C C . LEU A1 1 72 ? -17.852 17.202 -18.783 1.0 14.1 72 A 1 -ATOM 1086 O O . LEU A1 1 72 ? -18.819 16.586 -18.333 1.0 22.33 72 A 1 -ATOM 1087 C CB . LEU A1 1 72 ? -15.677 15.974 -18.645 1.0 54.24 72 A 1 -ATOM 1088 C CG . LEU A1 1 72 ? -15.846 15.686 -20.138 1.0 12.34 72 A 1 -ATOM 1089 C CD1 . LEU A1 1 72 ? -15.307 16.841 -20.968 1.0 71.53 72 A 1 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.15 14.386 -20.512 1.0 45.31 72 A 1 -ATOM 1091 H H . LEU A1 1 72 ? -17.211 16.283 -16.293 1.0 40.44 72 A 1 -ATOM 1092 H HA . LEU A1 1 72 ? -15.966 18.064 -18.281 1.0 22.23 72 A 1 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.635 16.186 -18.466 1.0 24.33 72 A 1 -ATOM 1094 H HB3 . LEU A1 1 72 ? -15.962 15.085 -18.101 1.0 64.44 72 A 1 -ATOM 1095 H HG . LEU A1 1 72 ? -16.899 15.579 -20.36 1.0 60.22 72 A 1 -ATOM 1096 H HD11 . LEU A1 1 72 ? -16.044 17.131 -21.702 1.0 22.12 72 A 1 -ATOM 1097 H HD12 . LEU A1 1 72 ? -14.402 16.531 -21.47 1.0 11.12 72 A 1 -ATOM 1098 H HD13 . LEU A1 1 72 ? -15.091 17.679 -20.322 1.0 74.11 72 A 1 -ATOM 1099 H HD21 . LEU A1 1 72 ? -15.669 13.925 -21.339 1.0 45.11 72 A 1 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.157 13.718 -19.664 1.0 64.51 72 A 1 -ATOM 1101 H HD23 . LEU A1 1 72 ? -14.128 14.594 -20.798 1.0 15.53 72 A 1 -ATOM 1102 N N . HIS A1 1 73 ? -17.918 17.947 -19.882 1.0 22.1 73 A 1 -ATOM 1103 C CA . HIS A1 1 73 ? -19.157 18.085 -20.639 1.0 43.22 73 A 1 -ATOM 1104 C C . HIS A1 1 73 ? -19.179 17.125 -21.825 1.0 1.12 73 A 1 -ATOM 1105 O O . HIS A1 1 73 ? -18.312 17.18 -22.698 1.0 41.41 73 A 1 -ATOM 1106 C CB . HIS A1 1 73 ? -19.321 19.524 -21.13 1.0 34.11 73 A 1 -ATOM 1107 C CG . HIS A1 1 73 ? -20.679 19.813 -21.694 1.0 25.31 73 A 1 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.391 20.955 -21.394 1.0 22.31 73 A 1 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.453 19.101 -22.546 1.0 30.12 73 A 1 -ATOM 1110 C CE1 . HIS A1 1 73 ? -22.545 20.932 -22.035 1.0 74.03 73 A 1 -ATOM 1111 N NE2 . HIS A1 1 73 ? -22.608 19.818 -22.742 1.0 22.32 73 A 1 -ATOM 1112 H H . HIS A1 1 73 ? -17.114 18.414 -20.191 1.0 41.1 73 A 1 -ATOM 1113 H HA . HIS A1 1 73 ? -19.977 17.843 -19.981 1.0 23.25 73 A 1 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.155 20.2 -20.304 1.0 51.13 73 A 1 -ATOM 1115 H HB3 . HIS A1 1 73 ? -18.592 19.72 -21.902 1.0 64.13 73 A 1 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.095 21.674 -20.798 1.0 63.31 73 A 1 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.209 18.146 -22.989 1.0 71.43 73 A 1 -ATOM 1118 H HE1 . HIS A1 1 73 ? -23.309 21.694 -21.991 1.0 3.34 73 A 1 -ATOM 1119 N N . LEU A1 1 74 ? -20.174 16.246 -21.849 1.0 31.4 74 A 1 -ATOM 1120 C CA . LEU A1 1 74 ? -20.309 15.272 -22.927 1.0 41.22 74 A 1 -ATOM 1121 C C . LEU A1 1 74 ? -21.536 15.573 -23.782 1.0 21.0 74 A 1 -ATOM 1122 O O . LEU A1 1 74 ? -22.666 15.551 -23.294 1.0 70.53 74 A 1 -ATOM 1123 C CB . LEU A1 1 74 ? -20.407 13.857 -22.354 1.0 42.32 74 A 1 -ATOM 1124 C CG . LEU A1 1 74 ? -21.014 12.8 -23.277 1.0 13.02 74 A 1 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.296 12.785 -24.617 1.0 50.12 74 A 1 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.958 11.427 -22.624 1.0 22.4 74 A 1 -ATOM 1127 H H . LEU A1 1 74 ? -20.834 16.25 -21.125 1.0 53.04 74 A 1 -ATOM 1128 H HA . LEU A1 1 74 ? -19.428 15.341 -23.547 1.0 65.43 74 A 1 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.41 13.536 -22.095 1.0 22.02 74 A 1 -ATOM 1130 H HB3 . LEU A1 1 74 ? -21.012 13.905 -21.46 1.0 20.31 74 A 1 -ATOM 1131 H HG . LEU A1 1 74 ? -22.052 13.043 -23.458 1.0 34.12 74 A 1 -ATOM 1132 H HD11 . LEU A1 1 74 ? -20.256 11.774 -24.993 1.0 33.01 74 A 1 -ATOM 1133 H HD12 . LEU A1 1 74 ? -19.292 13.162 -24.492 1.0 1.34 74 A 1 -ATOM 1134 H HD13 . LEU A1 1 74 ? -20.83 13.41 -25.318 1.0 63.14 74 A 1 -ATOM 1135 H HD21 . LEU A1 1 74 ? -19.928 11.116 -22.527 1.0 12.32 74 A 1 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.492 10.715 -23.236 1.0 54.43 74 A 1 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.414 11.474 -21.646 1.0 14.02 74 A 1 -ATOM 1138 N N . VAL A1 1 75 ? -21.306 15.852 -25.061 1.0 43.5 75 A 1 -ATOM 1139 C CA . VAL A1 1 75 ? -22.392 16.154 -25.985 1.0 52.32 75 A 1 -ATOM 1140 C C . VAL A1 1 75 ? -22.532 15.066 -27.043 1.0 61.15 75 A 1 -ATOM 1141 O O . VAL A1 1 75 ? -21.606 14.813 -27.816 1.0 54.31 75 A 1 -ATOM 1142 C CB . VAL A1 1 75 ? -22.175 17.51 -26.684 1.0 24.5 75 A 1 -ATOM 1143 C CG1 . VAL A1 1 75 ? -22.475 18.656 -25.731 1.0 55.3 75 A 1 -ATOM 1144 C CG2 . VAL A1 1 75 ? -20.755 17.61 -27.22 1.0 64.14 75 A 1 -ATOM 1145 H H . VAL A1 1 75 ? -20.383 15.855 -25.391 1.0 70.11 75 A 1 -ATOM 1146 H HA . VAL A1 1 75 ? -23.309 16.21 -25.416 1.0 60.52 75 A 1 -ATOM 1147 H HB . VAL A1 1 75 ? -22.858 17.575 -27.518 1.0 44.41 75 A 1 -ATOM 1148 H HG11 . VAL A1 1 75 ? -21.558 19.173 -25.489 1.0 31.54 75 A 1 -ATOM 1149 H HG12 . VAL A1 1 75 ? -23.164 19.344 -26.2 1.0 61.34 75 A 1 -ATOM 1150 H HG13 . VAL A1 1 75 ? -22.917 18.265 -24.826 1.0 54.52 75 A 1 -ATOM 1151 H HG21 . VAL A1 1 75 ? -20.599 16.85 -27.972 1.0 5.24 75 A 1 -ATOM 1152 H HG22 . VAL A1 1 75 ? -20.604 18.586 -27.657 1.0 61.35 75 A 1 -ATOM 1153 H HG23 . VAL A1 1 75 ? -20.053 17.466 -26.412 1.0 24.43 75 A 1 -ATOM 1154 N N . LEU A1 1 76 ? -23.694 14.424 -27.074 1.0 35.1 76 A 1 -ATOM 1155 C CA . LEU A1 1 76 ? -23.957 13.362 -28.039 1.0 22.53 76 A 1 -ATOM 1156 C C . LEU A1 1 76 ? -25.073 13.761 -28.999 1.0 2.14 76 A 1 -ATOM 1157 O O . LEU A1 1 76 ? -26.09 14.319 -28.586 1.0 21.5 76 A 1 -ATOM 1158 C CB . LEU A1 1 76 ? -24.331 12.068 -27.313 1.0 73.12 76 A 1 -ATOM 1159 C CG . LEU A1 1 76 ? -23.826 11.934 -25.876 1.0 64.45 76 A 1 -ATOM 1160 C CD1 . LEU A1 1 76 ? -24.855 12.474 -24.896 1.0 24.13 76 A 1 -ATOM 1161 C CD2 . LEU A1 1 76 ? -23.496 10.482 -25.561 1.0 22.03 76 A 1 -ATOM 1162 H H . LEU A1 1 76 ? -24.394 14.669 -26.433 1.0 44.32 76 A 1 -ATOM 1163 H HA . LEU A1 1 76 ? -23.052 13.198 -28.605 1.0 53.04 76 A 1 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.408 12.001 -27.292 1.0 71.31 76 A 1 -ATOM 1165 H HB3 . LEU A1 1 76 ? -23.932 11.242 -27.884 1.0 62.14 76 A 1 -ATOM 1166 H HG . LEU A1 1 76 ? -22.921 12.515 -25.764 1.0 42.11 76 A 1 -ATOM 1167 H HD11 . LEU A1 1 76 ? -25.455 13.227 -25.383 1.0 12.14 76 A 1 -ATOM 1168 H HD12 . LEU A1 1 76 ? -24.349 12.91 -24.047 1.0 23.21 76 A 1 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.49 11.667 -24.56 1.0 40.2 76 A 1 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.666 9.875 -26.437 1.0 53.24 76 A 1 -ATOM 1171 H HD22 . LEU A1 1 76 ? -24.127 10.137 -24.755 1.0 72.02 76 A 1 -ATOM 1172 H HD23 . LEU A1 1 76 ? -22.46 10.405 -25.264 1.0 63.4 76 A 1 -ATOM 1173 N N . ARG A1 1 77 ? -24.876 13.47 -30.28 1.0 50.44 77 A 1 -ATOM 1174 C CA . ARG A1 1 77 ? -25.866 13.798 -31.299 1.0 12.4 77 A 1 -ATOM 1175 C C . ARG A1 1 77 ? -26.636 12.553 -31.73 1.0 10.32 77 A 1 -ATOM 1176 O O . ARG A1 1 77 ? -26.551 12.125 -32.882 1.0 12.43 77 A 1 -ATOM 1177 C CB . ARG A1 1 77 ? -25.188 14.437 -32.512 1.0 55.35 77 A 1 -ATOM 1178 C CG . ARG A1 1 77 ? -24.609 15.814 -32.232 1.0 12.22 77 A 1 -ATOM 1179 C CD . ARG A1 1 77 ? -23.089 15.796 -32.262 1.0 60.22 77 A 1 -ATOM 1180 N NE . ARG A1 1 77 ? -22.529 17.134 -32.432 1.0 64.33 77 A 1 -ATOM 1181 C CZ . ARG A1 1 77 ? -22.48 17.767 -33.599 1.0 13.31 77 A 1 -ATOM 1182 N NH1 . ARG A1 1 77 ? -22.957 17.188 -34.692 1.0 63.3 77 A 1 -ATOM 1183 N NH2 . ARG A1 1 77 ? -21.955 18.984 -33.673 1.0 70.54 77 A 1 -ATOM 1184 H H . ARG A1 1 77 ? -24.045 13.025 -30.548 1.0 2.41 77 A 1 -ATOM 1185 H HA . ARG A1 1 77 ? -26.56 14.506 -30.871 1.0 53.23 77 A 1 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.386 13.794 -32.842 1.0 41.04 77 A 1 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.914 14.531 -33.307 1.0 23.23 77 A 1 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.965 16.504 -32.983 1.0 3.21 77 A 1 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.938 16.14 -31.256 1.0 45.32 77 A 1 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.729 15.381 -31.333 1.0 24.22 77 A 1 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.766 15.173 -33.083 1.0 55.12 77 A 1 -ATOM 1192 H HE . ARG A1 1 77 ? -22.171 17.58 -31.637 1.0 41.44 77 A 1 -ATOM 1193 H HH11 . ARG A1 1 77 ? -23.354 16.272 -34.639 1.0 31.24 77 A 1 -ATOM 1194 H HH12 . ARG A1 1 77 ? -22.92 17.668 -35.569 1.0 72.5 77 A 1 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.595 19.424 -32.851 1.0 71.34 77 A 1 -ATOM 1196 H HH22 . ARG A1 1 77 ? -21.919 19.459 -34.552 1.0 1.44 77 A 1 -ATOM 1197 N N . LEU A1 1 78 ? -27.386 11.976 -30.798 1.0 31.03 78 A 1 -ATOM 1198 C CA . LEU A1 1 78 ? -28.171 10.779 -31.08 1.0 51.32 78 A 1 -ATOM 1199 C C . LEU A1 1 78 ? -29.425 11.126 -31.876 1.0 14.11 78 A 1 -ATOM 1200 O O . LEU A1 1 78 ? -29.683 10.546 -32.931 1.0 12.31 78 A 1 -ATOM 1201 C CB . LEU A1 1 78 ? -28.558 10.079 -29.776 1.0 42.51 78 A 1 -ATOM 1202 C CG . LEU A1 1 78 ? -27.551 9.063 -29.235 1.0 51.45 78 A 1 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.209 9.729 -28.973 1.0 14.44 78 A 1 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.082 8.41 -27.968 1.0 25.32 78 A 1 -ATOM 1205 H H . LEU A1 1 78 ? -27.413 12.363 -29.898 1.0 75.31 78 A 1 -ATOM 1206 H HA . LEU A1 1 78 ? -27.559 10.113 -31.669 1.0 64.2 78 A 1 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.698 10.839 -29.022 1.0 61.14 78 A 1 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.493 9.564 -29.943 1.0 62.32 78 A 1 -ATOM 1209 H HG . LEU A1 1 78 ? -27.399 8.288 -29.974 1.0 53.42 78 A 1 -ATOM 1210 H HD11 . LEU A1 1 78 ? -25.536 9.516 -29.789 1.0 3.24 78 A 1 -ATOM 1211 H HD12 . LEU A1 1 78 ? -25.792 9.348 -28.052 1.0 74.14 78 A 1 -ATOM 1212 H HD13 . LEU A1 1 78 ? -26.348 10.797 -28.889 1.0 11.41 78 A 1 -ATOM 1213 H HD21 . LEU A1 1 78 ? -29.161 8.451 -27.966 1.0 65.32 78 A 1 -ATOM 1214 H HD22 . LEU A1 1 78 ? -27.7 8.936 -27.105 1.0 65.43 78 A 1 -ATOM 1215 H HD23 . LEU A1 1 78 ? -27.759 7.379 -27.933 1.0 34.04 78 A 1 -ATOM 1216 N N . ARG A1 1 79 ? -30.201 12.076 -31.364 1.0 44.5 79 A 1 -ATOM 1217 C CA . ARG A1 1 79 ? -31.427 12.501 -32.027 1.0 54.44 79 A 1 -ATOM 1218 C C . ARG A1 1 79 ? -32.402 11.335 -32.167 1.0 43.43 79 A 1 -ATOM 1219 O O . ARG A1 1 79 ? -33.196 11.286 -33.106 1.0 24.23 79 A 1 -ATOM 1220 C CB . ARG A1 1 79 ? -31.111 13.084 -33.406 1.0 53.1 79 A 1 -ATOM 1221 C CG . ARG A1 1 79 ? -32.115 14.127 -33.871 1.0 62.42 79 A 1 -ATOM 1222 C CD . ARG A1 1 79 ? -31.475 15.133 -34.815 1.0 15.2 79 A 1 -ATOM 1223 N NE . ARG A1 1 79 ? -31.728 14.807 -36.216 1.0 22.21 79 A 1 -ATOM 1224 C CZ . ARG A1 1 79 ? -32.924 14.895 -36.787 1.0 43.33 79 A 1 -ATOM 1225 N NH1 . ARG A1 1 79 ? -33.971 15.298 -36.081 1.0 51.34 79 A 1 -ATOM 1226 N NH2 . ARG A1 1 79 ? -33.074 14.581 -38.068 1.0 24.34 79 A 1 -ATOM 1227 H H . ARG A1 1 79 ? -29.942 12.502 -30.52 1.0 30.43 79 A 1 -ATOM 1228 H HA . ARG A1 1 79 ? -31.885 13.267 -31.419 1.0 75.12 79 A 1 -ATOM 1229 H HB2 . ARG A1 1 79 ? -30.135 13.546 -33.374 1.0 72.51 79 A 1 -ATOM 1230 H HB3 . ARG A1 1 79 ? -31.098 12.282 -34.128 1.0 62.3 79 A 1 -ATOM 1231 H HG2 . ARG A1 1 79 ? -32.923 13.63 -34.387 1.0 34.21 79 A 1 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.502 14.649 -33.009 1.0 51.44 79 A 1 -ATOM 1233 H HD2 . ARG A1 1 79 ? -31.881 16.112 -34.605 1.0 21.42 79 A 1 -ATOM 1234 H HD3 . ARG A1 1 79 ? -30.41 15.141 -34.643 1.0 24.22 79 A 1 -ATOM 1235 H HE . ARG A1 1 79 ? -30.968 14.507 -36.756 1.0 63.2 79 A 1 -ATOM 1236 H HH11 . ARG A1 1 79 ? -33.861 15.537 -35.117 1.0 0.03 79 A 1 -ATOM 1237 H HH12 . ARG A1 1 79 ? -34.87 15.365 -36.514 1.0 54.33 79 A 1 -ATOM 1238 H HH21 . ARG A1 1 79 ? -32.286 14.277 -38.603 1.0 72.3 79 A 1 -ATOM 1239 H HH22 . ARG A1 1 79 ? -33.974 14.647 -38.497 1.0 2.44 79 A 1 -ATOM 1240 N N . GLY A1 1 80 ? -32.334 10.398 -31.227 1.0 11.03 80 A 1 -ATOM 1241 C CA . GLY A1 1 80 ? -33.215 9.245 -31.264 1.0 3.12 80 A 1 -ATOM 1242 C C . GLY A1 1 80 ? -32.484 7.969 -31.633 1.0 52.34 80 A 1 -ATOM 1243 O O . GLY A1 1 80 ? -32.035 7.809 -32.767 1.0 43.44 80 A 1 -ATOM 1244 H H . GLY A1 1 80 ? -31.681 10.49 -30.502 1.0 0.24 80 A 1 -ATOM 1245 H HA2 . GLY A1 1 80 ? -33.667 9.12 -30.291 1.0 71.24 80 A 1 -ATOM 1246 H HA3 . GLY A1 1 80 ? -33.993 9.424 -31.991 1.0 43.14 80 A 1 -ATOM 1247 N N . GLY A1 1 81 ? -32.364 7.058 -30.672 1.0 43.34 81 A 1 -ATOM 1248 C CA . GLY A1 1 81 ? -31.68 5.803 -30.922 1.0 20.2 81 A 1 -ATOM 1249 C C . GLY A1 1 81 ? -31.579 4.941 -29.679 1.0 63.23 81 A 1 -ATOM 1250 O O . GLY A1 1 81 ? -32.344 5.114 -28.731 1.0 30.24 81 A 1 -ATOM 1251 H H . GLY A1 1 81 ? -32.742 7.24 -29.787 1.0 11.33 81 A 1 -ATOM 1252 H HA2 . GLY A1 1 81 ? -32.218 5.258 -31.683 1.0 30.51 81 A 1 -ATOM 1253 H HA3 . GLY A1 1 81 ? -30.683 6.014 -31.281 1.0 55.14 81 A 1 -ATOM 1254 N N . VAL A1 1 82 ? -30.632 4.008 -29.684 1.0 30.52 82 A 1 -ATOM 1255 C CA . VAL A1 1 82 ? -30.434 3.114 -28.549 1.0 4.45 82 A 1 -ATOM 1256 C C . VAL A1 1 82 ? -30.241 3.902 -27.257 1.0 63.52 82 A 1 -ATOM 1257 O O . VAL A1 1 82 ? -31.165 4.035 -26.456 1.0 12.52 82 A 1 -ATOM 1258 C CB . VAL A1 1 82 ? -29.216 2.195 -28.763 1.0 53.54 82 A 1 -ATOM 1259 C CG1 . VAL A1 1 82 ? -29.525 1.136 -29.81 1.0 33.31 82 A 1 -ATOM 1260 C CG2 . VAL A1 1 82 ? -27.997 3.012 -29.164 1.0 1.13 82 A 1 -ATOM 1261 H H . VAL A1 1 82 ? -30.053 3.918 -30.469 1.0 42.11 82 A 1 -ATOM 1262 H HA . VAL A1 1 82 ? -31.314 2.495 -28.453 1.0 65.12 82 A 1 -ATOM 1263 H HB . VAL A1 1 82 ? -28.999 1.696 -27.831 1.0 3.02 82 A 1 -ATOM 1264 H HG11 . VAL A1 1 82 ? -29.329 1.535 -30.794 1.0 71.54 82 A 1 -ATOM 1265 H HG12 . VAL A1 1 82 ? -28.903 0.269 -29.64 1.0 43.52 82 A 1 -ATOM 1266 H HG13 . VAL A1 1 82 ? -30.565 0.852 -29.738 1.0 60.31 82 A 1 -ATOM 1267 H HG21 . VAL A1 1 82 ? -27.114 2.588 -28.709 1.0 51.1 82 A 1 -ATOM 1268 H HG22 . VAL A1 1 82 ? -27.892 2.997 -30.238 1.0 43.42 82 A 1 -ATOM 1269 H HG23 . VAL A1 1 82 ? -28.12 4.032 -28.828 1.0 61.21 82 A 1 -ATOM 1 N N . GLY A1 1 1 ? -15.058 -3.936 -6.094 1.0 13.0 1 A 2 -ATOM 2 C CA . GLY A1 1 1 ? -14.031 -3.501 -5.166 1.0 45.03 1 A 2 -ATOM 3 C C . GLY A1 1 1 ? -13.291 -2.271 -5.655 1.0 65.21 1 A 2 -ATOM 4 O O . GLY A1 1 1 ? -13.379 -1.89 -6.822 1.0 33.34 1 A 2 -ATOM 5 H H1 . GLY A1 1 1 ? -15.465 -3.29 -6.709 1.0 52.4 1 A 2 -ATOM 6 H HA2 . GLY A1 1 1 ? -14.491 -3.277 -4.215 1.0 14.15 1 A 2 -ATOM 7 H HA3 . GLY A1 1 1 ? -13.321 -4.303 -5.03 1.0 34.23 1 A 2 -ATOM 8 N N . PRO A1 1 2 ? -12.541 -1.627 -4.748 1.0 55.32 2 A 2 -ATOM 9 C CA . PRO A1 1 2 ? -11.769 -0.423 -5.069 1.0 21.43 2 A 2 -ATOM 10 C C . PRO A1 1 2 ? -10.584 -0.721 -5.981 1.0 41.45 2 A 2 -ATOM 11 O O . PRO A1 1 2 ? -9.89 -1.723 -5.806 1.0 62.42 2 A 2 -ATOM 12 C CB . PRO A1 1 2 ? -11.283 0.063 -3.702 1.0 51.45 2 A 2 -ATOM 13 C CG . PRO A1 1 2 ? -11.259 -1.161 -2.852 1.0 43.11 2 A 2 -ATOM 14 C CD . PRO A1 1 2 ? -12.39 -2.025 -3.338 1.0 64.14 2 A 2 -ATOM 15 H HA . PRO A1 1 2 ? -12.389 0.336 -5.523 1.0 31.54 2 A 2 -ATOM 16 H HB2 . PRO A1 1 2 ? -10.298 0.496 -3.8 1.0 42.4 2 A 2 -ATOM 17 H HB3 . PRO A1 1 2 ? -11.969 0.8 -3.313 1.0 62.54 2 A 2 -ATOM 18 H HG2 . PRO A1 1 2 ? -10.317 -1.673 -2.972 1.0 3.22 2 A 2 -ATOM 19 H HG3 . PRO A1 1 2 ? -11.412 -0.891 -1.817 1.0 51.14 2 A 2 -ATOM 20 H HD2 . PRO A1 1 2 ? -12.127 -3.07 -3.258 1.0 11.0 2 A 2 -ATOM 21 H HD3 . PRO A1 1 2 ? -13.291 -1.816 -2.78 1.0 24.12 2 A 2 -ATOM 22 N N . LEU A1 1 3 ? -10.357 0.155 -6.954 1.0 34.12 3 A 2 -ATOM 23 C CA . LEU A1 1 3 ? -9.254 -0.014 -7.894 1.0 54.03 3 A 2 -ATOM 24 C C . LEU A1 1 3 ? -9.178 1.163 -8.861 1.0 63.21 3 A 2 -ATOM 25 O O . LEU A1 1 3 ? -10.184 1.808 -9.15 1.0 11.24 3 A 2 -ATOM 26 C CB . LEU A1 1 3 ? -9.419 -1.32 -8.674 1.0 60.12 3 A 2 -ATOM 27 C CG . LEU A1 1 3 ? -10.771 -1.527 -9.359 1.0 64.13 3 A 2 -ATOM 28 C CD1 . LEU A1 1 3 ? -10.7 -1.106 -10.818 1.0 62.25 3 A 2 -ATOM 29 C CD2 . LEU A1 1 3 ? -11.211 -2.979 -9.241 1.0 0.12 3 A 2 -ATOM 30 H H . LEU A1 1 3 ? -10.945 0.934 -7.043 1.0 52.35 3 A 2 -ATOM 31 H HA . LEU A1 1 3 ? -8.338 -0.058 -7.325 1.0 43.13 3 A 2 -ATOM 32 H HB2 . LEU A1 1 3 ? -8.655 -1.348 -9.436 1.0 74.24 3 A 2 -ATOM 33 H HB3 . LEU A1 1 3 ? -9.267 -2.138 -7.984 1.0 72.41 3 A 2 -ATOM 34 H HG . LEU A1 1 3 ? -11.513 -0.911 -8.869 1.0 43.5 3 A 2 -ATOM 35 H HD11 . LEU A1 1 3 ? -11.6 -0.571 -11.082 1.0 50.45 3 A 2 -ATOM 36 H HD12 . LEU A1 1 3 ? -10.607 -1.982 -11.442 1.0 4.34 3 A 2 -ATOM 37 H HD13 . LEU A1 1 3 ? -9.843 -0.465 -10.967 1.0 54.42 3 A 2 -ATOM 38 H HD21 . LEU A1 1 3 ? -11.808 -3.103 -8.35 1.0 23.33 3 A 2 -ATOM 39 H HD22 . LEU A1 1 3 ? -10.34 -3.615 -9.183 1.0 1.01 3 A 2 -ATOM 40 H HD23 . LEU A1 1 3 ? -11.796 -3.249 -10.109 1.0 75.24 3 A 2 -ATOM 41 N N . GLY A1 1 4 ? -7.975 1.436 -9.359 1.0 4.21 4 A 2 -ATOM 42 C CA . GLY A1 1 4 ? -7.789 2.534 -10.289 1.0 43.34 4 A 2 -ATOM 43 C C . GLY A1 1 4 ? -6.847 3.594 -9.754 1.0 32.24 4 A 2 -ATOM 44 O O . GLY A1 1 4 ? -6.263 3.432 -8.683 1.0 73.31 4 A 2 -ATOM 45 H H . GLY A1 1 4 ? -7.208 0.887 -9.092 1.0 2.13 4 A 2 -ATOM 46 H HA2 . GLY A1 1 4 ? -7.389 2.144 -11.213 1.0 53.5 4 A 2 -ATOM 47 H HA3 . GLY A1 1 4 ? -8.749 2.989 -10.488 1.0 61.41 4 A 2 -ATOM 48 N N . SER A1 1 5 ? -6.698 4.682 -10.503 1.0 14.33 5 A 2 -ATOM 49 C CA . SER A1 1 5 ? -5.815 5.771 -10.1 1.0 12.42 5 A 2 -ATOM 50 C C . SER A1 1 5 ? -6.608 7.053 -9.863 1.0 43.22 5 A 2 -ATOM 51 O O . SER A1 1 5 ? -6.73 7.52 -8.731 1.0 33.52 5 A 2 -ATOM 52 C CB . SER A1 1 5 ? -4.745 6.01 -11.167 1.0 72.02 5 A 2 -ATOM 53 O OG . SER A1 1 5 ? -3.601 6.634 -10.611 1.0 21.35 5 A 2 -ATOM 54 H H . SER A1 1 5 ? -7.191 4.753 -11.347 1.0 31.12 5 A 2 -ATOM 55 H HA . SER A1 1 5 ? -5.334 5.484 -9.177 1.0 12.32 5 A 2 -ATOM 56 H HB2 . SER A1 1 5 ? -4.451 5.064 -11.596 1.0 41.01 5 A 2 -ATOM 57 H HB3 . SER A1 1 5 ? -5.148 6.647 -11.941 1.0 74.13 5 A 2 -ATOM 58 H HG . SER A1 1 5 ? -3.289 6.122 -9.861 1.0 33.45 5 A 2 -ATOM 59 N N . MET A1 1 6 ? -7.144 7.618 -10.941 1.0 14.01 6 A 2 -ATOM 60 C CA . MET A1 1 6 ? -7.926 8.845 -10.851 1.0 54.33 6 A 2 -ATOM 61 C C . MET A1 1 6 ? -9.241 8.709 -11.612 1.0 31.44 6 A 2 -ATOM 62 O O . MET A1 1 6 ? -9.257 8.297 -12.771 1.0 1.11 6 A 2 -ATOM 63 C CB . MET A1 1 6 ? -7.125 10.027 -11.401 1.0 70.21 6 A 2 -ATOM 64 C CG . MET A1 1 6 ? -6.734 9.869 -12.861 1.0 25.05 6 A 2 -ATOM 65 S SD . MET A1 1 6 ? -4.993 10.234 -13.157 1.0 3.44 6 A 2 -ATOM 66 C CE . MET A1 1 6 ? -4.209 9.061 -12.054 1.0 13.21 6 A 2 -ATOM 67 H H . MET A1 1 6 ? -7.012 7.199 -11.817 1.0 2.32 6 A 2 -ATOM 68 H HA . MET A1 1 6 ? -8.144 9.024 -9.808 1.0 5.22 6 A 2 -ATOM 69 H HB2 . MET A1 1 6 ? -7.717 10.924 -11.304 1.0 62.43 6 A 2 -ATOM 70 H HB3 . MET A1 1 6 ? -6.222 10.137 -10.819 1.0 63.34 6 A 2 -ATOM 71 H HG2 . MET A1 1 6 ? -6.93 8.851 -13.165 1.0 33.13 6 A 2 -ATOM 72 H HG3 . MET A1 1 6 ? -7.335 10.541 -13.455 1.0 12.41 6 A 2 -ATOM 73 H HE1 . MET A1 1 6 ? -4.958 8.6 -11.427 1.0 12.23 6 A 2 -ATOM 74 H HE2 . MET A1 1 6 ? -3.708 8.3 -12.634 1.0 52.54 6 A 2 -ATOM 75 H HE3 . MET A1 1 6 ? -3.488 9.575 -11.436 1.0 2.41 6 A 2 -ATOM 76 N N . GLN A1 1 7 ? -10.341 9.058 -10.952 1.0 13.12 7 A 2 -ATOM 77 C CA . GLN A1 1 7 ? -11.66 8.973 -11.567 1.0 13.2 7 A 2 -ATOM 78 C C . GLN A1 1 7 ? -12.062 10.311 -12.178 1.0 42.42 7 A 2 -ATOM 79 O O . GLN A1 1 7 ? -11.548 11.361 -11.791 1.0 71.33 7 A 2 -ATOM 80 C CB . GLN A1 1 7 ? -12.7 8.537 -10.534 1.0 42.01 7 A 2 -ATOM 81 C CG . GLN A1 1 7 ? -12.202 7.459 -9.585 1.0 12.34 7 A 2 -ATOM 82 C CD . GLN A1 1 7 ? -11.543 8.032 -8.346 1.0 44.31 7 A 2 -ATOM 83 O OE1 . GLN A1 1 7 ? -11.491 9.248 -8.162 1.0 33.44 7 A 2 -ATOM 84 N NE2 . GLN A1 1 7 ? -11.036 7.156 -7.486 1.0 73.32 7 A 2 -ATOM 85 H H . GLN A1 1 7 ? -10.263 9.379 -10.03 1.0 71.21 7 A 2 -ATOM 86 H HA . GLN A1 1 7 ? -11.612 8.233 -12.351 1.0 62.03 7 A 2 -ATOM 87 H HB2 . GLN A1 1 7 ? -12.991 9.396 -9.948 1.0 13.25 7 A 2 -ATOM 88 H HB3 . GLN A1 1 7 ? -13.567 8.156 -11.053 1.0 41.42 7 A 2 -ATOM 89 H HG2 . GLN A1 1 7 ? -13.04 6.85 -9.28 1.0 43.33 7 A 2 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.482 6.844 -10.106 1.0 33.21 7 A 2 -ATOM 91 H HE21 . GLN A1 1 7 ? -11.114 6.202 -7.698 1.0 52.01 7 A 2 -ATOM 92 H HE22 . GLN A1 1 7 ? -10.604 7.499 -6.677 1.0 55.43 7 A 2 -ATOM 93 N N . ILE A1 1 8 ? -12.984 10.265 -13.135 1.0 12.12 8 A 2 -ATOM 94 C CA . ILE A1 1 8 ? -13.455 11.474 -13.799 1.0 64.2 8 A 2 -ATOM 95 C C . ILE A1 1 8 ? -14.978 11.545 -13.796 1.0 0.33 8 A 2 -ATOM 96 O O . ILE A1 1 8 ? -15.657 10.529 -13.645 1.0 11.35 8 A 2 -ATOM 97 C CB . ILE A1 1 8 ? -12.952 11.551 -15.252 1.0 65.34 8 A 2 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.089 10.331 -15.581 1.0 72.33 8 A 2 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.167 12.836 -15.474 1.0 55.24 8 A 2 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.709 10.236 -17.042 1.0 11.02 8 A 2 -ATOM 101 H H . ILE A1 1 8 ? -13.356 9.399 -13.399 1.0 43.45 8 A 2 -ATOM 102 H HA . ILE A1 1 8 ? -13.065 12.325 -13.258 1.0 41.41 8 A 2 -ATOM 103 H HB . ILE A1 1 8 ? -13.81 11.564 -15.907 1.0 13.24 8 A 2 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.179 10.375 -15.005 1.0 4.11 8 A 2 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.633 9.434 -15.32 1.0 33.41 8 A 2 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.566 13.046 -14.601 1.0 12.11 8 A 2 -ATOM 107 H HG22 . ILE A1 1 8 ? -11.524 12.721 -16.333 1.0 14.43 8 A 2 -ATOM 108 H HG23 . ILE A1 1 8 ? -12.853 13.652 -15.643 1.0 53.13 8 A 2 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.28 9.448 -17.512 1.0 4.51 8 A 2 -ATOM 110 H HD12 . ILE A1 1 8 ? -11.923 11.175 -17.532 1.0 22.53 8 A 2 -ATOM 111 H HD13 . ILE A1 1 8 ? -10.656 10.016 -17.127 1.0 32.23 8 A 2 -ATOM 112 N N . PHE A1 1 9 ? -15.51 12.751 -13.965 1.0 44.42 9 A 2 -ATOM 113 C CA . PHE A1 1 9 ? -16.954 12.954 -13.983 1.0 45.42 9 A 2 -ATOM 114 C C . PHE A1 1 9 ? -17.429 13.356 -15.376 1.0 62.05 9 A 2 -ATOM 115 O O . PHE A1 1 9 ? -16.933 14.32 -15.96 1.0 33.13 9 A 2 -ATOM 116 C CB . PHE A1 1 9 ? -17.352 14.027 -12.967 1.0 42.3 9 A 2 -ATOM 117 C CG . PHE A1 1 9 ? -17.511 13.5 -11.57 1.0 44.44 9 A 2 -ATOM 118 C CD1 . PHE A1 1 9 ? -18.673 12.848 -11.19 1.0 24.21 9 A 2 -ATOM 119 C CD2 . PHE A1 1 9 ? -16.498 13.655 -10.637 1.0 24.11 9 A 2 -ATOM 120 C CE1 . PHE A1 1 9 ? -18.822 12.362 -9.904 1.0 54.33 9 A 2 -ATOM 121 C CE2 . PHE A1 1 9 ? -16.641 13.171 -9.35 1.0 62.43 9 A 2 -ATOM 122 C CZ . PHE A1 1 9 ? -17.805 12.523 -8.984 1.0 72.21 9 A 2 -ATOM 123 H H . PHE A1 1 9 ? -14.916 13.523 -14.08 1.0 15.35 9 A 2 -ATOM 124 H HA . PHE A1 1 9 ? -17.422 12.021 -13.711 1.0 72.15 9 A 2 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.591 14.793 -12.947 1.0 13.22 9 A 2 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.291 14.465 -13.267 1.0 20.44 9 A 2 -ATOM 127 H HD1 . PHE A1 1 9 ? -19.469 12.72 -11.908 1.0 63.23 9 A 2 -ATOM 128 H HD2 . PHE A1 1 9 ? -15.587 14.162 -10.923 1.0 43.5 9 A 2 -ATOM 129 H HE1 . PHE A1 1 9 ? -19.732 11.855 -9.62 1.0 53.21 9 A 2 -ATOM 130 H HE2 . PHE A1 1 9 ? -15.844 13.299 -8.633 1.0 61.25 9 A 2 -ATOM 131 H HZ . PHE A1 1 9 ? -17.919 12.145 -7.979 1.0 11.33 9 A 2 -ATOM 132 N N . VAL A1 1 10 ? -18.394 12.609 -15.904 1.0 35.51 10 A 2 -ATOM 133 C CA . VAL A1 1 10 ? -18.937 12.887 -17.228 1.0 51.35 10 A 2 -ATOM 134 C C . VAL A1 1 10 ? -20.397 13.319 -17.144 1.0 20.3 10 A 2 -ATOM 135 O O . VAL A1 1 10 ? -21.222 12.644 -16.528 1.0 33.54 10 A 2 -ATOM 136 C CB . VAL A1 1 10 ? -18.831 11.656 -18.148 1.0 1.24 10 A 2 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.657 12.085 -19.597 1.0 43.55 10 A 2 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.683 10.76 -17.708 1.0 70.41 10 A 2 -ATOM 139 H H . VAL A1 1 10 ? -18.749 11.854 -15.391 1.0 13.11 10 A 2 -ATOM 140 H HA . VAL A1 1 10 ? -18.359 13.688 -17.666 1.0 52.2 10 A 2 -ATOM 141 H HB . VAL A1 1 10 ? -19.749 11.093 -18.07 1.0 21.21 10 A 2 -ATOM 142 H HG11 . VAL A1 1 10 ? -17.607 12.225 -19.807 1.0 75.22 10 A 2 -ATOM 143 H HG12 . VAL A1 1 10 ? -19.058 11.323 -20.249 1.0 54.41 10 A 2 -ATOM 144 H HG13 . VAL A1 1 10 ? -19.184 13.014 -19.762 1.0 61.31 10 A 2 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.407 10.102 -18.518 1.0 13.24 10 A 2 -ATOM 146 H HG22 . VAL A1 1 10 ? -16.835 11.371 -17.435 1.0 62.44 10 A 2 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.991 10.172 -16.856 1.0 2.35 10 A 2 -ATOM 148 N N . LYS A1 1 11 ? -20.71 14.45 -17.767 1.0 23.3 11 A 2 -ATOM 149 C CA . LYS A1 1 11 ? -22.071 14.974 -17.765 1.0 10.31 11 A 2 -ATOM 150 C C . LYS A1 1 11 ? -22.721 14.804 -19.134 1.0 22.12 11 A 2 -ATOM 151 O O . LYS A1 1 11 ? -22.29 15.407 -20.118 1.0 63.21 11 A 2 -ATOM 152 C CB . LYS A1 1 11 ? -22.069 16.452 -17.369 1.0 34.41 11 A 2 -ATOM 153 C CG . LYS A1 1 11 ? -23.392 17.153 -17.627 1.0 63.11 11 A 2 -ATOM 154 C CD . LYS A1 1 11 ? -23.331 18.621 -17.24 1.0 3.15 11 A 2 -ATOM 155 C CE . LYS A1 1 11 ? -22.991 19.498 -18.435 1.0 2.52 11 A 2 -ATOM 156 N NZ . LYS A1 1 11 ? -23.063 20.947 -18.097 1.0 51.12 11 A 2 -ATOM 157 H H . LYS A1 1 11 ? -20.008 14.945 -18.241 1.0 4.15 11 A 2 -ATOM 158 H HA . LYS A1 1 11 ? -22.64 14.416 -17.037 1.0 44.21 11 A 2 -ATOM 159 H HB2 . LYS A1 1 11 ? -21.844 16.53 -16.316 1.0 75.01 11 A 2 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.3 16.963 -17.931 1.0 15.43 11 A 2 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.629 17.078 -18.678 1.0 73.24 11 A 2 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.165 16.668 -17.047 1.0 30.03 11 A 2 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.292 18.921 -16.849 1.0 63.51 11 A 2 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.574 18.752 -16.48 1.0 61.22 11 A 2 -ATOM 165 H HE2 . LYS A1 1 11 ? -21.99 19.264 -18.764 1.0 70.24 11 A 2 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.69 19.288 -19.23 1.0 3.13 11 A 2 -ATOM 167 H HZ1 . LYS A1 1 11 ? -22.176 21.421 -18.362 1.0 1.34 11 A 2 -ATOM 168 H HZ2 . LYS A1 1 11 ? -23.216 21.068 -17.075 1.0 61.44 11 A 2 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.849 21.395 -18.609 1.0 12.11 11 A 2 -ATOM 170 N N . THR A1 1 12 ? -23.764 13.981 -19.191 1.0 60.33 12 A 2 -ATOM 171 C CA . THR A1 1 12 ? -24.474 13.732 -20.439 1.0 63.11 12 A 2 -ATOM 172 C C . THR A1 1 12 ? -25.344 14.924 -20.823 1.0 63.2 12 A 2 -ATOM 173 O O . THR A1 1 12 ? -25.676 15.76 -19.982 1.0 23.14 12 A 2 -ATOM 174 C CB . THR A1 1 12 ? -25.359 12.475 -20.341 1.0 13.53 12 A 2 -ATOM 175 O OG1 . THR A1 1 12 ? -26.511 12.749 -19.536 1.0 44.22 12 A 2 -ATOM 176 C CG2 . THR A1 1 12 ? -24.582 11.312 -19.744 1.0 44.25 12 A 2 -ATOM 177 H H . THR A1 1 12 ? -24.06 13.53 -18.373 1.0 50.31 12 A 2 -ATOM 178 H HA . THR A1 1 12 ? -23.739 13.57 -21.214 1.0 15.31 12 A 2 -ATOM 179 H HB . THR A1 1 12 ? -25.681 12.202 -21.336 1.0 3.11 12 A 2 -ATOM 180 H HG1 . THR A1 1 12 ? -27.271 12.285 -19.897 1.0 54.01 12 A 2 -ATOM 181 H HG21 . THR A1 1 12 ? -24.23 11.581 -18.76 1.0 54.24 12 A 2 -ATOM 182 H HG22 . THR A1 1 12 ? -23.737 11.081 -20.376 1.0 51.32 12 A 2 -ATOM 183 H HG23 . THR A1 1 12 ? -25.226 10.448 -19.673 1.0 74.05 12 A 2 -ATOM 184 N N . LEU A1 1 13 ? -25.711 14.995 -22.098 1.0 74.21 13 A 2 -ATOM 185 C CA . LEU A1 1 13 ? -26.544 16.085 -22.594 1.0 74.52 13 A 2 -ATOM 186 C C . LEU A1 1 13 ? -27.877 16.132 -21.854 1.0 25.21 13 A 2 -ATOM 187 O O . LEU A1 1 13 ? -28.567 17.152 -21.858 1.0 11.35 13 A 2 -ATOM 188 C CB . LEU A1 1 13 ? -26.787 15.925 -24.096 1.0 31.51 13 A 2 -ATOM 189 C CG . LEU A1 1 13 ? -27.406 17.128 -24.808 1.0 30.32 13 A 2 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.588 17.502 -26.034 1.0 44.31 13 A 2 -ATOM 191 C CD2 . LEU A1 1 13 ? -28.848 16.834 -25.196 1.0 64.01 13 A 2 -ATOM 192 H H . LEU A1 1 13 ? -25.415 14.3 -22.721 1.0 42.02 13 A 2 -ATOM 193 H HA . LEU A1 1 13 ? -26.016 17.011 -22.42 1.0 34.1 13 A 2 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.837 15.717 -24.564 1.0 62.11 13 A 2 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.447 15.081 -24.235 1.0 43.21 13 A 2 -ATOM 196 H HG . LEU A1 1 13 ? -27.407 17.975 -24.136 1.0 45.4 13 A 2 -ATOM 197 H HD11 . LEU A1 1 13 ? -25.537 17.448 -25.795 1.0 62.23 13 A 2 -ATOM 198 H HD12 . LEU A1 1 13 ? -26.837 18.508 -26.339 1.0 23.44 13 A 2 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.811 16.817 -26.838 1.0 25.55 13 A 2 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.863 16.15 -26.032 1.0 62.14 13 A 2 -ATOM 201 H HD22 . LEU A1 1 13 ? -29.341 17.754 -25.474 1.0 41.34 13 A 2 -ATOM 202 H HD23 . LEU A1 1 13 ? -29.363 16.389 -24.357 1.0 51.42 13 A 2 -ATOM 203 N N . THR A1 1 14 ? -28.233 15.021 -21.216 1.0 31.41 14 A 2 -ATOM 204 C CA . THR A1 1 14 ? -29.482 14.935 -20.471 1.0 30.33 14 A 2 -ATOM 205 C C . THR A1 1 14 ? -29.268 15.27 -18.999 1.0 22.13 14 A 2 -ATOM 206 O O . THR A1 1 14 ? -30.153 15.061 -18.17 1.0 5.31 14 A 2 -ATOM 207 C CB . THR A1 1 14 ? -30.107 13.532 -20.58 1.0 34.54 14 A 2 -ATOM 208 O OG1 . THR A1 1 14 ? -29.195 12.549 -20.077 1.0 3.22 14 A 2 -ATOM 209 C CG2 . THR A1 1 14 ? -30.462 13.209 -22.024 1.0 34.11 14 A 2 -ATOM 210 H H . THR A1 1 14 ? -27.641 14.241 -21.25 1.0 2.31 14 A 2 -ATOM 211 H HA . THR A1 1 14 ? -30.174 15.648 -20.895 1.0 25.44 14 A 2 -ATOM 212 H HB . THR A1 1 14 ? -31.011 13.509 -19.989 1.0 55.24 14 A 2 -ATOM 213 H HG1 . THR A1 1 14 ? -29.683 11.876 -19.596 1.0 24.42 14 A 2 -ATOM 214 H HG21 . THR A1 1 14 ? -30.879 12.214 -22.078 1.0 1.02 14 A 2 -ATOM 215 H HG22 . THR A1 1 14 ? -29.573 13.26 -22.634 1.0 12.23 14 A 2 -ATOM 216 H HG23 . THR A1 1 14 ? -31.188 13.923 -22.384 1.0 12.42 14 A 2 -ATOM 217 N N . GLY A1 1 15 ? -28.088 15.793 -18.681 1.0 61.2 15 A 2 -ATOM 218 C CA . GLY A1 1 15 ? -27.779 16.149 -17.308 1.0 25.44 15 A 2 -ATOM 219 C C . GLY A1 1 15 ? -27.607 14.934 -16.419 1.0 2.34 15 A 2 -ATOM 220 O O . GLY A1 1 15 ? -28.309 14.782 -15.419 1.0 24.03 15 A 2 -ATOM 221 H H . GLY A1 1 15 ? -27.421 15.938 -19.385 1.0 73.22 15 A 2 -ATOM 222 H HA2 . GLY A1 1 15 ? -26.866 16.725 -17.294 1.0 10.15 15 A 2 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.583 16.756 -16.917 1.0 23.53 15 A 2 -ATOM 224 N N . LYS A1 1 16 ? -26.671 14.064 -16.783 1.0 11.21 16 A 2 -ATOM 225 C CA . LYS A1 1 16 ? -26.408 12.855 -16.012 1.0 34.13 16 A 2 -ATOM 226 C C . LYS A1 1 16 ? -24.955 12.81 -15.55 1.0 15.24 16 A 2 -ATOM 227 O O . LYS A1 1 16 ? -24.035 12.737 -16.365 1.0 50.04 16 A 2 -ATOM 228 C CB . LYS A1 1 16 ? -26.727 11.613 -16.847 1.0 31.42 16 A 2 -ATOM 229 C CG . LYS A1 1 16 ? -27.314 10.47 -16.037 1.0 73.35 16 A 2 -ATOM 230 C CD . LYS A1 1 16 ? -26.226 9.601 -15.428 1.0 50.3 16 A 2 -ATOM 231 C CE . LYS A1 1 16 ? -25.458 8.838 -16.497 1.0 52.44 16 A 2 -ATOM 232 N NZ . LYS A1 1 16 ? -25.775 7.383 -16.475 1.0 2.53 16 A 2 -ATOM 233 H H . LYS A1 1 16 ? -26.143 14.24 -17.591 1.0 52.54 16 A 2 -ATOM 234 H HA . LYS A1 1 16 ? -27.049 12.869 -15.144 1.0 34.34 16 A 2 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.436 11.883 -17.616 1.0 44.24 16 A 2 -ATOM 236 H HB3 . LYS A1 1 16 ? -25.818 11.265 -17.315 1.0 12.13 16 A 2 -ATOM 237 H HG2 . LYS A1 1 16 ? -27.921 10.878 -15.243 1.0 3.41 16 A 2 -ATOM 238 H HG3 . LYS A1 1 16 ? -27.928 9.86 -16.685 1.0 74.14 16 A 2 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.536 10.231 -14.886 1.0 63.23 16 A 2 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.68 8.894 -14.749 1.0 14.51 16 A 2 -ATOM 241 H HE2 . LYS A1 1 16 ? -25.718 9.24 -17.464 1.0 44.12 16 A 2 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.4 8.971 -16.325 1.0 75.31 16 A 2 -ATOM 243 H HZ1 . LYS A1 1 16 ? -24.961 6.835 -16.818 1.0 61.55 16 A 2 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.594 7.187 -17.086 1.0 23.15 16 A 2 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.0 7.081 -15.506 1.0 43.23 16 A 2 -ATOM 246 N N . THR A1 1 17 ? -24.755 12.851 -14.236 1.0 33.03 17 A 2 -ATOM 247 C CA . THR A1 1 17 ? -23.414 12.815 -13.666 1.0 61.21 17 A 2 -ATOM 248 C C . THR A1 1 17 ? -22.965 11.381 -13.409 1.0 13.11 17 A 2 -ATOM 249 O O . THR A1 1 17 ? -23.588 10.655 -12.633 1.0 32.24 17 A 2 -ATOM 250 C CB . THR A1 1 17 ? -23.343 13.607 -12.347 1.0 22.54 17 A 2 -ATOM 251 O OG1 . THR A1 1 17 ? -24.664 13.852 -11.851 1.0 24.32 17 A 2 -ATOM 252 C CG2 . THR A1 1 17 ? -22.618 14.929 -12.548 1.0 72.42 17 A 2 -ATOM 253 H H . THR A1 1 17 ? -25.528 12.909 -13.637 1.0 63.53 17 A 2 -ATOM 254 H HA . THR A1 1 17 ? -22.738 13.272 -14.373 1.0 15.15 17 A 2 -ATOM 255 H HB . THR A1 1 17 ? -22.797 13.021 -11.621 1.0 61.22 17 A 2 -ATOM 256 H HG1 . THR A1 1 17 ? -24.741 13.502 -10.96 1.0 54.0 17 A 2 -ATOM 257 H HG21 . THR A1 1 17 ? -22.926 15.369 -13.485 1.0 31.34 17 A 2 -ATOM 258 H HG22 . THR A1 1 17 ? -21.552 14.757 -12.565 1.0 12.24 17 A 2 -ATOM 259 H HG23 . THR A1 1 17 ? -22.862 15.601 -11.739 1.0 74.01 17 A 2 -ATOM 260 N N . ILE A1 1 18 ? -21.88 10.979 -14.063 1.0 21.15 18 A 2 -ATOM 261 C CA . ILE A1 1 18 ? -21.347 9.632 -13.903 1.0 42.23 18 A 2 -ATOM 262 C C . ILE A1 1 18 ? -19.871 9.667 -13.524 1.0 2.02 18 A 2 -ATOM 263 O O . ILE A1 1 18 ? -19.111 10.502 -14.016 1.0 34.24 18 A 2 -ATOM 264 C CB . ILE A1 1 18 ? -21.516 8.803 -15.19 1.0 20.13 18 A 2 -ATOM 265 C CG1 . ILE A1 1 18 ? -20.74 7.489 -15.082 1.0 0.43 18 A 2 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.052 9.602 -16.399 1.0 34.34 18 A 2 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.021 6.526 -16.214 1.0 41.12 18 A 2 -ATOM 268 H H . ILE A1 1 18 ? -21.428 11.604 -14.667 1.0 72.35 18 A 2 -ATOM 269 H HA . ILE A1 1 18 ? -21.9 9.147 -13.111 1.0 33.1 18 A 2 -ATOM 270 H HB . ILE A1 1 18 ? -22.566 8.584 -15.315 1.0 55.23 18 A 2 -ATOM 271 H HG12 . ILE A1 1 18 ? -19.682 7.702 -15.084 1.0 35.45 18 A 2 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.003 7.0 -14.156 1.0 15.51 18 A 2 -ATOM 273 H HG21 . ILE A1 1 18 ? -20.067 10.003 -16.209 1.0 31.24 18 A 2 -ATOM 274 H HG22 . ILE A1 1 18 ? -21.016 8.956 -17.264 1.0 60.32 18 A 2 -ATOM 275 H HG23 . ILE A1 1 18 ? -21.742 10.412 -16.582 1.0 71.44 18 A 2 -ATOM 276 H HD11 . ILE A1 1 18 ? -21.531 7.048 -17.012 1.0 32.31 18 A 2 -ATOM 277 H HD12 . ILE A1 1 18 ? -20.09 6.125 -16.587 1.0 60.24 18 A 2 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.644 5.721 -15.856 1.0 25.35 18 A 2 -ATOM 279 N N . THR A1 1 19 ? -19.469 8.751 -12.648 1.0 42.32 19 A 2 -ATOM 280 C CA . THR A1 1 19 ? -18.083 8.676 -12.203 1.0 41.24 19 A 2 -ATOM 281 C C . THR A1 1 19 ? -17.414 7.4 -12.701 1.0 70.21 19 A 2 -ATOM 282 O O . THR A1 1 19 ? -18.003 6.319 -12.651 1.0 44.42 19 A 2 -ATOM 283 C CB . THR A1 1 19 ? -17.982 8.729 -10.667 1.0 2.4 19 A 2 -ATOM 284 O OG1 . THR A1 1 19 ? -19.156 9.34 -10.12 1.0 22.32 19 A 2 -ATOM 285 C CG2 . THR A1 1 19 ? -16.75 9.507 -10.232 1.0 13.14 19 A 2 -ATOM 286 H H . THR A1 1 19 ? -20.121 8.113 -12.292 1.0 1.15 19 A 2 -ATOM 287 H HA . THR A1 1 19 ? -17.556 9.528 -12.607 1.0 65.43 19 A 2 -ATOM 288 H HB . THR A1 1 19 ? -17.903 7.719 -10.291 1.0 44.24 19 A 2 -ATOM 289 H HG1 . THR A1 1 19 ? -19.289 9.03 -9.221 1.0 60.25 19 A 2 -ATOM 290 H HG21 . THR A1 1 19 ? -16.558 10.301 -10.938 1.0 73.33 19 A 2 -ATOM 291 H HG22 . THR A1 1 19 ? -15.898 8.844 -10.197 1.0 23.45 19 A 2 -ATOM 292 H HG23 . THR A1 1 19 ? -16.918 9.929 -9.252 1.0 51.03 19 A 2 -ATOM 293 N N . ILE A1 1 20 ? -16.182 7.531 -13.181 1.0 2.13 20 A 2 -ATOM 294 C CA . ILE A1 1 20 ? -15.433 6.387 -13.686 1.0 23.24 20 A 2 -ATOM 295 C C . ILE A1 1 20 ? -13.956 6.495 -13.325 1.0 21.51 20 A 2 -ATOM 296 O O . ILE A1 1 20 ? -13.335 7.541 -13.513 1.0 3.54 20 A 2 -ATOM 297 C CB . ILE A1 1 20 ? -15.569 6.256 -15.214 1.0 55.55 20 A 2 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.619 7.64 -15.864 1.0 1.5 20 A 2 -ATOM 299 C CG2 . ILE A1 1 20 ? -16.812 5.454 -15.569 1.0 1.32 20 A 2 -ATOM 300 C CD1 . ILE A1 1 20 ? -14.938 7.699 -17.214 1.0 2.4 20 A 2 -ATOM 301 H H . ILE A1 1 20 ? -15.766 8.418 -13.194 1.0 32.52 20 A 2 -ATOM 302 H HA . ILE A1 1 20 ? -15.84 5.496 -13.23 1.0 40.32 20 A 2 -ATOM 303 H HB . ILE A1 1 20 ? -14.708 5.722 -15.586 1.0 75.22 20 A 2 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.648 7.931 -16.0 1.0 4.24 20 A 2 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.131 8.352 -15.215 1.0 20.02 20 A 2 -ATOM 306 H HG21 . ILE A1 1 20 ? -16.658 4.948 -16.511 1.0 41.11 20 A 2 -ATOM 307 H HG22 . ILE A1 1 20 ? -17.001 4.723 -14.796 1.0 51.34 20 A 2 -ATOM 308 H HG23 . ILE A1 1 20 ? -17.659 6.118 -15.651 1.0 74.34 20 A 2 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.155 6.795 -17.766 1.0 44.23 20 A 2 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.304 8.552 -17.766 1.0 43.31 20 A 2 -ATOM 311 H HD13 . ILE A1 1 20 ? -13.871 7.788 -17.076 1.0 23.14 20 A 2 -ATOM 312 N N . ASP A1 1 21 ? -13.398 5.406 -12.809 1.0 44.41 21 A 2 -ATOM 313 C CA . ASP A1 1 21 ? -11.991 5.376 -12.424 1.0 13.43 21 A 2 -ATOM 314 C C . ASP A1 1 21 ? -11.103 5.106 -13.635 1.0 74.52 21 A 2 -ATOM 315 O O . ASP A1 1 21 ? -11.316 4.144 -14.372 1.0 3.25 21 A 2 -ATOM 316 C CB . ASP A1 1 21 ? -11.755 4.308 -11.355 1.0 40.32 21 A 2 -ATOM 317 C CG . ASP A1 1 21 ? -12.249 2.94 -11.784 1.0 70.32 21 A 2 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.475 2.708 -11.728 1.0 34.41 21 A 2 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.41 2.101 -12.174 1.0 4.34 21 A 2 -ATOM 320 H H . ASP A1 1 21 ? -13.945 4.602 -12.683 1.0 61.24 21 A 2 -ATOM 321 H HA . ASP A1 1 21 ? -11.738 6.343 -12.016 1.0 0.1 21 A 2 -ATOM 322 H HB2 . ASP A1 1 21 ? -10.696 4.24 -11.151 1.0 73.15 21 A 2 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.274 4.592 -10.452 1.0 61.23 21 A 2 -ATOM 324 N N . VAL A1 1 22 ? -10.107 5.964 -13.834 1.0 30.34 22 A 2 -ATOM 325 C CA . VAL A1 1 22 ? -9.186 5.819 -14.955 1.0 1.34 22 A 2 -ATOM 326 C C . VAL A1 1 22 ? -7.747 6.074 -14.521 1.0 61.2 22 A 2 -ATOM 327 O O . VAL A1 1 22 ? -7.5 6.647 -13.459 1.0 34.03 22 A 2 -ATOM 328 C CB . VAL A1 1 22 ? -9.542 6.782 -16.103 1.0 60.13 22 A 2 -ATOM 329 C CG1 . VAL A1 1 22 ? -10.989 7.238 -15.987 1.0 14.0 22 A 2 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.597 7.974 -16.11 1.0 61.12 22 A 2 -ATOM 331 H H . VAL A1 1 22 ? -9.988 6.711 -13.212 1.0 71.0 22 A 2 -ATOM 332 H HA . VAL A1 1 22 ? -9.266 4.807 -15.324 1.0 41.13 22 A 2 -ATOM 333 H HB . VAL A1 1 22 ? -9.428 6.253 -17.038 1.0 23.42 22 A 2 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.618 6.387 -15.774 1.0 3.13 22 A 2 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.076 7.961 -15.19 1.0 11.12 22 A 2 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.299 7.689 -16.918 1.0 2.3 22 A 2 -ATOM 337 H HG21 . VAL A1 1 22 ? -8.987 8.739 -16.766 1.0 43.3 22 A 2 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.509 8.368 -15.109 1.0 71.52 22 A 2 -ATOM 339 H HG23 . VAL A1 1 22 ? -7.624 7.661 -16.46 1.0 24.41 22 A 2 -ATOM 340 N N . ASP A1 1 23 ? -6.8 5.644 -15.348 1.0 73.14 23 A 2 -ATOM 341 C CA . ASP A1 1 23 ? -5.384 5.827 -15.05 1.0 0.33 23 A 2 -ATOM 342 C C . ASP A1 1 23 ? -4.695 6.621 -16.156 1.0 62.12 23 A 2 -ATOM 343 O O . ASP A1 1 23 ? -5.215 6.74 -17.266 1.0 35.34 23 A 2 -ATOM 344 C CB . ASP A1 1 23 ? -4.699 4.471 -14.875 1.0 24.44 23 A 2 -ATOM 345 C CG . ASP A1 1 23 ? -3.569 4.52 -13.864 1.0 11.25 23 A 2 -ATOM 346 O OD1 . ASP A1 1 23 ? -3.035 5.623 -13.625 1.0 71.52 23 A 2 -ATOM 347 O OD2 . ASP A1 1 23 ? -3.219 3.455 -13.313 1.0 54.12 23 A 2 -ATOM 348 H H . ASP A1 1 23 ? -7.06 5.194 -16.179 1.0 71.31 23 A 2 -ATOM 349 H HA . ASP A1 1 23 ? -5.308 6.381 -14.127 1.0 62.03 23 A 2 -ATOM 350 H HB2 . ASP A1 1 23 ? -5.427 3.748 -14.538 1.0 75.32 23 A 2 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.295 4.154 -15.825 1.0 32.1 23 A 2 -ATOM 352 N N . HIS A1 1 24 ? -3.521 7.162 -15.845 1.0 3.42 24 A 2 -ATOM 353 C CA . HIS A1 1 24 ? -2.76 7.945 -16.813 1.0 64.1 24 A 2 -ATOM 354 C C . HIS A1 1 24 ? -2.429 7.11 -18.047 1.0 13.22 24 A 2 -ATOM 355 O O . HIS A1 1 24 ? -2.085 7.649 -19.098 1.0 40.32 24 A 2 -ATOM 356 C CB . HIS A1 1 24 ? -1.472 8.469 -16.177 1.0 43.52 24 A 2 -ATOM 357 C CG . HIS A1 1 24 ? -1.255 9.936 -16.386 1.0 63.23 24 A 2 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.191 10.444 -17.1 1.0 33.23 24 A 2 -ATOM 359 C CD2 . HIS A1 1 24 ? -1.973 11.005 -15.971 1.0 70.35 24 A 2 -ATOM 360 C CE1 . HIS A1 1 24 ? -0.263 11.763 -17.114 1.0 52.22 24 A 2 -ATOM 361 N NE2 . HIS A1 1 24 ? -1.336 12.129 -16.436 1.0 51.1 24 A 2 -ATOM 362 H H . HIS A1 1 24 ? -3.158 7.032 -14.945 1.0 35.01 24 A 2 -ATOM 363 H HA . HIS A1 1 24 ? -3.37 8.783 -17.114 1.0 52.33 24 A 2 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.505 8.287 -15.113 1.0 74.33 24 A 2 -ATOM 365 H HB3 . HIS A1 1 24 ? -0.629 7.943 -16.601 1.0 2.24 24 A 2 -ATOM 366 H HD1 . HIS A1 1 24 ? 0.513 9.917 -17.531 1.0 61.24 24 A 2 -ATOM 367 H HD2 . HIS A1 1 24 ? -2.88 10.98 -15.382 1.0 14.35 24 A 2 -ATOM 368 H HE1 . HIS A1 1 24 ? 0.435 12.43 -17.598 1.0 73.24 24 A 2 -ATOM 369 N N . ALA A1 1 25 ? -2.535 5.793 -17.91 1.0 63.43 25 A 2 -ATOM 370 C CA . ALA A1 1 25 ? -2.248 4.885 -19.013 1.0 43.32 25 A 2 -ATOM 371 C C . ALA A1 1 25 ? -3.505 4.594 -19.826 1.0 33.54 25 A 2 -ATOM 372 O O . ALA A1 1 25 ? -3.491 3.762 -20.733 1.0 12.23 25 A 2 -ATOM 373 C CB . ALA A1 1 25 ? -1.646 3.59 -18.488 1.0 51.34 25 A 2 -ATOM 374 H H . ALA A1 1 25 ? -2.814 5.423 -17.046 1.0 55.41 25 A 2 -ATOM 375 H HA . ALA A1 1 25 ? -1.519 5.358 -19.654 1.0 23.12 25 A 2 -ATOM 376 H HB1 . ALA A1 1 25 ? -0.692 3.799 -18.025 1.0 42.21 25 A 2 -ATOM 377 H HB2 . ALA A1 1 25 ? -2.312 3.152 -17.76 1.0 3.14 25 A 2 -ATOM 378 H HB3 . ALA A1 1 25 ? -1.505 2.901 -19.307 1.0 44.44 25 A 2 -ATOM 379 N N . ASP A1 1 26 ? -4.591 5.284 -19.494 1.0 53.31 26 A 2 -ATOM 380 C CA . ASP A1 1 26 ? -5.857 5.1 -20.194 1.0 71.32 26 A 2 -ATOM 381 C C . ASP A1 1 26 ? -6.209 6.337 -21.015 1.0 31.24 26 A 2 -ATOM 382 O O . ASP A1 1 26 ? -6.357 7.433 -20.474 1.0 53.43 26 A 2 -ATOM 383 C CB . ASP A1 1 26 ? -6.977 4.799 -19.196 1.0 21.1 26 A 2 -ATOM 384 C CG . ASP A1 1 26 ? -6.751 3.5 -18.447 1.0 73.54 26 A 2 -ATOM 385 O OD1 . ASP A1 1 26 ? -6.078 3.531 -17.396 1.0 73.22 26 A 2 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.246 2.452 -18.913 1.0 2.02 26 A 2 -ATOM 387 H H . ASP A1 1 26 ? -4.54 5.933 -18.762 1.0 73.33 26 A 2 -ATOM 388 H HA . ASP A1 1 26 ? -5.748 4.259 -20.862 1.0 35.3 26 A 2 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.034 5.602 -18.476 1.0 71.15 26 A 2 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.914 4.729 -19.728 1.0 51.4 26 A 2 -ATOM 391 N N . THR A1 1 27 ? -6.342 6.153 -22.325 1.0 11.22 27 A 2 -ATOM 392 C CA . THR A1 1 27 ? -6.675 7.254 -23.221 1.0 12.11 27 A 2 -ATOM 393 C C . THR A1 1 27 ? -8.175 7.522 -23.229 1.0 24.55 27 A 2 -ATOM 394 O O . THR A1 1 27 ? -8.961 6.728 -22.711 1.0 14.34 27 A 2 -ATOM 395 C CB . THR A1 1 27 ? -6.207 6.967 -24.66 1.0 24.42 27 A 2 -ATOM 396 O OG1 . THR A1 1 27 ? -6.289 5.564 -24.931 1.0 51.41 27 A 2 -ATOM 397 C CG2 . THR A1 1 27 ? -4.779 7.447 -24.871 1.0 72.22 27 A 2 -ATOM 398 H H . THR A1 1 27 ? -6.213 5.256 -22.696 1.0 1.33 27 A 2 -ATOM 399 H HA . THR A1 1 27 ? -6.163 8.137 -22.868 1.0 54.42 27 A 2 -ATOM 400 H HB . THR A1 1 27 ? -6.855 7.497 -25.345 1.0 51.23 27 A 2 -ATOM 401 H HG1 . THR A1 1 27 ? -5.461 5.142 -24.69 1.0 23.44 27 A 2 -ATOM 402 H HG21 . THR A1 1 27 ? -4.464 7.205 -25.875 1.0 20.21 27 A 2 -ATOM 403 H HG22 . THR A1 1 27 ? -4.127 6.96 -24.162 1.0 40.31 27 A 2 -ATOM 404 H HG23 . THR A1 1 27 ? -4.734 8.516 -24.727 1.0 53.14 27 A 2 -ATOM 405 N N . VAL A1 1 28 ? -8.568 8.644 -23.823 1.0 70.04 28 A 2 -ATOM 406 C CA . VAL A1 1 28 ? -9.976 9.016 -23.901 1.0 40.12 28 A 2 -ATOM 407 C C . VAL A1 1 28 ? -10.809 7.891 -24.504 1.0 43.3 28 A 2 -ATOM 408 O O . VAL A1 1 28 ? -11.861 7.532 -23.977 1.0 51.44 28 A 2 -ATOM 409 C CB . VAL A1 1 28 ? -10.174 10.293 -24.739 1.0 70.14 28 A 2 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.568 10.862 -24.524 1.0 13.41 28 A 2 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.109 11.324 -24.398 1.0 73.55 28 A 2 -ATOM 412 H H . VAL A1 1 28 ? -7.895 9.237 -24.218 1.0 50.23 28 A 2 -ATOM 413 H HA . VAL A1 1 28 ? -10.326 9.212 -22.897 1.0 62.42 28 A 2 -ATOM 414 H HB . VAL A1 1 28 ? -10.072 10.033 -25.783 1.0 52.41 28 A 2 -ATOM 415 H HG11 . VAL A1 1 28 ? -12.292 10.062 -24.558 1.0 72.32 28 A 2 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.613 11.35 -23.562 1.0 75.12 28 A 2 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.787 11.578 -25.302 1.0 43.12 28 A 2 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.511 10.966 -23.573 1.0 22.23 28 A 2 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.477 11.486 -25.258 1.0 21.24 28 A 2 -ATOM 420 H HG23 . VAL A1 1 28 ? -9.584 12.254 -24.121 1.0 51.43 28 A 2 -ATOM 421 N N . GLY A1 1 29 ? -10.329 7.336 -25.613 1.0 51.02 29 A 2 -ATOM 422 C CA . GLY A1 1 29 ? -11.042 6.256 -26.271 1.0 24.21 29 A 2 -ATOM 423 C C . GLY A1 1 29 ? -11.509 5.192 -25.297 1.0 62.32 29 A 2 -ATOM 424 O O . GLY A1 1 29 ? -12.671 4.787 -25.32 1.0 1.41 29 A 2 -ATOM 425 H H . GLY A1 1 29 ? -9.485 7.663 -25.989 1.0 25.44 29 A 2 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.901 6.665 -26.781 1.0 33.14 29 A 2 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.387 5.799 -26.998 1.0 61.11 29 A 2 -ATOM 428 N N . ALA A1 1 30 ? -10.601 4.738 -24.439 1.0 0.3 30 A 2 -ATOM 429 C CA . ALA A1 1 30 ? -10.926 3.715 -23.453 1.0 24.42 30 A 2 -ATOM 430 C C . ALA A1 1 30 ? -11.993 4.209 -22.482 1.0 23.15 30 A 2 -ATOM 431 O O . ALA A1 1 30 ? -12.853 3.443 -22.047 1.0 23.32 30 A 2 -ATOM 432 C CB . ALA A1 1 30 ? -9.675 3.294 -22.697 1.0 4.23 30 A 2 -ATOM 433 H H . ALA A1 1 30 ? -9.691 5.1 -24.47 1.0 13.0 30 A 2 -ATOM 434 H HA . ALA A1 1 30 ? -11.306 2.852 -23.981 1.0 42.35 30 A 2 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.954 2.675 -21.856 1.0 24.3 30 A 2 -ATOM 436 H HB2 . ALA A1 1 30 ? -9.028 2.735 -23.356 1.0 15.25 30 A 2 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.157 4.172 -22.342 1.0 54.13 30 A 2 -ATOM 438 N N . VAL A1 1 31 ? -11.93 5.493 -22.144 1.0 44.02 31 A 2 -ATOM 439 C CA . VAL A1 1 31 ? -12.891 6.089 -21.223 1.0 44.43 31 A 2 -ATOM 440 C C . VAL A1 1 31 ? -14.295 6.084 -21.816 1.0 22.33 31 A 2 -ATOM 441 O O . VAL A1 1 31 ? -15.264 5.729 -21.144 1.0 41.34 31 A 2 -ATOM 442 C CB . VAL A1 1 31 ? -12.502 7.536 -20.865 1.0 42.01 31 A 2 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.589 8.189 -20.026 1.0 61.22 31 A 2 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.166 7.563 -20.138 1.0 34.2 31 A 2 -ATOM 445 H H . VAL A1 1 31 ? -11.221 6.053 -22.524 1.0 33.11 31 A 2 -ATOM 446 H HA . VAL A1 1 31 ? -12.891 5.504 -20.316 1.0 53.53 31 A 2 -ATOM 447 H HB . VAL A1 1 31 ? -12.4 8.097 -21.783 1.0 34.14 31 A 2 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.306 7.441 -19.721 1.0 24.43 31 A 2 -ATOM 449 H HG12 . VAL A1 1 31 ? -13.145 8.642 -19.151 1.0 62.24 31 A 2 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.088 8.948 -20.61 1.0 4.44 31 A 2 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.977 6.597 -19.695 1.0 32.4 31 A 2 -ATOM 452 H HG22 . VAL A1 1 31 ? -10.379 7.798 -20.84 1.0 31.51 31 A 2 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.192 8.316 -19.363 1.0 2.41 31 A 2 -ATOM 454 N N . LYS A1 1 32 ? -14.4 6.481 -23.08 1.0 44.33 32 A 2 -ATOM 455 C CA . LYS A1 1 32 ? -15.686 6.521 -23.766 1.0 33.41 32 A 2 -ATOM 456 C C . LYS A1 1 32 ? -16.367 5.157 -23.725 1.0 33.52 32 A 2 -ATOM 457 O O . LYS A1 1 32 ? -17.57 5.06 -23.485 1.0 55.22 32 A 2 -ATOM 458 C CB . LYS A1 1 32 ? -15.499 6.966 -25.218 1.0 21.43 32 A 2 -ATOM 459 C CG . LYS A1 1 32 ? -16.17 8.291 -25.539 1.0 62.04 32 A 2 -ATOM 460 C CD . LYS A1 1 32 ? -15.159 9.422 -25.625 1.0 13.3 32 A 2 -ATOM 461 C CE . LYS A1 1 32 ? -14.915 9.842 -27.066 1.0 61.02 32 A 2 -ATOM 462 N NZ . LYS A1 1 32 ? -16.108 10.508 -27.659 1.0 10.13 32 A 2 -ATOM 463 H H . LYS A1 1 32 ? -13.591 6.753 -23.564 1.0 0.43 32 A 2 -ATOM 464 H HA . LYS A1 1 32 ? -16.312 7.238 -23.256 1.0 20.21 32 A 2 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.442 7.064 -25.418 1.0 31.13 32 A 2 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.912 6.21 -25.87 1.0 51.43 32 A 2 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.68 8.205 -26.487 1.0 34.55 32 A 2 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.886 8.518 -24.762 1.0 75.31 32 A 2 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.534 10.271 -25.073 1.0 62.53 32 A 2 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.225 9.092 -25.192 1.0 34.24 32 A 2 -ATOM 471 H HE2 . LYS A1 1 32 ? -14.082 10.527 -27.092 1.0 32.35 32 A 2 -ATOM 472 H HE3 . LYS A1 1 32 ? -14.677 8.964 -27.648 1.0 31.14 32 A 2 -ATOM 473 H HZ1 . LYS A1 1 32 ? -15.845 11.439 -28.041 1.0 3.34 32 A 2 -ATOM 474 H HZ2 . LYS A1 1 32 ? -16.842 10.638 -26.934 1.0 11.13 32 A 2 -ATOM 475 H HZ3 . LYS A1 1 32 ? -16.496 9.927 -28.429 1.0 13.55 32 A 2 -ATOM 476 N N . ALA A1 1 33 ? -15.589 4.105 -23.96 1.0 34.21 33 A 2 -ATOM 477 C CA . ALA A1 1 33 ? -16.117 2.746 -23.947 1.0 60.31 33 A 2 -ATOM 478 C C . ALA A1 1 33 ? -16.633 2.371 -22.562 1.0 31.03 33 A 2 -ATOM 479 O O . ALA A1 1 33 ? -17.661 1.707 -22.429 1.0 31.32 33 A 2 -ATOM 480 C CB . ALA A1 1 33 ? -15.05 1.761 -24.4 1.0 54.24 33 A 2 -ATOM 481 H H . ALA A1 1 33 ? -14.638 4.246 -24.146 1.0 43.1 33 A 2 -ATOM 482 H HA . ALA A1 1 33 ? -16.937 2.7 -24.65 1.0 53.01 33 A 2 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.146 1.925 -23.832 1.0 2.33 33 A 2 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.4 0.752 -24.238 1.0 61.23 33 A 2 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.847 1.908 -25.45 1.0 53.23 33 A 2 -ATOM 486 N N . LYS A1 1 34 ? -15.912 2.8 -21.531 1.0 30.14 34 A 2 -ATOM 487 C CA . LYS A1 1 34 ? -16.296 2.51 -20.155 1.0 3.41 34 A 2 -ATOM 488 C C . LYS A1 1 34 ? -17.675 3.083 -19.843 1.0 51.04 34 A 2 -ATOM 489 O O . LYS A1 1 34 ? -18.501 2.425 -19.21 1.0 30.3 34 A 2 -ATOM 490 C CB . LYS A1 1 34 ? -15.262 3.084 -19.184 1.0 63.02 34 A 2 -ATOM 491 C CG . LYS A1 1 34 ? -15.529 2.729 -17.731 1.0 24.43 34 A 2 -ATOM 492 C CD . LYS A1 1 34 ? -15.352 1.241 -17.479 1.0 44.42 34 A 2 -ATOM 493 C CE . LYS A1 1 34 ? -13.887 0.836 -17.539 1.0 34.12 34 A 2 -ATOM 494 N NZ . LYS A1 1 34 ? -13.662 -0.52 -16.967 1.0 13.0 34 A 2 -ATOM 495 H H . LYS A1 1 34 ? -15.101 3.325 -21.701 1.0 65.25 34 A 2 -ATOM 496 H HA . LYS A1 1 34 ? -16.33 1.437 -20.039 1.0 3.22 34 A 2 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.286 2.706 -19.451 1.0 71.03 34 A 2 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.259 4.16 -19.275 1.0 71.12 34 A 2 -ATOM 499 H HG2 . LYS A1 1 34 ? -14.84 3.274 -17.104 1.0 24.23 34 A 2 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.543 3.008 -17.483 1.0 22.21 34 A 2 -ATOM 501 H HD2 . LYS A1 1 34 ? -15.739 1.002 -16.5 1.0 63.43 34 A 2 -ATOM 502 H HD3 . LYS A1 1 34 ? -15.9 0.689 -18.23 1.0 75.33 34 A 2 -ATOM 503 H HE2 . LYS A1 1 34 ? -13.568 0.84 -18.57 1.0 34.14 34 A 2 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.305 1.554 -16.98 1.0 0.12 34 A 2 -ATOM 505 H HZ1 . LYS A1 1 34 ? -13.236 -1.144 -17.682 1.0 62.42 34 A 2 -ATOM 506 H HZ2 . LYS A1 1 34 ? -14.566 -0.932 -16.659 1.0 14.2 34 A 2 -ATOM 507 H HZ3 . LYS A1 1 34 ? -13.024 -0.462 -16.148 1.0 65.2 34 A 2 -ATOM 508 N N . ILE A1 1 35 ? -17.916 4.31 -20.291 1.0 14.42 35 A 2 -ATOM 509 C CA . ILE A1 1 35 ? -19.196 4.969 -20.062 1.0 22.32 35 A 2 -ATOM 510 C C . ILE A1 1 35 ? -20.314 4.285 -20.841 1.0 74.31 35 A 2 -ATOM 511 O O . ILE A1 1 35 ? -21.449 4.199 -20.372 1.0 33.23 35 A 2 -ATOM 512 C CB . ILE A1 1 35 ? -19.143 6.456 -20.46 1.0 42.5 35 A 2 -ATOM 513 C CG1 . ILE A1 1 35 ? -17.971 7.151 -19.764 1.0 22.04 35 A 2 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.455 7.143 -20.114 1.0 45.14 35 A 2 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.034 7.077 -18.254 1.0 11.1 35 A 2 -ATOM 516 H H . ILE A1 1 35 ? -17.217 4.783 -20.79 1.0 54.44 35 A 2 -ATOM 517 H HA . ILE A1 1 35 ? -19.417 4.907 -19.006 1.0 30.01 35 A 2 -ATOM 518 H HB . ILE A1 1 35 ? -19.004 6.514 -21.528 1.0 2.44 35 A 2 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.048 6.69 -20.079 1.0 3.24 35 A 2 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.962 8.194 -20.046 1.0 0.11 35 A 2 -ATOM 521 H HG21 . ILE A1 1 35 ? -21.164 6.409 -19.76 1.0 65.32 35 A 2 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.283 7.878 -19.342 1.0 43.1 35 A 2 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.849 7.63 -20.993 1.0 75.41 35 A 2 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.443 7.876 -17.83 1.0 43.52 35 A 2 -ATOM 525 H HD12 . ILE A1 1 35 ? -19.06 7.179 -17.931 1.0 71.15 35 A 2 -ATOM 526 H HD13 . ILE A1 1 35 ? -17.644 6.127 -17.923 1.0 74.3 35 A 2 -ATOM 527 N N . TYR A1 1 36 ? -19.985 3.798 -22.032 1.0 62.53 36 A 2 -ATOM 528 C CA . TYR A1 1 36 ? -20.962 3.122 -22.878 1.0 64.44 36 A 2 -ATOM 529 C C . TYR A1 1 36 ? -21.59 1.94 -22.146 1.0 53.42 36 A 2 -ATOM 530 O O . TYR A1 1 36 ? -22.807 1.756 -22.171 1.0 34.33 36 A 2 -ATOM 531 C CB . TYR A1 1 36 ? -20.302 2.643 -24.172 1.0 74.42 36 A 2 -ATOM 532 C CG . TYR A1 1 36 ? -20.678 1.23 -24.556 1.0 43.51 36 A 2 -ATOM 533 C CD1 . TYR A1 1 36 ? -21.949 0.932 -25.032 1.0 62.31 36 A 2 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.761 0.191 -24.443 1.0 22.21 36 A 2 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.296 -0.358 -25.384 1.0 25.24 36 A 2 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.1 -1.101 -24.793 1.0 24.41 36 A 2 -ATOM 537 C CZ . TYR A1 1 36 ? -21.369 -1.371 -25.262 1.0 51.0 36 A 2 -ATOM 538 O OH . TYR A1 1 36 ? -21.71 -2.657 -25.612 1.0 31.41 36 A 2 -ATOM 539 H H . TYR A1 1 36 ? -19.064 3.898 -22.352 1.0 42.53 36 A 2 -ATOM 540 H HA . TYR A1 1 36 ? -21.738 3.833 -23.122 1.0 45.34 36 A 2 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.596 3.295 -24.98 1.0 32.41 36 A 2 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.229 2.682 -24.057 1.0 73.31 36 A 2 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.673 1.729 -25.127 1.0 14.41 36 A 2 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.768 0.406 -24.075 1.0 73.43 36 A 2 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.29 -0.569 -25.751 1.0 30.0 36 A 2 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.374 -1.895 -24.698 1.0 11.1 36 A 2 -ATOM 547 H HH . TYR A1 1 36 ? -21.252 -2.901 -26.42 1.0 20.21 36 A 2 -ATOM 548 N N . ASP A1 1 37 ? -20.751 1.142 -21.495 1.0 31.31 37 A 2 -ATOM 549 C CA . ASP A1 1 37 ? -21.222 -0.022 -20.754 1.0 4.3 37 A 2 -ATOM 550 C C . ASP A1 1 37 ? -21.886 0.399 -19.446 1.0 30.32 37 A 2 -ATOM 551 O O . ASP A1 1 37 ? -22.812 -0.257 -18.968 1.0 62.0 37 A 2 -ATOM 552 C CB . ASP A1 1 37 ? -20.06 -0.975 -20.467 1.0 35.43 37 A 2 -ATOM 553 C CG . ASP A1 1 37 ? -20.407 -2.419 -20.772 1.0 34.32 37 A 2 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.364 -2.941 -20.163 1.0 31.12 37 A 2 -ATOM 555 O OD2 . ASP A1 1 37 ? -19.722 -3.026 -21.622 1.0 3.2 37 A 2 -ATOM 556 H H . ASP A1 1 37 ? -19.791 1.342 -21.512 1.0 51.42 37 A 2 -ATOM 557 H HA . ASP A1 1 37 ? -21.951 -0.532 -21.365 1.0 32.24 37 A 2 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.212 -0.692 -21.074 1.0 43.14 37 A 2 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.792 -0.901 -19.423 1.0 34.23 37 A 2 -ATOM 560 N N . LYS A1 1 38 ? -21.406 1.496 -18.871 1.0 33.03 38 A 2 -ATOM 561 C CA . LYS A1 1 38 ? -21.952 2.005 -17.619 1.0 33.5 38 A 2 -ATOM 562 C C . LYS A1 1 38 ? -23.457 2.228 -17.732 1.0 62.1 38 A 2 -ATOM 563 O O . LYS A1 1 38 ? -24.219 1.831 -16.852 1.0 13.24 38 A 2 -ATOM 564 C CB . LYS A1 1 38 ? -21.26 3.314 -17.232 1.0 32.13 38 A 2 -ATOM 565 C CG . LYS A1 1 38 ? -20.428 3.211 -15.965 1.0 11.13 38 A 2 -ATOM 566 C CD . LYS A1 1 38 ? -18.959 2.98 -16.28 1.0 55.11 38 A 2 -ATOM 567 C CE . LYS A1 1 38 ? -18.649 1.5 -16.442 1.0 12.13 38 A 2 -ATOM 568 N NZ . LYS A1 1 38 ? -18.084 0.912 -15.197 1.0 62.42 38 A 2 -ATOM 569 H H . LYS A1 1 38 ? -20.666 1.976 -19.3 1.0 40.1 38 A 2 -ATOM 570 H HA . LYS A1 1 38 ? -21.766 1.269 -16.852 1.0 13.43 38 A 2 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.611 3.617 -18.04 1.0 53.44 38 A 2 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.012 4.075 -17.081 1.0 74.35 38 A 2 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.525 4.129 -15.405 1.0 72.35 38 A 2 -ATOM 574 H HG3 . LYS A1 1 38 ? -20.793 2.384 -15.372 1.0 65.33 38 A 2 -ATOM 575 H HD2 . LYS A1 1 38 ? -18.712 3.491 -17.199 1.0 31.44 38 A 2 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.36 3.378 -15.473 1.0 51.13 38 A 2 -ATOM 577 H HE2 . LYS A1 1 38 ? -19.561 0.98 -16.694 1.0 72.24 38 A 2 -ATOM 578 H HE3 . LYS A1 1 38 ? -17.934 1.381 -17.243 1.0 52.14 38 A 2 -ATOM 579 H HZ1 . LYS A1 1 38 ? -17.816 -0.08 -15.359 1.0 12.21 38 A 2 -ATOM 580 H HZ2 . LYS A1 1 38 ? -18.789 0.949 -14.432 1.0 31.3 38 A 2 -ATOM 581 H HZ3 . LYS A1 1 38 ? -17.241 1.443 -14.901 1.0 72.13 38 A 2 -ATOM 582 N N . GLU A1 1 39 ? -23.876 2.864 -18.822 1.0 74.33 39 A 2 -ATOM 583 C CA . GLU A1 1 39 ? -25.29 3.138 -19.049 1.0 31.43 39 A 2 -ATOM 584 C C . GLU A1 1 39 ? -25.827 2.301 -20.206 1.0 55.55 39 A 2 -ATOM 585 O O . GLU A1 1 39 ? -26.813 1.579 -20.06 1.0 44.25 39 A 2 -ATOM 586 C CB . GLU A1 1 39 ? -25.504 4.625 -19.338 1.0 31.12 39 A 2 -ATOM 587 C CG . GLU A1 1 39 ? -24.358 5.268 -20.1 1.0 22.34 39 A 2 -ATOM 588 C CD . GLU A1 1 39 ? -24.532 6.766 -20.261 1.0 34.02 39 A 2 -ATOM 589 O OE1 . GLU A1 1 39 ? -25.658 7.202 -20.577 1.0 60.52 39 A 2 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.541 7.502 -20.07 1.0 24.54 39 A 2 -ATOM 591 H H . GLU A1 1 39 ? -23.219 3.156 -19.488 1.0 53.12 39 A 2 -ATOM 592 H HA . GLU A1 1 39 ? -25.827 2.874 -18.15 1.0 24.23 39 A 2 -ATOM 593 H HB2 . GLU A1 1 39 ? -26.406 4.74 -19.921 1.0 13.32 39 A 2 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.624 5.148 -18.4 1.0 53.15 39 A 2 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.438 5.084 -19.564 1.0 73.51 39 A 2 -ATOM 596 H HG3 . GLU A1 1 39 ? -24.297 4.82 -21.08 1.0 55.55 39 A 2 -ATOM 597 N N . GLY A1 1 40 ? -25.172 2.405 -21.358 1.0 41.31 40 A 2 -ATOM 598 C CA . GLY A1 1 40 ? -25.598 1.653 -22.525 1.0 23.2 40 A 2 -ATOM 599 C C . GLY A1 1 40 ? -25.921 2.548 -23.705 1.0 54.31 40 A 2 -ATOM 600 O O . GLY A1 1 40 ? -26.988 2.43 -24.307 1.0 62.35 40 A 2 -ATOM 601 H H . GLY A1 1 40 ? -24.392 2.996 -21.417 1.0 1.31 40 A 2 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.809 0.972 -22.808 1.0 42.33 40 A 2 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.478 1.082 -22.269 1.0 42.25 40 A 2 -ATOM 604 N N . ILE A1 1 41 ? -24.999 3.446 -24.034 1.0 11.45 41 A 2 -ATOM 605 C CA . ILE A1 1 41 ? -25.192 4.365 -25.149 1.0 13.21 41 A 2 -ATOM 606 C C . ILE A1 1 41 ? -24.006 4.323 -26.107 1.0 73.14 41 A 2 -ATOM 607 O O . ILE A1 1 41 ? -22.905 3.901 -25.754 1.0 54.03 41 A 2 -ATOM 608 C CB . ILE A1 1 41 ? -25.391 5.811 -24.659 1.0 13.54 41 A 2 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.516 6.082 -23.433 1.0 35.25 41 A 2 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.856 6.065 -24.337 1.0 15.54 41 A 2 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.984 7.497 -23.371 1.0 51.21 41 A 2 -ATOM 612 H H . ILE A1 1 41 ? -24.169 3.492 -23.515 1.0 10.31 41 A 2 -ATOM 613 H HA . ILE A1 1 41 ? -26.082 4.061 -25.681 1.0 22.4 41 A 2 -ATOM 614 H HB . ILE A1 1 41 ? -25.1 6.48 -25.454 1.0 2.22 41 A 2 -ATOM 615 H HG12 . ILE A1 1 41 ? -25.094 5.907 -22.54 1.0 53.25 41 A 2 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.671 5.409 -23.448 1.0 73.21 41 A 2 -ATOM 617 H HG21 . ILE A1 1 41 ? -27.049 7.128 -24.354 1.0 41.34 41 A 2 -ATOM 618 H HG22 . ILE A1 1 41 ? -27.475 5.576 -25.074 1.0 35.01 41 A 2 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.083 5.673 -23.357 1.0 24.24 41 A 2 -ATOM 620 H HD11 . ILE A1 1 41 ? -24.734 8.145 -22.941 1.0 13.35 41 A 2 -ATOM 621 H HD12 . ILE A1 1 41 ? -23.095 7.521 -22.758 1.0 5.02 41 A 2 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.744 7.836 -24.368 1.0 73.01 41 A 2 -ATOM 623 N N . PRO A1 1 42 ? -24.235 4.772 -27.351 1.0 42.01 42 A 2 -ATOM 624 C CA . PRO A1 1 42 ? -23.197 4.799 -28.385 1.0 63.34 42 A 2 -ATOM 625 C C . PRO A1 1 42 ? -22.121 5.841 -28.101 1.0 4.23 42 A 2 -ATOM 626 O O . PRO A1 1 42 ? -22.367 7.047 -28.132 1.0 21.54 42 A 2 -ATOM 627 C CB . PRO A1 1 42 ? -23.971 5.162 -29.655 1.0 63.45 42 A 2 -ATOM 628 C CG . PRO A1 1 42 ? -25.17 5.901 -29.169 1.0 31.23 42 A 2 -ATOM 629 C CD . PRO A1 1 42 ? -25.523 5.29 -27.841 1.0 52.22 42 A 2 -ATOM 630 H HA . PRO A1 1 42 ? -22.734 3.83 -28.509 1.0 60.32 42 A 2 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.354 5.783 -30.29 1.0 50.23 42 A 2 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.249 4.262 -30.182 1.0 64.01 42 A 2 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.933 6.947 -29.049 1.0 0.11 42 A 2 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.985 5.777 -29.867 1.0 1.1 42 A 2 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.917 6.041 -27.173 1.0 11.32 42 A 2 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.235 4.488 -27.972 1.0 34.03 42 A 2 -ATOM 637 N N . PRO A1 1 43 ? -20.898 5.368 -27.816 1.0 1.41 43 A 2 -ATOM 638 C CA . PRO A1 1 43 ? -19.76 6.244 -27.522 1.0 62.53 43 A 2 -ATOM 639 C C . PRO A1 1 43 ? -19.284 7.01 -28.751 1.0 21.35 43 A 2 -ATOM 640 O O . PRO A1 1 43 ? -18.796 8.135 -28.642 1.0 73.42 43 A 2 -ATOM 641 C CB . PRO A1 1 43 ? -18.678 5.271 -27.047 1.0 74.43 43 A 2 -ATOM 642 C CG . PRO A1 1 43 ? -19.031 3.971 -27.684 1.0 42.11 43 A 2 -ATOM 643 C CD . PRO A1 1 43 ? -20.533 3.943 -27.761 1.0 32.53 43 A 2 -ATOM 644 H HA . PRO A1 1 43 ? -19.991 6.942 -26.73 1.0 3.1 43 A 2 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.708 5.62 -27.373 1.0 1.2 43 A 2 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.698 5.201 -25.97 1.0 52.2 43 A 2 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.603 3.918 -28.673 1.0 21.5 43 A 2 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.673 3.155 -27.074 1.0 41.32 43 A 2 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.855 3.428 -28.654 1.0 55.24 43 A 2 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.948 3.473 -26.882 1.0 31.14 43 A 2 -ATOM 651 N N . ASP A1 1 44 ? -19.431 6.395 -29.919 1.0 54.12 44 A 2 -ATOM 652 C CA . ASP A1 1 44 ? -19.017 7.021 -31.17 1.0 51.34 44 A 2 -ATOM 653 C C . ASP A1 1 44 ? -19.978 8.14 -31.561 1.0 65.34 44 A 2 -ATOM 654 O O . ASP A1 1 44 ? -19.655 8.983 -32.397 1.0 41.23 44 A 2 -ATOM 655 C CB . ASP A1 1 44 ? -18.947 5.979 -32.287 1.0 23.35 44 A 2 -ATOM 656 C CG . ASP A1 1 44 ? -18.062 6.421 -33.436 1.0 52.14 44 A 2 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.84 6.173 -33.372 1.0 70.43 44 A 2 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.591 7.015 -34.399 1.0 15.14 44 A 2 -ATOM 659 H H . ASP A1 1 44 ? -19.827 5.498 -29.941 1.0 64.31 44 A 2 -ATOM 660 H HA . ASP A1 1 44 ? -18.035 7.442 -31.021 1.0 72.42 44 A 2 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.551 5.057 -31.887 1.0 64.21 44 A 2 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.941 5.802 -32.67 1.0 74.33 44 A 2 -ATOM 663 N N . GLN A1 1 45 ? -21.159 8.139 -30.951 1.0 24.51 45 A 2 -ATOM 664 C CA . GLN A1 1 45 ? -22.166 9.154 -31.237 1.0 55.1 45 A 2 -ATOM 665 C C . GLN A1 1 45 ? -22.061 10.317 -30.257 1.0 65.33 45 A 2 -ATOM 666 O O . GLN A1 1 45 ? -22.663 11.37 -30.463 1.0 0.12 45 A 2 -ATOM 667 C CB . GLN A1 1 45 ? -23.567 8.543 -31.174 1.0 3.33 45 A 2 -ATOM 668 C CG . GLN A1 1 45 ? -24.028 7.939 -32.491 1.0 71.05 45 A 2 -ATOM 669 C CD . GLN A1 1 45 ? -25.001 6.793 -32.298 1.0 50.21 45 A 2 -ATOM 670 O OE1 . GLN A1 1 45 ? -26.134 6.993 -31.857 1.0 30.33 45 A 2 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.565 5.583 -32.628 1.0 54.11 45 A 2 -ATOM 672 H H . GLN A1 1 45 ? -21.357 7.441 -30.294 1.0 33.14 45 A 2 -ATOM 673 H HA . GLN A1 1 45 ? -21.989 9.523 -32.236 1.0 54.13 45 A 2 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.575 7.767 -30.424 1.0 72.22 45 A 2 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.27 9.313 -30.891 1.0 51.24 45 A 2 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.511 8.707 -33.075 1.0 11.31 45 A 2 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.164 7.572 -33.025 1.0 33.23 45 A 2 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.651 5.499 -32.972 1.0 35.4 45 A 2 -ATOM 679 H HE22 . GLN A1 1 45 ? -25.173 4.824 -32.513 1.0 53.4 45 A 2 -ATOM 680 N N . GLN A1 1 46 ? -21.292 10.119 -29.191 1.0 5.34 46 A 2 -ATOM 681 C CA . GLN A1 1 46 ? -21.109 11.153 -28.179 1.0 54.21 46 A 2 -ATOM 682 C C . GLN A1 1 46 ? -19.665 11.643 -28.156 1.0 23.33 46 A 2 -ATOM 683 O O . GLN A1 1 46 ? -18.744 10.908 -28.512 1.0 42.0 46 A 2 -ATOM 684 C CB . GLN A1 1 46 ? -21.502 10.62 -26.8 1.0 54.1 46 A 2 -ATOM 685 C CG . GLN A1 1 46 ? -20.742 9.368 -26.392 1.0 63.33 46 A 2 -ATOM 686 C CD . GLN A1 1 46 ? -20.699 9.174 -24.889 1.0 73.34 46 A 2 -ATOM 687 O OE1 . GLN A1 1 46 ? -21.738 9.109 -24.231 1.0 62.34 46 A 2 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.495 9.081 -24.338 1.0 52.51 46 A 2 -ATOM 689 H H . GLN A1 1 46 ? -20.838 9.258 -29.083 1.0 61.13 46 A 2 -ATOM 690 H HA . GLN A1 1 46 ? -21.753 11.981 -28.431 1.0 1.54 46 A 2 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.311 11.387 -26.064 1.0 70.34 46 A 2 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.557 10.389 -26.803 1.0 24.41 46 A 2 -ATOM 693 H HG2 . GLN A1 1 46 ? -21.223 8.51 -26.837 1.0 71.34 46 A 2 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.729 9.442 -26.76 1.0 12.44 46 A 2 -ATOM 695 H HE21 . GLN A1 1 46 ? -18.712 9.143 -24.924 1.0 61.21 46 A 2 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.438 8.956 -23.368 1.0 54.41 46 A 2 -ATOM 697 N N . ARG A1 1 47 ? -19.475 12.889 -27.736 1.0 11.31 47 A 2 -ATOM 698 C CA . ARG A1 1 47 ? -18.143 13.478 -27.668 1.0 74.42 47 A 2 -ATOM 699 C C . ARG A1 1 47 ? -17.946 14.226 -26.353 1.0 0.05 47 A 2 -ATOM 700 O O . ARG A1 1 47 ? -18.91 14.538 -25.652 1.0 62.43 47 A 2 -ATOM 701 C CB . ARG A1 1 47 ? -17.922 14.429 -28.846 1.0 53.24 47 A 2 -ATOM 702 C CG . ARG A1 1 47 ? -17.348 13.749 -30.078 1.0 25.13 47 A 2 -ATOM 703 C CD . ARG A1 1 47 ? -17.619 14.558 -31.337 1.0 74.31 47 A 2 -ATOM 704 N NE . ARG A1 1 47 ? -16.727 14.182 -32.431 1.0 72.02 47 A 2 -ATOM 705 C CZ . ARG A1 1 47 ? -16.885 14.597 -33.683 1.0 4.33 47 A 2 -ATOM 706 N NH1 . ARG A1 1 47 ? -17.895 15.396 -33.998 1.0 22.33 47 A 2 -ATOM 707 N NH2 . ARG A1 1 47 ? -16.032 14.212 -34.623 1.0 24.44 47 A 2 -ATOM 708 H H . ARG A1 1 47 ? -20.249 13.426 -27.465 1.0 14.32 47 A 2 -ATOM 709 H HA . ARG A1 1 47 ? -17.423 12.676 -27.724 1.0 52.1 47 A 2 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.868 14.875 -29.116 1.0 12.43 47 A 2 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.24 15.208 -28.54 1.0 31.22 47 A 2 -ATOM 712 H HG2 . ARG A1 1 47 ? -16.281 13.643 -29.955 1.0 2.15 47 A 2 -ATOM 713 H HG3 . ARG A1 1 47 ? -17.8 12.774 -30.182 1.0 3.22 47 A 2 -ATOM 714 H HD2 . ARG A1 1 47 ? -18.641 14.389 -31.644 1.0 62.34 47 A 2 -ATOM 715 H HD3 . ARG A1 1 47 ? -17.479 15.605 -31.114 1.0 4.32 47 A 2 -ATOM 716 H HE . ARG A1 1 47 ? -15.975 13.592 -32.221 1.0 51.12 47 A 2 -ATOM 717 H HH11 . ARG A1 1 47 ? -18.539 15.689 -33.292 1.0 35.02 47 A 2 -ATOM 718 H HH12 . ARG A1 1 47 ? -18.011 15.708 -34.941 1.0 42.25 47 A 2 -ATOM 719 H HH21 . ARG A1 1 47 ? -15.269 13.609 -34.39 1.0 32.54 47 A 2 -ATOM 720 H HH22 . ARG A1 1 47 ? -16.151 14.524 -35.565 1.0 51.04 47 A 2 -ATOM 721 N N . LEU A1 1 48 ? -16.691 14.51 -26.023 1.0 13.42 48 A 2 -ATOM 722 C CA . LEU A1 1 48 ? -16.366 15.221 -24.791 1.0 63.04 48 A 2 -ATOM 723 C C . LEU A1 1 48 ? -16.012 16.677 -25.079 1.0 70.54 48 A 2 -ATOM 724 O O . LEU A1 1 48 ? -15.464 16.995 -26.135 1.0 13.22 48 A 2 -ATOM 725 C CB . LEU A1 1 48 ? -15.202 14.534 -24.074 1.0 73.22 48 A 2 -ATOM 726 C CG . LEU A1 1 48 ? -15.157 13.009 -24.177 1.0 23.01 48 A 2 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.555 12.424 -24.054 1.0 2.23 48 A 2 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.511 12.582 -25.487 1.0 62.5 48 A 2 -ATOM 729 H H . LEU A1 1 48 ? -15.965 14.236 -26.621 1.0 13.1 48 A 2 -ATOM 730 H HA . LEU A1 1 48 ? -17.237 15.194 -24.153 1.0 5.14 48 A 2 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.284 14.921 -24.489 1.0 14.35 48 A 2 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.26 14.795 -23.027 1.0 62.22 48 A 2 -ATOM 733 H HG . LEU A1 1 48 ? -14.559 12.618 -23.365 1.0 74.12 48 A 2 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.179 13.099 -23.488 1.0 72.12 48 A 2 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.503 11.471 -23.547 1.0 51.52 48 A 2 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.975 12.285 -25.039 1.0 50.13 48 A 2 -ATOM 737 H HD21 . LEU A1 1 48 ? -15.28 12.384 -26.219 1.0 32.51 48 A 2 -ATOM 738 H HD22 . LEU A1 1 48 ? -13.928 11.687 -25.326 1.0 4.35 48 A 2 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.867 13.372 -25.845 1.0 44.23 48 A 2 -ATOM 740 N N . ILE A1 1 49 ? -16.329 17.555 -24.134 1.0 13.31 49 A 2 -ATOM 741 C CA . ILE A1 1 49 ? -16.041 18.976 -24.286 1.0 13.25 49 A 2 -ATOM 742 C C . ILE A1 1 49 ? -15.541 19.578 -22.977 1.0 73.24 49 A 2 -ATOM 743 O O . ILE A1 1 49 ? -16.186 19.453 -21.936 1.0 20.41 49 A 2 -ATOM 744 C CB . ILE A1 1 49 ? -17.284 19.755 -24.754 1.0 42.12 49 A 2 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.398 19.708 -26.279 1.0 21.4 49 A 2 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.222 21.195 -24.267 1.0 44.11 49 A 2 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.579 18.9 -26.772 1.0 30.32 49 A 2 -ATOM 748 H H . ILE A1 1 49 ? -16.765 17.24 -23.315 1.0 11.12 49 A 2 -ATOM 749 H HA . ILE A1 1 49 ? -15.271 19.082 -25.036 1.0 31.54 49 A 2 -ATOM 750 H HB . ILE A1 1 49 ? -18.157 19.291 -24.32 1.0 10.22 49 A 2 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.503 20.712 -26.658 1.0 52.53 49 A 2 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.5 19.266 -26.686 1.0 23.14 49 A 2 -ATOM 753 H HG21 . ILE A1 1 49 ? -17.876 21.808 -24.87 1.0 54.41 49 A 2 -ATOM 754 H HG22 . ILE A1 1 49 ? -17.538 21.24 -23.235 1.0 2.4 49 A 2 -ATOM 755 H HG23 . ILE A1 1 49 ? -16.209 21.56 -24.35 1.0 53.42 49 A 2 -ATOM 756 H HD11 . ILE A1 1 49 ? -18.307 18.384 -27.681 1.0 43.14 49 A 2 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.861 18.178 -26.02 1.0 61.33 49 A 2 -ATOM 758 H HD13 . ILE A1 1 49 ? -19.41 19.56 -26.968 1.0 3.14 49 A 2 -ATOM 759 N N . PHE A1 1 50 ? -14.387 20.235 -23.037 1.0 0.44 50 A 2 -ATOM 760 C CA . PHE A1 1 50 ? -13.8 20.858 -21.857 1.0 63.4 50 A 2 -ATOM 761 C C . PHE A1 1 50 ? -13.666 22.366 -22.048 1.0 34.31 50 A 2 -ATOM 762 O O . PHE A1 1 50 ? -12.835 22.834 -22.825 1.0 24.03 50 A 2 -ATOM 763 C CB . PHE A1 1 50 ? -12.429 20.247 -21.56 1.0 1.31 50 A 2 -ATOM 764 C CG . PHE A1 1 50 ? -11.893 20.608 -20.204 1.0 63.44 50 A 2 -ATOM 765 C CD1 . PHE A1 1 50 ? -12.451 20.066 -19.058 1.0 63.22 50 A 2 -ATOM 766 C CD2 . PHE A1 1 50 ? -10.831 21.488 -20.076 1.0 31.12 50 A 2 -ATOM 767 C CE1 . PHE A1 1 50 ? -11.96 20.395 -17.808 1.0 44.05 50 A 2 -ATOM 768 C CE2 . PHE A1 1 50 ? -10.335 21.821 -18.829 1.0 53.14 50 A 2 -ATOM 769 C CZ . PHE A1 1 50 ? -10.901 21.274 -17.694 1.0 64.24 50 A 2 -ATOM 770 H H . PHE A1 1 50 ? -13.919 20.301 -23.896 1.0 32.43 50 A 2 -ATOM 771 H HA . PHE A1 1 50 ? -14.457 20.67 -21.022 1.0 55.42 50 A 2 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.503 19.172 -21.612 1.0 72.21 50 A 2 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.722 20.591 -22.3 1.0 52.42 50 A 2 -ATOM 774 H HD1 . PHE A1 1 50 ? -13.28 19.378 -19.146 1.0 64.41 50 A 2 -ATOM 775 H HD2 . PHE A1 1 50 ? -10.388 21.917 -20.963 1.0 25.0 50 A 2 -ATOM 776 H HE1 . PHE A1 1 50 ? -12.405 19.966 -16.923 1.0 33.34 50 A 2 -ATOM 777 H HE2 . PHE A1 1 50 ? -9.507 22.509 -18.743 1.0 34.14 50 A 2 -ATOM 778 H HZ . PHE A1 1 50 ? -10.515 21.532 -16.719 1.0 42.2 50 A 2 -ATOM 779 N N . GLY A1 1 51 ? -14.493 23.123 -21.333 1.0 53.44 51 A 2 -ATOM 780 C CA . GLY A1 1 51 ? -14.453 24.57 -21.438 1.0 33.5 51 A 2 -ATOM 781 C C . GLY A1 1 51 ? -15.044 25.074 -22.739 1.0 34.32 51 A 2 -ATOM 782 O O . GLY A1 1 51 ? -15.134 26.28 -22.963 1.0 0.02 51 A 2 -ATOM 783 H H . GLY A1 1 51 ? -15.136 22.695 -20.729 1.0 14.34 51 A 2 -ATOM 784 H HA2 . GLY A1 1 51 ? -15.007 24.995 -20.614 1.0 71.3 51 A 2 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.425 24.895 -21.373 1.0 2.33 51 A 2 -ATOM 786 N N . GLY A1 1 52 ? -15.447 24.146 -23.603 1.0 51.33 52 A 2 -ATOM 787 C CA . GLY A1 1 52 ? -16.026 24.523 -24.879 1.0 70.11 52 A 2 -ATOM 788 C C . GLY A1 1 52 ? -15.383 23.796 -26.044 1.0 64.35 52 A 2 -ATOM 789 O O . GLY A1 1 52 ? -16.0 23.624 -27.095 1.0 21.12 52 A 2 -ATOM 790 H H . GLY A1 1 52 ? -15.351 23.199 -23.371 1.0 52.33 52 A 2 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.081 24.295 -24.865 1.0 34.31 52 A 2 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.899 25.586 -25.019 1.0 33.12 52 A 2 -ATOM 793 N N . LYS A1 1 53 ? -14.138 23.37 -25.859 1.0 4.12 53 A 2 -ATOM 794 C CA . LYS A1 1 53 ? -13.409 22.659 -26.902 1.0 20.15 53 A 2 -ATOM 795 C C . LYS A1 1 53 ? -13.578 21.15 -26.752 1.0 12.34 53 A 2 -ATOM 796 O O . LYS A1 1 53 ? -13.666 20.636 -25.637 1.0 53.3 53 A 2 -ATOM 797 C CB . LYS A1 1 53 ? -11.924 23.024 -26.856 1.0 12.13 53 A 2 -ATOM 798 C CG . LYS A1 1 53 ? -11.262 22.71 -25.525 1.0 34.42 53 A 2 -ATOM 799 C CD . LYS A1 1 53 ? -10.633 21.327 -25.528 1.0 44.0 53 A 2 -ATOM 800 C CE . LYS A1 1 53 ? -9.496 21.234 -26.535 1.0 75.53 53 A 2 -ATOM 801 N NZ . LYS A1 1 53 ? -8.188 20.974 -25.873 1.0 61.53 53 A 2 -ATOM 802 H H . LYS A1 1 53 ? -13.699 23.538 -24.999 1.0 32.12 53 A 2 -ATOM 803 H HA . LYS A1 1 53 ? -13.816 22.961 -27.856 1.0 74.23 53 A 2 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.406 22.477 -27.63 1.0 34.02 53 A 2 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.82 24.083 -27.044 1.0 32.22 53 A 2 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.493 23.443 -25.334 1.0 24.24 53 A 2 -ATOM 807 H HG3 . LYS A1 1 53 ? -12.007 22.755 -24.743 1.0 53.0 53 A 2 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.244 21.116 -24.543 1.0 22.42 53 A 2 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.388 20.598 -25.783 1.0 0.05 53 A 2 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.708 20.431 -27.224 1.0 25.2 53 A 2 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.436 22.166 -27.077 1.0 75.24 53 A 2 -ATOM 812 H HZ1 . LYS A1 1 53 ? -8.331 20.417 -25.006 1.0 1.33 53 A 2 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.729 21.873 -25.623 1.0 14.14 53 A 2 -ATOM 814 H HZ3 . LYS A1 1 53 ? -7.563 20.445 -26.513 1.0 31.25 53 A 2 -ATOM 815 N N . GLN A1 1 54 ? -13.62 20.448 -27.88 1.0 32.1 54 A 2 -ATOM 816 C CA . GLN A1 1 54 ? -13.777 18.999 -27.871 1.0 3.14 54 A 2 -ATOM 817 C C . GLN A1 1 54 ? -12.493 18.315 -27.415 1.0 14.5 54 A 2 -ATOM 818 O O . GLN A1 1 54 ? -11.42 18.92 -27.417 1.0 22.04 54 A 2 -ATOM 819 C CB . GLN A1 1 54 ? -14.168 18.499 -29.263 1.0 14.03 54 A 2 -ATOM 820 C CG . GLN A1 1 54 ? -15.381 17.583 -29.262 1.0 52.41 54 A 2 -ATOM 821 C CD . GLN A1 1 54 ? -15.005 16.116 -29.308 1.0 44.23 54 A 2 -ATOM 822 O OE1 . GLN A1 1 54 ? -14.949 15.445 -28.276 1.0 25.33 54 A 2 -ATOM 823 N NE2 . GLN A1 1 54 ? -14.745 15.608 -30.507 1.0 63.1 54 A 2 -ATOM 824 H H . GLN A1 1 54 ? -13.545 20.916 -28.737 1.0 52.11 54 A 2 -ATOM 825 H HA . GLN A1 1 54 ? -14.566 18.755 -27.177 1.0 62.04 54 A 2 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.387 19.35 -29.89 1.0 31.24 54 A 2 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.335 17.956 -29.685 1.0 25.42 54 A 2 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.953 17.765 -28.364 1.0 52.11 54 A 2 -ATOM 829 H HG3 . GLN A1 1 54 ? -15.989 17.811 -30.126 1.0 53.52 54 A 2 -ATOM 830 H HE21 . GLN A1 1 54 ? -14.808 16.202 -31.284 1.0 45.55 54 A 2 -ATOM 831 H HE22 . GLN A1 1 54 ? -14.498 14.662 -30.565 1.0 62.42 54 A 2 -ATOM 832 N N . LEU A1 1 55 ? -12.609 17.051 -27.023 1.0 51.34 55 A 2 -ATOM 833 C CA . LEU A1 1 55 ? -11.456 16.284 -26.562 1.0 40.45 55 A 2 -ATOM 834 C C . LEU A1 1 55 ? -11.183 15.103 -27.489 1.0 63.5 55 A 2 -ATOM 835 O O . LEU A1 1 55 ? -12.068 14.29 -27.75 1.0 52.11 55 A 2 -ATOM 836 C CB . LEU A1 1 55 ? -11.688 15.784 -25.135 1.0 25.03 55 A 2 -ATOM 837 C CG . LEU A1 1 55 ? -12.159 16.832 -24.126 1.0 41.33 55 A 2 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.184 16.246 -22.722 1.0 33.24 55 A 2 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.263 18.061 -24.176 1.0 52.23 55 A 2 -ATOM 840 H H . LEU A1 1 55 ? -13.489 16.623 -27.043 1.0 12.34 55 A 2 -ATOM 841 H HA . LEU A1 1 55 ? -10.598 16.939 -26.571 1.0 22.21 55 A 2 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.434 15.005 -25.175 1.0 55.1 55 A 2 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.757 15.371 -24.775 1.0 51.11 55 A 2 -ATOM 844 H HG . LEU A1 1 55 ? -13.164 17.139 -24.377 1.0 72.12 55 A 2 -ATOM 845 H HD11 . LEU A1 1 55 ? -12.015 17.032 -22.001 1.0 32.04 55 A 2 -ATOM 846 H HD12 . LEU A1 1 55 ? -11.41 15.499 -22.63 1.0 44.35 55 A 2 -ATOM 847 H HD13 . LEU A1 1 55 ? -13.147 15.791 -22.54 1.0 32.21 55 A 2 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.808 18.885 -24.613 1.0 33.14 55 A 2 -ATOM 849 H HD22 . LEU A1 1 55 ? -10.392 17.846 -24.777 1.0 72.01 55 A 2 -ATOM 850 H HD23 . LEU A1 1 55 ? -10.954 18.323 -23.175 1.0 74.33 55 A 2 -ATOM 851 N N . GLU A1 1 56 ? -9.951 15.016 -27.98 1.0 12.02 56 A 2 -ATOM 852 C CA . GLU A1 1 56 ? -9.561 13.934 -28.876 1.0 31.33 56 A 2 -ATOM 853 C C . GLU A1 1 56 ? -9.496 12.605 -28.128 1.0 62.51 56 A 2 -ATOM 854 O O . GLU A1 1 56 ? -9.843 12.526 -26.949 1.0 51.02 56 A 2 -ATOM 855 C CB . GLU A1 1 56 ? -8.206 14.236 -29.519 1.0 62.01 56 A 2 -ATOM 856 C CG . GLU A1 1 56 ? -8.231 14.199 -31.038 1.0 21.02 56 A 2 -ATOM 857 C CD . GLU A1 1 56 ? -7.542 15.396 -31.662 1.0 1.0 56 A 2 -ATOM 858 O OE1 . GLU A1 1 56 ? -7.759 16.526 -31.177 1.0 61.34 56 A 2 -ATOM 859 O OE2 . GLU A1 1 56 ? -6.785 15.203 -32.636 1.0 22.01 56 A 2 -ATOM 860 H H . GLU A1 1 56 ? -9.289 15.696 -27.735 1.0 72.43 56 A 2 -ATOM 861 H HA . GLU A1 1 56 ? -10.309 13.86 -29.652 1.0 4.21 56 A 2 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.886 15.22 -29.208 1.0 41.11 56 A 2 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.487 13.508 -29.174 1.0 51.02 56 A 2 -ATOM 864 H HG2 . GLU A1 1 56 ? -7.731 13.301 -31.371 1.0 71.31 56 A 2 -ATOM 865 H HG3 . GLU A1 1 56 ? -9.259 14.181 -31.368 1.0 60.44 56 A 2 -ATOM 866 N N . ASP A1 1 57 ? -9.051 11.564 -28.822 1.0 71.03 57 A 2 -ATOM 867 C CA . ASP A1 1 57 ? -8.94 10.238 -28.225 1.0 63.41 57 A 2 -ATOM 868 C C . ASP A1 1 57 ? -7.794 10.19 -27.218 1.0 21.4 57 A 2 -ATOM 869 O O . ASP A1 1 57 ? -7.765 9.331 -26.337 1.0 43.31 57 A 2 -ATOM 870 C CB . ASP A1 1 57 ? -8.726 9.182 -29.311 1.0 45.31 57 A 2 -ATOM 871 C CG . ASP A1 1 57 ? -9.517 9.478 -30.569 1.0 55.43 57 A 2 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.674 9.932 -30.449 1.0 72.35 57 A 2 -ATOM 873 O OD2 . ASP A1 1 57 ? -8.98 9.254 -31.675 1.0 15.11 57 A 2 -ATOM 874 H H . ASP A1 1 57 ? -8.789 11.69 -29.758 1.0 23.12 57 A 2 -ATOM 875 H HA . ASP A1 1 57 ? -9.864 10.028 -27.709 1.0 62.14 57 A 2 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.677 9.146 -29.567 1.0 24.44 57 A 2 -ATOM 877 H HB3 . ASP A1 1 57 ? -9.033 8.218 -28.932 1.0 64.03 57 A 2 -ATOM 878 N N . SER A1 1 58 ? -6.852 11.117 -27.357 1.0 32.51 58 A 2 -ATOM 879 C CA . SER A1 1 58 ? -5.701 11.177 -26.463 1.0 62.24 58 A 2 -ATOM 880 C C . SER A1 1 58 ? -5.776 12.407 -25.563 1.0 2.12 58 A 2 -ATOM 881 O O . SER A1 1 58 ? -4.859 12.682 -24.791 1.0 12.21 58 A 2 -ATOM 882 C CB . SER A1 1 58 ? -4.402 11.2 -27.27 1.0 65.11 58 A 2 -ATOM 883 O OG . SER A1 1 58 ? -3.28 10.971 -26.437 1.0 34.21 58 A 2 -ATOM 884 H H . SER A1 1 58 ? -6.932 11.775 -28.079 1.0 21.03 58 A 2 -ATOM 885 H HA . SER A1 1 58 ? -5.716 10.292 -25.844 1.0 33.55 58 A 2 -ATOM 886 H HB2 . SER A1 1 58 ? -4.437 10.43 -28.026 1.0 31.42 58 A 2 -ATOM 887 H HB3 . SER A1 1 58 ? -4.293 12.165 -27.744 1.0 40.4 58 A 2 -ATOM 888 H HG . SER A1 1 58 ? -2.998 10.057 -26.522 1.0 10.23 58 A 2 -ATOM 889 N N . ASN A1 1 59 ? -6.877 13.145 -25.671 1.0 35.41 59 A 2 -ATOM 890 C CA . ASN A1 1 59 ? -7.073 14.347 -24.868 1.0 52.34 59 A 2 -ATOM 891 C C . ASN A1 1 59 ? -7.594 13.994 -23.478 1.0 4.01 59 A 2 -ATOM 892 O O . ASN A1 1 59 ? -8.772 14.187 -23.179 1.0 42.21 59 A 2 -ATOM 893 C CB . ASN A1 1 59 ? -8.048 15.297 -25.565 1.0 21.1 59 A 2 -ATOM 894 C CG . ASN A1 1 59 ? -8.159 16.634 -24.856 1.0 14.54 59 A 2 -ATOM 895 O OD1 . ASN A1 1 59 ? -8.675 16.717 -23.742 1.0 24.42 59 A 2 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.673 17.687 -25.502 1.0 14.44 59 A 2 -ATOM 897 H H . ASN A1 1 59 ? -7.574 12.875 -26.305 1.0 5.51 59 A 2 -ATOM 898 H HA . ASN A1 1 59 ? -6.116 14.837 -24.767 1.0 74.51 59 A 2 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.709 15.475 -26.575 1.0 43.43 59 A 2 -ATOM 900 H HB3 . ASN A1 1 59 ? -9.027 14.843 -25.593 1.0 11.21 59 A 2 -ATOM 901 H HD21 . ASN A1 1 59 ? -7.276 17.546 -26.387 1.0 21.33 59 A 2 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.731 18.564 -25.067 1.0 12.0 59 A 2 -ATOM 903 N N . ALA A1 1 60 ? -6.708 13.477 -22.634 1.0 13.11 60 A 2 -ATOM 904 C CA . ALA A1 1 60 ? -7.077 13.099 -21.275 1.0 35.51 60 A 2 -ATOM 905 C C . ALA A1 1 60 ? -5.84 12.853 -20.418 1.0 74.01 60 A 2 -ATOM 906 O O . ALA A1 1 60 ? -5.336 13.764 -19.763 1.0 74.24 60 A 2 -ATOM 907 C CB . ALA A1 1 60 ? -7.964 11.863 -21.293 1.0 64.13 60 A 2 -ATOM 908 H H . ALA A1 1 60 ? -5.783 13.347 -22.931 1.0 31.12 60 A 2 -ATOM 909 H HA . ALA A1 1 60 ? -7.644 13.913 -20.845 1.0 20.01 60 A 2 -ATOM 910 H HB1 . ALA A1 1 60 ? -7.491 11.09 -21.882 1.0 72.33 60 A 2 -ATOM 911 H HB2 . ALA A1 1 60 ? -8.109 11.509 -20.284 1.0 25.02 60 A 2 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.92 12.113 -21.728 1.0 51.02 60 A 2 -ATOM 913 N N . MET A1 1 61 ? -5.357 11.615 -20.428 1.0 21.52 61 A 2 -ATOM 914 C CA . MET A1 1 61 ? -4.178 11.249 -19.651 1.0 32.03 61 A 2 -ATOM 915 C C . MET A1 1 61 ? -3.027 12.212 -19.925 1.0 55.14 61 A 2 -ATOM 916 O O . MET A1 1 61 ? -2.408 12.734 -18.997 1.0 73.23 61 A 2 -ATOM 917 C CB . MET A1 1 61 ? -3.749 9.817 -19.978 1.0 33.12 61 A 2 -ATOM 918 C CG . MET A1 1 61 ? -4.044 9.407 -21.411 1.0 10.31 61 A 2 -ATOM 919 S SD . MET A1 1 61 ? -2.828 8.248 -22.066 1.0 3.45 61 A 2 -ATOM 920 C CE . MET A1 1 61 ? -1.469 9.355 -22.435 1.0 11.34 61 A 2 -ATOM 921 H H . MET A1 1 61 ? -5.802 10.931 -20.97 1.0 44.35 61 A 2 -ATOM 922 H HA . MET A1 1 61 ? -4.439 11.307 -18.605 1.0 14.21 61 A 2 -ATOM 923 H HB2 . MET A1 1 61 ? -2.686 9.725 -19.811 1.0 14.23 61 A 2 -ATOM 924 H HB3 . MET A1 1 61 ? -4.269 9.139 -19.318 1.0 0.24 61 A 2 -ATOM 925 H HG2 . MET A1 1 61 ? -5.018 8.942 -21.446 1.0 62.14 61 A 2 -ATOM 926 H HG3 . MET A1 1 61 ? -4.048 10.292 -22.031 1.0 32.0 61 A 2 -ATOM 927 H HE1 . MET A1 1 61 ? -1.814 10.377 -22.382 1.0 54.23 61 A 2 -ATOM 928 H HE2 . MET A1 1 61 ? -0.677 9.205 -21.717 1.0 64.31 61 A 2 -ATOM 929 H HE3 . MET A1 1 61 ? -1.098 9.15 -23.428 1.0 24.11 61 A 2 -ATOM 930 N N . SER A1 1 62 ? -2.744 12.442 -21.203 1.0 73.15 62 A 2 -ATOM 931 C CA . SER A1 1 62 ? -1.664 13.338 -21.598 1.0 12.22 62 A 2 -ATOM 932 C C . SER A1 1 62 ? -2.081 14.797 -21.431 1.0 13.52 62 A 2 -ATOM 933 O O . SER A1 1 62 ? -1.257 15.658 -21.121 1.0 42.51 62 A 2 -ATOM 934 C CB . SER A1 1 62 ? -1.259 13.075 -23.049 1.0 62.33 62 A 2 -ATOM 935 O OG . SER A1 1 62 ? 0.0 12.427 -23.118 1.0 14.13 62 A 2 -ATOM 936 H H . SER A1 1 62 ? -3.273 11.995 -21.897 1.0 74.25 62 A 2 -ATOM 937 H HA . SER A1 1 62 ? -0.819 13.142 -20.956 1.0 74.15 62 A 2 -ATOM 938 H HB2 . SER A1 1 62 ? -2.0 12.445 -23.519 1.0 54.41 62 A 2 -ATOM 939 H HB3 . SER A1 1 62 ? -1.196 14.014 -23.579 1.0 23.45 62 A 2 -ATOM 940 H HG . SER A1 1 62 ? 0.571 12.9 -23.727 1.0 1.23 62 A 2 -ATOM 941 N N . ASP A1 1 63 ? -3.365 15.066 -21.64 1.0 34.33 63 A 2 -ATOM 942 C CA . ASP A1 1 63 ? -3.893 16.419 -21.512 1.0 10.21 63 A 2 -ATOM 943 C C . ASP A1 1 63 ? -3.606 16.986 -20.125 1.0 63.54 63 A 2 -ATOM 944 O O . ASP A1 1 63 ? -3.52 18.201 -19.945 1.0 31.33 63 A 2 -ATOM 945 C CB . ASP A1 1 63 ? -5.399 16.429 -21.78 1.0 21.1 63 A 2 -ATOM 946 C CG . ASP A1 1 63 ? -5.914 17.809 -22.139 1.0 12.2 63 A 2 -ATOM 947 O OD1 . ASP A1 1 63 ? -5.201 18.54 -22.858 1.0 53.24 63 A 2 -ATOM 948 O OD2 . ASP A1 1 63 ? -7.029 18.159 -21.699 1.0 3.13 63 A 2 -ATOM 949 H H . ASP A1 1 63 ? -3.972 14.336 -21.885 1.0 14.4 63 A 2 -ATOM 950 H HA . ASP A1 1 63 ? -3.402 17.038 -22.248 1.0 72.42 63 A 2 -ATOM 951 H HB2 . ASP A1 1 63 ? -5.617 15.76 -22.6 1.0 63.34 63 A 2 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.917 16.089 -20.896 1.0 44.51 63 A 2 -ATOM 953 N N . TYR A1 1 64 ? -3.461 16.098 -19.148 1.0 43.15 64 A 2 -ATOM 954 C CA . TYR A1 1 64 ? -3.188 16.51 -17.776 1.0 74.44 64 A 2 -ATOM 955 C C . TYR A1 1 64 ? -4.438 17.09 -17.122 1.0 35.31 64 A 2 -ATOM 956 O O . TYR A1 1 64 ? -4.355 17.805 -16.124 1.0 63.11 64 A 2 -ATOM 957 C CB . TYR A1 1 64 ? -2.058 17.54 -17.746 1.0 41.31 64 A 2 -ATOM 958 C CG . TYR A1 1 64 ? -0.929 17.173 -16.809 1.0 35.31 64 A 2 -ATOM 959 C CD1 . TYR A1 1 64 ? -1.186 16.75 -15.511 1.0 10.21 64 A 2 -ATOM 960 C CD2 . TYR A1 1 64 ? 0.395 17.247 -17.224 1.0 61.0 64 A 2 -ATOM 961 C CE1 . TYR A1 1 64 ? -0.158 16.415 -14.652 1.0 31.32 64 A 2 -ATOM 962 C CE2 . TYR A1 1 64 ? 1.43 16.912 -16.372 1.0 3.01 64 A 2 -ATOM 963 C CZ . TYR A1 1 64 ? 1.149 16.497 -15.087 1.0 35.43 64 A 2 -ATOM 964 O OH . TYR A1 1 64 ? 2.176 16.162 -14.235 1.0 23.32 64 A 2 -ATOM 965 H H . TYR A1 1 64 ? -3.541 15.143 -19.353 1.0 10.22 64 A 2 -ATOM 966 H HA . TYR A1 1 64 ? -2.88 15.635 -17.222 1.0 40.51 64 A 2 -ATOM 967 H HB2 . TYR A1 1 64 ? -1.645 17.641 -18.738 1.0 75.32 64 A 2 -ATOM 968 H HB3 . TYR A1 1 64 ? -2.456 18.492 -17.428 1.0 32.34 64 A 2 -ATOM 969 H HD1 . TYR A1 1 64 ? -2.211 16.687 -15.173 1.0 1.35 64 A 2 -ATOM 970 H HD2 . TYR A1 1 64 ? 0.613 17.572 -18.231 1.0 32.41 64 A 2 -ATOM 971 H HE1 . TYR A1 1 64 ? -0.378 16.089 -13.646 1.0 52.21 64 A 2 -ATOM 972 H HE2 . TYR A1 1 64 ? 2.453 16.976 -16.712 1.0 43.14 64 A 2 -ATOM 973 H HH . TYR A1 1 64 ? 1.946 15.364 -13.755 1.0 23.33 64 A 2 -ATOM 974 N N . ASN A1 1 65 ? -5.597 16.777 -17.693 1.0 61.21 65 A 2 -ATOM 975 C CA . ASN A1 1 65 ? -6.866 17.266 -17.167 1.0 70.22 65 A 2 -ATOM 976 C C . ASN A1 1 65 ? -7.664 16.133 -16.529 1.0 21.44 65 A 2 -ATOM 977 O O . ASN A1 1 65 ? -8.843 16.292 -16.212 1.0 22.24 65 A 2 -ATOM 978 C CB . ASN A1 1 65 ? -7.686 17.919 -18.282 1.0 30.31 65 A 2 -ATOM 979 C CG . ASN A1 1 65 ? -8.661 16.951 -18.924 1.0 75.23 65 A 2 -ATOM 980 O OD1 . ASN A1 1 65 ? -9.871 17.179 -18.924 1.0 74.2 65 A 2 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.138 15.862 -19.475 1.0 12.4 65 A 2 -ATOM 982 H H . ASN A1 1 65 ? -5.599 16.202 -18.487 1.0 72.01 65 A 2 -ATOM 983 H HA . ASN A1 1 65 ? -6.648 18.007 -16.413 1.0 43.44 65 A 2 -ATOM 984 H HB2 . ASN A1 1 65 ? -8.247 18.745 -17.871 1.0 12.24 65 A 2 -ATOM 985 H HB3 . ASN A1 1 65 ? -7.017 18.287 -19.045 1.0 73.02 65 A 2 -ATOM 986 H HD21 . ASN A1 1 65 ? -7.165 15.746 -19.438 1.0 23.44 65 A 2 -ATOM 987 H HD22 . ASN A1 1 65 ? -8.745 15.22 -19.898 1.0 32.24 65 A 2 -ATOM 988 N N . VAL A1 1 66 ? -7.013 14.99 -16.344 1.0 11.4 66 A 2 -ATOM 989 C CA . VAL A1 1 66 ? -7.66 13.83 -15.742 1.0 70.45 66 A 2 -ATOM 990 C C . VAL A1 1 66 ? -7.218 13.643 -14.295 1.0 73.11 66 A 2 -ATOM 991 O O . VAL A1 1 66 ? -6.287 12.889 -14.014 1.0 33.12 66 A 2 -ATOM 992 C CB . VAL A1 1 66 ? -7.354 12.544 -16.532 1.0 40.11 66 A 2 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.857 12.4 -16.759 1.0 32.21 66 A 2 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.91 11.328 -15.805 1.0 25.13 66 A 2 -ATOM 995 H H . VAL A1 1 66 ? -6.074 14.924 -16.617 1.0 25.31 66 A 2 -ATOM 996 H HA . VAL A1 1 66 ? -8.728 13.995 -15.764 1.0 44.24 66 A 2 -ATOM 997 H HB . VAL A1 1 66 ? -7.837 12.613 -17.495 1.0 65.05 66 A 2 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.326 13.056 -16.084 1.0 62.5 66 A 2 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.561 11.378 -16.578 1.0 4.5 66 A 2 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.621 12.668 -17.779 1.0 12.32 66 A 2 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.5 10.737 -16.49 1.0 23.4 66 A 2 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.093 10.732 -15.426 1.0 64.2 66 A 2 -ATOM 1003 H HG23 . VAL A1 1 66 ? -8.531 11.652 -14.983 1.0 74.31 66 A 2 -ATOM 1004 N N . GLN A1 1 67 ? -7.893 14.333 -13.382 1.0 5.43 67 A 2 -ATOM 1005 C CA . GLN A1 1 67 ? -7.569 14.242 -11.963 1.0 15.5 67 A 2 -ATOM 1006 C C . GLN A1 1 67 ? -8.491 13.254 -11.256 1.0 62.54 67 A 2 -ATOM 1007 O O . GLN A1 1 67 ? -9.339 12.621 -11.885 1.0 44.01 67 A 2 -ATOM 1008 C CB . GLN A1 1 67 ? -7.677 15.619 -11.305 1.0 35.11 67 A 2 -ATOM 1009 C CG . GLN A1 1 67 ? -9.014 16.302 -11.538 1.0 11.21 67 A 2 -ATOM 1010 C CD . GLN A1 1 67 ? -9.208 17.523 -10.661 1.0 34.44 67 A 2 -ATOM 1011 O OE1 . GLN A1 1 67 ? -9.081 17.449 -9.438 1.0 41.54 67 A 2 -ATOM 1012 N NE2 . GLN A1 1 67 ? -9.515 18.656 -11.281 1.0 50.51 67 A 2 -ATOM 1013 H H . GLN A1 1 67 ? -8.625 14.917 -13.668 1.0 54.23 67 A 2 -ATOM 1014 H HA . GLN A1 1 67 ? -6.552 13.891 -11.877 1.0 21.13 67 A 2 -ATOM 1015 H HB2 . GLN A1 1 67 ? -7.534 15.508 -10.24 1.0 61.05 67 A 2 -ATOM 1016 H HB3 . GLN A1 1 67 ? -6.899 16.255 -11.699 1.0 21.05 67 A 2 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.072 16.609 -12.572 1.0 63.24 67 A 2 -ATOM 1018 H HG3 . GLN A1 1 67 ? -9.805 15.597 -11.329 1.0 63.02 67 A 2 -ATOM 1019 H HE21 . GLN A1 1 67 ? -9.601 18.64 -12.258 1.0 0.12 67 A 2 -ATOM 1020 H HE22 . GLN A1 1 67 ? -9.647 19.46 -10.739 1.0 72.41 67 A 2 -ATOM 1021 N N . LYS A1 1 68 ? -8.319 13.127 -9.945 1.0 63.33 68 A 2 -ATOM 1022 C CA . LYS A1 1 68 ? -9.136 12.217 -9.151 1.0 34.0 68 A 2 -ATOM 1023 C C . LYS A1 1 68 ? -10.621 12.496 -9.358 1.0 33.21 68 A 2 -ATOM 1024 O O . LYS A1 1 68 ? -11.45 11.591 -9.267 1.0 33.01 68 A 2 -ATOM 1025 C CB . LYS A1 1 68 ? -8.784 12.346 -7.667 1.0 41.41 68 A 2 -ATOM 1026 C CG . LYS A1 1 68 ? -9.449 11.298 -6.791 1.0 61.44 68 A 2 -ATOM 1027 C CD . LYS A1 1 68 ? -8.88 9.913 -7.048 1.0 43.41 68 A 2 -ATOM 1028 C CE . LYS A1 1 68 ? -7.652 9.647 -6.191 1.0 23.43 68 A 2 -ATOM 1029 N NZ . LYS A1 1 68 ? -7.967 9.705 -4.737 1.0 52.05 68 A 2 -ATOM 1030 H H . LYS A1 1 68 ? -7.627 13.659 -9.499 1.0 75.53 68 A 2 -ATOM 1031 H HA . LYS A1 1 68 ? -8.922 11.21 -9.476 1.0 31.4 68 A 2 -ATOM 1032 H HB2 . LYS A1 1 68 ? -7.714 12.254 -7.553 1.0 51.5 68 A 2 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.092 13.322 -7.32 1.0 62.4 68 A 2 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.288 11.554 -5.754 1.0 22.33 68 A 2 -ATOM 1035 H HG3 . LYS A1 1 68 ? -10.509 11.287 -7.0 1.0 45.02 68 A 2 -ATOM 1036 H HD2 . LYS A1 1 68 ? -9.633 9.175 -6.817 1.0 14.2 68 A 2 -ATOM 1037 H HD3 . LYS A1 1 68 ? -8.605 9.835 -8.091 1.0 13.53 68 A 2 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.269 8.666 -6.429 1.0 43.13 68 A 2 -ATOM 1039 H HE3 . LYS A1 1 68 ? -6.902 10.391 -6.418 1.0 63.42 68 A 2 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.059 10.694 -4.43 1.0 1.54 68 A 2 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.208 9.252 -4.189 1.0 73.32 68 A 2 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.861 9.209 -4.545 1.0 23.44 68 A 2 -ATOM 1043 N N . GLU A1 1 69 ? -10.948 13.753 -9.639 1.0 51.1 69 A 2 -ATOM 1044 C CA . GLU A1 1 69 ? -12.334 14.15 -9.86 1.0 15.41 69 A 2 -ATOM 1045 C C . GLU A1 1 69 ? -12.411 15.373 -10.769 1.0 20.25 69 A 2 -ATOM 1046 O O . GLU A1 1 69 ? -12.42 16.51 -10.298 1.0 55.15 69 A 2 -ATOM 1047 C CB . GLU A1 1 69 ? -13.022 14.447 -8.526 1.0 42.14 69 A 2 -ATOM 1048 C CG . GLU A1 1 69 ? -12.201 15.331 -7.602 1.0 32.44 69 A 2 -ATOM 1049 C CD . GLU A1 1 69 ? -13.062 16.144 -6.656 1.0 60.3 69 A 2 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.044 15.587 -6.121 1.0 52.11 69 A 2 -ATOM 1051 O OE2 . GLU A1 1 69 ? -12.755 17.337 -6.449 1.0 33.22 69 A 2 -ATOM 1052 H H . GLU A1 1 69 ? -10.242 14.43 -9.698 1.0 51.55 69 A 2 -ATOM 1053 H HA . GLU A1 1 69 ? -12.842 13.327 -10.341 1.0 21.13 69 A 2 -ATOM 1054 H HB2 . GLU A1 1 69 ? -13.962 14.941 -8.722 1.0 70.35 69 A 2 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.215 13.514 -8.019 1.0 25.14 69 A 2 -ATOM 1056 H HG2 . GLU A1 1 69 ? -11.543 14.705 -7.018 1.0 60.54 69 A 2 -ATOM 1057 H HG3 . GLU A1 1 69 ? -11.612 16.009 -8.202 1.0 2.43 69 A 2 -ATOM 1058 N N . SER A1 1 70 ? -12.466 15.131 -12.075 1.0 51.41 70 A 2 -ATOM 1059 C CA . SER A1 1 70 ? -12.538 16.212 -13.051 1.0 50.24 70 A 2 -ATOM 1060 C C . SER A1 1 70 ? -13.928 16.288 -13.675 1.0 72.1 70 A 2 -ATOM 1061 O O . SER A1 1 70 ? -14.501 15.273 -14.072 1.0 13.02 70 A 2 -ATOM 1062 C CB . SER A1 1 70 ? -11.486 16.013 -14.143 1.0 75.43 70 A 2 -ATOM 1063 O OG . SER A1 1 70 ? -10.933 17.252 -14.551 1.0 45.33 70 A 2 -ATOM 1064 H H . SER A1 1 70 ? -12.456 14.203 -12.389 1.0 42.55 70 A 2 -ATOM 1065 H HA . SER A1 1 70 ? -12.337 17.139 -12.534 1.0 61.25 70 A 2 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.693 15.386 -13.765 1.0 1.23 70 A 2 -ATOM 1067 H HB3 . SER A1 1 70 ? -11.944 15.537 -14.998 1.0 50.33 70 A 2 -ATOM 1068 H HG . SER A1 1 70 ? -11.254 17.472 -15.429 1.0 14.24 70 A 2 -ATOM 1069 N N . THR A1 1 71 ? -14.467 17.501 -13.76 1.0 52.55 71 A 2 -ATOM 1070 C CA . THR A1 1 71 ? -15.789 17.712 -14.335 1.0 43.33 71 A 2 -ATOM 1071 C C . THR A1 1 71 ? -15.695 18.07 -15.813 1.0 63.44 71 A 2 -ATOM 1072 O O . THR A1 1 71 ? -15.068 19.063 -16.184 1.0 13.52 71 A 2 -ATOM 1073 C CB . THR A1 1 71 ? -16.552 18.827 -13.595 1.0 4.41 71 A 2 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.639 19.844 -13.166 1.0 4.41 71 A 2 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.297 18.268 -12.393 1.0 4.35 71 A 2 -ATOM 1076 H H . THR A1 1 71 ? -13.961 18.271 -13.426 1.0 14.04 71 A 2 -ATOM 1077 H HA . THR A1 1 71 ? -16.348 16.793 -14.232 1.0 24.13 71 A 2 -ATOM 1078 H HB . THR A1 1 71 ? -17.27 19.263 -14.275 1.0 70.41 71 A 2 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.115 20.512 -12.669 1.0 53.11 71 A 2 -ATOM 1080 H HG21 . THR A1 1 71 ? -16.753 17.426 -11.993 1.0 12.42 71 A 2 -ATOM 1081 H HG22 . THR A1 1 71 ? -18.283 17.948 -12.698 1.0 75.2 71 A 2 -ATOM 1082 H HG23 . THR A1 1 71 ? -17.385 19.033 -11.636 1.0 31.12 71 A 2 -ATOM 1083 N N . LEU A1 1 72 ? -16.323 17.256 -16.655 1.0 74.32 72 A 2 -ATOM 1084 C CA . LEU A1 1 72 ? -16.311 17.488 -18.096 1.0 62.12 72 A 2 -ATOM 1085 C C . LEU A1 1 72 ? -17.722 17.417 -18.67 1.0 14.1 72 A 2 -ATOM 1086 O O . LEU A1 1 72 ? -18.591 16.735 -18.127 1.0 22.33 72 A 2 -ATOM 1087 C CB . LEU A1 1 72 ? -15.413 16.462 -18.79 1.0 54.24 72 A 2 -ATOM 1088 C CG . LEU A1 1 72 ? -16.105 15.194 -19.29 1.0 12.34 72 A 2 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.437 15.316 -20.77 1.0 71.53 72 A 2 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.232 13.974 -19.036 1.0 45.31 72 A 2 -ATOM 1091 H H . LEU A1 1 72 ? -16.806 16.481 -16.301 1.0 40.44 72 A 2 -ATOM 1092 H HA . LEU A1 1 72 ? -15.914 18.477 -18.269 1.0 22.23 72 A 2 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.954 16.945 -19.639 1.0 24.33 72 A 2 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.646 16.167 -18.088 1.0 64.44 72 A 2 -ATOM 1095 H HG . LEU A1 1 72 ? -17.033 15.061 -18.751 1.0 60.22 72 A 2 -ATOM 1096 H HD11 . LEU A1 1 72 ? -16.247 14.373 -21.259 1.0 22.12 72 A 2 -ATOM 1097 H HD12 . LEU A1 1 72 ? -15.821 16.083 -21.215 1.0 11.12 72 A 2 -ATOM 1098 H HD13 . LEU A1 1 72 ? -17.478 15.579 -20.885 1.0 74.11 72 A 2 -ATOM 1099 H HD21 . LEU A1 1 72 ? -14.194 14.271 -19.018 1.0 45.11 72 A 2 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.387 13.251 -19.823 1.0 64.51 72 A 2 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.498 13.534 -18.085 1.0 15.53 72 A 2 -ATOM 1102 N N . HIS A1 1 73 ? -17.942 18.125 -19.774 1.0 22.1 73 A 2 -ATOM 1103 C CA . HIS A1 1 73 ? -19.247 18.14 -20.425 1.0 43.22 73 A 2 -ATOM 1104 C C . HIS A1 1 73 ? -19.288 17.15 -21.584 1.0 1.12 73 A 2 -ATOM 1105 O O . HIS A1 1 73 ? -18.504 17.252 -22.529 1.0 41.41 73 A 2 -ATOM 1106 C CB . HIS A1 1 73 ? -19.573 19.547 -20.928 1.0 34.11 73 A 2 -ATOM 1107 C CG . HIS A1 1 73 ? -21.032 19.768 -21.184 1.0 25.31 73 A 2 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.879 18.772 -21.622 1.0 22.31 73 A 2 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.794 20.88 -21.06 1.0 30.12 73 A 2 -ATOM 1110 C CE1 . HIS A1 1 73 ? -23.098 19.261 -21.758 1.0 74.03 73 A 2 -ATOM 1111 N NE2 . HIS A1 1 73 ? -23.074 20.539 -21.423 1.0 22.32 73 A 2 -ATOM 1112 H H . HIS A1 1 73 ? -17.209 18.649 -20.16 1.0 41.1 73 A 2 -ATOM 1113 H HA . HIS A1 1 73 ? -19.986 17.849 -19.693 1.0 23.25 73 A 2 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.253 20.269 -20.191 1.0 51.13 73 A 2 -ATOM 1115 H HB3 . HIS A1 1 73 ? -19.043 19.724 -21.852 1.0 64.13 73 A 2 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.624 17.844 -21.807 1.0 63.31 73 A 2 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.459 21.855 -20.737 1.0 71.43 73 A 2 -ATOM 1118 H HE1 . HIS A1 1 73 ? -23.968 18.711 -22.086 1.0 3.34 73 A 2 -ATOM 1119 N N . LEU A1 1 74 ? -20.205 16.192 -21.507 1.0 31.4 74 A 2 -ATOM 1120 C CA . LEU A1 1 74 ? -20.347 15.183 -22.55 1.0 41.22 74 A 2 -ATOM 1121 C C . LEU A1 1 74 ? -21.636 15.393 -23.339 1.0 21.0 74 A 2 -ATOM 1122 O O . LEU A1 1 74 ? -22.734 15.309 -22.788 1.0 70.53 74 A 2 -ATOM 1123 C CB . LEU A1 1 74 ? -20.335 13.782 -21.936 1.0 42.32 74 A 2 -ATOM 1124 C CG . LEU A1 1 74 ? -20.901 12.661 -22.809 1.0 13.02 74 A 2 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.095 12.525 -24.091 1.0 50.12 74 A 2 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.916 11.345 -22.044 1.0 22.4 74 A 2 -ATOM 1127 H H . LEU A1 1 74 ? -20.801 16.163 -20.73 1.0 53.04 74 A 2 -ATOM 1128 H HA . LEU A1 1 74 ? -19.508 15.28 -23.222 1.0 65.43 74 A 2 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.311 13.533 -21.701 1.0 22.02 74 A 2 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.913 13.816 -21.023 1.0 20.31 74 A 2 -ATOM 1131 H HG . LEU A1 1 74 ? -21.919 12.904 -23.079 1.0 34.12 74 A 2 -ATOM 1132 H HD11 . LEU A1 1 74 ? -19.955 11.479 -24.319 1.0 33.01 74 A 2 -ATOM 1133 H HD12 . LEU A1 1 74 ? -19.133 12.998 -23.964 1.0 1.34 74 A 2 -ATOM 1134 H HD13 . LEU A1 1 74 ? -20.626 13.002 -24.902 1.0 63.14 74 A 2 -ATOM 1135 H HD21 . LEU A1 1 74 ? -21.576 10.649 -22.539 1.0 12.32 74 A 2 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.265 11.519 -21.037 1.0 54.43 74 A 2 -ATOM 1137 H HD23 . LEU A1 1 74 ? -19.917 10.936 -22.013 1.0 14.02 74 A 2 -ATOM 1138 N N . VAL A1 1 75 ? -21.494 15.664 -24.632 1.0 43.5 75 A 2 -ATOM 1139 C CA . VAL A1 1 75 ? -22.646 15.882 -25.499 1.0 52.32 75 A 2 -ATOM 1140 C C . VAL A1 1 75 ? -22.808 14.741 -26.496 1.0 61.15 75 A 2 -ATOM 1141 O O . VAL A1 1 75 ? -21.834 14.282 -27.095 1.0 54.31 75 A 2 -ATOM 1142 C CB . VAL A1 1 75 ? -22.525 17.21 -26.269 1.0 24.5 75 A 2 -ATOM 1143 C CG1 . VAL A1 1 75 ? -22.527 18.388 -25.307 1.0 55.3 75 A 2 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.269 17.215 -27.128 1.0 64.14 75 A 2 -ATOM 1145 H H . VAL A1 1 75 ? -20.593 15.717 -25.013 1.0 70.11 75 A 2 -ATOM 1146 H HA . VAL A1 1 75 ? -23.528 15.931 -24.876 1.0 60.52 75 A 2 -ATOM 1147 H HB . VAL A1 1 75 ? -23.381 17.304 -26.921 1.0 44.41 75 A 2 -ATOM 1148 H HG11 . VAL A1 1 75 ? -21.51 18.695 -25.111 1.0 31.54 75 A 2 -ATOM 1149 H HG12 . VAL A1 1 75 ? -23.074 19.21 -25.745 1.0 61.34 75 A 2 -ATOM 1150 H HG13 . VAL A1 1 75 ? -22.999 18.095 -24.381 1.0 54.52 75 A 2 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.375 16.495 -27.925 1.0 5.24 75 A 2 -ATOM 1152 H HG22 . VAL A1 1 75 ? -21.125 18.199 -27.547 1.0 61.35 75 A 2 -ATOM 1153 H HG23 . VAL A1 1 75 ? -20.415 16.955 -26.519 1.0 24.43 75 A 2 -ATOM 1154 N N . LEU A1 1 76 ? -24.044 14.287 -26.672 1.0 35.1 76 A 2 -ATOM 1155 C CA . LEU A1 1 76 ? -24.334 13.198 -27.599 1.0 22.53 76 A 2 -ATOM 1156 C C . LEU A1 1 76 ? -25.376 13.624 -28.629 1.0 2.14 76 A 2 -ATOM 1157 O O . LEU A1 1 76 ? -26.364 14.278 -28.293 1.0 21.5 76 A 2 -ATOM 1158 C CB . LEU A1 1 76 ? -24.829 11.969 -26.834 1.0 73.12 76 A 2 -ATOM 1159 C CG . LEU A1 1 76 ? -24.552 11.958 -25.33 1.0 64.45 76 A 2 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.678 12.648 -24.575 1.0 24.13 76 A 2 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.369 10.532 -24.832 1.0 22.03 76 A 2 -ATOM 1162 H H . LEU A1 1 76 ? -24.779 14.692 -26.167 1.0 44.32 76 A 2 -ATOM 1163 H HA . LEU A1 1 76 ? -23.419 12.948 -28.113 1.0 53.04 76 A 2 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.897 11.9 -26.974 1.0 71.31 76 A 2 -ATOM 1165 H HB3 . LEU A1 1 76 ? -24.354 11.099 -27.265 1.0 62.14 76 A 2 -ATOM 1166 H HG . LEU A1 1 76 ? -23.638 12.502 -25.135 1.0 42.11 76 A 2 -ATOM 1167 H HD11 . LEU A1 1 76 ? -25.513 13.715 -24.578 1.0 12.14 76 A 2 -ATOM 1168 H HD12 . LEU A1 1 76 ? -25.701 12.289 -23.557 1.0 23.21 76 A 2 -ATOM 1169 H HD13 . LEU A1 1 76 ? -26.621 12.428 -25.056 1.0 40.2 76 A 2 -ATOM 1170 H HD21 . LEU A1 1 76 ? -25.28 10.196 -24.361 1.0 53.24 76 A 2 -ATOM 1171 H HD22 . LEU A1 1 76 ? -23.561 10.503 -24.116 1.0 72.02 76 A 2 -ATOM 1172 H HD23 . LEU A1 1 76 ? -24.134 9.887 -25.666 1.0 63.4 76 A 2 -ATOM 1173 N N . ARG A1 1 77 ? -25.15 13.246 -29.882 1.0 50.44 77 A 2 -ATOM 1174 C CA . ARG A1 1 77 ? -26.069 13.587 -30.961 1.0 12.4 77 A 2 -ATOM 1175 C C . ARG A1 1 77 ? -26.678 12.33 -31.575 1.0 10.32 77 A 2 -ATOM 1176 O O . ARG A1 1 77 ? -26.558 12.092 -32.777 1.0 12.43 77 A 2 -ATOM 1177 C CB . ARG A1 1 77 ? -25.346 14.395 -32.04 1.0 55.35 77 A 2 -ATOM 1178 C CG . ARG A1 1 77 ? -24.049 13.758 -32.511 1.0 12.22 77 A 2 -ATOM 1179 C CD . ARG A1 1 77 ? -22.836 14.527 -32.01 1.0 60.22 77 A 2 -ATOM 1180 N NE . ARG A1 1 77 ? -22.513 15.661 -32.872 1.0 64.33 77 A 2 -ATOM 1181 C CZ . ARG A1 1 77 ? -21.654 16.617 -32.536 1.0 13.31 77 A 2 -ATOM 1182 N NH1 . ARG A1 1 77 ? -21.035 16.576 -31.364 1.0 63.3 77 A 2 -ATOM 1183 N NH2 . ARG A1 1 77 ? -21.412 17.617 -33.374 1.0 70.54 77 A 2 -ATOM 1184 H H . ARG A1 1 77 ? -24.345 12.726 -30.087 1.0 2.41 77 A 2 -ATOM 1185 H HA . ARG A1 1 77 ? -26.862 14.19 -30.543 1.0 53.23 77 A 2 -ATOM 1186 H HB2 . ARG A1 1 77 ? -25.999 14.501 -32.893 1.0 41.04 77 A 2 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.118 15.375 -31.647 1.0 23.23 77 A 2 -ATOM 1188 H HG2 . ARG A1 1 77 ? -23.999 12.746 -32.137 1.0 3.21 77 A 2 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.036 13.746 -33.591 1.0 45.32 77 A 2 -ATOM 1190 H HD2 . ARG A1 1 77 ? -23.044 14.891 -31.015 1.0 24.22 77 A 2 -ATOM 1191 H HD3 . ARG A1 1 77 ? -21.99 13.857 -31.979 1.0 55.12 77 A 2 -ATOM 1192 H HE . ARG A1 1 77 ? -22.959 15.711 -33.742 1.0 41.44 77 A 2 -ATOM 1193 H HH11 . ARG A1 1 77 ? -21.215 15.823 -30.731 1.0 31.24 77 A 2 -ATOM 1194 H HH12 . ARG A1 1 77 ? -20.388 17.297 -31.115 1.0 72.5 77 A 2 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.876 17.651 -34.259 1.0 71.34 77 A 2 -ATOM 1196 H HH22 . ARG A1 1 77 ? -20.766 18.336 -33.121 1.0 1.44 77 A 2 -ATOM 1197 N N . LEU A1 1 78 ? -27.332 11.528 -30.741 1.0 31.03 78 A 2 -ATOM 1198 C CA . LEU A1 1 78 ? -27.96 10.294 -31.201 1.0 51.32 78 A 2 -ATOM 1199 C C . LEU A1 1 78 ? -29.003 10.582 -32.277 1.0 14.11 78 A 2 -ATOM 1200 O O . LEU A1 1 78 ? -29.283 9.736 -33.125 1.0 12.31 78 A 2 -ATOM 1201 C CB . LEU A1 1 78 ? -28.611 9.562 -30.027 1.0 42.51 78 A 2 -ATOM 1202 C CG . LEU A1 1 78 ? -27.727 8.554 -29.291 1.0 51.45 78 A 2 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.535 9.254 -28.656 1.0 14.44 78 A 2 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.532 7.808 -28.238 1.0 25.32 78 A 2 -ATOM 1205 H H . LEU A1 1 78 ? -27.395 11.771 -29.794 1.0 75.31 78 A 2 -ATOM 1206 H HA . LEU A1 1 78 ? -27.189 9.668 -31.623 1.0 64.2 78 A 2 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.932 10.303 -29.312 1.0 61.14 78 A 2 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.473 9.032 -30.406 1.0 62.32 78 A 2 -ATOM 1209 H HG . LEU A1 1 78 ? -27.35 7.831 -30.0 1.0 53.42 78 A 2 -ATOM 1210 H HD11 . LEU A1 1 78 ? -26.412 8.906 -27.642 1.0 3.24 78 A 2 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.703 10.321 -28.654 1.0 74.14 78 A 2 -ATOM 1212 H HD13 . LEU A1 1 78 ? -25.643 9.032 -29.224 1.0 11.41 78 A 2 -ATOM 1213 H HD21 . LEU A1 1 78 ? -28.513 8.361 -27.311 1.0 65.32 78 A 2 -ATOM 1214 H HD22 . LEU A1 1 78 ? -28.101 6.83 -28.082 1.0 65.43 78 A 2 -ATOM 1215 H HD23 . LEU A1 1 78 ? -29.553 7.701 -28.574 1.0 34.04 78 A 2 -ATOM 1216 N N . ARG A1 1 79 ? -29.572 11.782 -32.236 1.0 44.5 79 A 2 -ATOM 1217 C CA . ARG A1 1 79 ? -30.583 12.182 -33.207 1.0 54.44 79 A 2 -ATOM 1218 C C . ARG A1 1 79 ? -29.991 12.245 -34.613 1.0 43.43 79 A 2 -ATOM 1219 O O . ARG A1 1 79 ? -29.402 13.251 -35.005 1.0 24.23 79 A 2 -ATOM 1220 C CB . ARG A1 1 79 ? -31.174 13.542 -32.83 1.0 53.1 79 A 2 -ATOM 1221 C CG . ARG A1 1 79 ? -31.617 13.632 -31.379 1.0 62.42 79 A 2 -ATOM 1222 C CD . ARG A1 1 79 ? -32.649 12.566 -31.045 1.0 15.2 79 A 2 -ATOM 1223 N NE . ARG A1 1 79 ? -33.716 12.506 -32.04 1.0 22.21 79 A 2 -ATOM 1224 C CZ . ARG A1 1 79 ? -34.568 11.492 -32.145 1.0 43.33 79 A 2 -ATOM 1225 N NH1 . ARG A1 1 79 ? -34.479 10.459 -31.319 1.0 51.34 79 A 2 -ATOM 1226 N NH2 . ARG A1 1 79 ? -35.513 11.511 -33.077 1.0 24.34 79 A 2 -ATOM 1227 H H . ARG A1 1 79 ? -29.306 12.414 -31.535 1.0 30.43 79 A 2 -ATOM 1228 H HA . ARG A1 1 79 ? -31.368 11.442 -33.193 1.0 75.12 79 A 2 -ATOM 1229 H HB2 . ARG A1 1 79 ? -30.43 14.306 -33.004 1.0 72.51 79 A 2 -ATOM 1230 H HB3 . ARG A1 1 79 ? -32.03 13.735 -33.458 1.0 62.3 79 A 2 -ATOM 1231 H HG2 . ARG A1 1 79 ? -30.757 13.496 -30.74 1.0 34.21 79 A 2 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.048 14.606 -31.204 1.0 51.44 79 A 2 -ATOM 1233 H HD2 . ARG A1 1 79 ? -32.156 11.606 -31.003 1.0 21.42 79 A 2 -ATOM 1234 H HD3 . ARG A1 1 79 ? -33.081 12.791 -30.081 1.0 24.22 79 A 2 -ATOM 1235 H HE . ARG A1 1 79 ? -33.8 13.259 -32.661 1.0 63.2 79 A 2 -ATOM 1236 H HH11 . ARG A1 1 79 ? -33.769 10.443 -30.615 1.0 0.03 79 A 2 -ATOM 1237 H HH12 . ARG A1 1 79 ? -35.122 9.698 -31.398 1.0 54.33 79 A 2 -ATOM 1238 H HH21 . ARG A1 1 79 ? -35.583 12.288 -33.701 1.0 72.3 79 A 2 -ATOM 1239 H HH22 . ARG A1 1 79 ? -36.153 10.748 -33.154 1.0 2.44 79 A 2 -ATOM 1240 N N . GLY A1 1 80 ? -30.152 11.161 -35.366 1.0 11.03 80 A 2 -ATOM 1241 C CA . GLY A1 1 80 ? -29.629 11.114 -36.719 1.0 3.12 80 A 2 -ATOM 1242 C C . GLY A1 1 80 ? -29.498 9.697 -37.241 1.0 52.34 80 A 2 -ATOM 1243 O O . GLY A1 1 80 ? -29.919 9.398 -38.358 1.0 43.44 80 A 2 -ATOM 1244 H H . GLY A1 1 80 ? -30.631 10.388 -35.001 1.0 0.24 80 A 2 -ATOM 1245 H HA2 . GLY A1 1 80 ? -30.29 11.667 -37.369 1.0 71.24 80 A 2 -ATOM 1246 H HA3 . GLY A1 1 80 ? -28.654 11.58 -36.732 1.0 43.14 80 A 2 -ATOM 1247 N N . GLY A1 1 81 ? -28.912 8.82 -36.43 1.0 43.34 81 A 2 -ATOM 1248 C CA . GLY A1 1 81 ? -28.737 7.438 -36.835 1.0 20.2 81 A 2 -ATOM 1249 C C . GLY A1 1 81 ? -28.335 6.542 -35.68 1.0 63.23 81 A 2 -ATOM 1250 O O . GLY A1 1 81 ? -28.272 6.986 -34.533 1.0 30.24 81 A 2 -ATOM 1251 H H . GLY A1 1 81 ? -28.597 9.115 -35.55 1.0 11.33 81 A 2 -ATOM 1252 H HA2 . GLY A1 1 81 ? -29.665 7.076 -37.252 1.0 30.51 81 A 2 -ATOM 1253 H HA3 . GLY A1 1 81 ? -27.97 7.392 -37.594 1.0 55.14 81 A 2 -ATOM 1254 N N . VAL A1 1 82 ? -28.064 5.276 -35.981 1.0 30.52 82 A 2 -ATOM 1255 C CA . VAL A1 1 82 ? -27.666 4.315 -34.959 1.0 4.45 82 A 2 -ATOM 1256 C C . VAL A1 1 82 ? -26.494 3.463 -35.432 1.0 63.52 82 A 2 -ATOM 1257 O O . VAL A1 1 82 ? -25.348 3.699 -35.049 1.0 12.52 82 A 2 -ATOM 1258 C CB . VAL A1 1 82 ? -28.836 3.391 -34.573 1.0 53.54 82 A 2 -ATOM 1259 C CG1 . VAL A1 1 82 ? -30.004 4.203 -34.036 1.0 33.31 82 A 2 -ATOM 1260 C CG2 . VAL A1 1 82 ? -29.265 2.549 -35.765 1.0 1.13 82 A 2 -ATOM 1261 H H . VAL A1 1 82 ? -28.131 4.982 -36.913 1.0 42.11 82 A 2 -ATOM 1262 H HA . VAL A1 1 82 ? -27.366 4.868 -34.08 1.0 65.12 82 A 2 -ATOM 1263 H HB . VAL A1 1 82 ? -28.5 2.725 -33.791 1.0 3.02 82 A 2 -ATOM 1264 H HG11 . VAL A1 1 82 ? -30.178 5.052 -34.68 1.0 71.54 82 A 2 -ATOM 1265 H HG12 . VAL A1 1 82 ? -30.889 3.585 -34.005 1.0 43.52 82 A 2 -ATOM 1266 H HG13 . VAL A1 1 82 ? -29.773 4.55 -33.039 1.0 60.31 82 A 2 -ATOM 1267 H HG21 . VAL A1 1 82 ? -30.08 1.903 -35.476 1.0 51.1 82 A 2 -ATOM 1268 H HG22 . VAL A1 1 82 ? -29.586 3.198 -36.566 1.0 43.42 82 A 2 -ATOM 1269 H HG23 . VAL A1 1 82 ? -28.432 1.948 -36.101 1.0 61.21 82 A 2 -ATOM 1 N N . GLY A1 1 1 ? -8.875 2.341 -1.267 1.0 13.0 1 A 3 -ATOM 2 C CA . GLY A1 1 1 ? -7.892 3.405 -1.179 1.0 45.03 1 A 3 -ATOM 3 C C . GLY A1 1 1 ? -6.752 3.223 -2.161 1.0 65.21 1 A 3 -ATOM 4 O O . GLY A1 1 1 ? -5.629 2.885 -1.786 1.0 33.34 1 A 3 -ATOM 5 H H1 . GLY A1 1 1 ? -9.512 2.325 -2.012 1.0 52.4 1 A 3 -ATOM 6 H HA2 . GLY A1 1 1 ? -8.379 4.348 -1.38 1.0 14.15 1 A 3 -ATOM 7 H HA3 . GLY A1 1 1 ? -7.489 3.426 -0.178 1.0 34.23 1 A 3 -ATOM 8 N N . PRO A1 1 2 ? -7.036 3.448 -3.453 1.0 55.32 2 A 3 -ATOM 9 C CA . PRO A1 1 2 ? -6.039 3.311 -4.518 1.0 21.43 2 A 3 -ATOM 10 C C . PRO A1 1 2 ? -4.976 4.403 -4.461 1.0 41.45 2 A 3 -ATOM 11 O O . PRO A1 1 2 ? -5.047 5.31 -3.631 1.0 62.42 2 A 3 -ATOM 12 C CB . PRO A1 1 2 ? -6.868 3.439 -5.799 1.0 51.45 2 A 3 -ATOM 13 C CG . PRO A1 1 2 ? -8.064 4.232 -5.398 1.0 43.11 2 A 3 -ATOM 14 C CD . PRO A1 1 2 ? -8.353 3.853 -3.972 1.0 64.14 2 A 3 -ATOM 15 H HA . PRO A1 1 2 ? -5.561 2.343 -4.492 1.0 31.54 2 A 3 -ATOM 16 H HB2 . PRO A1 1 2 ? -6.29 3.949 -6.556 1.0 42.4 2 A 3 -ATOM 17 H HB3 . PRO A1 1 2 ? -7.146 2.457 -6.152 1.0 62.54 2 A 3 -ATOM 18 H HG2 . PRO A1 1 2 ? -7.845 5.287 -5.469 1.0 3.22 2 A 3 -ATOM 19 H HG3 . PRO A1 1 2 ? -8.901 3.977 -6.031 1.0 51.14 2 A 3 -ATOM 20 H HD2 . PRO A1 1 2 ? -8.738 4.702 -3.427 1.0 11.0 2 A 3 -ATOM 21 H HD3 . PRO A1 1 2 ? -9.052 3.03 -3.935 1.0 24.12 2 A 3 -ATOM 22 N N . LEU A1 1 3 ? -3.991 4.31 -5.348 1.0 34.12 3 A 3 -ATOM 23 C CA . LEU A1 1 3 ? -2.913 5.291 -5.399 1.0 54.03 3 A 3 -ATOM 24 C C . LEU A1 1 3 ? -2.895 6.012 -6.743 1.0 63.21 3 A 3 -ATOM 25 O O . LEU A1 1 3 ? -3.255 7.185 -6.834 1.0 11.24 3 A 3 -ATOM 26 C CB . LEU A1 1 3 ? -1.565 4.61 -5.155 1.0 60.12 3 A 3 -ATOM 27 C CG . LEU A1 1 3 ? -0.919 4.867 -3.793 1.0 64.13 3 A 3 -ATOM 28 C CD1 . LEU A1 1 3 ? -0.508 6.325 -3.665 1.0 62.25 3 A 3 -ATOM 29 C CD2 . LEU A1 1 3 ? -1.87 4.478 -2.671 1.0 0.12 3 A 3 -ATOM 30 H H . LEU A1 1 3 ? -3.989 3.565 -5.984 1.0 52.35 3 A 3 -ATOM 31 H HA . LEU A1 1 3 ? -3.087 6.016 -4.617 1.0 43.13 3 A 3 -ATOM 32 H HB2 . LEU A1 1 3 ? -1.71 3.545 -5.257 1.0 74.24 3 A 3 -ATOM 33 H HB3 . LEU A1 1 3 ? -0.88 4.952 -5.918 1.0 72.41 3 A 3 -ATOM 34 H HG . LEU A1 1 3 ? -0.029 4.26 -3.704 1.0 43.5 3 A 3 -ATOM 35 H HD11 . LEU A1 1 3 ? -0.498 6.784 -4.641 1.0 50.45 3 A 3 -ATOM 36 H HD12 . LEU A1 1 3 ? 0.479 6.383 -3.229 1.0 4.34 3 A 3 -ATOM 37 H HD13 . LEU A1 1 3 ? -1.212 6.843 -3.03 1.0 54.42 3 A 3 -ATOM 38 H HD21 . LEU A1 1 3 ? -2.087 3.422 -2.733 1.0 23.33 3 A 3 -ATOM 39 H HD22 . LEU A1 1 3 ? -2.787 5.041 -2.764 1.0 1.01 3 A 3 -ATOM 40 H HD23 . LEU A1 1 3 ? -1.41 4.696 -1.718 1.0 75.24 3 A 3 -ATOM 41 N N . GLY A1 1 4 ? -2.476 5.301 -7.785 1.0 4.21 4 A 3 -ATOM 42 C CA . GLY A1 1 4 ? -2.421 5.889 -9.111 1.0 43.34 4 A 3 -ATOM 43 C C . GLY A1 1 4 ? -3.785 5.962 -9.769 1.0 32.24 4 A 3 -ATOM 44 O O . GLY A1 1 4 ? -4.185 7.013 -10.268 1.0 73.31 4 A 3 -ATOM 45 H H . GLY A1 1 4 ? -2.201 4.37 -7.653 1.0 2.13 4 A 3 -ATOM 46 H HA2 . GLY A1 1 4 ? -2.016 6.887 -9.034 1.0 53.5 4 A 3 -ATOM 47 H HA3 . GLY A1 1 4 ? -1.767 5.293 -9.73 1.0 61.41 4 A 3 -ATOM 48 N N . SER A1 1 5 ? -4.5 4.841 -9.772 1.0 14.33 5 A 3 -ATOM 49 C CA . SER A1 1 5 ? -5.824 4.781 -10.379 1.0 12.42 5 A 3 -ATOM 50 C C . SER A1 1 5 ? -6.705 5.919 -9.874 1.0 43.22 5 A 3 -ATOM 51 O O . SER A1 1 5 ? -6.554 6.382 -8.744 1.0 33.52 5 A 3 -ATOM 52 C CB . SER A1 1 5 ? -6.486 3.435 -10.076 1.0 72.02 5 A 3 -ATOM 53 O OG . SER A1 1 5 ? -5.703 2.36 -10.565 1.0 21.35 5 A 3 -ATOM 54 H H . SER A1 1 5 ? -4.126 4.035 -9.358 1.0 31.12 5 A 3 -ATOM 55 H HA . SER A1 1 5 ? -5.704 4.881 -11.447 1.0 12.32 5 A 3 -ATOM 56 H HB2 . SER A1 1 5 ? -6.6 3.326 -9.008 1.0 41.01 5 A 3 -ATOM 57 H HB3 . SER A1 1 5 ? -7.458 3.401 -10.547 1.0 74.13 5 A 3 -ATOM 58 H HG . SER A1 1 5 ? -6.01 1.538 -10.175 1.0 33.45 5 A 3 -ATOM 59 N N . MET A1 1 6 ? -7.626 6.366 -10.722 1.0 14.01 6 A 3 -ATOM 60 C CA . MET A1 1 6 ? -8.533 7.45 -10.362 1.0 54.33 6 A 3 -ATOM 61 C C . MET A1 1 6 ? -9.878 7.29 -11.065 1.0 31.44 6 A 3 -ATOM 62 O O . MET A1 1 6 ? -10.128 6.279 -11.721 1.0 1.11 6 A 3 -ATOM 63 C CB . MET A1 1 6 ? -7.915 8.802 -10.722 1.0 70.21 6 A 3 -ATOM 64 C CG . MET A1 1 6 ? -7.324 8.847 -12.122 1.0 25.05 6 A 3 -ATOM 65 S SD . MET A1 1 6 ? -5.539 9.103 -12.115 1.0 3.44 6 A 3 -ATOM 66 C CE . MET A1 1 6 ? -5.077 8.311 -13.653 1.0 13.21 6 A 3 -ATOM 67 H H . MET A1 1 6 ? -7.699 5.958 -11.61 1.0 2.32 6 A 3 -ATOM 68 H HA . MET A1 1 6 ? -8.691 7.409 -9.295 1.0 5.22 6 A 3 -ATOM 69 H HB2 . MET A1 1 6 ? -8.677 9.564 -10.652 1.0 62.43 6 A 3 -ATOM 70 H HB3 . MET A1 1 6 ? -7.128 9.025 -10.016 1.0 63.34 6 A 3 -ATOM 71 H HG2 . MET A1 1 6 ? -7.536 7.912 -12.618 1.0 33.13 6 A 3 -ATOM 72 H HG3 . MET A1 1 6 ? -7.788 9.656 -12.667 1.0 12.41 6 A 3 -ATOM 73 H HE1 . MET A1 1 6 ? -4.385 7.507 -13.45 1.0 12.23 6 A 3 -ATOM 74 H HE2 . MET A1 1 6 ? -5.959 7.913 -14.133 1.0 52.54 6 A 3 -ATOM 75 H HE3 . MET A1 1 6 ? -4.609 9.035 -14.304 1.0 2.41 6 A 3 -ATOM 76 N N . GLN A1 1 7 ? -10.738 8.293 -10.923 1.0 13.12 7 A 3 -ATOM 77 C CA . GLN A1 1 7 ? -12.057 8.261 -11.544 1.0 13.2 7 A 3 -ATOM 78 C C . GLN A1 1 7 ? -12.416 9.623 -12.13 1.0 42.42 7 A 3 -ATOM 79 O O . GLN A1 1 7 ? -11.892 10.651 -11.701 1.0 71.33 7 A 3 -ATOM 80 C CB . GLN A1 1 7 ? -13.115 7.837 -10.524 1.0 42.01 7 A 3 -ATOM 81 C CG . GLN A1 1 7 ? -12.694 6.653 -9.668 1.0 12.34 7 A 3 -ATOM 82 C CD . GLN A1 1 7 ? -12.207 7.069 -8.294 1.0 44.31 7 A 3 -ATOM 83 O OE1 . GLN A1 1 7 ? -12.018 8.255 -8.023 1.0 33.44 7 A 3 -ATOM 84 N NE2 . GLN A1 1 7 ? -12.0 6.093 -7.418 1.0 73.32 7 A 3 -ATOM 85 H H . GLN A1 1 7 ? -10.48 9.072 -10.388 1.0 71.21 7 A 3 -ATOM 86 H HA . GLN A1 1 7 ? -12.03 7.536 -12.343 1.0 62.03 7 A 3 -ATOM 87 H HB2 . GLN A1 1 7 ? -13.321 8.671 -9.87 1.0 13.25 7 A 3 -ATOM 88 H HB3 . GLN A1 1 7 ? -14.019 7.57 -11.05 1.0 41.42 7 A 3 -ATOM 89 H HG2 . GLN A1 1 7 ? -13.541 5.994 -9.548 1.0 43.33 7 A 3 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.898 6.126 -10.173 1.0 33.21 7 A 3 -ATOM 91 H HE21 . GLN A1 1 7 ? -12.171 5.171 -7.705 1.0 52.01 7 A 3 -ATOM 92 H HE22 . GLN A1 1 7 ? -11.684 6.333 -6.523 1.0 55.43 7 A 3 -ATOM 93 N N . ILE A1 1 8 ? -13.31 9.622 -13.113 1.0 12.12 8 A 3 -ATOM 94 C CA . ILE A1 1 8 ? -13.739 10.857 -13.756 1.0 64.2 8 A 3 -ATOM 95 C C . ILE A1 1 8 ? -15.26 10.945 -13.819 1.0 0.33 8 A 3 -ATOM 96 O O . ILE A1 1 8 ? -15.954 9.931 -13.753 1.0 11.35 8 A 3 -ATOM 97 C CB . ILE A1 1 8 ? -13.169 10.976 -15.183 1.0 65.34 8 A 3 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.306 9.757 -15.513 1.0 72.33 8 A 3 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.363 12.258 -15.326 1.0 55.24 8 A 3 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.873 9.698 -16.961 1.0 11.02 8 A 3 -ATOM 101 H H . ILE A1 1 8 ? -13.691 8.77 -13.411 1.0 43.45 8 A 3 -ATOM 102 H HA . ILE A1 1 8 ? -13.364 11.685 -13.171 1.0 41.41 8 A 3 -ATOM 103 H HB . ILE A1 1 8 ? -13.997 11.02 -15.874 1.0 13.24 8 A 3 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.417 9.776 -14.902 1.0 4.11 8 A 3 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.866 8.858 -15.297 1.0 33.41 8 A 3 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.667 12.155 -16.146 1.0 12.11 8 A 3 -ATOM 107 H HG22 . ILE A1 1 8 ? -13.031 13.082 -15.523 1.0 14.43 8 A 3 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.818 12.445 -14.413 1.0 53.13 8 A 3 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.456 8.951 -17.482 1.0 4.51 8 A 3 -ATOM 110 H HD12 . ILE A1 1 8 ? -12.029 10.661 -17.424 1.0 22.53 8 A 3 -ATOM 111 H HD13 . ILE A1 1 8 ? -10.826 9.438 -17.015 1.0 32.23 8 A 3 -ATOM 112 N N . PHE A1 1 9 ? -15.771 12.165 -13.949 1.0 44.42 9 A 3 -ATOM 113 C CA . PHE A1 1 9 ? -17.211 12.386 -14.023 1.0 45.42 9 A 3 -ATOM 114 C C . PHE A1 1 9 ? -17.614 12.888 -15.406 1.0 62.05 9 A 3 -ATOM 115 O O . PHE A1 1 9 ? -17.078 13.879 -15.9 1.0 33.13 9 A 3 -ATOM 116 C CB . PHE A1 1 9 ? -17.648 13.392 -12.955 1.0 42.3 9 A 3 -ATOM 117 C CG . PHE A1 1 9 ? -17.593 12.845 -11.558 1.0 44.44 9 A 3 -ATOM 118 C CD1 . PHE A1 1 9 ? -16.376 12.561 -10.959 1.0 24.21 9 A 3 -ATOM 119 C CD2 . PHE A1 1 9 ? -18.757 12.615 -10.843 1.0 24.11 9 A 3 -ATOM 120 C CE1 . PHE A1 1 9 ? -16.323 12.057 -9.673 1.0 54.33 9 A 3 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.71 12.112 -9.556 1.0 62.43 9 A 3 -ATOM 122 C CZ . PHE A1 1 9 ? -17.491 11.833 -8.97 1.0 72.21 9 A 3 -ATOM 123 H H . PHE A1 1 9 ? -15.166 12.935 -13.997 1.0 15.35 9 A 3 -ATOM 124 H HA . PHE A1 1 9 ? -17.7 11.442 -13.838 1.0 72.15 9 A 3 -ATOM 125 H HB2 . PHE A1 1 9 ? -17.002 14.256 -12.999 1.0 13.22 9 A 3 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.665 13.697 -13.154 1.0 20.44 9 A 3 -ATOM 127 H HD1 . PHE A1 1 9 ? -15.462 12.736 -11.506 1.0 63.23 9 A 3 -ATOM 128 H HD2 . PHE A1 1 9 ? -19.712 12.833 -11.301 1.0 43.5 9 A 3 -ATOM 129 H HE1 . PHE A1 1 9 ? -15.368 11.84 -9.217 1.0 53.21 9 A 3 -ATOM 130 H HE2 . PHE A1 1 9 ? -19.625 11.938 -9.01 1.0 61.25 9 A 3 -ATOM 131 H HZ . PHE A1 1 9 ? -17.452 11.439 -7.966 1.0 11.33 9 A 3 -ATOM 132 N N . VAL A1 1 10 ? -18.564 12.195 -16.026 1.0 35.51 10 A 3 -ATOM 133 C CA . VAL A1 1 10 ? -19.041 12.569 -17.352 1.0 51.35 10 A 3 -ATOM 134 C C . VAL A1 1 10 ? -20.503 12.998 -17.31 1.0 20.3 10 A 3 -ATOM 135 O O . VAL A1 1 10 ? -21.348 12.31 -16.736 1.0 33.54 10 A 3 -ATOM 136 C CB . VAL A1 1 10 ? -18.888 11.407 -18.352 1.0 1.24 10 A 3 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.647 11.939 -19.757 1.0 43.55 10 A 3 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.76 10.481 -17.923 1.0 70.41 10 A 3 -ATOM 139 H H . VAL A1 1 10 ? -18.954 11.413 -15.581 1.0 13.11 10 A 3 -ATOM 140 H HA . VAL A1 1 10 ? -18.442 13.397 -17.701 1.0 52.2 10 A 3 -ATOM 141 H HB . VAL A1 1 10 ? -19.807 10.841 -18.359 1.0 21.21 10 A 3 -ATOM 142 H HG11 . VAL A1 1 10 ? -19.089 12.92 -19.85 1.0 75.22 10 A 3 -ATOM 143 H HG12 . VAL A1 1 10 ? -17.584 12.003 -19.94 1.0 54.41 10 A 3 -ATOM 144 H HG13 . VAL A1 1 10 ? -19.098 11.272 -20.476 1.0 61.31 10 A 3 -ATOM 145 H HG21 . VAL A1 1 10 ? -16.947 11.065 -17.518 1.0 13.24 10 A 3 -ATOM 146 H HG22 . VAL A1 1 10 ? -18.123 9.797 -17.17 1.0 62.44 10 A 3 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.408 9.921 -18.778 1.0 2.35 10 A 3 -ATOM 148 N N . LYS A1 1 11 ? -20.796 14.141 -17.921 1.0 23.3 11 A 3 -ATOM 149 C CA . LYS A1 1 11 ? -22.157 14.663 -17.956 1.0 10.31 11 A 3 -ATOM 150 C C . LYS A1 1 11 ? -22.75 14.544 -19.356 1.0 22.12 11 A 3 -ATOM 151 O O . LYS A1 1 11 ? -22.28 15.183 -20.298 1.0 63.21 11 A 3 -ATOM 152 C CB . LYS A1 1 11 ? -22.175 16.126 -17.506 1.0 34.41 11 A 3 -ATOM 153 C CG . LYS A1 1 11 ? -23.485 16.837 -17.8 1.0 63.11 11 A 3 -ATOM 154 C CD . LYS A1 1 11 ? -23.442 18.29 -17.358 1.0 3.15 11 A 3 -ATOM 155 C CE . LYS A1 1 11 ? -23.025 19.207 -18.497 1.0 2.52 11 A 3 -ATOM 156 N NZ . LYS A1 1 11 ? -23.057 20.641 -18.095 1.0 51.12 11 A 3 -ATOM 157 H H . LYS A1 1 11 ? -20.079 14.645 -18.362 1.0 4.15 11 A 3 -ATOM 158 H HA . LYS A1 1 11 ? -22.755 14.078 -17.274 1.0 44.21 11 A 3 -ATOM 159 H HB2 . LYS A1 1 11 ? -22.0 16.164 -16.44 1.0 75.01 11 A 3 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.381 16.656 -18.012 1.0 15.43 11 A 3 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.673 16.801 -18.862 1.0 73.24 11 A 3 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.283 16.333 -17.274 1.0 30.03 11 A 3 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.424 18.583 -17.016 1.0 63.51 11 A 3 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.733 18.39 -16.548 1.0 61.22 11 A 3 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.021 18.95 -18.8 1.0 70.24 11 A 3 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.7 19.059 -19.326 1.0 3.13 11 A 3 -ATOM 167 H HZ1 . LYS A1 1 11 ? -22.109 21.058 -18.182 1.0 1.34 11 A 3 -ATOM 168 H HZ2 . LYS A1 1 11 ? -23.374 20.728 -17.108 1.0 61.44 11 A 3 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.713 21.168 -18.705 1.0 12.11 11 A 3 -ATOM 170 N N . THR A1 1 12 ? -23.788 13.723 -19.486 1.0 60.33 12 A 3 -ATOM 171 C CA . THR A1 1 12 ? -24.445 13.52 -20.771 1.0 63.11 12 A 3 -ATOM 172 C C . THR A1 1 12 ? -25.282 14.734 -21.158 1.0 63.2 12 A 3 -ATOM 173 O O . THR A1 1 12 ? -25.654 15.542 -20.305 1.0 23.14 12 A 3 -ATOM 174 C CB . THR A1 1 12 ? -25.35 12.274 -20.749 1.0 13.53 12 A 3 -ATOM 175 O OG1 . THR A1 1 12 ? -26.528 12.537 -19.979 1.0 44.22 12 A 3 -ATOM 176 C CG2 . THR A1 1 12 ? -24.611 11.08 -20.163 1.0 44.25 12 A 3 -ATOM 177 H H . THR A1 1 12 ? -24.117 13.241 -18.699 1.0 50.31 12 A 3 -ATOM 178 H HA . THR A1 1 12 ? -23.679 13.371 -21.518 1.0 15.31 12 A 3 -ATOM 179 H HB . THR A1 1 12 ? -25.637 12.038 -21.764 1.0 3.11 12 A 3 -ATOM 180 H HG1 . THR A1 1 12 ? -27.293 12.171 -20.43 1.0 54.01 12 A 3 -ATOM 181 H HG21 . THR A1 1 12 ? -25.26 10.217 -20.17 1.0 54.24 12 A 3 -ATOM 182 H HG22 . THR A1 1 12 ? -24.318 11.301 -19.147 1.0 51.32 12 A 3 -ATOM 183 H HG23 . THR A1 1 12 ? -23.732 10.874 -20.755 1.0 74.05 12 A 3 -ATOM 184 N N . LEU A1 1 13 ? -25.576 14.858 -22.447 1.0 74.21 13 A 3 -ATOM 185 C CA . LEU A1 1 13 ? -26.371 15.974 -22.947 1.0 74.52 13 A 3 -ATOM 186 C C . LEU A1 1 13 ? -27.744 16.006 -22.282 1.0 25.21 13 A 3 -ATOM 187 O O . LEU A1 1 13 ? -28.424 17.033 -22.285 1.0 11.35 13 A 3 -ATOM 188 C CB . LEU A1 1 13 ? -26.529 15.874 -24.465 1.0 31.51 13 A 3 -ATOM 189 C CG . LEU A1 1 13 ? -27.088 17.113 -25.165 1.0 30.32 13 A 3 -ATOM 190 C CD1 . LEU A1 1 13 ? -25.993 18.148 -25.374 1.0 44.31 13 A 3 -ATOM 191 C CD2 . LEU A1 1 13 ? -27.726 16.733 -26.494 1.0 64.01 13 A 3 -ATOM 192 H H . LEU A1 1 13 ? -25.252 14.183 -23.079 1.0 42.02 13 A 3 -ATOM 193 H HA . LEU A1 1 13 ? -25.847 16.888 -22.707 1.0 34.1 13 A 3 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.557 15.667 -24.886 1.0 62.11 13 A 3 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.193 15.047 -24.674 1.0 43.21 13 A 3 -ATOM 196 H HG . LEU A1 1 13 ? -27.852 17.558 -24.542 1.0 45.4 13 A 3 -ATOM 197 H HD11 . LEU A1 1 13 ? -26.34 19.112 -25.033 1.0 62.23 13 A 3 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.747 18.204 -26.424 1.0 23.44 13 A 3 -ATOM 199 H HD13 . LEU A1 1 13 ? -25.116 17.861 -24.813 1.0 25.55 13 A 3 -ATOM 200 H HD21 . LEU A1 1 13 ? -27.155 15.94 -26.953 1.0 62.14 13 A 3 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.737 17.594 -27.146 1.0 41.34 13 A 3 -ATOM 202 H HD23 . LEU A1 1 13 ? -28.739 16.398 -26.324 1.0 51.42 13 A 3 -ATOM 203 N N . THR A1 1 14 ? -28.145 14.875 -21.711 1.0 31.41 14 A 3 -ATOM 204 C CA . THR A1 1 14 ? -29.436 14.773 -21.041 1.0 30.33 14 A 3 -ATOM 205 C C . THR A1 1 14 ? -29.319 15.133 -19.564 1.0 22.13 14 A 3 -ATOM 206 O O . THR A1 1 14 ? -30.271 14.981 -18.801 1.0 5.31 14 A 3 -ATOM 207 C CB . THR A1 1 14 ? -30.024 13.355 -21.168 1.0 34.54 14 A 3 -ATOM 208 O OG1 . THR A1 1 14 ? -29.213 12.422 -20.445 1.0 3.22 14 A 3 -ATOM 209 C CG2 . THR A1 1 14 ? -30.113 12.935 -22.627 1.0 34.11 14 A 3 -ATOM 210 H H . THR A1 1 14 ? -27.559 14.091 -21.741 1.0 2.31 14 A 3 -ATOM 211 H HA . THR A1 1 14 ? -30.114 15.466 -21.517 1.0 25.44 14 A 3 -ATOM 212 H HB . THR A1 1 14 ? -31.02 13.356 -20.747 1.0 55.24 14 A 3 -ATOM 213 H HG1 . THR A1 1 14 ? -29.368 12.526 -19.503 1.0 24.42 14 A 3 -ATOM 214 H HG21 . THR A1 1 14 ? -30.121 13.813 -23.254 1.0 1.02 14 A 3 -ATOM 215 H HG22 . THR A1 1 14 ? -31.021 12.372 -22.785 1.0 12.23 14 A 3 -ATOM 216 H HG23 . THR A1 1 14 ? -29.26 12.321 -22.877 1.0 12.42 14 A 3 -ATOM 217 N N . GLY A1 1 15 ? -28.143 15.611 -19.167 1.0 61.2 15 A 3 -ATOM 218 C CA . GLY A1 1 15 ? -27.924 15.985 -17.782 1.0 25.44 15 A 3 -ATOM 219 C C . GLY A1 1 15 ? -27.82 14.782 -16.866 1.0 2.34 15 A 3 -ATOM 220 O O . GLY A1 1 15 ? -28.571 14.662 -15.898 1.0 24.03 15 A 3 -ATOM 221 H H . GLY A1 1 15 ? -27.419 15.71 -19.82 1.0 73.22 15 A 3 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.009 16.555 -17.716 1.0 10.15 15 A 3 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.746 16.603 -17.454 1.0 23.53 15 A 3 -ATOM 224 N N . LYS A1 1 16 ? -26.888 13.886 -17.172 1.0 11.21 16 A 3 -ATOM 225 C CA . LYS A1 1 16 ? -26.688 12.685 -16.37 1.0 34.13 16 A 3 -ATOM 226 C C . LYS A1 1 16 ? -25.243 12.586 -15.89 1.0 15.24 16 A 3 -ATOM 227 O O . LYS A1 1 16 ? -24.314 12.512 -16.694 1.0 50.04 16 A 3 -ATOM 228 C CB . LYS A1 1 16 ? -27.053 11.439 -17.18 1.0 31.42 16 A 3 -ATOM 229 C CG . LYS A1 1 16 ? -27.658 10.325 -16.343 1.0 73.35 16 A 3 -ATOM 230 C CD . LYS A1 1 16 ? -26.585 9.413 -15.771 1.0 50.3 16 A 3 -ATOM 231 C CE . LYS A1 1 16 ? -25.896 8.61 -16.863 1.0 52.44 16 A 3 -ATOM 232 N NZ . LYS A1 1 16 ? -26.284 7.173 -16.823 1.0 2.53 16 A 3 -ATOM 233 H H . LYS A1 1 16 ? -26.319 14.037 -17.957 1.0 52.54 16 A 3 -ATOM 234 H HA . LYS A1 1 16 ? -27.337 12.748 -15.51 1.0 34.34 16 A 3 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.767 11.716 -17.942 1.0 44.24 16 A 3 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.161 11.059 -17.656 1.0 12.13 16 A 3 -ATOM 237 H HG2 . LYS A1 1 16 ? -28.216 10.761 -15.528 1.0 3.41 16 A 3 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.321 9.74 -16.964 1.0 74.14 16 A 3 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.847 10.015 -15.262 1.0 63.23 16 A 3 -ATOM 240 H HD3 . LYS A1 1 16 ? -27.043 8.731 -15.068 1.0 14.51 16 A 3 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.169 9.022 -17.822 1.0 44.12 16 A 3 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.827 8.689 -16.729 1.0 75.31 16 A 3 -ATOM 243 H HZ1 . LYS A1 1 16 ? -26.977 7.01 -16.065 1.0 61.55 16 A 3 -ATOM 244 H HZ2 . LYS A1 1 16 ? -25.447 6.581 -16.646 1.0 23.15 16 A 3 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.706 6.892 -17.731 1.0 43.23 16 A 3 -ATOM 246 N N . THR A1 1 17 ? -25.061 12.584 -14.573 1.0 33.03 17 A 3 -ATOM 247 C CA . THR A1 1 17 ? -23.731 12.493 -13.985 1.0 61.21 17 A 3 -ATOM 248 C C . THR A1 1 17 ? -23.31 11.04 -13.798 1.0 13.11 17 A 3 -ATOM 249 O O . THR A1 1 17 ? -23.954 10.287 -13.067 1.0 32.24 17 A 3 -ATOM 250 C CB . THR A1 1 17 ? -23.667 13.214 -12.625 1.0 22.54 17 A 3 -ATOM 251 O OG1 . THR A1 1 17 ? -24.959 13.21 -12.008 1.0 24.32 17 A 3 -ATOM 252 C CG2 . THR A1 1 17 ? -23.184 14.647 -12.794 1.0 72.42 17 A 3 -ATOM 253 H H . THR A1 1 17 ? -25.842 12.645 -13.983 1.0 63.53 17 A 3 -ATOM 254 H HA . THR A1 1 17 ? -23.036 12.975 -14.658 1.0 15.15 17 A 3 -ATOM 255 H HB . THR A1 1 17 ? -22.97 12.688 -11.989 1.0 61.22 17 A 3 -ATOM 256 H HG1 . THR A1 1 17 ? -24.873 12.949 -11.088 1.0 54.0 17 A 3 -ATOM 257 H HG21 . THR A1 1 17 ? -22.689 14.749 -13.748 1.0 31.34 17 A 3 -ATOM 258 H HG22 . THR A1 1 17 ? -22.492 14.889 -12.002 1.0 12.24 17 A 3 -ATOM 259 H HG23 . THR A1 1 17 ? -24.029 15.318 -12.753 1.0 74.01 17 A 3 -ATOM 260 N N . ILE A1 1 18 ? -22.226 10.653 -14.461 1.0 21.15 18 A 3 -ATOM 261 C CA . ILE A1 1 18 ? -21.719 9.289 -14.365 1.0 42.23 18 A 3 -ATOM 262 C C . ILE A1 1 18 ? -20.256 9.276 -13.934 1.0 2.02 18 A 3 -ATOM 263 O O . ILE A1 1 18 ? -19.463 10.114 -14.363 1.0 34.24 18 A 3 -ATOM 264 C CB . ILE A1 1 18 ? -21.854 8.543 -15.705 1.0 20.13 18 A 3 -ATOM 265 C CG1 . ILE A1 1 18 ? -21.079 7.225 -15.66 1.0 0.43 18 A 3 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.361 9.415 -16.85 1.0 34.34 18 A 3 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.335 6.332 -16.854 1.0 41.12 18 A 3 -ATOM 268 H H . ILE A1 1 18 ? -21.756 11.299 -15.028 1.0 72.35 18 A 3 -ATOM 269 H HA . ILE A1 1 18 ? -22.306 8.767 -13.624 1.0 33.1 18 A 3 -ATOM 270 H HB . ILE A1 1 18 ? -22.9 8.332 -15.87 1.0 55.23 18 A 3 -ATOM 271 H HG12 . ILE A1 1 18 ? -20.022 7.437 -15.627 1.0 35.45 18 A 3 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.361 6.68 -14.771 1.0 15.51 18 A 3 -ATOM 273 H HG21 . ILE A1 1 18 ? -21.199 8.803 -17.725 1.0 31.24 18 A 3 -ATOM 274 H HG22 . ILE A1 1 18 ? -22.1 10.17 -17.071 1.0 60.32 18 A 3 -ATOM 275 H HG23 . ILE A1 1 18 ? -20.434 9.891 -16.567 1.0 71.44 18 A 3 -ATOM 276 H HD11 . ILE A1 1 18 ? -20.396 5.935 -17.215 1.0 32.31 18 A 3 -ATOM 277 H HD12 . ILE A1 1 18 ? -21.981 5.517 -16.563 1.0 60.24 18 A 3 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.807 6.904 -17.638 1.0 25.35 18 A 3 -ATOM 279 N N . THR A1 1 19 ? -19.904 8.317 -13.083 1.0 42.32 19 A 3 -ATOM 280 C CA . THR A1 1 19 ? -18.537 8.193 -12.594 1.0 41.24 19 A 3 -ATOM 281 C C . THR A1 1 19 ? -17.882 6.917 -13.11 1.0 70.21 19 A 3 -ATOM 282 O O . THR A1 1 19 ? -18.51 5.858 -13.15 1.0 44.42 19 A 3 -ATOM 283 C CB . THR A1 1 19 ? -18.489 8.195 -11.055 1.0 2.4 19 A 3 -ATOM 284 O OG1 . THR A1 1 19 ? -19.681 8.787 -10.528 1.0 22.32 19 A 3 -ATOM 285 C CG2 . THR A1 1 19 ? -17.273 8.958 -10.552 1.0 13.14 19 A 3 -ATOM 286 H H . THR A1 1 19 ? -20.582 7.678 -12.778 1.0 1.15 19 A 3 -ATOM 287 H HA . THR A1 1 19 ? -17.976 9.044 -12.952 1.0 65.43 19 A 3 -ATOM 288 H HB . THR A1 1 19 ? -18.421 7.173 -10.71 1.0 44.24 19 A 3 -ATOM 289 H HG1 . THR A1 1 19 ? -19.899 9.573 -11.035 1.0 60.25 19 A 3 -ATOM 290 H HG21 . THR A1 1 19 ? -16.381 8.38 -10.744 1.0 73.33 19 A 3 -ATOM 291 H HG22 . THR A1 1 19 ? -17.369 9.13 -9.49 1.0 23.45 19 A 3 -ATOM 292 H HG23 . THR A1 1 19 ? -17.205 9.906 -11.066 1.0 51.03 19 A 3 -ATOM 293 N N . ILE A1 1 20 ? -16.617 7.023 -13.503 1.0 2.13 20 A 3 -ATOM 294 C CA . ILE A1 1 20 ? -15.878 5.876 -14.015 1.0 23.24 20 A 3 -ATOM 295 C C . ILE A1 1 20 ? -14.422 5.914 -13.561 1.0 21.51 20 A 3 -ATOM 296 O O . ILE A1 1 20 ? -13.753 6.942 -13.674 1.0 3.54 20 A 3 -ATOM 297 C CB . ILE A1 1 20 ? -15.923 5.818 -15.553 1.0 55.55 20 A 3 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.886 7.23 -16.14 1.0 1.5 20 A 3 -ATOM 299 C CG2 . ILE A1 1 20 ? -17.168 5.078 -16.019 1.0 1.32 20 A 3 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.143 7.319 -17.455 1.0 2.4 20 A 3 -ATOM 301 H H . ILE A1 1 20 ? -16.171 7.894 -13.447 1.0 32.52 20 A 3 -ATOM 302 H HA . ILE A1 1 20 ? -16.341 4.981 -13.627 1.0 40.32 20 A 3 -ATOM 303 H HB . ILE A1 1 20 ? -15.058 5.27 -15.896 1.0 75.22 20 A 3 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.895 7.571 -16.307 1.0 4.24 20 A 3 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.398 7.891 -15.438 1.0 20.02 20 A 3 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.984 5.777 -16.123 1.0 41.11 20 A 3 -ATOM 307 H HG22 . ILE A1 1 20 ? -16.972 4.61 -16.972 1.0 51.34 20 A 3 -ATOM 308 H HG23 . ILE A1 1 20 ? -17.43 4.323 -15.293 1.0 74.34 20 A 3 -ATOM 309 H HD11 . ILE A1 1 20 ? -14.079 7.313 -17.268 1.0 44.23 20 A 3 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.403 6.472 -18.074 1.0 43.31 20 A 3 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.414 8.232 -17.962 1.0 23.14 20 A 3 -ATOM 312 N N . ASP A1 1 21 ? -13.938 4.788 -13.051 1.0 44.41 21 A 3 -ATOM 313 C CA . ASP A1 1 21 ? -12.56 4.69 -12.583 1.0 13.43 21 A 3 -ATOM 314 C C . ASP A1 1 21 ? -11.613 4.393 -13.741 1.0 74.52 21 A 3 -ATOM 315 O O . ASP A1 1 21 ? -11.738 3.368 -14.411 1.0 3.25 21 A 3 -ATOM 316 C CB . ASP A1 1 21 ? -12.438 3.603 -11.514 1.0 40.32 21 A 3 -ATOM 317 C CG . ASP A1 1 21 ? -12.884 2.244 -12.018 1.0 70.32 21 A 3 -ATOM 318 O OD1 . ASP A1 1 21 ? -14.108 2.008 -12.082 1.0 34.41 21 A 3 -ATOM 319 O OD2 . ASP A1 1 21 ? -12.008 1.416 -12.347 1.0 4.34 21 A 3 -ATOM 320 H H . ASP A1 1 21 ? -14.521 4.002 -12.988 1.0 61.24 21 A 3 -ATOM 321 H HA . ASP A1 1 21 ? -12.29 5.641 -12.148 1.0 0.1 21 A 3 -ATOM 322 H HB2 . ASP A1 1 21 ? -11.406 3.529 -11.202 1.0 73.15 21 A 3 -ATOM 323 H HB3 . ASP A1 1 21 ? -13.049 3.871 -10.665 1.0 61.23 21 A 3 -ATOM 324 N N . VAL A1 1 22 ? -10.665 5.296 -13.971 1.0 30.34 22 A 3 -ATOM 325 C CA . VAL A1 1 22 ? -9.696 5.131 -15.047 1.0 1.34 22 A 3 -ATOM 326 C C . VAL A1 1 22 ? -8.27 5.287 -14.532 1.0 61.2 22 A 3 -ATOM 327 O O . VAL A1 1 22 ? -8.045 5.844 -13.457 1.0 34.03 22 A 3 -ATOM 328 C CB . VAL A1 1 22 ? -9.936 6.147 -16.179 1.0 60.13 22 A 3 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.384 6.613 -16.181 1.0 14.0 22 A 3 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.987 7.329 -16.043 1.0 61.12 22 A 3 -ATOM 331 H H . VAL A1 1 22 ? -10.616 6.093 -13.402 1.0 71.0 22 A 3 -ATOM 332 H HA . VAL A1 1 22 ? -9.815 4.137 -15.454 1.0 41.13 22 A 3 -ATOM 333 H HB . VAL A1 1 22 ? -9.737 5.659 -17.122 1.0 23.42 22 A 3 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.548 7.28 -15.348 1.0 3.13 22 A 3 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.595 7.131 -17.106 1.0 11.12 22 A 3 -ATOM 336 H HG13 . VAL A1 1 22 ? -12.037 5.757 -16.091 1.0 2.3 22 A 3 -ATOM 337 H HG21 . VAL A1 1 22 ? -8.944 7.639 -15.01 1.0 43.3 22 A 3 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.002 7.038 -16.374 1.0 71.52 22 A 3 -ATOM 339 H HG23 . VAL A1 1 22 ? -9.343 8.148 -16.651 1.0 24.41 22 A 3 -ATOM 340 N N . ASP A1 1 23 ? -7.31 4.793 -15.306 1.0 73.14 23 A 3 -ATOM 341 C CA . ASP A1 1 23 ? -5.904 4.879 -14.929 1.0 0.33 23 A 3 -ATOM 342 C C . ASP A1 1 23 ? -5.122 5.719 -15.934 1.0 62.12 23 A 3 -ATOM 343 O O . ASP A1 1 23 ? -5.577 5.946 -17.056 1.0 35.34 23 A 3 -ATOM 344 C CB . ASP A1 1 23 ? -5.294 3.48 -14.83 1.0 24.44 23 A 3 -ATOM 345 C CG . ASP A1 1 23 ? -4.363 3.336 -13.642 1.0 11.25 23 A 3 -ATOM 346 O OD1 . ASP A1 1 23 ? -3.876 4.372 -13.142 1.0 71.52 23 A 3 -ATOM 347 O OD2 . ASP A1 1 23 ? -4.122 2.189 -13.212 1.0 54.12 23 A 3 -ATOM 348 H H . ASP A1 1 23 ? -7.553 4.36 -16.151 1.0 71.31 23 A 3 -ATOM 349 H HA . ASP A1 1 23 ? -5.848 5.354 -13.961 1.0 62.03 23 A 3 -ATOM 350 H HB2 . ASP A1 1 23 ? -6.088 2.754 -14.732 1.0 75.32 23 A 3 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.733 3.274 -15.731 1.0 32.1 23 A 3 -ATOM 352 N N . HIS A1 1 24 ? -3.944 6.178 -15.525 1.0 3.42 24 A 3 -ATOM 353 C CA . HIS A1 1 24 ? -3.098 6.993 -16.389 1.0 64.1 24 A 3 -ATOM 354 C C . HIS A1 1 24 ? -2.731 6.235 -17.662 1.0 13.22 24 A 3 -ATOM 355 O O . HIS A1 1 24 ? -2.305 6.832 -18.65 1.0 40.32 24 A 3 -ATOM 356 C CB . HIS A1 1 24 ? -1.829 7.414 -15.648 1.0 43.52 24 A 3 -ATOM 357 C CG . HIS A1 1 24 ? -0.854 6.295 -15.447 1.0 63.23 24 A 3 -ATOM 358 N ND1 . HIS A1 1 24 ? 0.433 6.321 -15.939 1.0 33.23 24 A 3 -ATOM 359 C CD2 . HIS A1 1 24 ? -0.985 5.112 -14.801 1.0 70.35 24 A 3 -ATOM 360 C CE1 . HIS A1 1 24 ? 1.052 5.202 -15.606 1.0 52.22 24 A 3 -ATOM 361 N NE2 . HIS A1 1 24 ? 0.214 4.452 -14.914 1.0 51.1 24 A 3 -ATOM 362 H H . HIS A1 1 24 ? -3.635 5.963 -14.62 1.0 35.01 24 A 3 -ATOM 363 H HA . HIS A1 1 24 ? -3.656 7.877 -16.66 1.0 52.33 24 A 3 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.331 8.189 -16.211 1.0 74.33 24 A 3 -ATOM 365 H HB3 . HIS A1 1 24 ? -2.099 7.799 -14.675 1.0 2.24 24 A 3 -ATOM 366 H HD1 . HIS A1 1 24 ? 0.833 7.05 -16.457 1.0 61.24 24 A 3 -ATOM 367 H HD2 . HIS A1 1 24 ? -1.868 4.754 -14.291 1.0 14.35 24 A 3 -ATOM 368 H HE1 . HIS A1 1 24 ? 2.071 4.944 -15.855 1.0 73.24 24 A 3 -ATOM 369 N N . ALA A1 1 25 ? -2.899 4.917 -17.629 1.0 63.43 25 A 3 -ATOM 370 C CA . ALA A1 1 25 ? -2.587 4.078 -18.779 1.0 43.32 25 A 3 -ATOM 371 C C . ALA A1 1 25 ? -3.812 3.883 -19.665 1.0 33.54 25 A 3 -ATOM 372 O O . ALA A1 1 25 ? -3.779 3.113 -20.625 1.0 12.23 25 A 3 -ATOM 373 C CB . ALA A1 1 25 ? -2.046 2.733 -18.319 1.0 51.34 25 A 3 -ATOM 374 H H . ALA A1 1 25 ? -3.243 4.5 -16.812 1.0 55.41 25 A 3 -ATOM 375 H HA . ALA A1 1 25 ? -1.815 4.572 -19.352 1.0 23.12 25 A 3 -ATOM 376 H HB1 . ALA A1 1 25 ? -2.759 2.267 -17.654 1.0 42.21 25 A 3 -ATOM 377 H HB2 . ALA A1 1 25 ? -1.885 2.097 -19.178 1.0 3.14 25 A 3 -ATOM 378 H HB3 . ALA A1 1 25 ? -1.111 2.879 -17.8 1.0 44.44 25 A 3 -ATOM 379 N N . ASP A1 1 26 ? -4.891 4.585 -19.337 1.0 53.31 26 A 3 -ATOM 380 C CA . ASP A1 1 26 ? -6.128 4.489 -20.104 1.0 71.32 26 A 3 -ATOM 381 C C . ASP A1 1 26 ? -6.412 5.793 -20.843 1.0 31.24 26 A 3 -ATOM 382 O O . ASP A1 1 26 ? -6.595 6.843 -20.225 1.0 53.43 26 A 3 -ATOM 383 C CB . ASP A1 1 26 ? -7.299 4.145 -19.183 1.0 21.1 26 A 3 -ATOM 384 C CG . ASP A1 1 26 ? -7.126 2.801 -18.503 1.0 73.54 26 A 3 -ATOM 385 O OD1 . ASP A1 1 26 ? -7.359 1.768 -19.165 1.0 73.22 26 A 3 -ATOM 386 O OD2 . ASP A1 1 26 ? -6.758 2.782 -17.31 1.0 2.02 26 A 3 -ATOM 387 H H . ASP A1 1 26 ? -4.855 5.182 -18.561 1.0 73.33 26 A 3 -ATOM 388 H HA . ASP A1 1 26 ? -6.008 3.698 -20.829 1.0 35.3 26 A 3 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.383 4.905 -18.419 1.0 71.15 26 A 3 -ATOM 390 H HB3 . ASP A1 1 26 ? -8.21 4.121 -19.763 1.0 51.4 26 A 3 -ATOM 391 N N . THR A1 1 27 ? -6.446 5.721 -22.17 1.0 11.22 27 A 3 -ATOM 392 C CA . THR A1 1 27 ? -6.705 6.895 -22.993 1.0 12.11 27 A 3 -ATOM 393 C C . THR A1 1 27 ? -8.199 7.178 -23.093 1.0 24.55 27 A 3 -ATOM 394 O O . THR A1 1 27 ? -9.025 6.355 -22.696 1.0 14.34 27 A 3 -ATOM 395 C CB . THR A1 1 27 ? -6.131 6.724 -24.412 1.0 24.42 27 A 3 -ATOM 396 O OG1 . THR A1 1 27 ? -6.188 5.347 -24.801 1.0 51.41 27 A 3 -ATOM 397 C CG2 . THR A1 1 27 ? -4.692 7.215 -24.477 1.0 72.22 27 A 3 -ATOM 398 H H . THR A1 1 27 ? -6.292 4.856 -22.604 1.0 1.33 27 A 3 -ATOM 399 H HA . THR A1 1 27 ? -6.218 7.741 -22.53 1.0 54.42 27 A 3 -ATOM 400 H HB . THR A1 1 27 ? -6.726 7.31 -25.098 1.0 51.23 27 A 3 -ATOM 401 H HG1 . THR A1 1 27 ? -7.069 5.143 -25.125 1.0 23.44 27 A 3 -ATOM 402 H HG21 . THR A1 1 27 ? -4.641 8.229 -24.111 1.0 20.21 27 A 3 -ATOM 403 H HG22 . THR A1 1 27 ? -4.346 7.183 -25.499 1.0 40.31 27 A 3 -ATOM 404 H HG23 . THR A1 1 27 ? -4.068 6.58 -23.866 1.0 53.14 27 A 3 -ATOM 405 N N . VAL A1 1 28 ? -8.541 8.347 -23.625 1.0 70.04 28 A 3 -ATOM 406 C CA . VAL A1 1 28 ? -9.938 8.738 -23.779 1.0 40.12 28 A 3 -ATOM 407 C C . VAL A1 1 28 ? -10.735 7.656 -24.499 1.0 43.3 28 A 3 -ATOM 408 O O . VAL A1 1 28 ? -11.825 7.283 -24.068 1.0 51.44 28 A 3 -ATOM 409 C CB . VAL A1 1 28 ? -10.068 10.061 -24.557 1.0 70.14 28 A 3 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.457 10.653 -24.374 1.0 13.41 28 A 3 -ATOM 411 C CG2 . VAL A1 1 28 ? -8.997 11.046 -24.114 1.0 73.55 28 A 3 -ATOM 412 H H . VAL A1 1 28 ? -7.838 8.961 -23.923 1.0 50.23 28 A 3 -ATOM 413 H HA . VAL A1 1 28 ? -10.355 8.882 -22.792 1.0 62.42 28 A 3 -ATOM 414 H HB . VAL A1 1 28 ? -9.925 9.853 -25.607 1.0 52.41 28 A 3 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.525 11.119 -23.402 1.0 72.32 28 A 3 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.638 11.391 -25.142 1.0 75.12 28 A 3 -ATOM 417 H HG13 . VAL A1 1 28 ? -12.195 9.868 -24.448 1.0 43.12 28 A 3 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.91 11.024 -23.038 1.0 22.23 28 A 3 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.052 10.773 -24.558 1.0 21.24 28 A 3 -ATOM 420 H HG23 . VAL A1 1 28 ? -9.27 12.042 -24.433 1.0 51.43 28 A 3 -ATOM 421 N N . GLY A1 1 29 ? -10.183 7.156 -25.601 1.0 51.02 29 A 3 -ATOM 422 C CA . GLY A1 1 29 ? -10.856 6.122 -26.364 1.0 24.21 29 A 3 -ATOM 423 C C . GLY A1 1 29 ? -11.404 5.016 -25.484 1.0 62.32 29 A 3 -ATOM 424 O O . GLY A1 1 29 ? -12.575 4.653 -25.589 1.0 1.41 29 A 3 -ATOM 425 H H . GLY A1 1 29 ? -9.311 7.493 -25.897 1.0 25.44 29 A 3 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.672 6.568 -26.913 1.0 33.14 29 A 3 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.155 5.694 -27.065 1.0 61.11 29 A 3 -ATOM 428 N N . ALA A1 1 30 ? -10.554 4.477 -24.616 1.0 0.3 30 A 3 -ATOM 429 C CA . ALA A1 1 30 ? -10.959 3.406 -23.715 1.0 24.42 30 A 3 -ATOM 430 C C . ALA A1 1 30 ? -12.072 3.867 -22.779 1.0 23.15 30 A 3 -ATOM 431 O O . ALA A1 1 30 ? -12.967 3.095 -22.434 1.0 23.32 30 A 3 -ATOM 432 C CB . ALA A1 1 30 ? -9.765 2.91 -22.913 1.0 4.23 30 A 3 -ATOM 433 H H . ALA A1 1 30 ? -9.633 4.809 -24.58 1.0 13.0 30 A 3 -ATOM 434 H HA . ALA A1 1 30 ? -11.325 2.585 -24.315 1.0 42.35 30 A 3 -ATOM 435 H HB1 . ALA A1 1 30 ? -10.052 2.037 -22.344 1.0 24.3 30 A 3 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.961 2.652 -23.587 1.0 15.25 30 A 3 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.436 3.687 -22.24 1.0 54.13 30 A 3 -ATOM 438 N N . VAL A1 1 31 ? -12.009 5.13 -22.371 1.0 44.02 31 A 3 -ATOM 439 C CA . VAL A1 1 31 ? -13.012 5.695 -21.475 1.0 44.43 31 A 3 -ATOM 440 C C . VAL A1 1 31 ? -14.381 5.741 -22.143 1.0 22.33 31 A 3 -ATOM 441 O O . VAL A1 1 31 ? -15.39 5.371 -21.543 1.0 41.34 31 A 3 -ATOM 442 C CB . VAL A1 1 31 ? -12.625 7.115 -21.023 1.0 42.01 31 A 3 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.765 7.76 -20.25 1.0 61.22 31 A 3 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.355 7.08 -20.186 1.0 34.2 31 A 3 -ATOM 445 H H . VAL A1 1 31 ? -11.272 5.697 -22.68 1.0 33.11 31 A 3 -ATOM 446 H HA . VAL A1 1 31 ? -13.07 5.065 -20.6 1.0 53.53 31 A 3 -ATOM 447 H HB . VAL A1 1 31 ? -12.434 7.712 -21.903 1.0 34.14 31 A 3 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.47 6.999 -19.949 1.0 24.43 31 A 3 -ATOM 449 H HG12 . VAL A1 1 31 ? -13.372 8.256 -19.375 1.0 62.24 31 A 3 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.264 8.481 -20.88 1.0 4.44 31 A 3 -ATOM 451 H HG21 . VAL A1 1 31 ? -11.219 6.089 -19.779 1.0 32.4 31 A 3 -ATOM 452 H HG22 . VAL A1 1 31 ? -10.509 7.334 -20.806 1.0 31.51 31 A 3 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.436 7.793 -19.378 1.0 2.41 31 A 3 -ATOM 454 N N . LYS A1 1 32 ? -14.41 6.199 -23.39 1.0 44.33 32 A 3 -ATOM 455 C CA . LYS A1 1 32 ? -15.656 6.294 -24.143 1.0 33.41 32 A 3 -ATOM 456 C C . LYS A1 1 32 ? -16.363 4.943 -24.195 1.0 33.52 32 A 3 -ATOM 457 O O . LYS A1 1 32 ? -17.582 4.864 -24.041 1.0 55.22 32 A 3 -ATOM 458 C CB . LYS A1 1 32 ? -15.381 6.792 -25.563 1.0 21.43 32 A 3 -ATOM 459 C CG . LYS A1 1 32 ? -16.03 8.13 -25.874 1.0 62.04 32 A 3 -ATOM 460 C CD . LYS A1 1 32 ? -15.025 9.267 -25.802 1.0 13.3 32 A 3 -ATOM 461 C CE . LYS A1 1 32 ? -14.634 9.754 -27.189 1.0 61.02 32 A 3 -ATOM 462 N NZ . LYS A1 1 32 ? -15.773 10.409 -27.889 1.0 10.13 32 A 3 -ATOM 463 H H . LYS A1 1 32 ? -13.572 6.48 -23.815 1.0 0.43 32 A 3 -ATOM 464 H HA . LYS A1 1 32 ? -16.295 7.002 -23.639 1.0 20.21 32 A 3 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.314 6.894 -25.696 1.0 31.13 32 A 3 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.755 6.062 -26.267 1.0 51.43 32 A 3 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.446 8.095 -26.87 1.0 34.55 32 A 3 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.818 8.312 -25.158 1.0 75.31 32 A 3 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.462 10.089 -25.255 1.0 62.53 32 A 3 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.139 8.922 -25.288 1.0 34.24 32 A 3 -ATOM 471 H HE2 . LYS A1 1 32 ? -13.826 10.464 -27.092 1.0 32.35 32 A 3 -ATOM 472 H HE3 . LYS A1 1 32 ? -14.302 8.909 -27.773 1.0 31.14 32 A 3 -ATOM 473 H HZ1 . LYS A1 1 32 ? -16.226 9.738 -28.541 1.0 3.34 32 A 3 -ATOM 474 H HZ2 . LYS A1 1 32 ? -15.435 11.229 -28.432 1.0 11.13 32 A 3 -ATOM 475 H HZ3 . LYS A1 1 32 ? -16.478 10.734 -27.197 1.0 13.55 32 A 3 -ATOM 476 N N . ALA A1 1 33 ? -15.591 3.884 -24.411 1.0 34.21 33 A 3 -ATOM 477 C CA . ALA A1 1 33 ? -16.144 2.537 -24.48 1.0 60.31 33 A 3 -ATOM 478 C C . ALA A1 1 33 ? -16.764 2.129 -23.147 1.0 31.03 33 A 3 -ATOM 479 O O . ALA A1 1 33 ? -17.83 1.514 -23.109 1.0 31.32 33 A 3 -ATOM 480 C CB . ALA A1 1 33 ? -15.066 1.544 -24.888 1.0 54.24 33 A 3 -ATOM 481 H H . ALA A1 1 33 ? -14.626 4.011 -24.526 1.0 43.1 33 A 3 -ATOM 482 H HA . ALA A1 1 33 ? -16.912 2.529 -25.24 1.0 53.01 33 A 3 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.17 1.731 -24.315 1.0 2.33 33 A 3 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.412 0.539 -24.698 1.0 61.23 33 A 3 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.851 1.658 -25.94 1.0 53.23 33 A 3 -ATOM 486 N N . LYS A1 1 34 ? -16.09 2.475 -22.056 1.0 30.14 34 A 3 -ATOM 487 C CA . LYS A1 1 34 ? -16.574 2.147 -20.72 1.0 3.41 34 A 3 -ATOM 488 C C . LYS A1 1 34 ? -17.935 2.784 -20.463 1.0 51.04 34 A 3 -ATOM 489 O O . LYS A1 1 34 ? -18.841 2.142 -19.929 1.0 30.3 34 A 3 -ATOM 490 C CB . LYS A1 1 34 ? -15.572 2.614 -19.663 1.0 63.02 34 A 3 -ATOM 491 C CG . LYS A1 1 34 ? -15.963 2.237 -18.245 1.0 24.43 34 A 3 -ATOM 492 C CD . LYS A1 1 34 ? -15.881 0.736 -18.024 1.0 44.42 34 A 3 -ATOM 493 C CE . LYS A1 1 34 ? -14.45 0.233 -18.143 1.0 34.12 34 A 3 -ATOM 494 N NZ . LYS A1 1 34 ? -14.285 -1.117 -17.537 1.0 13.0 34 A 3 -ATOM 495 H H . LYS A1 1 34 ? -15.246 2.965 -22.151 1.0 65.25 34 A 3 -ATOM 496 H HA . LYS A1 1 34 ? -16.675 1.074 -20.659 1.0 3.22 34 A 3 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.609 2.175 -19.877 1.0 71.03 34 A 3 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.486 3.69 -19.716 1.0 71.12 34 A 3 -ATOM 499 H HG2 . LYS A1 1 34 ? -15.296 2.729 -17.553 1.0 24.23 34 A 3 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.978 2.564 -18.062 1.0 22.21 34 A 3 -ATOM 501 H HD2 . LYS A1 1 34 ? -16.25 0.506 -17.035 1.0 63.43 34 A 3 -ATOM 502 H HD3 . LYS A1 1 34 ? -16.492 0.238 -18.763 1.0 75.33 34 A 3 -ATOM 503 H HE2 . LYS A1 1 34 ? -14.186 0.184 -19.189 1.0 34.14 34 A 3 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.795 0.928 -17.639 1.0 0.12 34 A 3 -ATOM 505 H HZ1 . LYS A1 1 34 ? -15.139 -1.377 -17.005 1.0 62.42 34 A 3 -ATOM 506 H HZ2 . LYS A1 1 34 ? -13.471 -1.12 -16.89 1.0 14.2 34 A 3 -ATOM 507 H HZ3 . LYS A1 1 34 ? -14.124 -1.825 -18.281 1.0 65.2 34 A 3 -ATOM 508 N N . ILE A1 1 35 ? -18.073 4.049 -20.847 1.0 14.42 35 A 3 -ATOM 509 C CA . ILE A1 1 35 ? -19.325 4.771 -20.659 1.0 22.32 35 A 3 -ATOM 510 C C . ILE A1 1 35 ? -20.441 4.166 -21.504 1.0 74.31 35 A 3 -ATOM 511 O O . ILE A1 1 35 ? -21.592 4.094 -21.073 1.0 33.23 35 A 3 -ATOM 512 C CB . ILE A1 1 35 ? -19.175 6.261 -21.019 1.0 42.5 35 A 3 -ATOM 513 C CG1 . ILE A1 1 35 ? -18.031 6.888 -20.219 1.0 22.04 35 A 3 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.478 7.003 -20.76 1.0 45.14 35 A 3 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.219 6.795 -18.721 1.0 11.1 35 A 3 -ATOM 516 H H . ILE A1 1 35 ? -17.316 4.507 -21.266 1.0 54.44 35 A 3 -ATOM 517 H HA . ILE A1 1 35 ? -19.599 4.699 -19.616 1.0 30.01 35 A 3 -ATOM 518 H HB . ILE A1 1 35 ? -18.951 6.334 -22.072 1.0 2.44 35 A 3 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.109 6.388 -20.469 1.0 3.24 35 A 3 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.951 7.934 -20.48 1.0 0.11 35 A 3 -ATOM 521 H HG21 . ILE A1 1 35 ? -21.237 6.299 -20.45 1.0 65.32 35 A 3 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.327 7.734 -19.981 1.0 43.1 35 A 3 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.796 7.499 -21.664 1.0 75.41 35 A 3 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.597 7.533 -18.234 1.0 43.52 35 A 3 -ATOM 525 H HD12 . ILE A1 1 35 ? -19.254 6.979 -18.475 1.0 71.15 35 A 3 -ATOM 526 H HD13 . ILE A1 1 35 ? -17.937 5.809 -18.383 1.0 74.3 35 A 3 -ATOM 527 N N . TYR A1 1 36 ? -20.092 3.73 -22.71 1.0 62.53 36 A 3 -ATOM 528 C CA . TYR A1 1 36 ? -21.064 3.131 -23.616 1.0 64.44 36 A 3 -ATOM 529 C C . TYR A1 1 36 ? -21.758 1.94 -22.962 1.0 53.42 36 A 3 -ATOM 530 O O . TYR A1 1 36 ? -22.979 1.801 -23.036 1.0 34.33 36 A 3 -ATOM 531 C CB . TYR A1 1 36 ? -20.38 2.689 -24.911 1.0 74.42 36 A 3 -ATOM 532 C CG . TYR A1 1 36 ? -20.765 1.295 -25.353 1.0 43.51 36 A 3 -ATOM 533 C CD1 . TYR A1 1 36 ? -22.021 1.036 -25.889 1.0 62.31 36 A 3 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.872 0.237 -25.237 1.0 22.21 36 A 3 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.377 -0.236 -26.293 1.0 25.24 36 A 3 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.219 -1.038 -25.64 1.0 24.41 36 A 3 -ATOM 537 C CZ . TYR A1 1 36 ? -21.472 -1.27 -26.167 1.0 51.0 36 A 3 -ATOM 538 O OH . TYR A1 1 36 ? -21.822 -2.538 -26.57 1.0 31.41 36 A 3 -ATOM 539 H H . TYR A1 1 36 ? -19.16 3.815 -22.998 1.0 42.53 36 A 3 -ATOM 540 H HA . TYR A1 1 36 ? -21.806 3.881 -23.851 1.0 45.34 36 A 3 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.646 3.372 -25.702 1.0 32.41 36 A 3 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.31 2.708 -24.769 1.0 73.31 36 A 3 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.727 1.848 -25.986 1.0 14.41 36 A 3 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.891 0.421 -24.824 1.0 73.43 36 A 3 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.358 -0.417 -26.706 1.0 30.0 36 A 3 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.511 -1.848 -25.542 1.0 11.1 36 A 3 -ATOM 547 H HH . TYR A1 1 36 ? -21.032 -3.024 -26.819 1.0 20.21 36 A 3 -ATOM 548 N N . ASP A1 1 37 ? -20.97 1.085 -22.321 1.0 31.31 37 A 3 -ATOM 549 C CA . ASP A1 1 37 ? -21.507 -0.094 -21.65 1.0 4.3 37 A 3 -ATOM 550 C C . ASP A1 1 37 ? -22.2 0.29 -20.347 1.0 30.32 37 A 3 -ATOM 551 O O . ASP A1 1 37 ? -23.153 -0.363 -19.921 1.0 62.0 37 A 3 -ATOM 552 C CB . ASP A1 1 37 ? -20.391 -1.102 -21.372 1.0 35.43 37 A 3 -ATOM 553 C CG . ASP A1 1 37 ? -20.909 -2.521 -21.249 1.0 34.32 37 A 3 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.504 -3.023 -22.226 1.0 31.12 37 A 3 -ATOM 555 O OD2 . ASP A1 1 37 ? -20.719 -3.131 -20.176 1.0 3.2 37 A 3 -ATOM 556 H H . ASP A1 1 37 ? -20.004 1.25 -22.296 1.0 51.42 37 A 3 -ATOM 557 H HA . ASP A1 1 37 ? -22.233 -0.548 -22.308 1.0 32.24 37 A 3 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.675 -1.069 -22.18 1.0 43.14 37 A 3 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.897 -0.836 -20.449 1.0 34.23 37 A 3 -ATOM 560 N N . LYS A1 1 38 ? -21.713 1.353 -19.715 1.0 33.03 38 A 3 -ATOM 561 C CA . LYS A1 1 38 ? -22.284 1.826 -18.459 1.0 33.5 38 A 3 -ATOM 562 C C . LYS A1 1 38 ? -23.784 2.065 -18.6 1.0 62.1 38 A 3 -ATOM 563 O O . LYS A1 1 38 ? -24.569 1.649 -17.749 1.0 13.24 38 A 3 -ATOM 564 C CB . LYS A1 1 38 ? -21.59 3.115 -18.013 1.0 32.13 38 A 3 -ATOM 565 C CG . LYS A1 1 38 ? -20.811 2.97 -16.718 1.0 11.13 38 A 3 -ATOM 566 C CD . LYS A1 1 38 ? -19.346 2.661 -16.98 1.0 55.11 38 A 3 -ATOM 567 C CE . LYS A1 1 38 ? -19.108 1.166 -17.12 1.0 12.13 38 A 3 -ATOM 568 N NZ . LYS A1 1 38 ? -18.473 0.588 -15.904 1.0 62.42 38 A 3 -ATOM 569 H H . LYS A1 1 38 ? -20.951 1.832 -20.104 1.0 40.1 38 A 3 -ATOM 570 H HA . LYS A1 1 38 ? -22.121 1.063 -17.713 1.0 13.43 38 A 3 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.906 3.428 -18.788 1.0 53.44 38 A 3 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.339 3.882 -17.875 1.0 74.35 38 A 3 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.88 3.893 -16.162 1.0 72.35 38 A 3 -ATOM 574 H HG3 . LYS A1 1 38 ? -21.241 2.165 -16.138 1.0 65.33 38 A 3 -ATOM 575 H HD2 . LYS A1 1 38 ? -19.042 3.15 -17.893 1.0 31.44 38 A 3 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.756 3.035 -16.155 1.0 51.13 38 A 3 -ATOM 577 H HE2 . LYS A1 1 38 ? -20.056 0.678 -17.288 1.0 72.24 38 A 3 -ATOM 578 H HE3 . LYS A1 1 38 ? -18.461 0.996 -17.969 1.0 52.14 38 A 3 -ATOM 579 H HZ1 . LYS A1 1 38 ? -19.198 0.372 -15.19 1.0 12.21 38 A 3 -ATOM 580 H HZ2 . LYS A1 1 38 ? -17.795 1.266 -15.499 1.0 31.3 38 A 3 -ATOM 581 H HZ3 . LYS A1 1 38 ? -17.968 -0.288 -16.146 1.0 72.13 38 A 3 -ATOM 582 N N . GLU A1 1 39 ? -24.173 2.736 -19.679 1.0 74.33 39 A 3 -ATOM 583 C CA . GLU A1 1 39 ? -25.579 3.029 -19.929 1.0 31.43 39 A 3 -ATOM 584 C C . GLU A1 1 39 ? -26.073 2.302 -21.178 1.0 55.55 39 A 3 -ATOM 585 O O . GLU A1 1 39 ? -27.069 1.581 -21.137 1.0 44.25 39 A 3 -ATOM 586 C CB . GLU A1 1 39 ? -25.789 4.536 -20.087 1.0 31.12 39 A 3 -ATOM 587 C CG . GLU A1 1 39 ? -24.713 5.217 -20.916 1.0 22.34 39 A 3 -ATOM 588 C CD . GLU A1 1 39 ? -24.791 6.73 -20.844 1.0 34.02 39 A 3 -ATOM 589 O OE1 . GLU A1 1 39 ? -25.874 7.253 -20.506 1.0 60.52 39 A 3 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.769 7.39 -21.126 1.0 24.54 39 A 3 -ATOM 591 H H . GLU A1 1 39 ? -23.499 3.041 -20.321 1.0 53.12 39 A 3 -ATOM 592 H HA . GLU A1 1 39 ? -26.147 2.683 -19.079 1.0 24.23 39 A 3 -ATOM 593 H HB2 . GLU A1 1 39 ? -26.744 4.707 -20.563 1.0 13.32 39 A 3 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.8 4.99 -19.107 1.0 53.15 39 A 3 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.745 4.905 -20.553 1.0 73.51 39 A 3 -ATOM 596 H HG3 . GLU A1 1 39 ? -24.824 4.914 -21.946 1.0 55.55 39 A 3 -ATOM 597 N N . GLY A1 1 40 ? -25.367 2.499 -22.288 1.0 41.31 40 A 3 -ATOM 598 C CA . GLY A1 1 40 ? -25.748 1.858 -23.532 1.0 23.2 40 A 3 -ATOM 599 C C . GLY A1 1 40 ? -25.929 2.849 -24.664 1.0 54.31 40 A 3 -ATOM 600 O O . GLY A1 1 40 ? -26.94 2.822 -25.367 1.0 62.35 40 A 3 -ATOM 601 H H . GLY A1 1 40 ? -24.582 3.085 -22.261 1.0 1.31 40 A 3 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.982 1.148 -23.808 1.0 42.33 40 A 3 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.678 1.328 -23.381 1.0 42.25 40 A 3 -ATOM 604 N N . ILE A1 1 41 ? -24.948 3.729 -24.84 1.0 11.45 41 A 3 -ATOM 605 C CA . ILE A1 1 41 ? -25.005 4.734 -25.895 1.0 13.21 41 A 3 -ATOM 606 C C . ILE A1 1 41 ? -23.827 4.591 -26.853 1.0 73.14 41 A 3 -ATOM 607 O O . ILE A1 1 41 ? -22.771 4.063 -26.505 1.0 54.03 41 A 3 -ATOM 608 C CB . ILE A1 1 41 ? -25.009 6.16 -25.313 1.0 13.54 41 A 3 -ATOM 609 C CG1 . ILE A1 1 41 ? -23.926 6.301 -24.242 1.0 35.25 41 A 3 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.378 6.492 -24.737 1.0 15.54 41 A 3 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.074 7.541 -24.404 1.0 51.21 41 A 3 -ATOM 612 H H . ILE A1 1 41 ? -24.169 3.7 -24.248 1.0 10.31 41 A 3 -ATOM 613 H HA . ILE A1 1 41 ? -25.923 4.588 -26.445 1.0 22.4 41 A 3 -ATOM 614 H HB . ILE A1 1 41 ? -24.805 6.852 -26.115 1.0 2.22 41 A 3 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.392 6.344 -23.271 1.0 53.25 41 A 3 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.273 5.441 -24.286 1.0 73.21 41 A 3 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.369 6.325 -23.67 1.0 41.34 41 A 3 -ATOM 618 H HG22 . ILE A1 1 41 ? -26.61 7.528 -24.936 1.0 35.01 41 A 3 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.124 5.861 -25.194 1.0 24.24 41 A 3 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.362 8.274 -23.663 1.0 13.35 41 A 3 -ATOM 621 H HD12 . ILE A1 1 41 ? -22.034 7.284 -24.269 1.0 5.02 41 A 3 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.22 7.952 -25.391 1.0 73.01 41 A 3 -ATOM 623 N N . PRO A1 1 42 ? -24.01 5.076 -28.091 1.0 42.01 42 A 3 -ATOM 624 C CA . PRO A1 1 42 ? -22.973 5.016 -29.125 1.0 63.34 42 A 3 -ATOM 625 C C . PRO A1 1 42 ? -21.803 5.948 -28.827 1.0 4.23 42 A 3 -ATOM 626 O O . PRO A1 1 42 ? -21.939 7.172 -28.822 1.0 21.54 42 A 3 -ATOM 627 C CB . PRO A1 1 42 ? -23.707 5.467 -30.39 1.0 63.45 42 A 3 -ATOM 628 C CG . PRO A1 1 42 ? -24.832 6.31 -29.895 1.0 31.23 42 A 3 -ATOM 629 C CD . PRO A1 1 42 ? -25.243 5.719 -28.575 1.0 52.22 42 A 3 -ATOM 630 H HA . PRO A1 1 42 ? -22.604 4.01 -29.26 1.0 60.32 42 A 3 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.034 6.034 -31.017 1.0 50.23 42 A 3 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.068 4.604 -30.928 1.0 64.01 42 A 3 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.497 7.328 -29.762 1.0 0.11 42 A 3 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.653 6.273 -30.595 1.0 1.1 42 A 3 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.565 6.495 -27.897 1.0 11.32 42 A 3 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.027 4.99 -28.716 1.0 34.03 42 A 3 -ATOM 637 N N . PRO A1 1 43 ? -20.626 5.359 -28.572 1.0 1.41 43 A 3 -ATOM 638 C CA . PRO A1 1 43 ? -19.409 6.119 -28.27 1.0 62.53 43 A 3 -ATOM 639 C C . PRO A1 1 43 ? -18.88 6.873 -29.485 1.0 21.35 43 A 3 -ATOM 640 O O . PRO A1 1 43 ? -18.226 7.908 -29.348 1.0 73.42 43 A 3 -ATOM 641 C CB . PRO A1 1 43 ? -18.415 5.039 -27.837 1.0 74.43 43 A 3 -ATOM 642 C CG . PRO A1 1 43 ? -18.892 3.795 -28.503 1.0 42.11 43 A 3 -ATOM 643 C CD . PRO A1 1 43 ? -20.391 3.905 -28.561 1.0 32.53 43 A 3 -ATOM 644 H HA . PRO A1 1 43 ? -19.566 6.813 -27.457 1.0 3.1 43 A 3 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.421 5.308 -28.166 1.0 1.2 43 A 3 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.43 4.941 -26.762 1.0 52.2 43 A 3 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.482 3.731 -29.499 1.0 21.5 43 A 3 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.603 2.932 -27.921 1.0 41.32 43 A 3 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.769 3.447 -29.463 1.0 55.24 43 A 3 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.837 3.45 -27.689 1.0 31.14 43 A 3 -ATOM 651 N N . ASP A1 1 44 ? -19.167 6.35 -30.671 1.0 54.12 44 A 3 -ATOM 652 C CA . ASP A1 1 44 ? -18.721 6.976 -31.911 1.0 51.34 44 A 3 -ATOM 653 C C . ASP A1 1 44 ? -19.593 8.178 -32.257 1.0 65.34 44 A 3 -ATOM 654 O O . ASP A1 1 44 ? -19.22 9.009 -33.085 1.0 41.23 44 A 3 -ATOM 655 C CB . ASP A1 1 44 ? -18.748 5.963 -33.057 1.0 23.35 44 A 3 -ATOM 656 C CG . ASP A1 1 44 ? -17.963 6.435 -34.265 1.0 52.14 44 A 3 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.892 7.049 -34.074 1.0 70.43 44 A 3 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.418 6.188 -35.401 1.0 15.14 44 A 3 -ATOM 659 H H . ASP A1 1 44 ? -19.692 5.523 -30.715 1.0 64.31 44 A 3 -ATOM 660 H HA . ASP A1 1 44 ? -17.706 7.313 -31.765 1.0 72.42 44 A 3 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.322 5.031 -32.715 1.0 64.21 44 A 3 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.772 5.798 -33.358 1.0 74.33 44 A 3 -ATOM 663 N N . GLN A1 1 45 ? -20.756 8.263 -31.619 1.0 24.51 45 A 3 -ATOM 664 C CA . GLN A1 1 45 ? -21.682 9.363 -31.861 1.0 55.1 45 A 3 -ATOM 665 C C . GLN A1 1 45 ? -21.584 10.41 -30.757 1.0 65.33 45 A 3 -ATOM 666 O O . GLN A1 1 45 ? -22.113 11.514 -30.887 1.0 0.12 45 A 3 -ATOM 667 C CB . GLN A1 1 45 ? -23.115 8.839 -31.957 1.0 3.33 45 A 3 -ATOM 668 C CG . GLN A1 1 45 ? -23.515 8.413 -33.361 1.0 71.05 45 A 3 -ATOM 669 C CD . GLN A1 1 45 ? -24.592 7.347 -33.363 1.0 50.21 45 A 3 -ATOM 670 O OE1 . GLN A1 1 45 ? -25.745 7.612 -33.023 1.0 30.33 45 A 3 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.221 6.131 -33.749 1.0 54.11 45 A 3 -ATOM 672 H H . GLN A1 1 45 ? -20.997 7.569 -30.97 1.0 33.14 45 A 3 -ATOM 673 H HA . GLN A1 1 45 ? -21.412 9.822 -32.8 1.0 54.13 45 A 3 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.219 7.987 -31.303 1.0 72.22 45 A 3 -ATOM 675 H HB3 . GLN A1 1 45 ? -23.792 9.616 -31.634 1.0 51.24 45 A 3 -ATOM 676 H HG2 . GLN A1 1 45 ? -23.884 9.277 -33.894 1.0 11.31 45 A 3 -ATOM 677 H HG3 . GLN A1 1 45 ? -22.643 8.025 -33.867 1.0 33.23 45 A 3 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.285 5.993 -34.005 1.0 35.4 45 A 3 -ATOM 679 H HE22 . GLN A1 1 45 ? -24.897 5.423 -33.759 1.0 53.4 45 A 3 -ATOM 680 N N . GLN A1 1 46 ? -20.904 10.057 -29.671 1.0 5.34 46 A 3 -ATOM 681 C CA . GLN A1 1 46 ? -20.738 10.967 -28.544 1.0 54.21 46 A 3 -ATOM 682 C C . GLN A1 1 46 ? -19.317 11.52 -28.496 1.0 23.33 46 A 3 -ATOM 683 O O . GLN A1 1 46 ? -18.389 10.924 -29.042 1.0 42.0 46 A 3 -ATOM 684 C CB . GLN A1 1 46 ? -21.064 10.252 -27.232 1.0 54.1 46 A 3 -ATOM 685 C CG . GLN A1 1 46 ? -20.028 9.213 -26.831 1.0 63.33 46 A 3 -ATOM 686 C CD . GLN A1 1 46 ? -19.19 9.652 -25.647 1.0 73.34 46 A 3 -ATOM 687 O OE1 . GLN A1 1 46 ? -18.213 10.386 -25.802 1.0 62.34 46 A 3 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.567 9.205 -24.455 1.0 52.51 46 A 3 -ATOM 689 H H . GLN A1 1 46 ? -20.505 9.163 -29.627 1.0 61.13 46 A 3 -ATOM 690 H HA . GLN A1 1 46 ? -21.426 11.787 -28.677 1.0 1.54 46 A 3 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.131 10.985 -26.443 1.0 70.34 46 A 3 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.018 9.756 -27.333 1.0 24.41 46 A 3 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.538 8.297 -26.571 1.0 71.34 46 A 3 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.374 9.034 -27.671 1.0 12.44 46 A 3 -ATOM 695 H HE21 . GLN A1 1 46 ? -20.355 8.623 -24.408 1.0 61.21 46 A 3 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.043 9.472 -23.673 1.0 54.41 46 A 3 -ATOM 697 N N . ARG A1 1 47 ? -19.155 12.664 -27.839 1.0 11.31 47 A 3 -ATOM 698 C CA . ARG A1 1 47 ? -17.848 13.299 -27.721 1.0 74.42 47 A 3 -ATOM 699 C C . ARG A1 1 47 ? -17.712 14.019 -26.383 1.0 0.05 47 A 3 -ATOM 700 O O . ARG A1 1 47 ? -18.707 14.297 -25.711 1.0 62.43 47 A 3 -ATOM 701 C CB . ARG A1 1 47 ? -17.633 14.288 -28.868 1.0 53.24 47 A 3 -ATOM 702 C CG . ARG A1 1 47 ? -17.167 13.633 -30.158 1.0 25.13 47 A 3 -ATOM 703 C CD . ARG A1 1 47 ? -18.297 13.531 -31.171 1.0 74.31 47 A 3 -ATOM 704 N NE . ARG A1 1 47 ? -17.842 12.987 -32.447 1.0 72.02 47 A 3 -ATOM 705 C CZ . ARG A1 1 47 ? -18.523 13.104 -33.581 1.0 4.33 47 A 3 -ATOM 706 N NH1 . ARG A1 1 47 ? -19.685 13.743 -33.598 1.0 22.33 47 A 3 -ATOM 707 N NH2 . ARG A1 1 47 ? -18.042 12.582 -34.703 1.0 24.44 47 A 3 -ATOM 708 H H . ARG A1 1 47 ? -19.934 13.092 -27.425 1.0 14.32 47 A 3 -ATOM 709 H HA . ARG A1 1 47 ? -17.097 12.526 -27.779 1.0 52.1 47 A 3 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.563 14.801 -29.066 1.0 12.43 47 A 3 -ATOM 711 H HB3 . ARG A1 1 47 ? -16.889 15.011 -28.569 1.0 31.22 47 A 3 -ATOM 712 H HG2 . ARG A1 1 47 ? -16.37 14.223 -30.584 1.0 2.15 47 A 3 -ATOM 713 H HG3 . ARG A1 1 47 ? -16.804 12.64 -29.936 1.0 3.22 47 A 3 -ATOM 714 H HD2 . ARG A1 1 47 ? -19.065 12.886 -30.77 1.0 62.34 47 A 3 -ATOM 715 H HD3 . ARG A1 1 47 ? -18.705 14.517 -31.335 1.0 4.32 47 A 3 -ATOM 716 H HE . ARG A1 1 47 ? -16.986 12.511 -32.458 1.0 51.12 47 A 3 -ATOM 717 H HH11 . ARG A1 1 47 ? -20.049 14.138 -32.754 1.0 35.02 47 A 3 -ATOM 718 H HH12 . ARG A1 1 47 ? -20.195 13.831 -34.453 1.0 42.25 47 A 3 -ATOM 719 H HH21 . ARG A1 1 47 ? -17.167 12.1 -34.694 1.0 32.54 47 A 3 -ATOM 720 H HH22 . ARG A1 1 47 ? -18.556 12.671 -35.555 1.0 51.04 47 A 3 -ATOM 721 N N . LEU A1 1 48 ? -16.475 14.317 -26.0 1.0 13.42 48 A 3 -ATOM 722 C CA . LEU A1 1 48 ? -16.208 15.004 -24.742 1.0 63.04 48 A 3 -ATOM 723 C C . LEU A1 1 48 ? -15.834 16.463 -24.986 1.0 70.54 48 A 3 -ATOM 724 O O . LEU A1 1 48 ? -15.233 16.796 -26.007 1.0 13.22 48 A 3 -ATOM 725 C CB . LEU A1 1 48 ? -15.085 14.298 -23.981 1.0 73.22 48 A 3 -ATOM 726 C CG . LEU A1 1 48 ? -15.03 12.777 -24.125 1.0 23.01 48 A 3 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.431 12.186 -24.088 1.0 2.23 48 A 3 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.319 12.388 -25.413 1.0 62.5 48 A 3 -ATOM 729 H H . LEU A1 1 48 ? -15.724 14.07 -26.578 1.0 13.1 48 A 3 -ATOM 730 H HA . LEU A1 1 48 ? -17.11 14.971 -24.148 1.0 5.14 48 A 3 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.146 14.697 -24.332 1.0 14.35 48 A 3 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.202 14.528 -22.931 1.0 62.22 48 A 3 -ATOM 733 H HG . LEU A1 1 48 ? -14.472 12.363 -23.296 1.0 74.12 48 A 3 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.088 12.851 -23.548 1.0 72.12 48 A 3 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.404 11.226 -23.593 1.0 51.52 48 A 3 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.795 12.06 -25.097 1.0 50.13 48 A 3 -ATOM 737 H HD21 . LEU A1 1 48 ? -15.047 12.243 -26.196 1.0 32.51 48 A 3 -ATOM 738 H HD22 . LEU A1 1 48 ? -13.769 11.472 -25.257 1.0 4.35 48 A 3 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.635 13.174 -25.697 1.0 44.23 48 A 3 -ATOM 740 N N . ILE A1 1 49 ? -16.192 17.326 -24.041 1.0 13.31 49 A 3 -ATOM 741 C CA . ILE A1 1 49 ? -15.891 18.748 -24.153 1.0 13.25 49 A 3 -ATOM 742 C C . ILE A1 1 49 ? -15.462 19.326 -22.808 1.0 73.24 49 A 3 -ATOM 743 O O . ILE A1 1 49 ? -16.151 19.16 -21.801 1.0 20.41 49 A 3 -ATOM 744 C CB . ILE A1 1 49 ? -17.102 19.541 -24.678 1.0 42.12 49 A 3 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.232 19.373 -26.193 1.0 21.4 49 A 3 -ATOM 746 C CG2 . ILE A1 1 49 ? -16.972 21.011 -24.311 1.0 44.11 49 A 3 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.548 18.764 -26.623 1.0 30.32 49 A 3 -ATOM 748 H H . ILE A1 1 49 ? -16.669 16.999 -23.251 1.0 11.12 49 A 3 -ATOM 749 H HA . ILE A1 1 49 ? -15.079 18.862 -24.857 1.0 31.54 49 A 3 -ATOM 750 H HB . ILE A1 1 49 ? -17.991 19.154 -24.202 1.0 10.22 49 A 3 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.144 20.339 -26.665 1.0 52.53 49 A 3 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.437 18.731 -26.545 1.0 23.14 49 A 3 -ATOM 753 H HG21 . ILE A1 1 49 ? -15.927 21.287 -24.295 1.0 54.41 49 A 3 -ATOM 754 H HG22 . ILE A1 1 49 ? -17.49 21.612 -25.044 1.0 2.4 49 A 3 -ATOM 755 H HG23 . ILE A1 1 49 ? -17.403 21.18 -23.336 1.0 53.42 49 A 3 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.209 19.545 -26.971 1.0 43.14 49 A 3 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.374 18.059 -27.422 1.0 61.33 49 A 3 -ATOM 758 H HD13 . ILE A1 1 49 ? -19.001 18.256 -25.785 1.0 3.14 49 A 3 -ATOM 759 N N . PHE A1 1 50 ? -14.322 20.007 -22.8 1.0 0.44 50 A 3 -ATOM 760 C CA . PHE A1 1 50 ? -13.801 20.612 -21.579 1.0 63.4 50 A 3 -ATOM 761 C C . PHE A1 1 50 ? -13.689 22.127 -21.727 1.0 34.31 50 A 3 -ATOM 762 O O . PHE A1 1 50 ? -12.837 22.628 -22.459 1.0 24.03 50 A 3 -ATOM 763 C CB . PHE A1 1 50 ? -12.433 20.019 -21.234 1.0 1.31 50 A 3 -ATOM 764 C CG . PHE A1 1 50 ? -11.946 20.393 -19.864 1.0 63.44 50 A 3 -ATOM 765 C CD1 . PHE A1 1 50 ? -11.226 21.56 -19.664 1.0 63.22 50 A 3 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.209 19.578 -18.774 1.0 31.12 50 A 3 -ATOM 767 C CE1 . PHE A1 1 50 ? -10.776 21.906 -18.404 1.0 44.05 50 A 3 -ATOM 768 C CE2 . PHE A1 1 50 ? -11.762 19.919 -17.512 1.0 53.14 50 A 3 -ATOM 769 C CZ . PHE A1 1 50 ? -11.046 21.085 -17.326 1.0 64.24 50 A 3 -ATOM 770 H H . PHE A1 1 50 ? -13.817 20.106 -23.635 1.0 32.43 50 A 3 -ATOM 771 H HA . PHE A1 1 50 ? -14.492 20.391 -20.78 1.0 55.42 50 A 3 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.493 18.942 -21.282 1.0 72.21 50 A 3 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.707 20.368 -21.953 1.0 52.42 50 A 3 -ATOM 774 H HD1 . PHE A1 1 50 ? -11.016 22.203 -20.506 1.0 64.41 50 A 3 -ATOM 775 H HD2 . PHE A1 1 50 ? -12.77 18.665 -18.919 1.0 25.0 50 A 3 -ATOM 776 H HE1 . PHE A1 1 50 ? -10.217 22.818 -18.261 1.0 33.34 50 A 3 -ATOM 777 H HE2 . PHE A1 1 50 ? -11.975 19.275 -16.671 1.0 34.14 50 A 3 -ATOM 778 H HZ . PHE A1 1 50 ? -10.695 21.353 -16.341 1.0 42.2 50 A 3 -ATOM 779 N N . GLY A1 1 51 ? -14.557 22.85 -21.026 1.0 53.44 51 A 3 -ATOM 780 C CA . GLY A1 1 51 ? -14.54 24.299 -21.094 1.0 33.5 51 A 3 -ATOM 781 C C . GLY A1 1 51 ? -15.101 24.826 -22.4 1.0 34.32 51 A 3 -ATOM 782 O O . GLY A1 1 51 ? -15.214 26.036 -22.592 1.0 0.02 51 A 3 -ATOM 783 H H . GLY A1 1 51 ? -15.215 22.395 -20.459 1.0 14.34 51 A 3 -ATOM 784 H HA2 . GLY A1 1 51 ? -15.126 24.694 -20.277 1.0 71.3 51 A 3 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.521 24.641 -20.99 1.0 2.33 51 A 3 -ATOM 786 N N . GLY A1 1 52 ? -15.453 23.914 -23.301 1.0 51.33 52 A 3 -ATOM 787 C CA . GLY A1 1 52 ? -16.0 24.313 -24.585 1.0 70.11 52 A 3 -ATOM 788 C C . GLY A1 1 52 ? -15.309 23.627 -25.748 1.0 64.35 52 A 3 -ATOM 789 O O . GLY A1 1 52 ? -15.89 23.473 -26.822 1.0 21.12 52 A 3 -ATOM 790 H H . GLY A1 1 52 ? -15.34 22.963 -23.093 1.0 52.33 52 A 3 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.051 24.067 -24.609 1.0 34.31 52 A 3 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.888 25.382 -24.695 1.0 33.12 52 A 3 -ATOM 793 N N . LYS A1 1 53 ? -14.063 23.217 -25.535 1.0 4.12 53 A 3 -ATOM 794 C CA . LYS A1 1 53 ? -13.291 22.544 -26.572 1.0 20.15 53 A 3 -ATOM 795 C C . LYS A1 1 53 ? -13.431 21.029 -26.459 1.0 12.34 53 A 3 -ATOM 796 O O . LYS A1 1 53 ? -13.539 20.488 -25.36 1.0 53.3 53 A 3 -ATOM 797 C CB . LYS A1 1 53 ? -11.816 22.939 -26.476 1.0 12.13 53 A 3 -ATOM 798 C CG . LYS A1 1 53 ? -11.189 22.626 -25.128 1.0 34.42 53 A 3 -ATOM 799 C CD . LYS A1 1 53 ? -10.53 21.257 -25.124 1.0 44.0 53 A 3 -ATOM 800 C CE . LYS A1 1 53 ? -9.364 21.197 -26.098 1.0 75.53 53 A 3 -ATOM 801 N NZ . LYS A1 1 53 ? -8.083 20.874 -25.41 1.0 61.53 53 A 3 -ATOM 802 H H . LYS A1 1 53 ? -13.654 23.369 -24.657 1.0 32.12 53 A 3 -ATOM 803 H HA . LYS A1 1 53 ? -13.677 22.859 -27.53 1.0 74.23 53 A 3 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.263 22.41 -27.238 1.0 34.02 53 A 3 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.728 24.002 -26.652 1.0 32.22 53 A 3 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.442 23.374 -24.906 1.0 24.24 53 A 3 -ATOM 807 H HG3 . LYS A1 1 53 ? -11.959 22.648 -24.37 1.0 53.0 53 A 3 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.166 21.045 -24.13 1.0 22.42 53 A 3 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.263 20.514 -25.407 1.0 0.05 53 A 3 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.567 20.437 -26.837 1.0 25.2 53 A 3 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.269 22.156 -26.585 1.0 75.24 53 A 3 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.379 21.615 -25.598 1.0 1.33 53 A 3 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.713 19.964 -25.754 1.0 14.14 53 A 3 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.235 20.807 -24.384 1.0 31.25 53 A 3 -ATOM 815 N N . GLN A1 1 54 ? -13.425 20.352 -27.603 1.0 32.1 54 A 3 -ATOM 816 C CA . GLN A1 1 54 ? -13.551 18.9 -27.631 1.0 3.14 54 A 3 -ATOM 817 C C . GLN A1 1 54 ? -12.284 18.234 -27.103 1.0 14.5 54 A 3 -ATOM 818 O O . GLN A1 1 54 ? -11.233 18.868 -27.0 1.0 22.04 54 A 3 -ATOM 819 C CB . GLN A1 1 54 ? -13.839 18.419 -29.054 1.0 14.03 54 A 3 -ATOM 820 C CG . GLN A1 1 54 ? -15.311 18.145 -29.317 1.0 52.41 54 A 3 -ATOM 821 C CD . GLN A1 1 54 ? -16.086 19.401 -29.664 1.0 44.23 54 A 3 -ATOM 822 O OE1 . GLN A1 1 54 ? -15.742 20.497 -29.222 1.0 25.33 54 A 3 -ATOM 823 N NE2 . GLN A1 1 54 ? -17.138 19.247 -30.459 1.0 63.1 54 A 3 -ATOM 824 H H . GLN A1 1 54 ? -13.335 20.84 -28.447 1.0 52.11 54 A 3 -ATOM 825 H HA . GLN A1 1 54 ? -14.378 18.626 -26.994 1.0 62.04 54 A 3 -ATOM 826 H HB2 . GLN A1 1 54 ? -13.505 19.173 -29.751 1.0 31.24 54 A 3 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.288 17.507 -29.231 1.0 25.42 54 A 3 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.393 17.451 -30.141 1.0 52.11 54 A 3 -ATOM 829 H HG3 . GLN A1 1 54 ? -15.745 17.704 -28.432 1.0 53.52 54 A 3 -ATOM 830 H HE21 . GLN A1 1 54 ? -17.353 18.343 -30.772 1.0 45.55 54 A 3 -ATOM 831 H HE22 . GLN A1 1 54 ? -17.657 20.042 -30.698 1.0 62.42 54 A 3 -ATOM 832 N N . LEU A1 1 55 ? -12.391 16.952 -26.77 1.0 51.34 55 A 3 -ATOM 833 C CA . LEU A1 1 55 ? -11.253 16.199 -26.252 1.0 40.45 55 A 3 -ATOM 834 C C . LEU A1 1 55 ? -10.889 15.051 -27.187 1.0 63.5 55 A 3 -ATOM 835 O O . LEU A1 1 55 ? -11.736 14.228 -27.534 1.0 52.11 55 A 3 -ATOM 836 C CB . LEU A1 1 55 ? -11.569 15.656 -24.857 1.0 25.03 55 A 3 -ATOM 837 C CG . LEU A1 1 55 ? -12.143 16.662 -23.859 1.0 41.33 55 A 3 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.258 16.037 -22.478 1.0 33.24 55 A 3 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.282 17.916 -23.81 1.0 52.23 55 A 3 -ATOM 840 H H . LEU A1 1 55 ? -13.253 16.501 -26.875 1.0 12.34 55 A 3 -ATOM 841 H HA . LEU A1 1 55 ? -10.412 16.874 -26.186 1.0 22.21 55 A 3 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.284 14.856 -24.968 1.0 55.1 55 A 3 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.652 15.263 -24.442 1.0 51.11 55 A 3 -ATOM 844 H HG . LEU A1 1 55 ? -13.135 16.95 -24.178 1.0 72.12 55 A 3 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.487 15.292 -22.355 1.0 32.04 55 A 3 -ATOM 846 H HD12 . LEU A1 1 55 ? -13.227 15.573 -22.372 1.0 44.35 55 A 3 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.142 16.804 -21.725 1.0 32.21 55 A 3 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.149 18.221 -22.783 1.0 33.14 55 A 3 -ATOM 849 H HD22 . LEU A1 1 55 ? -11.766 18.707 -24.362 1.0 72.01 55 A 3 -ATOM 850 H HD23 . LEU A1 1 55 ? -10.318 17.707 -24.251 1.0 74.33 55 A 3 -ATOM 851 N N . GLU A1 1 56 ? -9.624 15.001 -27.591 1.0 12.02 56 A 3 -ATOM 852 C CA . GLU A1 1 56 ? -9.148 13.952 -28.485 1.0 31.33 56 A 3 -ATOM 853 C C . GLU A1 1 56 ? -9.199 12.589 -27.8 1.0 62.51 56 A 3 -ATOM 854 O O . GLU A1 1 56 ? -9.637 12.474 -26.655 1.0 51.02 56 A 3 -ATOM 855 C CB . GLU A1 1 56 ? -7.719 14.251 -28.944 1.0 62.01 56 A 3 -ATOM 856 C CG . GLU A1 1 56 ? -7.495 14.017 -30.428 1.0 21.02 56 A 3 -ATOM 857 C CD . GLU A1 1 56 ? -7.252 15.304 -31.191 1.0 1.0 56 A 3 -ATOM 858 O OE1 . GLU A1 1 56 ? -8.238 16.006 -31.502 1.0 61.34 56 A 3 -ATOM 859 O OE2 . GLU A1 1 56 ? -6.076 15.611 -31.477 1.0 22.01 56 A 3 -ATOM 860 H H . GLU A1 1 56 ? -8.995 15.686 -27.28 1.0 72.43 56 A 3 -ATOM 861 H HA . GLU A1 1 56 ? -9.797 13.932 -29.347 1.0 4.21 56 A 3 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.492 15.284 -28.724 1.0 41.11 56 A 3 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.038 13.617 -28.394 1.0 51.02 56 A 3 -ATOM 864 H HG2 . GLU A1 1 56 ? -6.636 13.375 -30.553 1.0 71.31 56 A 3 -ATOM 865 H HG3 . GLU A1 1 56 ? -8.369 13.531 -30.839 1.0 60.44 56 A 3 -ATOM 866 N N . ASP A1 1 57 ? -8.749 11.56 -28.509 1.0 71.03 57 A 3 -ATOM 867 C CA . ASP A1 1 57 ? -8.743 10.205 -27.971 1.0 63.41 57 A 3 -ATOM 868 C C . ASP A1 1 57 ? -7.662 10.048 -26.905 1.0 21.4 57 A 3 -ATOM 869 O O . ASP A1 1 57 ? -7.703 9.121 -26.097 1.0 43.31 57 A 3 -ATOM 870 C CB . ASP A1 1 57 ? -8.521 9.189 -29.092 1.0 45.31 57 A 3 -ATOM 871 C CG . ASP A1 1 57 ? -9.358 9.49 -30.32 1.0 55.43 57 A 3 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.462 10.052 -30.162 1.0 72.35 57 A 3 -ATOM 873 O OD2 . ASP A1 1 57 ? -8.909 9.164 -31.439 1.0 15.11 57 A 3 -ATOM 874 H H . ASP A1 1 57 ? -8.412 11.716 -29.417 1.0 23.12 57 A 3 -ATOM 875 H HA . ASP A1 1 57 ? -9.706 10.023 -27.518 1.0 62.14 57 A 3 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.479 9.199 -29.378 1.0 24.44 57 A 3 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.782 8.204 -28.734 1.0 64.03 57 A 3 -ATOM 878 N N . SER A1 1 58 ? -6.696 10.961 -26.911 1.0 32.51 58 A 3 -ATOM 879 C CA . SER A1 1 58 ? -5.602 10.922 -25.948 1.0 62.24 58 A 3 -ATOM 880 C C . SER A1 1 58 ? -5.72 12.064 -24.944 1.0 2.12 58 A 3 -ATOM 881 O O . SER A1 1 58 ? -4.85 12.251 -24.095 1.0 12.21 58 A 3 -ATOM 882 C CB . SER A1 1 58 ? -4.255 11.0 -26.671 1.0 65.11 58 A 3 -ATOM 883 O OG . SER A1 1 58 ? -3.179 10.86 -25.76 1.0 34.21 58 A 3 -ATOM 884 H H . SER A1 1 58 ? -6.719 11.676 -27.581 1.0 21.03 58 A 3 -ATOM 885 H HA . SER A1 1 58 ? -5.661 9.983 -25.417 1.0 33.55 58 A 3 -ATOM 886 H HB2 . SER A1 1 58 ? -4.196 10.21 -27.404 1.0 31.42 58 A 3 -ATOM 887 H HB3 . SER A1 1 58 ? -4.171 11.957 -27.165 1.0 40.4 58 A 3 -ATOM 888 H HG . SER A1 1 58 ? -2.676 11.677 -25.73 1.0 10.23 58 A 3 -ATOM 889 N N . ASN A1 1 59 ? -6.804 12.826 -25.05 1.0 35.41 59 A 3 -ATOM 890 C CA . ASN A1 1 59 ? -7.038 13.951 -24.152 1.0 52.34 59 A 3 -ATOM 891 C C . ASN A1 1 59 ? -7.588 13.472 -22.811 1.0 4.01 59 A 3 -ATOM 892 O O . ASN A1 1 59 ? -8.797 13.492 -22.582 1.0 42.21 59 A 3 -ATOM 893 C CB . ASN A1 1 59 ? -8.011 14.945 -24.789 1.0 21.1 59 A 3 -ATOM 894 C CG . ASN A1 1 59 ? -7.298 16.029 -25.575 1.0 14.54 59 A 3 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.49 15.74 -26.459 1.0 24.42 59 A 3 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.593 17.283 -25.256 1.0 14.44 59 A 3 -ATOM 897 H H . ASN A1 1 59 ? -7.463 12.627 -25.748 1.0 5.51 59 A 3 -ATOM 898 H HA . ASN A1 1 59 ? -6.092 14.443 -23.984 1.0 74.51 59 A 3 -ATOM 899 H HB2 . ASN A1 1 59 ? -8.67 14.415 -25.461 1.0 43.43 59 A 3 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.596 15.415 -24.013 1.0 11.21 59 A 3 -ATOM 901 H HD21 . ASN A1 1 59 ? -8.246 17.438 -24.541 1.0 21.33 59 A 3 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.147 18.003 -25.749 1.0 12.0 59 A 3 -ATOM 903 N N . ALA A1 1 60 ? -6.691 13.044 -21.929 1.0 13.11 60 A 3 -ATOM 904 C CA . ALA A1 1 60 ? -7.086 12.563 -20.611 1.0 35.51 60 A 3 -ATOM 905 C C . ALA A1 1 60 ? -5.865 12.232 -19.759 1.0 74.01 60 A 3 -ATOM 906 O O . ALA A1 1 60 ? -5.367 13.077 -19.016 1.0 74.24 60 A 3 -ATOM 907 C CB . ALA A1 1 60 ? -7.986 11.343 -20.742 1.0 64.13 60 A 3 -ATOM 908 H H . ALA A1 1 60 ? -5.741 13.052 -22.17 1.0 31.12 60 A 3 -ATOM 909 H HA . ALA A1 1 60 ? -7.65 13.346 -20.125 1.0 20.01 60 A 3 -ATOM 910 H HB1 . ALA A1 1 60 ? -7.531 10.632 -21.416 1.0 72.33 60 A 3 -ATOM 911 H HB2 . ALA A1 1 60 ? -8.119 10.888 -19.772 1.0 25.02 60 A 3 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.947 11.646 -21.132 1.0 51.02 60 A 3 -ATOM 913 N N . MET A1 1 61 ? -5.388 10.996 -19.871 1.0 21.52 61 A 3 -ATOM 914 C CA . MET A1 1 61 ? -4.224 10.555 -19.111 1.0 32.03 61 A 3 -ATOM 915 C C . MET A1 1 61 ? -3.029 11.468 -19.367 1.0 55.14 61 A 3 -ATOM 916 O O . MET A1 1 61 ? -2.378 11.93 -18.431 1.0 73.23 61 A 3 -ATOM 917 C CB . MET A1 1 61 ? -3.867 9.113 -19.476 1.0 33.12 61 A 3 -ATOM 918 C CG . MET A1 1 61 ? -4.115 8.777 -20.938 1.0 10.31 61 A 3 -ATOM 919 S SD . MET A1 1 61 ? -2.845 7.699 -21.628 1.0 3.45 61 A 3 -ATOM 920 C CE . MET A1 1 61 ? -1.969 8.845 -22.691 1.0 11.34 61 A 3 -ATOM 921 H H . MET A1 1 61 ? -5.828 10.367 -20.48 1.0 44.35 61 A 3 -ATOM 922 H HA . MET A1 1 61 ? -4.478 10.599 -18.063 1.0 14.21 61 A 3 -ATOM 923 H HB2 . MET A1 1 61 ? -2.821 8.949 -19.264 1.0 14.23 61 A 3 -ATOM 924 H HB3 . MET A1 1 61 ? -4.459 8.443 -18.871 1.0 0.24 61 A 3 -ATOM 925 H HG2 . MET A1 1 61 ? -5.071 8.282 -21.023 1.0 62.14 61 A 3 -ATOM 926 H HG3 . MET A1 1 61 ? -4.136 9.696 -21.505 1.0 32.0 61 A 3 -ATOM 927 H HE1 . MET A1 1 61 ? -1.303 8.296 -23.34 1.0 54.23 61 A 3 -ATOM 928 H HE2 . MET A1 1 61 ? -2.68 9.397 -23.288 1.0 64.31 61 A 3 -ATOM 929 H HE3 . MET A1 1 61 ? -1.397 9.532 -22.085 1.0 24.11 61 A 3 -ATOM 930 N N . SER A1 1 62 ? -2.747 11.723 -20.641 1.0 73.15 62 A 3 -ATOM 931 C CA . SER A1 1 62 ? -1.628 12.577 -21.019 1.0 12.22 62 A 3 -ATOM 932 C C . SER A1 1 62 ? -1.967 14.048 -20.797 1.0 13.52 62 A 3 -ATOM 933 O O . SER A1 1 62 ? -1.098 14.854 -20.467 1.0 42.51 62 A 3 -ATOM 934 C CB . SER A1 1 62 ? -1.253 12.344 -22.484 1.0 62.33 62 A 3 -ATOM 935 O OG . SER A1 1 62 ? -0.843 13.551 -23.104 1.0 14.13 62 A 3 -ATOM 936 H H . SER A1 1 62 ? -3.304 11.325 -21.342 1.0 74.25 62 A 3 -ATOM 937 H HA . SER A1 1 62 ? -0.786 12.316 -20.395 1.0 74.15 62 A 3 -ATOM 938 H HB2 . SER A1 1 62 ? -0.444 11.633 -22.537 1.0 54.41 62 A 3 -ATOM 939 H HB3 . SER A1 1 62 ? -2.111 11.955 -23.014 1.0 23.45 62 A 3 -ATOM 940 H HG . SER A1 1 62 ? -1.36 13.694 -23.9 1.0 1.23 62 A 3 -ATOM 941 N N . ASP A1 1 63 ? -3.238 14.389 -20.981 1.0 34.33 63 A 3 -ATOM 942 C CA . ASP A1 1 63 ? -3.695 15.762 -20.8 1.0 10.21 63 A 3 -ATOM 943 C C . ASP A1 1 63 ? -3.372 16.262 -19.395 1.0 63.54 63 A 3 -ATOM 944 O O . ASP A1 1 63 ? -3.23 17.464 -19.17 1.0 31.33 63 A 3 -ATOM 945 C CB . ASP A1 1 63 ? -5.199 15.86 -21.056 1.0 21.1 63 A 3 -ATOM 946 C CG . ASP A1 1 63 ? -5.647 17.28 -21.344 1.0 12.2 63 A 3 -ATOM 947 O OD1 . ASP A1 1 63 ? -5.963 18.009 -20.381 1.0 53.24 63 A 3 -ATOM 948 O OD2 . ASP A1 1 63 ? -5.679 17.661 -22.532 1.0 3.13 63 A 3 -ATOM 949 H H . ASP A1 1 63 ? -3.885 13.701 -21.244 1.0 14.4 63 A 3 -ATOM 950 H HA . ASP A1 1 63 ? -3.176 16.381 -21.516 1.0 72.42 63 A 3 -ATOM 951 H HB2 . ASP A1 1 63 ? -5.454 15.243 -21.906 1.0 63.34 63 A 3 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.73 15.503 -20.186 1.0 44.51 63 A 3 -ATOM 953 N N . TYR A1 1 64 ? -3.26 15.331 -18.453 1.0 43.15 64 A 3 -ATOM 954 C CA . TYR A1 1 64 ? -2.957 15.677 -17.069 1.0 74.44 64 A 3 -ATOM 955 C C . TYR A1 1 64 ? -4.176 16.283 -16.381 1.0 35.31 64 A 3 -ATOM 956 O O . TYR A1 1 64 ? -4.058 16.931 -15.342 1.0 63.11 64 A 3 -ATOM 957 C CB . TYR A1 1 64 ? -1.785 16.657 -17.011 1.0 41.31 64 A 3 -ATOM 958 C CG . TYR A1 1 64 ? -0.67 16.213 -16.091 1.0 35.31 64 A 3 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.306 15.326 -16.528 1.0 10.21 64 A 3 -ATOM 960 C CD2 . TYR A1 1 64 ? -0.592 16.682 -14.785 1.0 61.0 64 A 3 -ATOM 961 C CE1 . TYR A1 1 64 ? 1.326 14.917 -15.69 1.0 31.32 64 A 3 -ATOM 962 C CE2 . TYR A1 1 64 ? 0.425 16.279 -13.941 1.0 3.01 64 A 3 -ATOM 963 C CZ . TYR A1 1 64 ? 1.381 15.396 -14.398 1.0 35.43 64 A 3 -ATOM 964 O OH . TYR A1 1 64 ? 2.396 14.993 -13.562 1.0 23.32 64 A 3 -ATOM 965 H H . TYR A1 1 64 ? -3.384 14.39 -18.694 1.0 10.22 64 A 3 -ATOM 966 H HA . TYR A1 1 64 ? -2.681 14.769 -16.554 1.0 40.51 64 A 3 -ATOM 967 H HB2 . TYR A1 1 64 ? -1.371 16.772 -18.001 1.0 75.32 64 A 3 -ATOM 968 H HB3 . TYR A1 1 64 ? -2.142 17.615 -16.662 1.0 32.34 64 A 3 -ATOM 969 H HD1 . TYR A1 1 64 ? 0.26 14.952 -17.541 1.0 1.35 64 A 3 -ATOM 970 H HD2 . TYR A1 1 64 ? -1.342 17.373 -14.43 1.0 32.41 64 A 3 -ATOM 971 H HE1 . TYR A1 1 64 ? 2.075 14.226 -16.048 1.0 52.21 64 A 3 -ATOM 972 H HE2 . TYR A1 1 64 ? 0.469 16.654 -12.929 1.0 43.14 64 A 3 -ATOM 973 H HH . TYR A1 1 64 ? 2.538 15.659 -12.885 1.0 23.33 64 A 3 -ATOM 974 N N . ASN A1 1 65 ? -5.348 16.068 -16.969 1.0 61.21 65 A 3 -ATOM 975 C CA . ASN A1 1 65 ? -6.591 16.593 -16.414 1.0 70.22 65 A 3 -ATOM 976 C C . ASN A1 1 65 ? -7.461 15.465 -15.867 1.0 21.44 65 A 3 -ATOM 977 O O . ASN A1 1 65 ? -8.652 15.651 -15.617 1.0 22.24 65 A 3 -ATOM 978 C CB . ASN A1 1 65 ? -7.36 17.375 -17.48 1.0 30.31 65 A 3 -ATOM 979 C CG . ASN A1 1 65 ? -8.171 16.471 -18.388 1.0 75.23 65 A 3 -ATOM 980 O OD1 . ASN A1 1 65 ? -7.685 15.438 -18.848 1.0 74.2 65 A 3 -ATOM 981 N ND2 . ASN A1 1 65 ? -9.414 16.857 -18.651 1.0 12.4 65 A 3 -ATOM 982 H H . ASN A1 1 65 ? -5.379 15.544 -17.797 1.0 72.01 65 A 3 -ATOM 983 H HA . ASN A1 1 65 ? -6.336 17.26 -15.604 1.0 43.44 65 A 3 -ATOM 984 H HB2 . ASN A1 1 65 ? -8.036 18.064 -16.994 1.0 12.24 65 A 3 -ATOM 985 H HB3 . ASN A1 1 65 ? -6.66 17.93 -18.086 1.0 73.02 65 A 3 -ATOM 986 H HD21 . ASN A1 1 65 ? -9.734 17.692 -18.249 1.0 23.44 65 A 3 -ATOM 987 H HD22 . ASN A1 1 65 ? -9.96 16.291 -19.235 1.0 32.24 65 A 3 -ATOM 988 N N . VAL A1 1 66 ? -6.858 14.295 -15.683 1.0 11.4 66 A 3 -ATOM 989 C CA . VAL A1 1 66 ? -7.577 13.137 -15.165 1.0 70.45 66 A 3 -ATOM 990 C C . VAL A1 1 66 ? -7.33 12.961 -13.671 1.0 73.11 66 A 3 -ATOM 991 O O . VAL A1 1 66 ? -6.44 12.215 -13.263 1.0 33.12 66 A 3 -ATOM 992 C CB . VAL A1 1 66 ? -7.165 11.846 -15.898 1.0 40.11 66 A 3 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.65 11.716 -15.939 1.0 32.21 66 A 3 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.795 10.632 -15.232 1.0 25.13 66 A 3 -ATOM 995 H H . VAL A1 1 66 ? -5.906 14.208 -15.901 1.0 25.31 66 A 3 -ATOM 996 H HA . VAL A1 1 66 ? -8.632 13.298 -15.329 1.0 44.24 66 A 3 -ATOM 997 H HB . VAL A1 1 66 ? -7.527 11.902 -16.914 1.0 65.05 66 A 3 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.29 12.005 -16.915 1.0 62.5 66 A 3 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.212 12.357 -15.188 1.0 4.5 66 A 3 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.372 10.69 -15.744 1.0 12.32 66 A 3 -ATOM 1001 H HG21 . VAL A1 1 66 ? -7.932 9.851 -15.964 1.0 23.4 66 A 3 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.148 10.279 -14.444 1.0 64.2 66 A 3 -ATOM 1003 H HG23 . VAL A1 1 66 ? -8.754 10.907 -14.816 1.0 74.31 66 A 3 -ATOM 1004 N N . GLN A1 1 67 ? -8.124 13.652 -12.86 1.0 5.43 67 A 3 -ATOM 1005 C CA . GLN A1 1 67 ? -7.992 13.572 -11.41 1.0 15.5 67 A 3 -ATOM 1006 C C . GLN A1 1 67 ? -8.951 12.536 -10.832 1.0 62.54 67 A 3 -ATOM 1007 O O . GLN A1 1 67 ? -9.67 11.862 -11.569 1.0 44.01 67 A 3 -ATOM 1008 C CB . GLN A1 1 67 ? -8.256 14.939 -10.776 1.0 35.11 67 A 3 -ATOM 1009 C CG . GLN A1 1 67 ? -9.615 15.521 -11.129 1.0 11.21 67 A 3 -ATOM 1010 C CD . GLN A1 1 67 ? -9.904 16.816 -10.396 1.0 34.44 67 A 3 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.28 17.817 -11.005 1.0 41.54 67 A 3 -ATOM 1012 N NE2 . GLN A1 1 67 ? -9.729 16.802 -9.079 1.0 50.51 67 A 3 -ATOM 1013 H H . GLN A1 1 67 ? -8.815 14.23 -13.246 1.0 54.23 67 A 3 -ATOM 1014 H HA . GLN A1 1 67 ? -6.979 13.271 -11.186 1.0 21.13 67 A 3 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.197 14.842 -9.702 1.0 61.05 67 A 3 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.495 15.63 -11.109 1.0 21.05 67 A 3 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.645 15.713 -12.192 1.0 63.24 67 A 3 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.378 14.801 -10.873 1.0 63.02 67 A 3 -ATOM 1019 H HE21 . GLN A1 1 67 ? -9.427 15.968 -8.662 1.0 0.12 67 A 3 -ATOM 1020 H HE22 . GLN A1 1 67 ? -9.908 17.625 -8.58 1.0 72.41 67 A 3 -ATOM 1021 N N . LYS A1 1 68 ? -8.955 12.415 -9.509 1.0 63.33 68 A 3 -ATOM 1022 C CA . LYS A1 1 68 ? -9.826 11.463 -8.831 1.0 34.0 68 A 3 -ATOM 1023 C C . LYS A1 1 68 ? -11.292 11.754 -9.134 1.0 33.21 68 A 3 -ATOM 1024 O O . LYS A1 1 68 ? -12.119 10.844 -9.173 1.0 33.01 68 A 3 -ATOM 1025 C CB . LYS A1 1 68 ? -9.588 11.51 -7.32 1.0 41.41 68 A 3 -ATOM 1026 C CG . LYS A1 1 68 ? -10.178 10.325 -6.574 1.0 61.44 68 A 3 -ATOM 1027 C CD . LYS A1 1 68 ? -9.453 9.034 -6.916 1.0 43.41 68 A 3 -ATOM 1028 C CE . LYS A1 1 68 ? -8.151 8.903 -6.14 1.0 23.43 68 A 3 -ATOM 1029 N NZ . LYS A1 1 68 ? -8.381 8.898 -4.668 1.0 52.05 68 A 3 -ATOM 1030 H H . LYS A1 1 68 ? -8.358 12.982 -8.975 1.0 75.53 68 A 3 -ATOM 1031 H HA . LYS A1 1 68 ? -9.585 10.475 -9.194 1.0 31.4 68 A 3 -ATOM 1032 H HB2 . LYS A1 1 68 ? -8.524 11.531 -7.135 1.0 51.5 68 A 3 -ATOM 1033 H HB3 . LYS A1 1 68 ? -10.031 12.413 -6.925 1.0 62.4 68 A 3 -ATOM 1034 H HG2 . LYS A1 1 68 ? -10.094 10.501 -5.512 1.0 22.33 68 A 3 -ATOM 1035 H HG3 . LYS A1 1 68 ? -11.22 10.224 -6.843 1.0 45.02 68 A 3 -ATOM 1036 H HD2 . LYS A1 1 68 ? -10.09 8.197 -6.671 1.0 14.2 68 A 3 -ATOM 1037 H HD3 . LYS A1 1 68 ? -9.233 9.024 -7.974 1.0 13.53 68 A 3 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.669 7.981 -6.424 1.0 43.13 68 A 3 -ATOM 1039 H HE3 . LYS A1 1 68 ? -7.512 9.736 -6.392 1.0 63.42 68 A 3 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.578 9.862 -4.333 1.0 1.54 68 A 3 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.538 8.537 -4.177 1.0 73.32 68 A 3 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.191 8.288 -4.436 1.0 23.44 68 A 3 -ATOM 1043 N N . GLU A1 1 69 ? -11.606 13.027 -9.351 1.0 51.1 69 A 3 -ATOM 1044 C CA . GLU A1 1 69 ? -12.972 13.437 -9.652 1.0 15.41 69 A 3 -ATOM 1045 C C . GLU A1 1 69 ? -12.986 14.658 -10.566 1.0 20.25 69 A 3 -ATOM 1046 O O . GLU A1 1 69 ? -13.171 15.786 -10.11 1.0 55.15 69 A 3 -ATOM 1047 C CB . GLU A1 1 69 ? -13.733 13.744 -8.36 1.0 42.14 69 A 3 -ATOM 1048 C CG . GLU A1 1 69 ? -12.961 14.63 -7.396 1.0 32.44 69 A 3 -ATOM 1049 C CD . GLU A1 1 69 ? -13.788 15.794 -6.884 1.0 60.3 69 A 3 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.201 16.636 -7.708 1.0 52.11 69 A 3 -ATOM 1051 O OE2 . GLU A1 1 69 ? -14.021 15.862 -5.659 1.0 33.22 69 A 3 -ATOM 1052 H H . GLU A1 1 69 ? -10.902 13.708 -9.306 1.0 51.55 69 A 3 -ATOM 1053 H HA . GLU A1 1 69 ? -13.46 12.618 -10.159 1.0 21.13 69 A 3 -ATOM 1054 H HB2 . GLU A1 1 69 ? -14.659 14.24 -8.611 1.0 70.35 69 A 3 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.958 12.814 -7.859 1.0 25.14 69 A 3 -ATOM 1056 H HG2 . GLU A1 1 69 ? -12.647 14.034 -6.553 1.0 60.54 69 A 3 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.092 15.021 -7.904 1.0 2.43 69 A 3 -ATOM 1058 N N . SER A1 1 70 ? -12.787 14.425 -11.859 1.0 51.41 70 A 3 -ATOM 1059 C CA . SER A1 1 70 ? -12.771 15.506 -12.838 1.0 50.24 70 A 3 -ATOM 1060 C C . SER A1 1 70 ? -14.134 15.652 -13.507 1.0 72.1 70 A 3 -ATOM 1061 O O . SER A1 1 70 ? -14.718 14.674 -13.976 1.0 13.02 70 A 3 -ATOM 1062 C CB . SER A1 1 70 ? -11.696 15.249 -13.895 1.0 75.43 70 A 3 -ATOM 1063 O OG . SER A1 1 70 ? -11.015 16.446 -14.231 1.0 45.33 70 A 3 -ATOM 1064 H H . SER A1 1 70 ? -12.645 13.503 -12.162 1.0 42.55 70 A 3 -ATOM 1065 H HA . SER A1 1 70 ? -12.539 16.422 -12.316 1.0 61.25 70 A 3 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.981 14.537 -13.513 1.0 1.23 70 A 3 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.159 14.85 -14.786 1.0 50.33 70 A 3 -ATOM 1068 H HG . SER A1 1 70 ? -11.623 17.187 -14.175 1.0 14.24 70 A 3 -ATOM 1069 N N . THR A1 1 71 ? -14.637 16.882 -13.549 1.0 52.55 71 A 3 -ATOM 1070 C CA . THR A1 1 71 ? -15.932 17.158 -14.159 1.0 43.33 71 A 3 -ATOM 1071 C C . THR A1 1 71 ? -15.774 17.583 -15.614 1.0 63.44 71 A 3 -ATOM 1072 O O . THR A1 1 71 ? -15.094 18.565 -15.915 1.0 13.52 71 A 3 -ATOM 1073 C CB . THR A1 1 71 ? -16.69 18.259 -13.394 1.0 4.41 71 A 3 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.775 19.27 -12.955 1.0 4.41 71 A 3 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.424 17.678 -12.195 1.0 4.35 71 A 3 -ATOM 1076 H H . THR A1 1 71 ? -14.125 17.62 -13.158 1.0 14.04 71 A 3 -ATOM 1077 H HA . THR A1 1 71 ? -16.519 16.252 -14.12 1.0 24.13 71 A 3 -ATOM 1078 H HB . THR A1 1 71 ? -17.415 18.705 -14.06 1.0 70.41 71 A 3 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.264 20.059 -12.71 1.0 53.11 71 A 3 -ATOM 1080 H HG21 . THR A1 1 71 ? -17.503 18.428 -11.423 1.0 12.42 71 A 3 -ATOM 1081 H HG22 . THR A1 1 71 ? -16.878 16.827 -11.816 1.0 75.2 71 A 3 -ATOM 1082 H HG23 . THR A1 1 71 ? -18.413 17.365 -12.496 1.0 31.12 71 A 3 -ATOM 1083 N N . LEU A1 1 72 ? -16.406 16.838 -16.515 1.0 74.32 72 A 3 -ATOM 1084 C CA . LEU A1 1 72 ? -16.337 17.139 -17.941 1.0 62.12 72 A 3 -ATOM 1085 C C . LEU A1 1 72 ? -17.723 17.096 -18.574 1.0 14.1 72 A 3 -ATOM 1086 O O . LEU A1 1 72 ? -18.616 16.396 -18.094 1.0 22.33 72 A 3 -ATOM 1087 C CB . LEU A1 1 72 ? -15.41 16.147 -18.646 1.0 54.24 72 A 3 -ATOM 1088 C CG . LEU A1 1 72 ? -16.077 14.894 -19.215 1.0 12.34 72 A 3 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.369 15.07 -20.697 1.0 71.53 72 A 3 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.199 13.672 -18.984 1.0 45.31 72 A 3 -ATOM 1091 H H . LEU A1 1 72 ? -16.932 16.068 -16.215 1.0 40.44 72 A 3 -ATOM 1092 H HA . LEU A1 1 72 ? -15.935 18.135 -18.05 1.0 22.23 72 A 3 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.931 16.665 -19.462 1.0 24.33 72 A 3 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.662 15.831 -17.934 1.0 64.44 72 A 3 -ATOM 1095 H HG . LEU A1 1 72 ? -17.017 14.732 -18.707 1.0 60.22 72 A 3 -ATOM 1096 H HD11 . LEU A1 1 72 ? -15.746 15.857 -21.095 1.0 22.12 72 A 3 -ATOM 1097 H HD12 . LEU A1 1 72 ? -17.408 15.332 -20.83 1.0 11.12 72 A 3 -ATOM 1098 H HD13 . LEU A1 1 72 ? -16.161 14.147 -21.217 1.0 74.11 72 A 3 -ATOM 1099 H HD21 . LEU A1 1 72 ? -15.342 13.311 -17.977 1.0 45.11 72 A 3 -ATOM 1100 H HD22 . LEU A1 1 72 ? -14.163 13.941 -19.127 1.0 64.51 72 A 3 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.47 12.897 -19.687 1.0 15.53 72 A 3 -ATOM 1102 N N . HIS A1 1 73 ? -17.897 17.848 -19.657 1.0 22.1 73 A 3 -ATOM 1103 C CA . HIS A1 1 73 ? -19.175 17.893 -20.359 1.0 43.22 73 A 3 -ATOM 1104 C C . HIS A1 1 73 ? -19.176 16.939 -21.549 1.0 1.12 73 A 3 -ATOM 1105 O O . HIS A1 1 73 ? -18.354 17.062 -22.458 1.0 41.41 73 A 3 -ATOM 1106 C CB . HIS A1 1 73 ? -19.47 19.317 -20.832 1.0 34.11 73 A 3 -ATOM 1107 C CG . HIS A1 1 73 ? -20.916 19.559 -21.136 1.0 25.31 73 A 3 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.751 18.589 -21.649 1.0 22.31 73 A 3 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.677 20.67 -20.995 1.0 30.12 73 A 3 -ATOM 1110 C CE1 . HIS A1 1 73 ? -22.961 19.092 -21.812 1.0 74.03 73 A 3 -ATOM 1111 N NE2 . HIS A1 1 73 ? -22.943 20.354 -21.422 1.0 22.32 73 A 3 -ATOM 1112 H H . HIS A1 1 73 ? -17.148 18.384 -19.992 1.0 41.1 73 A 3 -ATOM 1113 H HA . HIS A1 1 73 ? -19.944 17.587 -19.667 1.0 23.25 73 A 3 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.172 20.014 -20.063 1.0 51.13 73 A 3 -ATOM 1115 H HB3 . HIS A1 1 73 ? -18.904 19.516 -21.731 1.0 64.13 73 A 3 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.493 17.668 -21.864 1.0 63.31 73 A 3 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.349 21.629 -20.617 1.0 71.43 73 A 3 -ATOM 1118 H HE1 . HIS A1 1 73 ? -23.82 18.563 -22.197 1.0 3.34 73 A 3 -ATOM 1119 N N . LEU A1 1 74 ? -20.102 15.987 -21.537 1.0 31.4 74 A 3 -ATOM 1120 C CA . LEU A1 1 74 ? -20.209 15.01 -22.615 1.0 41.22 74 A 3 -ATOM 1121 C C . LEU A1 1 74 ? -21.433 15.288 -23.482 1.0 21.0 74 A 3 -ATOM 1122 O O . LEU A1 1 74 ? -22.568 15.231 -23.009 1.0 70.53 74 A 3 -ATOM 1123 C CB . LEU A1 1 74 ? -20.289 13.594 -22.04 1.0 42.32 74 A 3 -ATOM 1124 C CG . LEU A1 1 74 ? -21.025 12.563 -22.896 1.0 13.02 74 A 3 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.399 12.473 -24.279 1.0 50.12 74 A 3 -ATOM 1126 C CD2 . LEU A1 1 74 ? -21.018 11.202 -22.216 1.0 22.4 74 A 3 -ATOM 1127 H H . LEU A1 1 74 ? -20.729 15.939 -20.785 1.0 53.04 74 A 3 -ATOM 1128 H HA . LEU A1 1 74 ? -19.323 15.092 -23.226 1.0 65.43 74 A 3 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.28 13.24 -21.892 1.0 22.02 74 A 3 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.792 13.653 -21.086 1.0 20.31 74 A 3 -ATOM 1131 H HG . LEU A1 1 74 ? -22.054 12.872 -23.016 1.0 34.12 74 A 3 -ATOM 1132 H HD11 . LEU A1 1 74 ? -19.348 12.709 -24.215 1.0 33.01 74 A 3 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.886 13.174 -24.941 1.0 1.34 74 A 3 -ATOM 1134 H HD13 . LEU A1 1 74 ? -20.521 11.471 -24.665 1.0 63.14 74 A 3 -ATOM 1135 H HD21 . LEU A1 1 74 ? -20.009 10.818 -22.189 1.0 12.32 74 A 3 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.648 10.52 -22.768 1.0 54.43 74 A 3 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.392 11.302 -21.207 1.0 14.02 74 A 3 -ATOM 1138 N N . VAL A1 1 75 ? -21.194 15.587 -24.755 1.0 43.5 75 A 3 -ATOM 1139 C CA . VAL A1 1 75 ? -22.276 15.871 -25.69 1.0 52.32 75 A 3 -ATOM 1140 C C . VAL A1 1 75 ? -22.401 14.77 -26.736 1.0 61.15 75 A 3 -ATOM 1141 O O . VAL A1 1 75 ? -21.421 14.397 -27.382 1.0 54.31 75 A 3 -ATOM 1142 C CB . VAL A1 1 75 ? -22.062 17.22 -26.403 1.0 24.5 75 A 3 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.245 17.54 -27.304 1.0 55.3 75 A 3 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.84 18.33 -25.387 1.0 64.14 75 A 3 -ATOM 1145 H H . VAL A1 1 75 ? -20.267 15.617 -25.073 1.0 70.11 75 A 3 -ATOM 1146 H HA . VAL A1 1 75 ? -23.197 15.927 -25.128 1.0 60.52 75 A 3 -ATOM 1147 H HB . VAL A1 1 75 ? -21.179 17.142 -27.019 1.0 44.41 75 A 3 -ATOM 1148 H HG11 . VAL A1 1 75 ? -24.059 16.866 -27.083 1.0 31.54 75 A 3 -ATOM 1149 H HG12 . VAL A1 1 75 ? -23.562 18.559 -27.135 1.0 61.34 75 A 3 -ATOM 1150 H HG13 . VAL A1 1 75 ? -22.952 17.422 -28.337 1.0 54.52 75 A 3 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.619 19.252 -25.903 1.0 5.24 75 A 3 -ATOM 1152 H HG22 . VAL A1 1 75 ? -22.731 18.455 -24.791 1.0 61.35 75 A 3 -ATOM 1153 H HG23 . VAL A1 1 75 ? -21.011 18.069 -24.744 1.0 24.43 75 A 3 -ATOM 1154 N N . LEU A1 1 76 ? -23.614 14.252 -26.9 1.0 35.1 76 A 3 -ATOM 1155 C CA . LEU A1 1 76 ? -23.869 13.193 -27.87 1.0 22.53 76 A 3 -ATOM 1156 C C . LEU A1 1 76 ? -24.972 13.598 -28.842 1.0 2.14 76 A 3 -ATOM 1157 O O . LEU A1 1 76 ? -25.989 14.165 -28.442 1.0 21.5 76 A 3 -ATOM 1158 C CB . LEU A1 1 76 ? -24.257 11.899 -27.151 1.0 73.12 76 A 3 -ATOM 1159 C CG . LEU A1 1 76 ? -24.193 11.935 -25.624 1.0 64.45 76 A 3 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.435 12.602 -25.053 1.0 24.13 76 A 3 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.036 10.529 -25.064 1.0 22.03 76 A 3 -ATOM 1162 H H . LEU A1 1 76 ? -24.356 14.59 -26.357 1.0 44.32 76 A 3 -ATOM 1163 H HA . LEU A1 1 76 ? -22.958 13.027 -28.426 1.0 53.04 76 A 3 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.269 11.655 -27.434 1.0 71.31 76 A 3 -ATOM 1165 H HB3 . LEU A1 1 76 ? -23.592 11.119 -27.493 1.0 62.14 76 A 3 -ATOM 1166 H HG . LEU A1 1 76 ? -23.333 12.516 -25.319 1.0 42.11 76 A 3 -ATOM 1167 H HD11 . LEU A1 1 76 ? -26.266 12.452 -25.726 1.0 12.14 76 A 3 -ATOM 1168 H HD12 . LEU A1 1 76 ? -25.254 13.66 -24.936 1.0 23.21 76 A 3 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.667 12.168 -24.091 1.0 40.2 76 A 3 -ATOM 1170 H HD21 . LEU A1 1 76 ? -24.93 10.254 -24.525 1.0 53.24 76 A 3 -ATOM 1171 H HD22 . LEU A1 1 76 ? -23.189 10.502 -24.394 1.0 72.02 76 A 3 -ATOM 1172 H HD23 . LEU A1 1 76 ? -23.875 9.834 -25.875 1.0 63.4 76 A 3 -ATOM 1173 N N . ARG A1 1 77 ? -24.764 13.303 -30.121 1.0 50.44 77 A 3 -ATOM 1174 C CA . ARG A1 1 77 ? -25.741 13.636 -31.151 1.0 12.4 77 A 3 -ATOM 1175 C C . ARG A1 1 77 ? -26.295 12.373 -31.803 1.0 10.32 77 A 3 -ATOM 1176 O O . ARG A1 1 77 ? -26.109 12.146 -33.0 1.0 12.43 77 A 3 -ATOM 1177 C CB . ARG A1 1 77 ? -25.107 14.536 -32.214 1.0 55.35 77 A 3 -ATOM 1178 C CG . ARG A1 1 77 ? -24.351 15.721 -31.636 1.0 12.22 77 A 3 -ATOM 1179 C CD . ARG A1 1 77 ? -22.847 15.53 -31.748 1.0 60.22 77 A 3 -ATOM 1180 N NE . ARG A1 1 77 ? -22.252 16.432 -32.731 1.0 64.33 77 A 3 -ATOM 1181 C CZ . ARG A1 1 77 ? -22.141 17.743 -32.552 1.0 13.31 77 A 3 -ATOM 1182 N NH1 . ARG A1 1 77 ? -22.58 18.303 -31.434 1.0 63.3 77 A 3 -ATOM 1183 N NH2 . ARG A1 1 77 ? -21.588 18.498 -33.494 1.0 70.54 77 A 3 -ATOM 1184 H H . ARG A1 1 77 ? -23.933 12.851 -30.379 1.0 2.41 77 A 3 -ATOM 1185 H HA . ARG A1 1 77 ? -26.553 14.169 -30.678 1.0 53.23 77 A 3 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.417 13.948 -32.801 1.0 41.04 77 A 3 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.886 14.913 -32.859 1.0 23.23 77 A 3 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.631 16.613 -32.177 1.0 3.21 77 A 3 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.615 15.831 -30.595 1.0 45.32 77 A 3 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.4 15.72 -30.784 1.0 24.22 77 A 3 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.648 14.51 -32.042 1.0 55.12 77 A 3 -ATOM 1192 H HE . ARG A1 1 77 ? -21.921 16.039 -33.565 1.0 41.44 77 A 3 -ATOM 1193 H HH11 . ARG A1 1 77 ? -22.996 17.737 -30.722 1.0 31.24 77 A 3 -ATOM 1194 H HH12 . ARG A1 1 77 ? -22.494 19.291 -31.301 1.0 72.5 77 A 3 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.255 18.08 -34.338 1.0 71.34 77 A 3 -ATOM 1196 H HH22 . ARG A1 1 77 ? -21.505 19.485 -33.358 1.0 1.44 77 A 3 -ATOM 1197 N N . LEU A1 1 78 ? -26.976 11.554 -31.01 1.0 31.03 78 A 3 -ATOM 1198 C CA . LEU A1 1 78 ? -27.558 10.313 -31.51 1.0 51.32 78 A 3 -ATOM 1199 C C . LEU A1 1 78 ? -28.547 10.59 -32.638 1.0 14.11 78 A 3 -ATOM 1200 O O . LEU A1 1 78 ? -28.465 9.99 -33.709 1.0 12.31 78 A 3 -ATOM 1201 C CB . LEU A1 1 78 ? -28.258 9.561 -30.376 1.0 42.51 78 A 3 -ATOM 1202 C CG . LEU A1 1 78 ? -27.379 8.621 -29.55 1.0 51.45 78 A 3 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.298 9.404 -28.821 1.0 14.44 78 A 3 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.224 7.829 -28.563 1.0 25.32 78 A 3 -ATOM 1205 H H . LEU A1 1 78 ? -27.092 11.788 -30.066 1.0 75.31 78 A 3 -ATOM 1206 H HA . LEU A1 1 78 ? -26.755 9.701 -31.893 1.0 64.2 78 A 3 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.679 10.294 -29.705 1.0 61.14 78 A 3 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.054 8.974 -30.811 1.0 62.32 78 A 3 -ATOM 1209 H HG . LEU A1 1 78 ? -26.892 7.919 -30.213 1.0 53.42 78 A 3 -ATOM 1210 H HD11 . LEU A1 1 78 ? -25.407 9.441 -29.429 1.0 3.24 78 A 3 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.074 8.919 -27.882 1.0 74.14 78 A 3 -ATOM 1212 H HD13 . LEU A1 1 78 ? -26.647 10.409 -28.631 1.0 11.41 78 A 3 -ATOM 1213 H HD21 . LEU A1 1 78 ? -29.179 8.318 -28.435 1.0 65.32 78 A 3 -ATOM 1214 H HD22 . LEU A1 1 78 ? -27.714 7.779 -27.613 1.0 65.43 78 A 3 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.379 6.83 -28.943 1.0 34.04 78 A 3 -ATOM 1216 N N . ARG A1 1 79 ? -29.479 11.504 -32.389 1.0 44.5 79 A 3 -ATOM 1217 C CA . ARG A1 1 79 ? -30.482 11.861 -33.384 1.0 54.44 79 A 3 -ATOM 1218 C C . ARG A1 1 79 ? -31.251 10.628 -33.849 1.0 43.43 79 A 3 -ATOM 1219 O O . ARG A1 1 79 ? -31.105 9.544 -33.285 1.0 24.23 79 A 3 -ATOM 1220 C CB . ARG A1 1 79 ? -29.822 12.546 -34.582 1.0 53.1 79 A 3 -ATOM 1221 C CG . ARG A1 1 79 ? -30.393 13.921 -34.889 1.0 62.42 79 A 3 -ATOM 1222 C CD . ARG A1 1 79 ? -29.419 15.026 -34.511 1.0 15.2 79 A 3 -ATOM 1223 N NE . ARG A1 1 79 ? -29.671 16.256 -35.256 1.0 22.21 79 A 3 -ATOM 1224 C CZ . ARG A1 1 79 ? -30.714 17.048 -35.035 1.0 43.33 79 A 3 -ATOM 1225 N NH1 . ARG A1 1 79 ? -31.597 16.74 -34.095 1.0 51.34 79 A 3 -ATOM 1226 N NH2 . ARG A1 1 79 ? -30.875 18.152 -35.754 1.0 24.34 79 A 3 -ATOM 1227 H H . ARG A1 1 79 ? -29.492 11.948 -31.516 1.0 30.43 79 A 3 -ATOM 1228 H HA . ARG A1 1 79 ? -31.175 12.55 -32.924 1.0 75.12 79 A 3 -ATOM 1229 H HB2 . ARG A1 1 79 ? -28.766 12.655 -34.383 1.0 72.51 79 A 3 -ATOM 1230 H HB3 . ARG A1 1 79 ? -29.953 11.923 -35.454 1.0 62.3 79 A 3 -ATOM 1231 H HG2 . ARG A1 1 79 ? -30.601 13.987 -35.947 1.0 34.21 79 A 3 -ATOM 1232 H HG3 . ARG A1 1 79 ? -31.308 14.053 -34.331 1.0 51.44 79 A 3 -ATOM 1233 H HD2 . ARG A1 1 79 ? -29.517 15.229 -33.455 1.0 21.42 79 A 3 -ATOM 1234 H HD3 . ARG A1 1 79 ? -28.414 14.688 -34.72 1.0 24.22 79 A 3 -ATOM 1235 H HE . ARG A1 1 79 ? -29.03 16.503 -35.955 1.0 63.2 79 A 3 -ATOM 1236 H HH11 . ARG A1 1 79 ? -31.478 15.91 -33.551 1.0 0.03 79 A 3 -ATOM 1237 H HH12 . ARG A1 1 79 ? -32.381 17.339 -33.93 1.0 54.33 79 A 3 -ATOM 1238 H HH21 . ARG A1 1 79 ? -30.211 18.387 -36.463 1.0 72.3 79 A 3 -ATOM 1239 H HH22 . ARG A1 1 79 ? -31.66 18.747 -35.587 1.0 2.44 79 A 3 -ATOM 1240 N N . GLY A1 1 80 ? -32.07 10.802 -34.882 1.0 11.03 80 A 3 -ATOM 1241 C CA . GLY A1 1 80 ? -32.85 9.695 -35.405 1.0 3.12 80 A 3 -ATOM 1242 C C . GLY A1 1 80 ? -34.29 10.079 -35.681 1.0 52.34 80 A 3 -ATOM 1243 O O . GLY A1 1 80 ? -34.583 10.737 -36.678 1.0 43.44 80 A 3 -ATOM 1244 H H . GLY A1 1 80 ? -32.146 11.689 -35.292 1.0 0.24 80 A 3 -ATOM 1245 H HA2 . GLY A1 1 80 ? -32.397 9.352 -36.323 1.0 71.24 80 A 3 -ATOM 1246 H HA3 . GLY A1 1 80 ? -32.837 8.889 -34.685 1.0 43.14 80 A 3 -ATOM 1247 N N . GLY A1 1 81 ? -35.192 9.666 -34.796 1.0 43.34 81 A 3 -ATOM 1248 C CA . GLY A1 1 81 ? -36.598 9.979 -34.969 1.0 20.2 81 A 3 -ATOM 1249 C C . GLY A1 1 81 ? -37.332 8.926 -35.776 1.0 63.23 81 A 3 -ATOM 1250 O O . GLY A1 1 81 ? -36.826 8.447 -36.791 1.0 30.24 81 A 3 -ATOM 1251 H H . GLY A1 1 81 ? -34.9 9.144 -34.019 1.0 11.33 81 A 3 -ATOM 1252 H HA2 . GLY A1 1 81 ? -37.06 10.059 -33.996 1.0 30.51 81 A 3 -ATOM 1253 H HA3 . GLY A1 1 81 ? -36.684 10.929 -35.476 1.0 55.14 81 A 3 -ATOM 1254 N N . VAL A1 1 82 ? -38.528 8.563 -35.323 1.0 30.52 82 A 3 -ATOM 1255 C CA . VAL A1 1 82 ? -39.332 7.559 -36.01 1.0 4.45 82 A 3 -ATOM 1256 C C . VAL A1 1 82 ? -40.078 8.167 -37.193 1.0 63.52 82 A 3 -ATOM 1257 O O . VAL A1 1 82 ? -39.728 7.931 -38.349 1.0 12.52 82 A 3 -ATOM 1258 C CB . VAL A1 1 82 ? -40.35 6.907 -35.056 1.0 53.54 82 A 3 -ATOM 1259 C CG1 . VAL A1 1 82 ? -41.052 5.743 -35.738 1.0 33.31 82 A 3 -ATOM 1260 C CG2 . VAL A1 1 82 ? -39.665 6.452 -33.776 1.0 1.13 82 A 3 -ATOM 1261 H H . VAL A1 1 82 ? -38.878 8.981 -34.509 1.0 42.11 82 A 3 -ATOM 1262 H HA . VAL A1 1 82 ? -38.667 6.79 -36.374 1.0 65.12 82 A 3 -ATOM 1263 H HB . VAL A1 1 82 ? -41.095 7.645 -34.797 1.0 3.02 82 A 3 -ATOM 1264 H HG11 . VAL A1 1 82 ? -41.945 5.488 -35.186 1.0 71.54 82 A 3 -ATOM 1265 H HG12 . VAL A1 1 82 ? -41.318 6.023 -36.747 1.0 43.52 82 A 3 -ATOM 1266 H HG13 . VAL A1 1 82 ? -40.39 4.889 -35.764 1.0 60.31 82 A 3 -ATOM 1267 H HG21 . VAL A1 1 82 ? -40.367 5.902 -33.167 1.0 51.1 82 A 3 -ATOM 1268 H HG22 . VAL A1 1 82 ? -38.828 5.816 -34.024 1.0 43.42 82 A 3 -ATOM 1269 H HG23 . VAL A1 1 82 ? -39.312 7.314 -33.23 1.0 61.21 82 A 3 -ATOM 1 N N . GLY A1 1 1 ? -15.13 -4.109 -7.524 1.0 13.0 1 A 4 -ATOM 2 C CA . GLY A1 1 1 ? -14.03 -3.547 -6.762 1.0 45.03 1 A 4 -ATOM 3 C C . GLY A1 1 1 ? -13.407 -2.345 -7.444 1.0 65.21 1 A 4 -ATOM 4 O O . GLY A1 1 1 ? -12.323 -2.425 -8.023 1.0 33.34 1 A 4 -ATOM 5 H H1 . GLY A1 1 1 ? -15.976 -3.618 -7.594 1.0 52.4 1 A 4 -ATOM 6 H HA2 . GLY A1 1 1 ? -14.395 -3.248 -5.791 1.0 14.15 1 A 4 -ATOM 7 H HA3 . GLY A1 1 1 ? -13.272 -4.306 -6.633 1.0 34.23 1 A 4 -ATOM 8 N N . PRO A1 1 2 ? -14.102 -1.199 -7.382 1.0 55.32 2 A 4 -ATOM 9 C CA . PRO A1 1 2 ? -13.63 0.047 -7.995 1.0 21.43 2 A 4 -ATOM 10 C C . PRO A1 1 2 ? -12.42 0.626 -7.27 1.0 41.45 2 A 4 -ATOM 11 O O . PRO A1 1 2 ? -12.521 1.064 -6.123 1.0 62.42 2 A 4 -ATOM 12 C CB . PRO A1 1 2 ? -14.832 0.985 -7.863 1.0 51.45 2 A 4 -ATOM 13 C CG . PRO A1 1 2 ? -15.595 0.46 -6.696 1.0 43.11 2 A 4 -ATOM 14 C CD . PRO A1 1 2 ? -15.401 -1.031 -6.71 1.0 64.14 2 A 4 -ATOM 15 H HA . PRO A1 1 2 ? -13.391 -0.09 -9.039 1.0 31.54 2 A 4 -ATOM 16 H HB2 . PRO A1 1 2 ? -14.487 1.994 -7.689 1.0 42.4 2 A 4 -ATOM 17 H HB3 . PRO A1 1 2 ? -15.421 0.95 -8.767 1.0 62.54 2 A 4 -ATOM 18 H HG2 . PRO A1 1 2 ? -15.204 0.881 -5.782 1.0 3.22 2 A 4 -ATOM 19 H HG3 . PRO A1 1 2 ? -16.642 0.702 -6.804 1.0 51.14 2 A 4 -ATOM 20 H HD2 . PRO A1 1 2 ? -15.366 -1.416 -5.702 1.0 11.0 2 A 4 -ATOM 21 H HD3 . PRO A1 1 2 ? -16.19 -1.509 -7.272 1.0 24.12 2 A 4 -ATOM 22 N N . LEU A1 1 3 ? -11.276 0.628 -7.946 1.0 34.12 3 A 4 -ATOM 23 C CA . LEU A1 1 3 ? -10.045 1.155 -7.366 1.0 54.03 3 A 4 -ATOM 24 C C . LEU A1 1 3 ? -8.94 1.236 -8.415 1.0 63.21 3 A 4 -ATOM 25 O O . LEU A1 1 3 ? -8.731 0.299 -9.184 1.0 11.24 3 A 4 -ATOM 26 C CB . LEU A1 1 3 ? -9.592 0.278 -6.198 1.0 60.12 3 A 4 -ATOM 27 C CG . LEU A1 1 3 ? -9.307 -1.188 -6.529 1.0 64.13 3 A 4 -ATOM 28 C CD1 . LEU A1 1 3 ? -7.859 -1.366 -6.959 1.0 62.25 3 A 4 -ATOM 29 C CD2 . LEU A1 1 3 ? -9.625 -2.076 -5.336 1.0 0.12 3 A 4 -ATOM 30 H H . LEU A1 1 3 ? -11.257 0.266 -8.856 1.0 52.35 3 A 4 -ATOM 31 H HA . LEU A1 1 3 ? -10.251 2.15 -7.0 1.0 43.13 3 A 4 -ATOM 32 H HB2 . LEU A1 1 3 ? -8.688 0.707 -5.794 1.0 74.24 3 A 4 -ATOM 33 H HB3 . LEU A1 1 3 ? -10.368 0.303 -5.446 1.0 72.41 3 A 4 -ATOM 34 H HG . LEU A1 1 3 ? -9.939 -1.493 -7.352 1.0 43.5 3 A 4 -ATOM 35 H HD11 . LEU A1 1 3 ? -7.391 -0.398 -7.058 1.0 50.45 3 A 4 -ATOM 36 H HD12 . LEU A1 1 3 ? -7.826 -1.881 -7.907 1.0 4.34 3 A 4 -ATOM 37 H HD13 . LEU A1 1 3 ? -7.333 -1.947 -6.215 1.0 54.42 3 A 4 -ATOM 38 H HD21 . LEU A1 1 3 ? -9.144 -1.68 -4.454 1.0 23.33 3 A 4 -ATOM 39 H HD22 . LEU A1 1 3 ? -9.263 -3.076 -5.525 1.0 1.01 3 A 4 -ATOM 40 H HD23 . LEU A1 1 3 ? -10.694 -2.104 -5.182 1.0 75.24 3 A 4 -ATOM 41 N N . GLY A1 1 4 ? -8.234 2.362 -8.438 1.0 4.21 4 A 4 -ATOM 42 C CA . GLY A1 1 4 ? -7.158 2.543 -9.394 1.0 43.34 4 A 4 -ATOM 43 C C . GLY A1 1 4 ? -6.348 3.796 -9.124 1.0 32.24 4 A 4 -ATOM 44 O O . GLY A1 1 4 ? -5.897 4.022 -8.001 1.0 73.31 4 A 4 -ATOM 45 H H . GLY A1 1 4 ? -8.446 3.076 -7.8 1.0 2.13 4 A 4 -ATOM 46 H HA2 . GLY A1 1 4 ? -6.503 1.686 -9.349 1.0 53.5 4 A 4 -ATOM 47 H HA3 . GLY A1 1 4 ? -7.58 2.609 -10.386 1.0 61.41 4 A 4 -ATOM 48 N N . SER A1 1 5 ? -6.161 4.612 -10.157 1.0 14.33 5 A 4 -ATOM 49 C CA . SER A1 1 5 ? -5.394 5.846 -10.027 1.0 12.42 5 A 4 -ATOM 50 C C . SER A1 1 5 ? -6.297 7.005 -9.618 1.0 43.22 5 A 4 -ATOM 51 O O . SER A1 1 5 ? -6.175 7.543 -8.518 1.0 33.52 5 A 4 -ATOM 52 C CB . SER A1 1 5 ? -4.689 6.174 -11.344 1.0 72.02 5 A 4 -ATOM 53 O OG . SER A1 1 5 ? -3.513 6.932 -11.119 1.0 21.35 5 A 4 -ATOM 54 H H . SER A1 1 5 ? -6.546 4.377 -11.027 1.0 31.12 5 A 4 -ATOM 55 H HA . SER A1 1 5 ? -4.651 5.695 -9.258 1.0 12.32 5 A 4 -ATOM 56 H HB2 . SER A1 1 5 ? -4.42 5.255 -11.844 1.0 41.01 5 A 4 -ATOM 57 H HB3 . SER A1 1 5 ? -5.356 6.744 -11.974 1.0 74.13 5 A 4 -ATOM 58 H HG . SER A1 1 5 ? -2.827 6.361 -10.767 1.0 33.45 5 A 4 -ATOM 59 N N . MET A1 1 6 ? -7.204 7.385 -10.512 1.0 14.01 6 A 4 -ATOM 60 C CA . MET A1 1 6 ? -8.129 8.481 -10.244 1.0 54.33 6 A 4 -ATOM 61 C C . MET A1 1 6 ? -9.472 8.237 -10.926 1.0 31.44 6 A 4 -ATOM 62 O O . MET A1 1 6 ? -9.698 7.177 -11.508 1.0 1.11 6 A 4 -ATOM 63 C CB . MET A1 1 6 ? -7.534 9.807 -10.723 1.0 70.21 6 A 4 -ATOM 64 C CG . MET A1 1 6 ? -6.818 9.705 -12.059 1.0 25.05 6 A 4 -ATOM 65 S SD . MET A1 1 6 ? -5.033 9.519 -11.878 1.0 3.44 6 A 4 -ATOM 66 C CE . MET A1 1 6 ? -4.505 11.229 -11.958 1.0 13.21 6 A 4 -ATOM 67 H H . MET A1 1 6 ? -7.254 6.918 -11.372 1.0 2.32 6 A 4 -ATOM 68 H HA . MET A1 1 6 ? -8.283 8.53 -9.177 1.0 5.22 6 A 4 -ATOM 69 H HB2 . MET A1 1 6 ? -8.33 10.53 -10.819 1.0 62.43 6 A 4 -ATOM 70 H HB3 . MET A1 1 6 ? -6.827 10.157 -9.986 1.0 63.34 6 A 4 -ATOM 71 H HG2 . MET A1 1 6 ? -7.201 8.849 -12.594 1.0 33.13 6 A 4 -ATOM 72 H HG3 . MET A1 1 6 ? -7.017 10.601 -12.628 1.0 12.41 6 A 4 -ATOM 73 H HE1 . MET A1 1 6 ? -5.323 11.842 -12.309 1.0 12.23 6 A 4 -ATOM 74 H HE2 . MET A1 1 6 ? -4.205 11.559 -10.974 1.0 52.54 6 A 4 -ATOM 75 H HE3 . MET A1 1 6 ? -3.671 11.316 -12.637 1.0 2.41 6 A 4 -ATOM 76 N N . GLN A1 1 7 ? -10.358 9.225 -10.847 1.0 13.12 7 A 4 -ATOM 77 C CA . GLN A1 1 7 ? -11.678 9.115 -11.456 1.0 13.2 7 A 4 -ATOM 78 C C . GLN A1 1 7 ? -12.079 10.426 -12.126 1.0 42.42 7 A 4 -ATOM 79 O O . GLN A1 1 7 ? -11.556 11.49 -11.792 1.0 71.33 7 A 4 -ATOM 80 C CB . GLN A1 1 7 ? -12.718 8.729 -10.403 1.0 42.01 7 A 4 -ATOM 81 C CG . GLN A1 1 7 ? -12.232 7.668 -9.428 1.0 12.34 7 A 4 -ATOM 82 C CD . GLN A1 1 7 ? -13.196 7.444 -8.28 1.0 44.31 7 A 4 -ATOM 83 O OE1 . GLN A1 1 7 ? -14.345 7.885 -8.325 1.0 33.44 7 A 4 -ATOM 84 N NE2 . GLN A1 1 7 ? -12.734 6.755 -7.244 1.0 73.32 7 A 4 -ATOM 85 H H . GLN A1 1 7 ? -10.118 10.045 -10.369 1.0 71.21 7 A 4 -ATOM 86 H HA . GLN A1 1 7 ? -11.634 8.341 -12.206 1.0 62.03 7 A 4 -ATOM 87 H HB2 . GLN A1 1 7 ? -12.986 9.61 -9.838 1.0 13.25 7 A 4 -ATOM 88 H HB3 . GLN A1 1 7 ? -13.597 8.351 -10.904 1.0 41.42 7 A 4 -ATOM 89 H HG2 . GLN A1 1 7 ? -12.109 6.737 -9.962 1.0 43.33 7 A 4 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.28 7.978 -9.024 1.0 33.21 7 A 4 -ATOM 91 H HE21 . GLN A1 1 7 ? -11.807 6.436 -7.277 1.0 52.01 7 A 4 -ATOM 92 H HE22 . GLN A1 1 7 ? -13.335 6.597 -6.488 1.0 55.43 7 A 4 -ATOM 93 N N . ILE A1 1 8 ? -13.008 10.341 -13.072 1.0 12.12 8 A 4 -ATOM 94 C CA . ILE A1 1 8 ? -13.478 11.52 -13.788 1.0 64.2 8 A 4 -ATOM 95 C C . ILE A1 1 8 ? -15.001 11.591 -13.79 1.0 0.33 8 A 4 -ATOM 96 O O . ILE A1 1 8 ? -15.681 10.571 -13.671 1.0 11.35 8 A 4 -ATOM 97 C CB . ILE A1 1 8 ? -12.973 11.533 -15.243 1.0 65.34 8 A 4 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.115 10.297 -15.52 1.0 72.33 8 A 4 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.185 12.805 -15.519 1.0 55.24 8 A 4 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.73 10.142 -16.975 1.0 11.02 8 A 4 -ATOM 101 H H . ILE A1 1 8 ? -13.386 9.464 -13.293 1.0 43.45 8 A 4 -ATOM 102 H HA . ILE A1 1 8 ? -13.088 12.393 -13.285 1.0 41.41 8 A 4 -ATOM 103 H HB . ILE A1 1 8 ? -13.831 11.521 -15.898 1.0 13.24 8 A 4 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.206 10.362 -14.942 1.0 4.11 8 A 4 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.663 9.414 -15.224 1.0 33.41 8 A 4 -ATOM 106 H HG21 . ILE A1 1 8 ? -12.87 13.617 -15.714 1.0 12.11 8 A 4 -ATOM 107 H HG22 . ILE A1 1 8 ? -11.579 13.046 -14.658 1.0 14.43 8 A 4 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.549 12.656 -16.378 1.0 53.13 8 A 4 -ATOM 109 H HD11 . ILE A1 1 8 ? -10.668 9.956 -17.048 1.0 4.51 8 A 4 -ATOM 110 H HD12 . ILE A1 1 8 ? -12.27 9.31 -17.403 1.0 22.53 8 A 4 -ATOM 111 H HD13 . ILE A1 1 8 ? -11.975 11.046 -17.511 1.0 32.23 8 A 4 -ATOM 112 N N . PHE A1 1 9 ? -15.532 12.802 -13.927 1.0 44.42 9 A 4 -ATOM 113 C CA . PHE A1 1 9 ? -16.975 13.006 -13.945 1.0 45.42 9 A 4 -ATOM 114 C C . PHE A1 1 9 ? -17.451 13.401 -15.34 1.0 62.05 9 A 4 -ATOM 115 O O . PHE A1 1 9 ? -16.954 14.36 -15.93 1.0 33.13 9 A 4 -ATOM 116 C CB . PHE A1 1 9 ? -17.371 14.085 -12.935 1.0 42.3 9 A 4 -ATOM 117 C CG . PHE A1 1 9 ? -18.024 13.538 -11.698 1.0 44.44 9 A 4 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.246 12.889 -11.773 1.0 24.21 9 A 4 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.416 13.673 -10.46 1.0 24.11 9 A 4 -ATOM 120 C CE1 . PHE A1 1 9 ? -19.849 12.384 -10.636 1.0 54.33 9 A 4 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.014 13.169 -9.321 1.0 62.43 9 A 4 -ATOM 122 C CZ . PHE A1 1 9 ? -19.233 12.525 -9.409 1.0 72.21 9 A 4 -ATOM 123 H H . PHE A1 1 9 ? -14.937 13.576 -14.018 1.0 15.35 9 A 4 -ATOM 124 H HA . PHE A1 1 9 ? -17.445 12.076 -13.667 1.0 72.15 9 A 4 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.488 14.626 -12.632 1.0 13.22 9 A 4 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.064 14.769 -13.403 1.0 20.44 9 A 4 -ATOM 127 H HD1 . PHE A1 1 9 ? -19.73 12.778 -12.733 1.0 63.23 9 A 4 -ATOM 128 H HD2 . PHE A1 1 9 ? -16.463 14.177 -10.39 1.0 43.5 9 A 4 -ATOM 129 H HE1 . PHE A1 1 9 ? -20.802 11.881 -10.709 1.0 53.21 9 A 4 -ATOM 130 H HE2 . PHE A1 1 9 ? -17.53 13.281 -8.362 1.0 61.25 9 A 4 -ATOM 131 H HZ . PHE A1 1 9 ? -19.702 12.131 -8.52 1.0 11.33 9 A 4 -ATOM 132 N N . VAL A1 1 10 ? -18.417 12.652 -15.863 1.0 35.51 10 A 4 -ATOM 133 C CA . VAL A1 1 10 ? -18.962 12.922 -17.188 1.0 51.35 10 A 4 -ATOM 134 C C . VAL A1 1 10 ? -20.435 13.308 -17.109 1.0 20.3 10 A 4 -ATOM 135 O O . VAL A1 1 10 ? -21.242 12.599 -16.507 1.0 33.54 10 A 4 -ATOM 136 C CB . VAL A1 1 10 ? -18.811 11.702 -18.116 1.0 1.24 10 A 4 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.829 12.135 -19.574 1.0 43.55 10 A 4 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.534 10.942 -17.793 1.0 70.41 10 A 4 -ATOM 139 H H . VAL A1 1 10 ? -18.773 11.9 -15.344 1.0 13.11 10 A 4 -ATOM 140 H HA . VAL A1 1 10 ? -18.407 13.744 -17.616 1.0 52.2 10 A 4 -ATOM 141 H HB . VAL A1 1 10 ? -19.65 11.043 -17.949 1.0 21.21 10 A 4 -ATOM 142 H HG11 . VAL A1 1 10 ? -18.296 11.409 -20.171 1.0 75.22 10 A 4 -ATOM 143 H HG12 . VAL A1 1 10 ? -19.851 12.206 -19.917 1.0 54.41 10 A 4 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.349 13.099 -19.669 1.0 61.31 10 A 4 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.65 10.426 -16.851 1.0 13.24 10 A 4 -ATOM 146 H HG22 . VAL A1 1 10 ? -17.335 10.225 -18.575 1.0 62.44 10 A 4 -ATOM 147 H HG23 . VAL A1 1 10 ? -16.709 11.636 -17.722 1.0 2.35 10 A 4 -ATOM 148 N N . LYS A1 1 11 ? -20.779 14.436 -17.721 1.0 23.3 11 A 4 -ATOM 149 C CA . LYS A1 1 11 ? -22.155 14.917 -17.723 1.0 10.31 11 A 4 -ATOM 150 C C . LYS A1 1 11 ? -22.798 14.722 -19.092 1.0 22.12 11 A 4 -ATOM 151 O O . LYS A1 1 11 ? -22.395 15.346 -20.074 1.0 63.21 11 A 4 -ATOM 152 C CB . LYS A1 1 11 ? -22.201 16.396 -17.332 1.0 34.41 11 A 4 -ATOM 153 C CG . LYS A1 1 11 ? -23.536 17.06 -17.621 1.0 63.11 11 A 4 -ATOM 154 C CD . LYS A1 1 11 ? -23.524 18.528 -17.229 1.0 3.15 11 A 4 -ATOM 155 C CE . LYS A1 1 11 ? -23.214 19.421 -18.421 1.0 2.52 11 A 4 -ATOM 156 N NZ . LYS A1 1 11 ? -23.396 20.863 -18.096 1.0 51.12 11 A 4 -ATOM 157 H H . LYS A1 1 11 ? -20.09 14.958 -18.184 1.0 4.15 11 A 4 -ATOM 158 H HA . LYS A1 1 11 ? -22.708 14.343 -16.994 1.0 44.21 11 A 4 -ATOM 159 H HB2 . LYS A1 1 11 ? -22.001 16.482 -16.274 1.0 75.01 11 A 4 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.434 16.924 -17.879 1.0 15.43 11 A 4 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.745 16.983 -18.678 1.0 73.24 11 A 4 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.309 16.553 -17.061 1.0 30.03 11 A 4 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.495 18.795 -16.837 1.0 63.51 11 A 4 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.772 18.683 -16.468 1.0 61.22 11 A 4 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.19 19.255 -18.721 1.0 70.24 11 A 4 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.874 19.157 -19.233 1.0 3.13 11 A 4 -ATOM 167 H HZ1 . LYS A1 1 11 ? -22.64 21.426 -18.534 1.0 1.34 11 A 4 -ATOM 168 H HZ2 . LYS A1 1 11 ? -23.366 21.003 -17.066 1.0 61.44 11 A 4 -ATOM 169 H HZ3 . LYS A1 1 11 ? -24.314 21.196 -18.453 1.0 12.11 11 A 4 -ATOM 170 N N . THR A1 1 12 ? -23.803 13.853 -19.151 1.0 60.33 12 A 4 -ATOM 171 C CA . THR A1 1 12 ? -24.501 13.576 -20.4 1.0 63.11 12 A 4 -ATOM 172 C C . THR A1 1 12 ? -25.407 14.738 -20.792 1.0 63.2 12 A 4 -ATOM 173 O O . THR A1 1 12 ? -25.77 15.565 -19.955 1.0 23.14 12 A 4 -ATOM 174 C CB . THR A1 1 12 ? -25.347 12.293 -20.298 1.0 13.53 12 A 4 -ATOM 175 O OG1 . THR A1 1 12 ? -26.496 12.527 -19.477 1.0 44.22 12 A 4 -ATOM 176 C CG2 . THR A1 1 12 ? -24.528 11.149 -19.718 1.0 44.25 12 A 4 -ATOM 177 H H . THR A1 1 12 ? -24.078 13.386 -18.335 1.0 50.31 12 A 4 -ATOM 178 H HA . THR A1 1 12 ? -23.76 13.433 -21.173 1.0 15.31 12 A 4 -ATOM 179 H HB . THR A1 1 12 ? -25.673 12.015 -21.29 1.0 3.11 12 A 4 -ATOM 180 H HG1 . THR A1 1 12 ? -27.139 11.828 -19.619 1.0 54.01 12 A 4 -ATOM 181 H HG21 . THR A1 1 12 ? -23.677 10.959 -20.354 1.0 54.24 12 A 4 -ATOM 182 H HG22 . THR A1 1 12 ? -25.14 10.261 -19.66 1.0 51.32 12 A 4 -ATOM 183 H HG23 . THR A1 1 12 ? -24.186 11.417 -18.73 1.0 74.05 12 A 4 -ATOM 184 N N . LEU A1 1 13 ? -25.769 14.795 -22.069 1.0 74.21 13 A 4 -ATOM 185 C CA . LEU A1 1 13 ? -26.634 15.856 -22.573 1.0 74.52 13 A 4 -ATOM 186 C C . LEU A1 1 13 ? -27.972 15.861 -21.841 1.0 25.21 13 A 4 -ATOM 187 O O . LEU A1 1 13 ? -28.697 16.857 -21.854 1.0 11.35 13 A 4 -ATOM 188 C CB . LEU A1 1 13 ? -26.862 15.685 -24.075 1.0 31.51 13 A 4 -ATOM 189 C CG . LEU A1 1 13 ? -27.507 16.87 -24.796 1.0 30.32 13 A 4 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.454 17.899 -25.178 1.0 44.31 13 A 4 -ATOM 191 C CD2 . LEU A1 1 13 ? -28.265 16.397 -26.027 1.0 64.01 13 A 4 -ATOM 192 H H . LEU A1 1 13 ? -25.448 14.107 -22.689 1.0 42.02 13 A 4 -ATOM 193 H HA . LEU A1 1 13 ? -26.138 16.799 -22.397 1.0 34.1 13 A 4 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.904 15.5 -24.536 1.0 62.11 13 A 4 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.5 14.824 -24.217 1.0 43.21 13 A 4 -ATOM 196 H HG . LEU A1 1 13 ? -28.213 17.347 -24.13 1.0 45.4 13 A 4 -ATOM 197 H HD11 . LEU A1 1 13 ? -26.699 18.849 -24.727 1.0 62.23 13 A 4 -ATOM 198 H HD12 . LEU A1 1 13 ? -26.429 18.006 -26.252 1.0 23.44 13 A 4 -ATOM 199 H HD13 . LEU A1 1 13 ? -25.487 17.572 -24.826 1.0 25.55 13 A 4 -ATOM 200 H HD21 . LEU A1 1 13 ? -29.16 15.877 -25.721 1.0 62.14 13 A 4 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.639 15.73 -26.601 1.0 41.34 13 A 4 -ATOM 202 H HD23 . LEU A1 1 13 ? -28.533 17.25 -26.634 1.0 51.42 13 A 4 -ATOM 203 N N . THR A1 1 14 ? -28.295 14.741 -21.2 1.0 31.41 14 A 4 -ATOM 204 C CA . THR A1 1 14 ? -29.545 14.616 -20.462 1.0 30.33 14 A 4 -ATOM 205 C C . THR A1 1 14 ? -29.377 15.067 -19.016 1.0 22.13 14 A 4 -ATOM 206 O O . THR A1 1 14 ? -30.284 14.916 -18.198 1.0 5.31 14 A 4 -ATOM 207 C CB . THR A1 1 14 ? -30.065 13.166 -20.478 1.0 34.54 14 A 4 -ATOM 208 O OG1 . THR A1 1 14 ? -29.242 12.341 -19.646 1.0 3.22 14 A 4 -ATOM 209 C CG2 . THR A1 1 14 ? -30.079 12.613 -21.895 1.0 34.11 14 A 4 -ATOM 210 H H . THR A1 1 14 ? -27.676 13.982 -21.226 1.0 2.31 14 A 4 -ATOM 211 H HA . THR A1 1 14 ? -30.281 15.246 -20.942 1.0 25.44 14 A 4 -ATOM 212 H HB . THR A1 1 14 ? -31.075 13.158 -20.094 1.0 55.24 14 A 4 -ATOM 213 H HG1 . THR A1 1 14 ? -29.792 11.71 -19.177 1.0 24.42 14 A 4 -ATOM 214 H HG21 . THR A1 1 14 ? -29.926 13.418 -22.597 1.0 1.02 14 A 4 -ATOM 215 H HG22 . THR A1 1 14 ? -31.032 12.143 -22.089 1.0 12.23 14 A 4 -ATOM 216 H HG23 . THR A1 1 14 ? -29.29 11.884 -22.005 1.0 12.42 14 A 4 -ATOM 217 N N . GLY A1 1 15 ? -28.21 15.623 -18.705 1.0 61.2 15 A 4 -ATOM 218 C CA . GLY A1 1 15 ? -27.944 16.088 -17.357 1.0 25.44 15 A 4 -ATOM 219 C C . GLY A1 1 15 ? -27.766 14.948 -16.374 1.0 2.34 15 A 4 -ATOM 220 O O . GLY A1 1 15 ? -28.458 14.879 -15.359 1.0 24.03 15 A 4 -ATOM 221 H H . GLY A1 1 15 ? -27.523 15.718 -19.398 1.0 73.22 15 A 4 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.046 16.687 -17.364 1.0 10.15 15 A 4 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.771 16.702 -17.031 1.0 23.53 15 A 4 -ATOM 224 N N . LYS A1 1 16 ? -26.836 14.049 -16.677 1.0 11.21 16 A 4 -ATOM 225 C CA . LYS A1 1 16 ? -26.568 12.904 -15.814 1.0 34.13 16 A 4 -ATOM 226 C C . LYS A1 1 16 ? -25.103 12.874 -15.391 1.0 15.24 16 A 4 -ATOM 227 O O . LYS A1 1 16 ? -24.204 12.801 -16.23 1.0 50.04 16 A 4 -ATOM 228 C CB . LYS A1 1 16 ? -26.929 11.602 -16.532 1.0 31.42 16 A 4 -ATOM 229 C CG . LYS A1 1 16 ? -27.442 10.517 -15.602 1.0 73.35 16 A 4 -ATOM 230 C CD . LYS A1 1 16 ? -26.31 9.643 -15.087 1.0 50.3 16 A 4 -ATOM 231 C CE . LYS A1 1 16 ? -25.706 8.8 -16.199 1.0 52.44 16 A 4 -ATOM 232 N NZ . LYS A1 1 16 ? -26.063 7.361 -16.06 1.0 2.53 16 A 4 -ATOM 233 H H . LYS A1 1 16 ? -26.316 14.158 -17.501 1.0 52.54 16 A 4 -ATOM 234 H HA . LYS A1 1 16 ? -27.183 13.002 -14.933 1.0 34.34 16 A 4 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.695 11.81 -17.265 1.0 44.24 16 A 4 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.051 11.228 -17.038 1.0 12.13 16 A 4 -ATOM 237 H HG2 . LYS A1 1 16 ? -27.936 10.98 -14.76 1.0 3.41 16 A 4 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.146 9.897 -16.139 1.0 74.14 16 A 4 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.539 10.276 -14.671 1.0 63.23 16 A 4 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.693 8.988 -14.318 1.0 14.51 16 A 4 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.072 9.163 -17.147 1.0 44.12 16 A 4 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.631 8.9 -16.166 1.0 75.31 16 A 4 -ATOM 243 H HZ1 . LYS A1 1 16 ? -25.929 7.053 -15.076 1.0 61.55 16 A 4 -ATOM 244 H HZ2 . LYS A1 1 16 ? -25.46 6.782 -16.679 1.0 23.15 16 A 4 -ATOM 245 H HZ3 . LYS A1 1 16 ? -27.057 7.212 -16.326 1.0 43.23 16 A 4 -ATOM 246 N N . THR A1 1 17 ? -24.868 12.929 -14.083 1.0 33.03 17 A 4 -ATOM 247 C CA . THR A1 1 17 ? -23.512 12.907 -13.549 1.0 61.21 17 A 4 -ATOM 248 C C . THR A1 1 17 ? -23.043 11.478 -13.296 1.0 13.11 17 A 4 -ATOM 249 O O . THR A1 1 17 ? -23.636 10.753 -12.497 1.0 32.24 17 A 4 -ATOM 250 C CB . THR A1 1 17 ? -23.413 13.707 -12.236 1.0 22.54 17 A 4 -ATOM 251 O OG1 . THR A1 1 17 ? -24.667 13.674 -11.546 1.0 24.32 17 A 4 -ATOM 252 C CG2 . THR A1 1 17 ? -23.017 15.15 -12.511 1.0 72.42 17 A 4 -ATOM 253 H H . THR A1 1 17 ? -25.626 12.986 -13.465 1.0 63.53 17 A 4 -ATOM 254 H HA . THR A1 1 17 ? -22.859 13.366 -14.276 1.0 15.15 17 A 4 -ATOM 255 H HB . THR A1 1 17 ? -22.655 13.254 -11.612 1.0 61.22 17 A 4 -ATOM 256 H HG1 . THR A1 1 17 ? -24.703 14.394 -10.912 1.0 54.0 17 A 4 -ATOM 257 H HG21 . THR A1 1 17 ? -23.893 15.779 -12.458 1.0 31.34 17 A 4 -ATOM 258 H HG22 . THR A1 1 17 ? -22.582 15.223 -13.496 1.0 12.24 17 A 4 -ATOM 259 H HG23 . THR A1 1 17 ? -22.297 15.472 -11.773 1.0 74.01 17 A 4 -ATOM 260 N N . ILE A1 1 18 ? -21.977 11.081 -13.981 1.0 21.15 18 A 4 -ATOM 261 C CA . ILE A1 1 18 ? -21.428 9.739 -13.829 1.0 42.23 18 A 4 -ATOM 262 C C . ILE A1 1 18 ? -19.948 9.788 -13.466 1.0 2.02 18 A 4 -ATOM 263 O O . ILE A1 1 18 ? -19.206 10.645 -13.948 1.0 34.24 18 A 4 -ATOM 264 C CB . ILE A1 1 18 ? -21.602 8.911 -15.116 1.0 20.13 18 A 4 -ATOM 265 C CG1 . ILE A1 1 18 ? -20.806 7.607 -15.02 1.0 0.43 18 A 4 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.164 9.717 -16.329 1.0 34.34 18 A 4 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.088 6.643 -16.151 1.0 41.12 18 A 4 -ATOM 268 H H . ILE A1 1 18 ? -21.548 11.705 -14.603 1.0 72.35 18 A 4 -ATOM 269 H HA . ILE A1 1 18 ? -21.967 9.247 -13.032 1.0 33.1 18 A 4 -ATOM 270 H HB . ILE A1 1 18 ? -22.65 8.677 -15.228 1.0 55.23 18 A 4 -ATOM 271 H HG12 . ILE A1 1 18 ? -19.752 7.834 -15.034 1.0 35.45 18 A 4 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.052 7.112 -14.092 1.0 15.51 18 A 4 -ATOM 273 H HG21 . ILE A1 1 18 ? -20.259 10.259 -16.093 1.0 31.24 18 A 4 -ATOM 274 H HG22 . ILE A1 1 18 ? -20.976 9.05 -17.156 1.0 60.32 18 A 4 -ATOM 275 H HG23 . ILE A1 1 18 ? -21.942 10.416 -16.597 1.0 71.44 18 A 4 -ATOM 276 H HD11 . ILE A1 1 18 ? -21.599 7.163 -16.949 1.0 32.31 18 A 4 -ATOM 277 H HD12 . ILE A1 1 18 ? -20.157 6.242 -16.524 1.0 60.24 18 A 4 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.71 5.837 -15.792 1.0 25.35 18 A 4 -ATOM 279 N N . THR A1 1 19 ? -19.522 8.862 -12.612 1.0 42.32 19 A 4 -ATOM 280 C CA . THR A1 1 19 ? -18.131 8.799 -12.184 1.0 41.24 19 A 4 -ATOM 281 C C . THR A1 1 19 ? -17.468 7.51 -12.657 1.0 70.21 19 A 4 -ATOM 282 O O . THR A1 1 19 ? -18.069 6.436 -12.602 1.0 44.42 19 A 4 -ATOM 283 C CB . THR A1 1 19 ? -18.009 8.893 -10.651 1.0 2.4 19 A 4 -ATOM 284 O OG1 . THR A1 1 19 ? -19.274 9.249 -10.081 1.0 22.32 19 A 4 -ATOM 285 C CG2 . THR A1 1 19 ? -16.96 9.92 -10.253 1.0 13.14 19 A 4 -ATOM 286 H H . THR A1 1 19 ? -20.161 8.207 -12.262 1.0 1.15 19 A 4 -ATOM 287 H HA . THR A1 1 19 ? -17.61 9.64 -12.618 1.0 65.43 19 A 4 -ATOM 288 H HB . THR A1 1 19 ? -17.71 7.927 -10.269 1.0 44.24 19 A 4 -ATOM 289 H HG1 . THR A1 1 19 ? -19.487 8.64 -9.369 1.0 60.25 19 A 4 -ATOM 290 H HG21 . THR A1 1 19 ? -15.987 9.454 -10.244 1.0 73.33 19 A 4 -ATOM 291 H HG22 . THR A1 1 19 ? -17.186 10.302 -9.269 1.0 23.45 19 A 4 -ATOM 292 H HG23 . THR A1 1 19 ? -16.964 10.732 -10.965 1.0 51.03 19 A 4 -ATOM 293 N N . ILE A1 1 20 ? -16.228 7.623 -13.119 1.0 2.13 20 A 4 -ATOM 294 C CA . ILE A1 1 20 ? -15.484 6.465 -13.6 1.0 23.24 20 A 4 -ATOM 295 C C . ILE A1 1 20 ? -14.011 6.561 -13.218 1.0 21.51 20 A 4 -ATOM 296 O O . ILE A1 1 20 ? -13.374 7.596 -13.415 1.0 3.54 20 A 4 -ATOM 297 C CB . ILE A1 1 20 ? -15.597 6.317 -15.128 1.0 55.55 20 A 4 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.636 7.695 -15.794 1.0 1.5 20 A 4 -ATOM 299 C CG2 . ILE A1 1 20 ? -16.836 5.513 -15.492 1.0 1.32 20 A 4 -ATOM 300 C CD1 . ILE A1 1 20 ? -14.951 7.733 -17.142 1.0 2.4 20 A 4 -ATOM 301 H H . ILE A1 1 20 ? -15.803 8.505 -13.137 1.0 32.52 20 A 4 -ATOM 302 H HA . ILE A1 1 20 ? -15.907 5.583 -13.14 1.0 40.32 20 A 4 -ATOM 303 H HB . ILE A1 1 20 ? -14.731 5.779 -15.481 1.0 75.22 20 A 4 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.663 7.991 -15.936 1.0 4.24 20 A 4 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.145 8.411 -15.151 1.0 20.02 20 A 4 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.002 4.75 -14.746 1.0 41.11 20 A 4 -ATOM 307 H HG22 . ILE A1 1 20 ? -17.693 6.169 -15.531 1.0 51.34 20 A 4 -ATOM 308 H HG23 . ILE A1 1 20 ? -16.694 5.048 -16.456 1.0 74.34 20 A 4 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.089 6.786 -17.643 1.0 44.23 20 A 4 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.38 8.522 -17.742 1.0 43.31 20 A 4 -ATOM 311 H HD13 . ILE A1 1 20 ? -13.896 7.916 -17.006 1.0 23.14 20 A 4 -ATOM 312 N N . ASP A1 1 21 ? -13.475 5.475 -12.672 1.0 44.41 21 A 4 -ATOM 313 C CA . ASP A1 1 21 ? -12.075 5.435 -12.265 1.0 13.43 21 A 4 -ATOM 314 C C . ASP A1 1 21 ? -11.171 5.124 -13.454 1.0 74.52 21 A 4 -ATOM 315 O O . ASP A1 1 21 ? -11.327 4.096 -14.113 1.0 3.25 21 A 4 -ATOM 316 C CB . ASP A1 1 21 ? -11.871 4.391 -11.166 1.0 40.32 21 A 4 -ATOM 317 C CG . ASP A1 1 21 ? -12.204 2.987 -11.633 1.0 70.32 21 A 4 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.365 2.754 -12.031 1.0 34.41 21 A 4 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.305 2.122 -11.601 1.0 4.34 21 A 4 -ATOM 320 H H . ASP A1 1 21 ? -14.034 4.681 -12.541 1.0 61.24 21 A 4 -ATOM 321 H HA . ASP A1 1 21 ? -11.815 6.408 -11.876 1.0 0.1 21 A 4 -ATOM 322 H HB2 . ASP A1 1 21 ? -10.838 4.408 -10.849 1.0 73.15 21 A 4 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.505 4.632 -10.327 1.0 61.23 21 A 4 -ATOM 324 N N . VAL A1 1 22 ? -10.227 6.02 -13.724 1.0 30.34 22 A 4 -ATOM 325 C CA . VAL A1 1 22 ? -9.298 5.842 -14.833 1.0 1.34 22 A 4 -ATOM 326 C C . VAL A1 1 22 ? -7.868 6.154 -14.409 1.0 61.2 22 A 4 -ATOM 327 O O . VAL A1 1 22 ? -7.64 6.78 -13.373 1.0 34.03 22 A 4 -ATOM 328 C CB . VAL A1 1 22 ? -9.675 6.737 -16.029 1.0 60.13 22 A 4 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.14 7.137 -15.957 1.0 14.0 22 A 4 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.779 7.966 -16.077 1.0 61.12 22 A 4 -ATOM 331 H H . VAL A1 1 22 ? -10.153 6.82 -13.162 1.0 71.0 22 A 4 -ATOM 332 H HA . VAL A1 1 22 ? -9.352 4.811 -15.151 1.0 41.13 22 A 4 -ATOM 333 H HB . VAL A1 1 22 ? -9.523 6.172 -16.937 1.0 23.42 22 A 4 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.742 6.263 -15.758 1.0 3.13 22 A 4 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.278 7.859 -15.164 1.0 11.12 22 A 4 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.441 7.574 -16.898 1.0 2.3 22 A 4 -ATOM 337 H HG21 . VAL A1 1 22 ? -7.786 7.676 -16.387 1.0 43.3 22 A 4 -ATOM 338 H HG22 . VAL A1 1 22 ? -9.184 8.678 -16.781 1.0 71.52 22 A 4 -ATOM 339 H HG23 . VAL A1 1 22 ? -8.733 8.416 -15.096 1.0 24.41 22 A 4 -ATOM 340 N N . ASP A1 1 23 ? -6.908 5.715 -15.216 1.0 73.14 23 A 4 -ATOM 341 C CA . ASP A1 1 23 ? -5.498 5.95 -14.925 1.0 0.33 23 A 4 -ATOM 342 C C . ASP A1 1 23 ? -4.864 6.838 -15.99 1.0 62.12 23 A 4 -ATOM 343 O O . ASP A1 1 23 ? -5.309 6.863 -17.138 1.0 35.34 23 A 4 -ATOM 344 C CB . ASP A1 1 23 ? -4.746 4.621 -14.837 1.0 24.44 23 A 4 -ATOM 345 C CG . ASP A1 1 23 ? -5.61 3.502 -14.287 1.0 11.25 23 A 4 -ATOM 346 O OD1 . ASP A1 1 23 ? -6.152 3.664 -13.174 1.0 71.52 23 A 4 -ATOM 347 O OD2 . ASP A1 1 23 ? -5.742 2.465 -14.97 1.0 54.12 23 A 4 -ATOM 348 H H . ASP A1 1 23 ? -7.154 5.223 -16.027 1.0 71.31 23 A 4 -ATOM 349 H HA . ASP A1 1 23 ? -5.436 6.452 -13.971 1.0 62.03 23 A 4 -ATOM 350 H HB2 . ASP A1 1 23 ? -4.41 4.339 -15.824 1.0 75.32 23 A 4 -ATOM 351 H HB3 . ASP A1 1 23 ? -3.89 4.742 -14.19 1.0 32.1 23 A 4 -ATOM 352 N N . HIS A1 1 24 ? -3.822 7.567 -15.603 1.0 3.42 24 A 4 -ATOM 353 C CA . HIS A1 1 24 ? -3.127 8.457 -16.525 1.0 64.1 24 A 4 -ATOM 354 C C . HIS A1 1 24 ? -2.55 7.677 -17.702 1.0 13.22 24 A 4 -ATOM 355 O O . HIS A1 1 24 ? -2.192 8.257 -18.727 1.0 40.32 24 A 4 -ATOM 356 C CB . HIS A1 1 24 ? -2.009 9.207 -15.798 1.0 43.52 24 A 4 -ATOM 357 C CG . HIS A1 1 24 ? -1.103 8.313 -15.009 1.0 63.23 24 A 4 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.088 7.575 -15.581 1.0 33.23 24 A 4 -ATOM 359 C CD2 . HIS A1 1 24 ? -1.063 8.041 -13.684 1.0 70.35 24 A 4 -ATOM 360 C CE1 . HIS A1 1 24 ? 0.536 6.887 -14.642 1.0 52.22 24 A 4 -ATOM 361 N NE2 . HIS A1 1 24 ? -0.035 7.152 -13.482 1.0 51.1 24 A 4 -ATOM 362 H H . HIS A1 1 24 ? -3.514 7.504 -14.675 1.0 35.01 24 A 4 -ATOM 363 H HA . HIS A1 1 24 ? -3.843 9.172 -16.899 1.0 52.33 24 A 4 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.406 9.732 -16.524 1.0 74.33 24 A 4 -ATOM 365 H HB3 . HIS A1 1 24 ? -2.448 9.921 -15.117 1.0 2.24 24 A 4 -ATOM 366 H HD1 . HIS A1 1 24 ? 0.139 7.558 -16.534 1.0 61.24 24 A 4 -ATOM 367 H HD2 . HIS A1 1 24 ? -1.717 8.447 -12.925 1.0 14.35 24 A 4 -ATOM 368 H HE1 . HIS A1 1 24 ? 1.372 6.221 -14.797 1.0 73.24 24 A 4 -ATOM 369 N N . ALA A1 1 25 ? -2.462 6.36 -17.547 1.0 63.43 25 A 4 -ATOM 370 C CA . ALA A1 1 25 ? -1.931 5.501 -18.598 1.0 43.32 25 A 4 -ATOM 371 C C . ALA A1 1 25 ? -3.023 5.098 -19.583 1.0 33.54 25 A 4 -ATOM 372 O O . ALA A1 1 25 ? -2.8 4.269 -20.466 1.0 12.23 25 A 4 -ATOM 373 C CB . ALA A1 1 25 ? -1.282 4.266 -17.992 1.0 51.34 25 A 4 -ATOM 374 H H . ALA A1 1 25 ? -2.764 5.957 -16.707 1.0 55.41 25 A 4 -ATOM 375 H HA . ALA A1 1 25 ? -1.168 6.055 -19.128 1.0 23.12 25 A 4 -ATOM 376 H HB1 . ALA A1 1 25 ? -1.008 3.58 -18.78 1.0 42.21 25 A 4 -ATOM 377 H HB2 . ALA A1 1 25 ? -0.398 4.556 -17.443 1.0 3.14 25 A 4 -ATOM 378 H HB3 . ALA A1 1 25 ? -1.98 3.785 -17.323 1.0 44.44 25 A 4 -ATOM 379 N N . ASP A1 1 26 ? -4.202 5.689 -19.425 1.0 53.31 26 A 4 -ATOM 380 C CA . ASP A1 1 26 ? -5.329 5.391 -20.301 1.0 71.32 26 A 4 -ATOM 381 C C . ASP A1 1 26 ? -5.487 6.47 -21.369 1.0 31.24 26 A 4 -ATOM 382 O O . ASP A1 1 26 ? -4.614 7.321 -21.541 1.0 53.43 26 A 4 -ATOM 383 C CB . ASP A1 1 26 ? -6.618 5.27 -19.487 1.0 21.1 26 A 4 -ATOM 384 C CG . ASP A1 1 26 ? -6.574 4.118 -18.501 1.0 73.54 26 A 4 -ATOM 385 O OD1 . ASP A1 1 26 ? -5.57 4.004 -17.766 1.0 73.22 26 A 4 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.543 3.332 -18.465 1.0 2.02 26 A 4 -ATOM 387 H H . ASP A1 1 26 ? -4.317 6.341 -18.703 1.0 73.33 26 A 4 -ATOM 388 H HA . ASP A1 1 26 ? -5.132 4.448 -20.788 1.0 35.3 26 A 4 -ATOM 389 H HB2 . ASP A1 1 26 ? -6.775 6.185 -18.935 1.0 71.15 26 A 4 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.448 5.113 -20.159 1.0 51.4 26 A 4 -ATOM 391 N N . THR A1 1 27 ? -6.607 6.427 -22.084 1.0 11.22 27 A 4 -ATOM 392 C CA . THR A1 1 27 ? -6.879 7.399 -23.136 1.0 12.11 27 A 4 -ATOM 393 C C . THR A1 1 27 ? -8.37 7.698 -23.236 1.0 24.55 27 A 4 -ATOM 394 O O . THR A1 1 27 ? -9.2 6.948 -22.723 1.0 14.34 27 A 4 -ATOM 395 C CB . THR A1 1 27 ? -6.374 6.902 -24.504 1.0 24.42 27 A 4 -ATOM 396 O OG1 . THR A1 1 27 ? -6.34 5.47 -24.523 1.0 51.41 27 A 4 -ATOM 397 C CG2 . THR A1 1 27 ? -4.987 7.451 -24.801 1.0 72.22 27 A 4 -ATOM 398 H H . THR A1 1 27 ? -7.265 5.725 -21.899 1.0 1.33 27 A 4 -ATOM 399 H HA . THR A1 1 27 ? -6.354 8.311 -22.892 1.0 54.42 27 A 4 -ATOM 400 H HB . THR A1 1 27 ? -7.054 7.248 -25.269 1.0 51.23 27 A 4 -ATOM 401 H HG1 . THR A1 1 27 ? -5.595 5.161 -24.002 1.0 23.44 27 A 4 -ATOM 402 H HG21 . THR A1 1 27 ? -4.641 7.061 -25.746 1.0 20.21 27 A 4 -ATOM 403 H HG22 . THR A1 1 27 ? -4.306 7.154 -24.017 1.0 40.31 27 A 4 -ATOM 404 H HG23 . THR A1 1 27 ? -5.03 8.529 -24.851 1.0 53.14 27 A 4 -ATOM 405 N N . VAL A1 1 28 ? -8.705 8.8 -23.9 1.0 70.04 28 A 4 -ATOM 406 C CA . VAL A1 1 28 ? -10.098 9.198 -24.069 1.0 40.12 28 A 4 -ATOM 407 C C . VAL A1 1 28 ? -10.922 8.069 -24.678 1.0 43.3 28 A 4 -ATOM 408 O O . VAL A1 1 28 ? -11.996 7.733 -24.182 1.0 51.44 28 A 4 -ATOM 409 C CB . VAL A1 1 28 ? -10.22 10.448 -24.961 1.0 70.14 28 A 4 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.641 10.99 -24.927 1.0 13.41 28 A 4 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.223 11.512 -24.526 1.0 73.55 28 A 4 -ATOM 412 H H . VAL A1 1 28 ? -7.998 9.358 -24.287 1.0 50.23 28 A 4 -ATOM 413 H HA . VAL A1 1 28 ? -10.497 9.437 -23.094 1.0 62.42 28 A 4 -ATOM 414 H HB . VAL A1 1 28 ? -9.991 10.163 -25.977 1.0 52.41 28 A 4 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.796 11.533 -24.006 1.0 72.32 28 A 4 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.793 11.652 -25.767 1.0 75.12 28 A 4 -ATOM 417 H HG13 . VAL A1 1 28 ? -12.341 10.17 -24.983 1.0 43.12 28 A 4 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.618 11.804 -25.371 1.0 22.23 28 A 4 -ATOM 419 H HG22 . VAL A1 1 28 ? -9.757 12.371 -24.15 1.0 21.24 28 A 4 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.588 11.114 -23.748 1.0 51.43 28 A 4 -ATOM 421 N N . GLY A1 1 29 ? -10.41 7.486 -25.758 1.0 51.02 29 A 4 -ATOM 422 C CA . GLY A1 1 29 ? -11.111 6.401 -26.418 1.0 24.21 29 A 4 -ATOM 423 C C . GLY A1 1 29 ? -11.527 5.308 -25.453 1.0 62.32 29 A 4 -ATOM 424 O O . GLY A1 1 29 ? -12.684 4.887 -25.443 1.0 1.41 29 A 4 -ATOM 425 H H . GLY A1 1 29 ? -9.549 7.796 -26.11 1.0 25.44 29 A 4 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.993 6.797 -26.9 1.0 33.14 29 A 4 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.464 5.974 -27.17 1.0 61.11 29 A 4 -ATOM 428 N N . ALA A1 1 30 ? -10.582 4.847 -24.641 1.0 0.3 30 A 4 -ATOM 429 C CA . ALA A1 1 30 ? -10.857 3.797 -23.668 1.0 24.42 30 A 4 -ATOM 430 C C . ALA A1 1 30 ? -11.939 4.229 -22.684 1.0 23.15 30 A 4 -ATOM 431 O O . ALA A1 1 30 ? -12.821 3.446 -22.332 1.0 23.32 30 A 4 -ATOM 432 C CB . ALA A1 1 30 ? -9.584 3.421 -22.924 1.0 4.23 30 A 4 -ATOM 433 H H . ALA A1 1 30 ? -9.679 5.223 -24.696 1.0 13.0 30 A 4 -ATOM 434 H HA . ALA A1 1 30 ? -11.201 2.925 -24.206 1.0 42.35 30 A 4 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.352 2.382 -23.111 1.0 24.3 30 A 4 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.77 4.04 -23.269 1.0 15.25 30 A 4 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.729 3.572 -21.865 1.0 54.13 30 A 4 -ATOM 438 N N . VAL A1 1 31 ? -11.865 5.481 -22.243 1.0 44.02 31 A 4 -ATOM 439 C CA . VAL A1 1 31 ? -12.838 6.018 -21.3 1.0 44.43 31 A 4 -ATOM 440 C C . VAL A1 1 31 ? -14.244 6.0 -21.89 1.0 22.33 31 A 4 -ATOM 441 O O . VAL A1 1 31 ? -15.209 5.644 -21.215 1.0 41.34 31 A 4 -ATOM 442 C CB . VAL A1 1 31 ? -12.485 7.459 -20.887 1.0 42.01 31 A 4 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.566 8.038 -19.988 1.0 61.22 31 A 4 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.129 7.498 -20.198 1.0 34.2 31 A 4 -ATOM 445 H H . VAL A1 1 31 ? -11.139 6.057 -22.56 1.0 33.11 31 A 4 -ATOM 446 H HA . VAL A1 1 31 ? -12.823 5.399 -20.415 1.0 53.53 31 A 4 -ATOM 447 H HB . VAL A1 1 31 ? -12.429 8.064 -21.78 1.0 34.14 31 A 4 -ATOM 448 H HG11 . VAL A1 1 31 ? -13.106 8.605 -19.192 1.0 24.43 31 A 4 -ATOM 449 H HG12 . VAL A1 1 31 ? -14.209 8.684 -20.567 1.0 62.24 31 A 4 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.15 7.234 -19.564 1.0 4.44 31 A 4 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.881 6.513 -19.834 1.0 32.4 31 A 4 -ATOM 452 H HG22 . VAL A1 1 31 ? -10.377 7.822 -20.903 1.0 31.51 31 A 4 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.166 8.19 -19.369 1.0 2.41 31 A 4 -ATOM 454 N N . LYS A1 1 32 ? -14.352 6.387 -23.157 1.0 44.33 32 A 4 -ATOM 455 C CA . LYS A1 1 32 ? -15.639 6.415 -23.842 1.0 33.41 32 A 4 -ATOM 456 C C . LYS A1 1 32 ? -16.316 5.049 -23.783 1.0 33.52 32 A 4 -ATOM 457 O O . LYS A1 1 32 ? -17.521 4.953 -23.553 1.0 55.22 32 A 4 -ATOM 458 C CB . LYS A1 1 32 ? -15.455 6.842 -25.3 1.0 21.43 32 A 4 -ATOM 459 C CG . LYS A1 1 32 ? -16.161 8.141 -25.647 1.0 62.04 32 A 4 -ATOM 460 C CD . LYS A1 1 32 ? -15.201 9.319 -25.634 1.0 13.3 32 A 4 -ATOM 461 C CE . LYS A1 1 32 ? -14.724 9.664 -27.036 1.0 61.02 32 A 4 -ATOM 462 N NZ . LYS A1 1 32 ? -14.215 8.467 -27.759 1.0 10.13 32 A 4 -ATOM 463 H H . LYS A1 1 32 ? -13.545 6.66 -23.644 1.0 0.43 32 A 4 -ATOM 464 H HA . LYS A1 1 32 ? -16.266 7.136 -23.341 1.0 20.21 32 A 4 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.4 6.967 -25.495 1.0 31.13 32 A 4 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.842 6.064 -25.942 1.0 51.43 32 A 4 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.593 8.053 -26.633 1.0 34.55 32 A 4 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.945 8.318 -24.924 1.0 75.31 32 A 4 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.704 10.178 -25.215 1.0 62.53 32 A 4 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.345 9.067 -25.023 1.0 34.24 32 A 4 -ATOM 471 H HE2 . LYS A1 1 32 ? -15.549 10.085 -27.59 1.0 32.35 32 A 4 -ATOM 472 H HE3 . LYS A1 1 32 ? -13.931 10.394 -26.962 1.0 31.14 32 A 4 -ATOM 473 H HZ1 . LYS A1 1 32 ? -13.661 7.868 -27.114 1.0 3.34 32 A 4 -ATOM 474 H HZ2 . LYS A1 1 32 ? -13.606 8.76 -28.551 1.0 11.13 32 A 4 -ATOM 475 H HZ3 . LYS A1 1 32 ? -15.009 7.912 -28.135 1.0 13.55 32 A 4 -ATOM 476 N N . ALA A1 1 33 ? -15.533 3.996 -23.99 1.0 34.21 33 A 4 -ATOM 477 C CA . ALA A1 1 33 ? -16.056 2.636 -23.956 1.0 60.31 33 A 4 -ATOM 478 C C . ALA A1 1 33 ? -16.579 2.283 -22.568 1.0 31.03 33 A 4 -ATOM 479 O O . ALA A1 1 33 ? -17.616 1.634 -22.43 1.0 31.32 33 A 4 -ATOM 480 C CB . ALA A1 1 33 ? -14.984 1.647 -24.386 1.0 54.24 33 A 4 -ATOM 481 H H . ALA A1 1 33 ? -14.58 4.137 -24.168 1.0 43.1 33 A 4 -ATOM 482 H HA . ALA A1 1 33 ? -16.872 2.575 -24.663 1.0 53.01 33 A 4 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.07 1.85 -23.847 1.0 2.33 33 A 4 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.314 0.642 -24.17 1.0 61.23 33 A 4 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.806 1.747 -25.447 1.0 53.23 33 A 4 -ATOM 486 N N . LYS A1 1 34 ? -15.854 2.714 -21.541 1.0 30.14 34 A 4 -ATOM 487 C CA . LYS A1 1 34 ? -16.243 2.444 -20.162 1.0 3.41 34 A 4 -ATOM 488 C C . LYS A1 1 34 ? -17.611 3.046 -19.856 1.0 51.04 34 A 4 -ATOM 489 O O . LYS A1 1 34 ? -18.462 2.398 -19.245 1.0 30.3 34 A 4 -ATOM 490 C CB . LYS A1 1 34 ? -15.199 3.007 -19.196 1.0 63.02 34 A 4 -ATOM 491 C CG . LYS A1 1 34 ? -15.478 2.679 -17.739 1.0 24.43 34 A 4 -ATOM 492 C CD . LYS A1 1 34 ? -15.405 1.183 -17.481 1.0 44.42 34 A 4 -ATOM 493 C CE . LYS A1 1 34 ? -14.015 0.635 -17.763 1.0 34.12 34 A 4 -ATOM 494 N NZ . LYS A1 1 34 ? -13.881 -0.785 -17.337 1.0 13.0 34 A 4 -ATOM 495 H H . LYS A1 1 34 ? -15.037 3.227 -21.715 1.0 65.25 34 A 4 -ATOM 496 H HA . LYS A1 1 34 ? -16.298 1.374 -20.036 1.0 3.22 34 A 4 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.231 2.603 -19.455 1.0 71.03 34 A 4 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.17 4.082 -19.302 1.0 71.12 34 A 4 -ATOM 499 H HG2 . LYS A1 1 34 ? -14.746 3.176 -17.121 1.0 24.23 34 A 4 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.467 3.032 -17.484 1.0 22.21 34 A 4 -ATOM 501 H HD2 . LYS A1 1 34 ? -15.652 0.992 -16.447 1.0 63.43 34 A 4 -ATOM 502 H HD3 . LYS A1 1 34 ? -16.117 0.681 -18.121 1.0 75.33 34 A 4 -ATOM 503 H HE2 . LYS A1 1 34 ? -13.823 0.704 -18.822 1.0 34.14 34 A 4 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.292 1.233 -17.227 1.0 0.12 34 A 4 -ATOM 505 H HZ1 . LYS A1 1 34 ? -14.136 -0.884 -16.334 1.0 62.42 34 A 4 -ATOM 506 H HZ2 . LYS A1 1 34 ? -12.9 -1.106 -17.468 1.0 14.2 34 A 4 -ATOM 507 H HZ3 . LYS A1 1 34 ? -14.51 -1.389 -17.905 1.0 65.2 34 A 4 -ATOM 508 N N . ILE A1 1 35 ? -17.816 4.287 -20.284 1.0 14.42 35 A 4 -ATOM 509 C CA . ILE A1 1 35 ? -19.081 4.974 -20.057 1.0 22.32 35 A 4 -ATOM 510 C C . ILE A1 1 35 ? -20.213 4.314 -20.838 1.0 74.31 35 A 4 -ATOM 511 O O . ILE A1 1 35 ? -21.347 4.238 -20.364 1.0 33.23 35 A 4 -ATOM 512 C CB . ILE A1 1 35 ? -18.995 6.459 -20.456 1.0 42.5 35 A 4 -ATOM 513 C CG1 . ILE A1 1 35 ? -17.817 7.132 -19.749 1.0 22.04 35 A 4 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.297 7.173 -20.125 1.0 45.14 35 A 4 -ATOM 515 C CD1 . ILE A1 1 35 ? -17.859 6.996 -18.243 1.0 11.1 35 A 4 -ATOM 516 H H . ILE A1 1 35 ? -17.099 4.751 -20.765 1.0 54.44 35 A 4 -ATOM 517 H HA . ILE A1 1 35 ? -19.306 4.918 -19.002 1.0 30.01 35 A 4 -ATOM 518 H HB . ILE A1 1 35 ? -18.844 6.514 -21.523 1.0 2.44 35 A 4 -ATOM 519 H HG12 . ILE A1 1 35 ? -16.897 6.69 -20.095 1.0 3.24 35 A 4 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.819 8.186 -19.988 1.0 0.11 35 A 4 -ATOM 521 H HG21 . ILE A1 1 35 ? -21.127 6.616 -20.535 1.0 65.32 35 A 4 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.406 7.243 -19.053 1.0 43.1 35 A 4 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.283 8.164 -20.552 1.0 75.41 35 A 4 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.033 6.382 -17.914 1.0 43.52 35 A 4 -ATOM 525 H HD12 . ILE A1 1 35 ? -17.783 7.974 -17.79 1.0 71.15 35 A 4 -ATOM 526 H HD13 . ILE A1 1 35 ? -18.789 6.534 -17.948 1.0 74.3 35 A 4 -ATOM 527 N N . TYR A1 1 36 ? -19.897 3.836 -22.036 1.0 62.53 36 A 4 -ATOM 528 C CA . TYR A1 1 36 ? -20.887 3.182 -22.884 1.0 64.44 36 A 4 -ATOM 529 C C . TYR A1 1 36 ? -21.531 2.004 -22.16 1.0 53.42 36 A 4 -ATOM 530 O O . TYR A1 1 36 ? -22.75 1.836 -22.187 1.0 34.33 36 A 4 -ATOM 531 C CB . TYR A1 1 36 ? -20.239 2.704 -24.185 1.0 74.42 36 A 4 -ATOM 532 C CG . TYR A1 1 36 ? -20.606 1.285 -24.557 1.0 43.51 36 A 4 -ATOM 533 C CD1 . TYR A1 1 36 ? -21.879 0.974 -25.019 1.0 62.31 36 A 4 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.68 0.255 -24.447 1.0 22.21 36 A 4 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.219 -0.321 -25.36 1.0 25.24 36 A 4 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.01 -1.042 -24.787 1.0 24.41 36 A 4 -ATOM 537 C CZ . TYR A1 1 36 ? -21.281 -1.325 -25.243 1.0 51.0 36 A 4 -ATOM 538 O OH . TYR A1 1 36 ? -21.614 -2.617 -25.581 1.0 31.41 36 A 4 -ATOM 539 H H . TYR A1 1 36 ? -18.976 3.926 -22.36 1.0 42.53 36 A 4 -ATOM 540 H HA . TYR A1 1 36 ? -21.652 3.907 -23.12 1.0 45.34 36 A 4 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.55 3.349 -24.992 1.0 32.41 36 A 4 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.165 2.754 -24.083 1.0 73.31 36 A 4 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.612 1.763 -25.11 1.0 14.41 36 A 4 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.685 0.481 -24.089 1.0 73.43 36 A 4 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.213 -0.543 -25.717 1.0 30.0 36 A 4 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.276 -1.829 -24.694 1.0 11.1 36 A 4 -ATOM 547 H HH . TYR A1 1 36 ? -20.841 -3.066 -25.93 1.0 20.21 36 A 4 -ATOM 548 N N . ASP A1 1 37 ? -20.703 1.192 -21.513 1.0 31.31 37 A 4 -ATOM 549 C CA . ASP A1 1 37 ? -21.19 0.029 -20.779 1.0 4.3 37 A 4 -ATOM 550 C C . ASP A1 1 37 ? -21.845 0.45 -19.467 1.0 30.32 37 A 4 -ATOM 551 O O . ASP A1 1 37 ? -22.77 -0.203 -18.984 1.0 62.0 37 A 4 -ATOM 552 C CB . ASP A1 1 37 ? -20.043 -0.943 -20.502 1.0 35.43 37 A 4 -ATOM 553 C CG . ASP A1 1 37 ? -20.524 -2.369 -20.32 1.0 34.32 37 A 4 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.733 -2.561 -20.071 1.0 31.12 37 A 4 -ATOM 555 O OD2 . ASP A1 1 37 ? -19.691 -3.294 -20.427 1.0 3.2 37 A 4 -ATOM 556 H H . ASP A1 1 37 ? -19.741 1.379 -21.528 1.0 51.42 37 A 4 -ATOM 557 H HA . ASP A1 1 37 ? -21.928 -0.465 -21.393 1.0 32.24 37 A 4 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.351 -0.92 -21.331 1.0 43.14 37 A 4 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.53 -0.637 -19.602 1.0 34.23 37 A 4 -ATOM 560 N N . LYS A1 1 38 ? -21.358 1.546 -18.893 1.0 33.03 38 A 4 -ATOM 561 C CA . LYS A1 1 38 ? -21.895 2.055 -17.637 1.0 33.5 38 A 4 -ATOM 562 C C . LYS A1 1 38 ? -23.404 2.258 -17.733 1.0 62.1 38 A 4 -ATOM 563 O O . LYS A1 1 38 ? -24.15 1.863 -16.837 1.0 13.24 38 A 4 -ATOM 564 C CB . LYS A1 1 38 ? -21.215 3.375 -17.266 1.0 32.13 38 A 4 -ATOM 565 C CG . LYS A1 1 38 ? -20.384 3.295 -15.997 1.0 11.13 38 A 4 -ATOM 566 C CD . LYS A1 1 38 ? -18.926 2.995 -16.304 1.0 55.11 38 A 4 -ATOM 567 C CE . LYS A1 1 38 ? -18.678 1.499 -16.426 1.0 12.13 38 A 4 -ATOM 568 N NZ . LYS A1 1 38 ? -18.087 0.932 -15.182 1.0 62.42 38 A 4 -ATOM 569 H H . LYS A1 1 38 ? -20.62 2.024 -19.327 1.0 40.1 38 A 4 -ATOM 570 H HA . LYS A1 1 38 ? -21.69 1.325 -16.869 1.0 13.43 38 A 4 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.568 3.673 -18.078 1.0 53.44 38 A 4 -ATOM 572 H HB3 . LYS A1 1 38 ? -21.975 4.13 -17.126 1.0 74.35 38 A 4 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.444 4.24 -15.478 1.0 72.35 38 A 4 -ATOM 574 H HG3 . LYS A1 1 38 ? -20.778 2.51 -15.368 1.0 65.33 38 A 4 -ATOM 575 H HD2 . LYS A1 1 38 ? -18.658 3.47 -17.236 1.0 31.44 38 A 4 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.311 3.39 -15.508 1.0 51.13 38 A 4 -ATOM 577 H HE2 . LYS A1 1 38 ? -19.617 1.007 -16.625 1.0 72.24 38 A 4 -ATOM 578 H HE3 . LYS A1 1 38 ? -18.0 1.326 -17.248 1.0 52.14 38 A 4 -ATOM 579 H HZ1 . LYS A1 1 38 ? -17.541 0.075 -15.404 1.0 12.21 38 A 4 -ATOM 580 H HZ2 . LYS A1 1 38 ? -18.841 0.686 -14.509 1.0 31.3 38 A 4 -ATOM 581 H HZ3 . LYS A1 1 38 ? -17.455 1.628 -14.737 1.0 72.13 38 A 4 -ATOM 582 N N . GLU A1 1 39 ? -23.846 2.874 -18.825 1.0 74.33 39 A 4 -ATOM 583 C CA . GLU A1 1 39 ? -25.266 3.128 -19.036 1.0 31.43 39 A 4 -ATOM 584 C C . GLU A1 1 39 ? -25.788 2.335 -20.231 1.0 55.55 39 A 4 -ATOM 585 O O . GLU A1 1 39 ? -26.766 1.597 -20.121 1.0 44.25 39 A 4 -ATOM 586 C CB . GLU A1 1 39 ? -25.513 4.622 -19.253 1.0 31.12 39 A 4 -ATOM 587 C CG . GLU A1 1 39 ? -24.469 5.29 -20.132 1.0 22.34 39 A 4 -ATOM 588 C CD . GLU A1 1 39 ? -24.592 6.801 -20.138 1.0 34.02 39 A 4 -ATOM 589 O OE1 . GLU A1 1 39 ? -25.691 7.308 -19.825 1.0 60.52 39 A 4 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.592 7.478 -20.455 1.0 24.54 39 A 4 -ATOM 591 H H . GLU A1 1 39 ? -23.202 3.165 -19.503 1.0 53.12 39 A 4 -ATOM 592 H HA . GLU A1 1 39 ? -25.795 2.81 -18.15 1.0 24.23 39 A 4 -ATOM 593 H HB2 . GLU A1 1 39 ? -26.48 4.751 -19.717 1.0 13.32 39 A 4 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.516 5.117 -18.293 1.0 53.15 39 A 4 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.488 5.026 -19.767 1.0 73.51 39 A 4 -ATOM 596 H HG3 . GLU A1 1 39 ? -24.584 4.93 -21.143 1.0 55.55 39 A 4 -ATOM 597 N N . GLY A1 1 40 ? -25.128 2.496 -21.374 1.0 41.31 40 A 4 -ATOM 598 C CA . GLY A1 1 40 ? -25.54 1.791 -22.574 1.0 23.2 40 A 4 -ATOM 599 C C . GLY A1 1 40 ? -25.79 2.727 -23.74 1.0 54.31 40 A 4 -ATOM 600 O O . GLY A1 1 40 ? -26.825 2.641 -24.402 1.0 62.35 40 A 4 -ATOM 601 H H . GLY A1 1 40 ? -24.356 3.098 -21.403 1.0 1.31 40 A 4 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.768 1.088 -22.849 1.0 42.33 40 A 4 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.449 1.246 -22.363 1.0 42.25 40 A 4 -ATOM 604 N N . ILE A1 1 41 ? -24.842 3.623 -23.99 1.0 11.45 41 A 4 -ATOM 605 C CA . ILE A1 1 41 ? -24.966 4.58 -25.083 1.0 13.21 41 A 4 -ATOM 606 C C . ILE A1 1 41 ? -23.827 4.419 -26.085 1.0 73.14 41 A 4 -ATOM 607 O O . ILE A1 1 41 ? -22.744 3.932 -25.759 1.0 54.03 41 A 4 -ATOM 608 C CB . ILE A1 1 41 ? -24.978 6.03 -24.565 1.0 13.54 41 A 4 -ATOM 609 C CG1 . ILE A1 1 41 ? -23.849 6.242 -23.553 1.0 35.25 41 A 4 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.325 6.357 -23.939 1.0 15.54 41 A 4 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.048 7.501 -23.798 1.0 51.21 41 A 4 -ATOM 612 H H . ILE A1 1 41 ? -24.041 3.642 -23.427 1.0 10.31 41 A 4 -ATOM 613 H HA . ILE A1 1 41 ? -25.903 4.391 -25.587 1.0 22.4 41 A 4 -ATOM 614 H HB . ILE A1 1 41 ? -24.827 6.69 -25.405 1.0 2.22 41 A 4 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.269 6.304 -22.562 1.0 53.25 41 A 4 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.171 5.402 -23.6 1.0 73.21 41 A 4 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.313 7.372 -23.569 1.0 41.34 41 A 4 -ATOM 618 H HG22 . ILE A1 1 41 ? -27.101 6.256 -24.683 1.0 35.01 41 A 4 -ATOM 619 H HG23 . ILE A1 1 41 ? -26.518 5.678 -23.123 1.0 24.24 41 A 4 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.372 8.272 -23.114 1.0 13.35 41 A 4 -ATOM 621 H HD12 . ILE A1 1 41 ? -21.999 7.298 -23.638 1.0 5.02 41 A 4 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.2 7.834 -24.813 1.0 73.01 41 A 4 -ATOM 623 N N . PRO A1 1 42 ? -24.074 4.84 -27.334 1.0 42.01 42 A 4 -ATOM 624 C CA . PRO A1 1 42 ? -23.081 4.756 -28.409 1.0 63.34 42 A 4 -ATOM 625 C C . PRO A1 1 42 ? -21.923 5.727 -28.206 1.0 4.23 42 A 4 -ATOM 626 O O . PRO A1 1 42 ? -22.096 6.946 -28.209 1.0 21.54 42 A 4 -ATOM 627 C CB . PRO A1 1 42 ? -23.88 5.13 -29.66 1.0 63.45 42 A 4 -ATOM 628 C CG . PRO A1 1 42 ? -25.002 5.969 -29.156 1.0 31.23 42 A 4 -ATOM 629 C CD . PRO A1 1 42 ? -25.342 5.431 -27.794 1.0 52.22 42 A 4 -ATOM 630 H HA . PRO A1 1 42 ? -22.694 3.753 -28.514 1.0 60.32 42 A 4 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.248 5.682 -30.342 1.0 50.23 42 A 4 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.242 4.234 -30.142 1.0 64.01 42 A 4 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.688 6.999 -29.085 1.0 0.11 42 A 4 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.852 5.88 -29.817 1.0 1.1 42 A 4 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.654 6.232 -27.139 1.0 11.32 42 A 4 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.114 4.679 -27.867 1.0 34.03 42 A 4 -ATOM 637 N N . PRO A1 1 43 ? -20.713 5.177 -28.026 1.0 1.41 43 A 4 -ATOM 638 C CA . PRO A1 1 43 ? -19.503 5.978 -27.819 1.0 62.53 43 A 4 -ATOM 639 C C . PRO A1 1 43 ? -19.083 6.729 -29.078 1.0 21.35 43 A 4 -ATOM 640 O O . PRO A1 1 43 ? -18.474 7.797 -29.001 1.0 73.42 43 A 4 -ATOM 641 C CB . PRO A1 1 43 ? -18.448 4.935 -27.442 1.0 74.43 43 A 4 -ATOM 642 C CG . PRO A1 1 43 ? -18.931 3.667 -28.057 1.0 42.11 43 A 4 -ATOM 643 C CD . PRO A1 1 43 ? -20.433 3.732 -28.011 1.0 32.53 43 A 4 -ATOM 644 H HA . PRO A1 1 43 ? -19.625 6.68 -27.007 1.0 3.1 43 A 4 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.488 5.229 -27.843 1.0 1.2 43 A 4 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.385 4.854 -26.367 1.0 52.2 43 A 4 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.59 3.601 -29.078 1.0 21.5 43 A 4 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.576 2.823 -27.484 1.0 41.32 43 A 4 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.858 3.248 -28.878 1.0 55.24 43 A 4 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.803 3.278 -27.104 1.0 31.14 43 A 4 -ATOM 651 N N . ASP A1 1 44 ? -19.411 6.166 -30.235 1.0 54.12 44 A 4 -ATOM 652 C CA . ASP A1 1 44 ? -19.069 6.783 -31.511 1.0 51.34 44 A 4 -ATOM 653 C C . ASP A1 1 44 ? -20.02 7.932 -31.831 1.0 65.34 44 A 4 -ATOM 654 O O . ASP A1 1 44 ? -19.737 8.762 -32.695 1.0 41.23 44 A 4 -ATOM 655 C CB . ASP A1 1 44 ? -19.109 5.744 -32.632 1.0 23.35 44 A 4 -ATOM 656 C CG . ASP A1 1 44 ? -18.421 6.226 -33.894 1.0 52.14 44 A 4 -ATOM 657 O OD1 . ASP A1 1 44 ? -17.204 6.498 -33.839 1.0 70.43 44 A 4 -ATOM 658 O OD2 . ASP A1 1 44 ? -19.1 6.333 -34.937 1.0 15.14 44 A 4 -ATOM 659 H H . ASP A1 1 44 ? -19.896 5.314 -30.231 1.0 64.31 44 A 4 -ATOM 660 H HA . ASP A1 1 44 ? -18.066 7.175 -31.432 1.0 72.42 44 A 4 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.616 4.843 -32.298 1.0 64.21 44 A 4 -ATOM 662 H HB3 . ASP A1 1 44 ? -20.139 5.519 -32.869 1.0 74.33 44 A 4 -ATOM 663 N N . GLN A1 1 45 ? -21.149 7.972 -31.13 1.0 24.51 45 A 4 -ATOM 664 C CA . GLN A1 1 45 ? -22.142 9.018 -31.341 1.0 55.1 45 A 4 -ATOM 665 C C . GLN A1 1 45 ? -22.03 10.1 -30.272 1.0 65.33 45 A 4 -ATOM 666 O O . GLN A1 1 45 ? -22.618 11.174 -30.399 1.0 0.12 45 A 4 -ATOM 667 C CB . GLN A1 1 45 ? -23.551 8.422 -31.334 1.0 3.33 45 A 4 -ATOM 668 C CG . GLN A1 1 45 ? -23.995 7.895 -32.689 1.0 71.05 45 A 4 -ATOM 669 C CD . GLN A1 1 45 ? -24.896 6.68 -32.576 1.0 50.21 45 A 4 -ATOM 670 O OE1 . GLN A1 1 45 ? -25.997 6.759 -32.03 1.0 30.33 45 A 4 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.432 5.549 -33.093 1.0 54.11 45 A 4 -ATOM 672 H H . GLN A1 1 45 ? -21.317 7.282 -30.456 1.0 33.14 45 A 4 -ATOM 673 H HA . GLN A1 1 45 ? -21.955 9.463 -32.307 1.0 54.13 45 A 4 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.58 7.607 -30.627 1.0 72.22 45 A 4 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.25 9.184 -31.023 1.0 51.24 45 A 4 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.533 8.675 -33.207 1.0 11.31 45 A 4 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.119 7.623 -33.26 1.0 33.23 45 A 4 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.545 5.561 -33.512 1.0 35.4 45 A 4 -ATOM 679 H HE22 . GLN A1 1 45 ? -24.993 4.748 -33.033 1.0 53.4 45 A 4 -ATOM 680 N N . GLN A1 1 46 ? -21.272 9.808 -29.22 1.0 5.34 46 A 4 -ATOM 681 C CA . GLN A1 1 46 ? -21.084 10.757 -28.128 1.0 54.21 46 A 4 -ATOM 682 C C . GLN A1 1 46 ? -19.697 11.387 -28.188 1.0 23.33 46 A 4 -ATOM 683 O O . GLN A1 1 46 ? -18.749 10.781 -28.688 1.0 42.0 46 A 4 -ATOM 684 C CB . GLN A1 1 46 ? -21.284 10.061 -26.781 1.0 54.1 46 A 4 -ATOM 685 C CG . GLN A1 1 46 ? -20.185 9.067 -26.44 1.0 63.33 46 A 4 -ATOM 686 C CD . GLN A1 1 46 ? -19.279 9.557 -25.328 1.0 73.34 46 A 4 -ATOM 687 O OE1 . GLN A1 1 46 ? -18.297 10.258 -25.575 1.0 62.34 46 A 4 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.604 9.189 -24.094 1.0 52.51 46 A 4 -ATOM 689 H H . GLN A1 1 46 ? -20.829 8.936 -29.177 1.0 61.13 46 A 4 -ATOM 690 H HA . GLN A1 1 46 ? -21.824 11.535 -28.235 1.0 1.54 46 A 4 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.315 10.81 -26.004 1.0 70.34 46 A 4 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.225 9.532 -26.798 1.0 24.41 46 A 4 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.641 8.139 -26.129 1.0 71.34 46 A 4 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.587 8.895 -27.323 1.0 12.44 46 A 4 -ATOM 695 H HE21 . GLN A1 1 46 ? -20.399 8.629 -23.973 1.0 61.21 46 A 4 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.035 9.491 -23.356 1.0 54.41 46 A 4 -ATOM 697 N N . ARG A1 1 47 ? -19.584 12.608 -27.675 1.0 11.31 47 A 4 -ATOM 698 C CA . ARG A1 1 47 ? -18.313 13.321 -27.671 1.0 74.42 47 A 4 -ATOM 699 C C . ARG A1 1 47 ? -18.119 14.081 -26.362 1.0 0.05 47 A 4 -ATOM 700 O O . ARG A1 1 47 ? -19.084 14.379 -25.656 1.0 62.43 47 A 4 -ATOM 701 C CB . ARG A1 1 47 ? -18.245 14.292 -28.851 1.0 53.24 47 A 4 -ATOM 702 C CG . ARG A1 1 47 ? -18.208 13.603 -30.205 1.0 25.13 47 A 4 -ATOM 703 C CD . ARG A1 1 47 ? -16.788 13.233 -30.604 1.0 74.31 47 A 4 -ATOM 704 N NE . ARG A1 1 47 ? -16.318 14.014 -31.744 1.0 72.02 47 A 4 -ATOM 705 C CZ . ARG A1 1 47 ? -15.255 13.687 -32.471 1.0 4.33 47 A 4 -ATOM 706 N NH1 . ARG A1 1 47 ? -14.556 12.6 -32.178 1.0 22.33 47 A 4 -ATOM 707 N NH2 . ARG A1 1 47 ? -14.89 14.449 -33.495 1.0 24.44 47 A 4 -ATOM 708 H H . ARG A1 1 47 ? -20.376 13.04 -27.29 1.0 14.32 47 A 4 -ATOM 709 H HA . ARG A1 1 47 ? -17.523 12.592 -27.77 1.0 52.1 47 A 4 -ATOM 710 H HB2 . ARG A1 1 47 ? -19.112 14.936 -28.823 1.0 12.43 47 A 4 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.355 14.896 -28.754 1.0 31.22 47 A 4 -ATOM 712 H HG2 . ARG A1 1 47 ? -18.803 12.703 -30.157 1.0 2.15 47 A 4 -ATOM 713 H HG3 . ARG A1 1 47 ? -18.62 14.269 -30.949 1.0 3.22 47 A 4 -ATOM 714 H HD2 . ARG A1 1 47 ? -16.134 13.412 -29.763 1.0 62.34 47 A 4 -ATOM 715 H HD3 . ARG A1 1 47 ? -16.763 12.185 -30.862 1.0 4.32 47 A 4 -ATOM 716 H HE . ARG A1 1 47 ? -16.82 14.822 -31.979 1.0 51.12 47 A 4 -ATOM 717 H HH11 . ARG A1 1 47 ? -14.83 12.023 -31.408 1.0 35.02 47 A 4 -ATOM 718 H HH12 . ARG A1 1 47 ? -13.757 12.355 -32.728 1.0 42.25 47 A 4 -ATOM 719 H HH21 . ARG A1 1 47 ? -15.415 15.27 -33.719 1.0 32.54 47 A 4 -ATOM 720 H HH22 . ARG A1 1 47 ? -14.091 14.203 -34.041 1.0 51.04 47 A 4 -ATOM 721 N N . LEU A1 1 48 ? -16.868 14.391 -26.043 1.0 13.42 48 A 4 -ATOM 722 C CA . LEU A1 1 48 ? -16.547 15.115 -24.818 1.0 63.04 48 A 4 -ATOM 723 C C . LEU A1 1 48 ? -16.193 16.568 -25.122 1.0 70.54 48 A 4 -ATOM 724 O O . LEU A1 1 48 ? -15.644 16.875 -26.18 1.0 13.22 48 A 4 -ATOM 725 C CB . LEU A1 1 48 ? -15.385 14.437 -24.09 1.0 73.22 48 A 4 -ATOM 726 C CG . LEU A1 1 48 ? -15.312 12.915 -24.215 1.0 23.01 48 A 4 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.7 12.303 -24.105 1.0 2.23 48 A 4 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.655 12.519 -25.53 1.0 62.5 48 A 4 -ATOM 729 H H . LEU A1 1 48 ? -16.141 14.127 -26.645 1.0 13.1 48 A 4 -ATOM 730 H HA . LEU A1 1 48 ? -17.42 15.095 -24.183 1.0 5.14 48 A 4 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.466 14.845 -24.482 1.0 14.35 48 A 4 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.467 14.68 -23.04 1.0 62.22 48 A 4 -ATOM 733 H HG . LEU A1 1 48 ? -14.71 12.522 -23.408 1.0 74.12 48 A 4 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.107 12.153 -25.094 1.0 72.12 48 A 4 -ATOM 735 H HD12 . LEU A1 1 48 ? -17.343 12.968 -23.548 1.0 51.52 48 A 4 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.635 11.353 -23.594 1.0 50.13 48 A 4 -ATOM 737 H HD21 . LEU A1 1 48 ? -14.084 11.613 -25.388 1.0 32.51 48 A 4 -ATOM 738 H HD22 . LEU A1 1 48 ? -13.998 13.311 -25.856 1.0 4.35 48 A 4 -ATOM 739 H HD23 . LEU A1 1 48 ? -15.417 12.352 -26.277 1.0 44.23 48 A 4 -ATOM 740 N N . ILE A1 1 49 ? -16.509 17.456 -24.186 1.0 13.31 49 A 4 -ATOM 741 C CA . ILE A1 1 49 ? -16.222 18.876 -24.352 1.0 13.25 49 A 4 -ATOM 742 C C . ILE A1 1 49 ? -15.733 19.494 -23.047 1.0 73.24 49 A 4 -ATOM 743 O O . ILE A1 1 49 ? -16.38 19.369 -22.007 1.0 20.41 49 A 4 -ATOM 744 C CB . ILE A1 1 49 ? -17.461 19.648 -24.84 1.0 42.12 49 A 4 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.645 19.461 -26.348 1.0 21.4 49 A 4 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.335 21.124 -24.496 1.0 44.11 49 A 4 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.961 18.816 -26.721 1.0 30.32 49 A 4 -ATOM 748 H H . ILE A1 1 49 ? -16.946 17.15 -23.364 1.0 11.12 49 A 4 -ATOM 749 H HA . ILE A1 1 49 ? -15.445 18.973 -25.097 1.0 31.54 49 A 4 -ATOM 750 H HB . ILE A1 1 49 ? -18.327 19.256 -24.328 1.0 10.22 49 A 4 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.599 20.423 -26.832 1.0 52.53 49 A 4 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.849 18.834 -26.724 1.0 23.14 49 A 4 -ATOM 753 H HG21 . ILE A1 1 49 ? -16.297 21.417 -24.543 1.0 54.41 49 A 4 -ATOM 754 H HG22 . ILE A1 1 49 ? -17.905 21.708 -25.203 1.0 2.4 49 A 4 -ATOM 755 H HG23 . ILE A1 1 49 ? -17.713 21.295 -23.499 1.0 53.42 49 A 4 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.666 19.58 -27.016 1.0 43.14 49 A 4 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.808 18.133 -27.543 1.0 61.33 49 A 4 -ATOM 758 H HD13 . ILE A1 1 49 ? -19.352 18.276 -25.871 1.0 3.14 49 A 4 -ATOM 759 N N . PHE A1 1 50 ? -14.586 20.164 -23.109 1.0 0.44 50 A 4 -ATOM 760 C CA . PHE A1 1 50 ? -14.01 20.803 -21.931 1.0 63.4 50 A 4 -ATOM 761 C C . PHE A1 1 50 ? -13.897 22.311 -22.133 1.0 34.31 50 A 4 -ATOM 762 O O . PHE A1 1 50 ? -13.071 22.784 -22.912 1.0 24.03 50 A 4 -ATOM 763 C CB . PHE A1 1 50 ? -12.632 20.213 -21.627 1.0 1.31 50 A 4 -ATOM 764 C CG . PHE A1 1 50 ? -11.931 20.886 -20.482 1.0 63.44 50 A 4 -ATOM 765 C CD1 . PHE A1 1 50 ? -12.125 20.45 -19.181 1.0 63.22 50 A 4 -ATOM 766 C CD2 . PHE A1 1 50 ? -11.077 21.954 -20.706 1.0 31.12 50 A 4 -ATOM 767 C CE1 . PHE A1 1 50 ? -11.482 21.068 -18.126 1.0 44.05 50 A 4 -ATOM 768 C CE2 . PHE A1 1 50 ? -10.431 22.576 -19.655 1.0 53.14 50 A 4 -ATOM 769 C CZ . PHE A1 1 50 ? -10.633 22.132 -18.363 1.0 64.24 50 A 4 -ATOM 770 H H . PHE A1 1 50 ? -14.116 20.229 -23.966 1.0 32.43 50 A 4 -ATOM 771 H HA . PHE A1 1 50 ? -14.667 20.612 -21.097 1.0 55.42 50 A 4 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.742 19.168 -21.38 1.0 72.21 50 A 4 -ATOM 773 H HB3 . PHE A1 1 50 ? -12.007 20.307 -22.502 1.0 52.42 50 A 4 -ATOM 774 H HD1 . PHE A1 1 50 ? -12.788 19.618 -18.994 1.0 64.41 50 A 4 -ATOM 775 H HD2 . PHE A1 1 50 ? -10.918 22.302 -21.717 1.0 25.0 50 A 4 -ATOM 776 H HE1 . PHE A1 1 50 ? -11.642 20.719 -17.116 1.0 33.34 50 A 4 -ATOM 777 H HE2 . PHE A1 1 50 ? -9.768 23.407 -19.844 1.0 34.14 50 A 4 -ATOM 778 H HZ . PHE A1 1 50 ? -10.13 22.616 -17.54 1.0 42.2 50 A 4 -ATOM 779 N N . GLY A1 1 51 ? -14.735 23.062 -21.423 1.0 53.44 51 A 4 -ATOM 780 C CA . GLY A1 1 51 ? -14.713 24.509 -21.538 1.0 33.5 51 A 4 -ATOM 781 C C . GLY A1 1 51 ? -15.317 24.996 -22.84 1.0 34.32 51 A 4 -ATOM 782 O O . GLY A1 1 51 ? -15.428 26.199 -23.07 1.0 0.02 51 A 4 -ATOM 783 H H . GLY A1 1 51 ? -15.372 22.63 -20.817 1.0 14.34 51 A 4 -ATOM 784 H HA2 . GLY A1 1 51 ? -15.269 24.932 -20.715 1.0 71.3 51 A 4 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.689 24.848 -21.481 1.0 2.33 51 A 4 -ATOM 786 N N . GLY A1 1 52 ? -15.708 24.057 -23.698 1.0 51.33 52 A 4 -ATOM 787 C CA . GLY A1 1 52 ? -16.298 24.417 -24.974 1.0 70.11 52 A 4 -ATOM 788 C C . GLY A1 1 52 ? -15.65 23.692 -26.137 1.0 64.35 52 A 4 -ATOM 789 O O . GLY A1 1 52 ? -16.268 23.508 -27.186 1.0 21.12 52 A 4 -ATOM 790 H H . GLY A1 1 52 ? -15.596 23.113 -23.461 1.0 52.33 52 A 4 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.35 24.176 -24.953 1.0 34.31 52 A 4 -ATOM 792 H HA3 . GLY A1 1 52 ? -16.186 25.481 -25.122 1.0 33.12 52 A 4 -ATOM 793 N N . LYS A1 1 53 ? -14.401 23.279 -25.953 1.0 4.12 53 A 4 -ATOM 794 C CA . LYS A1 1 53 ? -13.667 22.57 -26.994 1.0 20.15 53 A 4 -ATOM 795 C C . LYS A1 1 53 ? -13.81 21.06 -26.828 1.0 12.34 53 A 4 -ATOM 796 O O . LYS A1 1 53 ? -13.89 20.556 -25.709 1.0 53.3 53 A 4 -ATOM 797 C CB . LYS A1 1 53 ? -12.188 22.96 -26.961 1.0 12.13 53 A 4 -ATOM 798 C CG . LYS A1 1 53 ? -11.511 22.667 -25.634 1.0 34.42 53 A 4 -ATOM 799 C CD . LYS A1 1 53 ? -10.866 21.292 -25.629 1.0 44.0 53 A 4 -ATOM 800 C CE . LYS A1 1 53 ? -9.75 21.196 -26.658 1.0 75.53 53 A 4 -ATOM 801 N NZ . LYS A1 1 53 ? -8.517 20.588 -26.084 1.0 61.53 53 A 4 -ATOM 802 H H . LYS A1 1 53 ? -13.961 23.455 -25.094 1.0 32.12 53 A 4 -ATOM 803 H HA . LYS A1 1 53 ? -14.085 22.856 -27.948 1.0 74.23 53 A 4 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.667 22.416 -27.735 1.0 34.02 53 A 4 -ATOM 805 H HB3 . LYS A1 1 53 ? -12.103 24.019 -27.159 1.0 32.22 53 A 4 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.749 23.411 -25.456 1.0 24.24 53 A 4 -ATOM 807 H HG3 . LYS A1 1 53 ? -12.25 22.711 -24.846 1.0 53.0 53 A 4 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.454 21.1 -24.649 1.0 22.42 53 A 4 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.618 20.549 -25.856 1.0 0.05 53 A 4 -ATOM 810 H HE2 . LYS A1 1 53 ? -10.089 20.589 -27.483 1.0 25.2 53 A 4 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.519 22.189 -27.013 1.0 75.24 53 A 4 -ATOM 812 H HZ1 . LYS A1 1 53 ? -8.493 20.733 -25.055 1.0 1.33 53 A 4 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.673 21.027 -26.505 1.0 14.14 53 A 4 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.497 19.567 -26.281 1.0 31.25 53 A 4 -ATOM 815 N N . GLN A1 1 54 ? -13.839 20.346 -27.949 1.0 32.1 54 A 4 -ATOM 816 C CA . GLN A1 1 54 ? -13.971 18.894 -27.925 1.0 3.14 54 A 4 -ATOM 817 C C . GLN A1 1 54 ? -12.681 18.238 -27.442 1.0 14.5 54 A 4 -ATOM 818 O O . GLN A1 1 54 ? -11.621 18.865 -27.427 1.0 22.04 54 A 4 -ATOM 819 C CB . GLN A1 1 54 ? -14.332 18.371 -29.317 1.0 14.03 54 A 4 -ATOM 820 C CG . GLN A1 1 54 ? -15.818 18.111 -29.502 1.0 52.41 54 A 4 -ATOM 821 C CD . GLN A1 1 54 ? -16.553 19.307 -30.075 1.0 44.23 54 A 4 -ATOM 822 O OE1 . GLN A1 1 54 ? -16.332 20.444 -29.658 1.0 25.33 54 A 4 -ATOM 823 N NE2 . GLN A1 1 54 ? -17.434 19.056 -31.036 1.0 63.1 54 A 4 -ATOM 824 H H . GLN A1 1 54 ? -13.771 20.806 -28.811 1.0 52.11 54 A 4 -ATOM 825 H HA . GLN A1 1 54 ? -14.766 18.645 -27.239 1.0 62.04 54 A 4 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.021 19.097 -30.053 1.0 31.24 54 A 4 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.803 17.446 -29.489 1.0 25.42 54 A 4 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.944 17.276 -30.174 1.0 52.11 54 A 4 -ATOM 829 H HG3 . GLN A1 1 54 ? -16.25 17.868 -28.542 1.0 53.52 54 A 4 -ATOM 830 H HE21 . GLN A1 1 54 ? -17.56 18.125 -31.316 1.0 45.55 54 A 4 -ATOM 831 H HE22 . GLN A1 1 54 ? -17.924 19.81 -31.423 1.0 62.42 54 A 4 -ATOM 832 N N . LEU A1 1 55 ? -12.779 16.974 -27.047 1.0 51.34 55 A 4 -ATOM 833 C CA . LEU A1 1 55 ? -11.62 16.232 -26.562 1.0 40.45 55 A 4 -ATOM 834 C C . LEU A1 1 55 ? -11.259 15.1 -27.519 1.0 63.5 55 A 4 -ATOM 835 O O . LEU A1 1 55 ? -12.096 14.259 -27.843 1.0 52.11 55 A 4 -ATOM 836 C CB . LEU A1 1 55 ? -11.897 15.668 -25.168 1.0 25.03 55 A 4 -ATOM 837 C CG . LEU A1 1 55 ? -12.366 16.676 -24.117 1.0 41.33 55 A 4 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.451 16.019 -22.748 1.0 33.24 55 A 4 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.434 17.878 -24.077 1.0 52.23 55 A 4 -ATOM 840 H H . LEU A1 1 55 ? -13.65 16.527 -27.082 1.0 12.34 55 A 4 -ATOM 841 H HA . LEU A1 1 55 ? -10.788 16.918 -26.505 1.0 22.21 55 A 4 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.66 14.911 -25.263 1.0 55.1 55 A 4 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.985 15.214 -24.808 1.0 51.11 55 A 4 -ATOM 844 H HG . LEU A1 1 55 ? -13.355 17.027 -24.381 1.0 72.12 55 A 4 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.695 15.253 -22.669 1.0 32.04 55 A 4 -ATOM 846 H HD12 . LEU A1 1 55 ? -13.428 15.575 -22.622 1.0 44.35 55 A 4 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.293 16.763 -21.982 1.0 32.21 55 A 4 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.918 18.724 -24.541 1.0 33.14 55 A 4 -ATOM 849 H HD22 . LEU A1 1 55 ? -10.525 17.645 -24.612 1.0 72.01 55 A 4 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.197 18.115 -23.05 1.0 74.33 55 A 4 -ATOM 851 N N . GLU A1 1 56 ? -10.007 15.085 -27.965 1.0 12.02 56 A 4 -ATOM 852 C CA . GLU A1 1 56 ? -9.536 14.055 -28.883 1.0 31.33 56 A 4 -ATOM 853 C C . GLU A1 1 56 ? -9.518 12.688 -28.204 1.0 62.51 56 A 4 -ATOM 854 O O . GLU A1 1 56 ? -9.964 12.543 -27.066 1.0 51.02 56 A 4 -ATOM 855 C CB . GLU A1 1 56 ? -8.136 14.399 -29.396 1.0 62.01 56 A 4 -ATOM 856 C CG . GLU A1 1 56 ? -8.036 14.439 -30.912 1.0 21.02 56 A 4 -ATOM 857 C CD . GLU A1 1 56 ? -8.877 15.542 -31.523 1.0 1.0 56 A 4 -ATOM 858 O OE1 . GLU A1 1 56 ? -9.288 16.457 -30.778 1.0 61.34 56 A 4 -ATOM 859 O OE2 . GLU A1 1 56 ? -9.125 15.492 -32.746 1.0 22.01 56 A 4 -ATOM 860 H H . GLU A1 1 56 ? -9.386 15.784 -27.67 1.0 72.43 56 A 4 -ATOM 861 H HA . GLU A1 1 56 ? -10.217 14.019 -29.719 1.0 4.21 56 A 4 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.853 15.368 -29.011 1.0 41.11 56 A 4 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.44 13.659 -29.03 1.0 51.02 56 A 4 -ATOM 864 H HG2 . GLU A1 1 56 ? -7.005 14.599 -31.188 1.0 71.31 56 A 4 -ATOM 865 H HG3 . GLU A1 1 56 ? -8.37 13.491 -31.307 1.0 60.44 56 A 4 -ATOM 866 N N . ASP A1 1 57 ? -9.002 11.69 -28.912 1.0 71.03 57 A 4 -ATOM 867 C CA . ASP A1 1 57 ? -8.926 10.334 -28.379 1.0 63.41 57 A 4 -ATOM 868 C C . ASP A1 1 57 ? -7.828 10.225 -27.326 1.0 21.4 57 A 4 -ATOM 869 O O . ASP A1 1 57 ? -7.9 9.391 -26.424 1.0 43.31 57 A 4 -ATOM 870 C CB . ASP A1 1 57 ? -8.67 9.334 -29.507 1.0 45.31 57 A 4 -ATOM 871 C CG . ASP A1 1 57 ? -9.776 9.334 -30.544 1.0 55.43 57 A 4 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.958 9.239 -30.151 1.0 72.35 57 A 4 -ATOM 873 O OD2 . ASP A1 1 57 ? -9.46 9.43 -31.748 1.0 15.11 57 A 4 -ATOM 874 H H . ASP A1 1 57 ? -8.663 11.868 -29.814 1.0 23.12 57 A 4 -ATOM 875 H HA . ASP A1 1 57 ? -9.874 10.106 -27.916 1.0 62.14 57 A 4 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.741 9.585 -29.999 1.0 24.44 57 A 4 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.593 8.341 -29.088 1.0 64.03 57 A 4 -ATOM 878 N N . SER A1 1 58 ? -6.811 11.073 -27.449 1.0 32.51 58 A 4 -ATOM 879 C CA . SER A1 1 58 ? -5.695 11.068 -26.511 1.0 62.24 58 A 4 -ATOM 880 C C . SER A1 1 58 ? -5.707 12.325 -25.646 1.0 2.12 58 A 4 -ATOM 881 O O . SER A1 1 58 ? -4.804 12.546 -24.841 1.0 12.21 58 A 4 -ATOM 882 C CB . SER A1 1 58 ? -4.367 10.967 -27.265 1.0 65.11 58 A 4 -ATOM 883 O OG . SER A1 1 58 ? -3.281 10.818 -26.368 1.0 34.21 58 A 4 -ATOM 884 H H . SER A1 1 58 ? -6.811 11.714 -28.19 1.0 21.03 58 A 4 -ATOM 885 H HA . SER A1 1 58 ? -5.802 10.205 -25.872 1.0 33.55 58 A 4 -ATOM 886 H HB2 . SER A1 1 58 ? -4.395 10.112 -27.924 1.0 31.42 58 A 4 -ATOM 887 H HB3 . SER A1 1 58 ? -4.218 11.865 -27.847 1.0 40.4 58 A 4 -ATOM 888 H HG . SER A1 1 58 ? -3.516 10.189 -25.682 1.0 10.23 58 A 4 -ATOM 889 N N . ASN A1 1 59 ? -6.738 13.146 -25.82 1.0 35.41 59 A 4 -ATOM 890 C CA . ASN A1 1 59 ? -6.868 14.381 -25.057 1.0 52.34 59 A 4 -ATOM 891 C C . ASN A1 1 59 ? -7.548 14.123 -23.716 1.0 4.01 59 A 4 -ATOM 892 O O . ASN A1 1 59 ? -8.748 14.349 -23.562 1.0 42.21 59 A 4 -ATOM 893 C CB . ASN A1 1 59 ? -7.665 15.416 -25.854 1.0 21.1 59 A 4 -ATOM 894 C CG . ASN A1 1 59 ? -7.339 16.839 -25.443 1.0 14.54 59 A 4 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.786 17.611 -26.226 1.0 24.42 59 A 4 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.682 17.191 -24.21 1.0 14.44 59 A 4 -ATOM 897 H H . ASN A1 1 59 ? -7.427 12.915 -26.478 1.0 5.51 59 A 4 -ATOM 898 H HA . ASN A1 1 59 ? -5.876 14.766 -24.877 1.0 74.51 59 A 4 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.439 15.304 -26.905 1.0 43.43 59 A 4 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.72 15.248 -25.698 1.0 11.21 59 A 4 -ATOM 901 H HD21 . ASN A1 1 59 ? -8.119 16.523 -23.641 1.0 21.33 59 A 4 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.483 18.106 -23.918 1.0 12.0 59 A 4 -ATOM 903 N N . ALA A1 1 60 ? -6.771 13.648 -22.747 1.0 13.11 60 A 4 -ATOM 904 C CA . ALA A1 1 60 ? -7.297 13.361 -21.418 1.0 35.51 60 A 4 -ATOM 905 C C . ALA A1 1 60 ? -6.182 12.949 -20.464 1.0 74.01 60 A 4 -ATOM 906 O O . ALA A1 1 60 ? -5.681 13.764 -19.69 1.0 74.24 60 A 4 -ATOM 907 C CB . ALA A1 1 60 ? -8.359 12.274 -21.494 1.0 64.13 60 A 4 -ATOM 908 H H . ALA A1 1 60 ? -5.822 13.488 -22.931 1.0 31.12 60 A 4 -ATOM 909 H HA . ALA A1 1 60 ? -7.764 14.26 -21.043 1.0 20.01 60 A 4 -ATOM 910 H HB1 . ALA A1 1 60 ? -9.179 12.615 -22.109 1.0 72.33 60 A 4 -ATOM 911 H HB2 . ALA A1 1 60 ? -7.93 11.382 -21.926 1.0 25.02 60 A 4 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.721 12.055 -20.501 1.0 51.02 60 A 4 -ATOM 913 N N . MET A1 1 61 ? -5.798 11.678 -20.524 1.0 21.52 61 A 4 -ATOM 914 C CA . MET A1 1 61 ? -4.74 11.158 -19.665 1.0 32.03 61 A 4 -ATOM 915 C C . MET A1 1 61 ? -3.378 11.691 -20.095 1.0 55.14 61 A 4 -ATOM 916 O O . MET A1 1 61 ? -2.695 12.369 -19.327 1.0 73.23 61 A 4 -ATOM 917 C CB . MET A1 1 61 ? -4.735 9.628 -19.695 1.0 33.12 61 A 4 -ATOM 918 C CG . MET A1 1 61 ? -6.126 9.015 -19.686 1.0 10.31 61 A 4 -ATOM 919 S SD . MET A1 1 61 ? -7.191 9.729 -18.418 1.0 3.45 61 A 4 -ATOM 920 C CE . MET A1 1 61 ? -8.774 9.71 -19.256 1.0 11.34 61 A 4 -ATOM 921 H H . MET A1 1 61 ? -6.235 11.075 -21.162 1.0 44.35 61 A 4 -ATOM 922 H HA . MET A1 1 61 ? -4.941 11.488 -18.657 1.0 14.21 61 A 4 -ATOM 923 H HB2 . MET A1 1 61 ? -4.226 9.3 -20.589 1.0 14.23 61 A 4 -ATOM 924 H HB3 . MET A1 1 61 ? -4.199 9.264 -18.831 1.0 0.24 61 A 4 -ATOM 925 H HG2 . MET A1 1 61 ? -6.583 9.176 -20.651 1.0 62.14 61 A 4 -ATOM 926 H HG3 . MET A1 1 61 ? -6.035 7.954 -19.506 1.0 32.0 61 A 4 -ATOM 927 H HE1 . MET A1 1 61 ? -9.248 10.675 -19.149 1.0 54.23 61 A 4 -ATOM 928 H HE2 . MET A1 1 61 ? -8.624 9.496 -20.304 1.0 64.31 61 A 4 -ATOM 929 H HE3 . MET A1 1 61 ? -9.403 8.949 -18.819 1.0 24.11 61 A 4 -ATOM 930 N N . SER A1 1 62 ? -2.988 11.381 -21.328 1.0 73.15 62 A 4 -ATOM 931 C CA . SER A1 1 62 ? -1.705 11.826 -21.859 1.0 12.22 62 A 4 -ATOM 932 C C . SER A1 1 62 ? -1.6 13.348 -21.821 1.0 13.52 62 A 4 -ATOM 933 O O . SER A1 1 62 ? -0.521 13.902 -21.612 1.0 42.51 62 A 4 -ATOM 934 C CB . SER A1 1 62 ? -1.522 11.327 -23.293 1.0 62.33 62 A 4 -ATOM 935 O OG . SER A1 1 62 ? -0.896 12.31 -24.099 1.0 14.13 62 A 4 -ATOM 936 H H . SER A1 1 62 ? -3.577 10.838 -21.892 1.0 74.25 62 A 4 -ATOM 937 H HA . SER A1 1 62 ? -0.927 11.408 -21.239 1.0 74.15 62 A 4 -ATOM 938 H HB2 . SER A1 1 62 ? -0.908 10.439 -23.287 1.0 54.41 62 A 4 -ATOM 939 H HB3 . SER A1 1 62 ? -2.489 11.094 -23.716 1.0 23.45 62 A 4 -ATOM 940 H HG . SER A1 1 62 ? -1.533 12.989 -24.33 1.0 1.23 62 A 4 -ATOM 941 N N . ASP A1 1 63 ? -2.729 14.018 -22.024 1.0 34.33 63 A 4 -ATOM 942 C CA . ASP A1 1 63 ? -2.766 15.476 -22.012 1.0 10.21 63 A 4 -ATOM 943 C C . ASP A1 1 63 ? -2.285 16.021 -20.671 1.0 63.54 63 A 4 -ATOM 944 O O . ASP A1 1 63 ? -1.845 17.167 -20.577 1.0 31.33 63 A 4 -ATOM 945 C CB . ASP A1 1 63 ? -4.184 15.974 -22.3 1.0 21.1 63 A 4 -ATOM 946 C CG . ASP A1 1 63 ? -4.204 17.406 -22.795 1.0 12.2 63 A 4 -ATOM 947 O OD1 . ASP A1 1 63 ? -3.887 17.628 -23.982 1.0 53.24 63 A 4 -ATOM 948 O OD2 . ASP A1 1 63 ? -4.538 18.306 -21.995 1.0 3.13 63 A 4 -ATOM 949 H H . ASP A1 1 63 ? -3.558 13.52 -22.185 1.0 14.4 63 A 4 -ATOM 950 H HA . ASP A1 1 63 ? -2.106 15.83 -22.789 1.0 72.42 63 A 4 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.633 15.345 -23.055 1.0 63.34 63 A 4 -ATOM 952 H HB3 . ASP A1 1 63 ? -4.769 15.916 -21.394 1.0 44.51 63 A 4 -ATOM 953 N N . TYR A1 1 64 ? -2.372 15.192 -19.636 1.0 43.15 64 A 4 -ATOM 954 C CA . TYR A1 1 64 ? -1.949 15.592 -18.3 1.0 74.44 64 A 4 -ATOM 955 C C . TYR A1 1 64 ? -2.97 16.53 -17.662 1.0 35.31 64 A 4 -ATOM 956 O O . TYR A1 1 64 ? -2.61 17.541 -17.061 1.0 63.11 64 A 4 -ATOM 957 C CB . TYR A1 1 64 ? -0.581 16.274 -18.358 1.0 41.31 64 A 4 -ATOM 958 C CG . TYR A1 1 64 ? 0.408 15.572 -19.261 1.0 35.31 64 A 4 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.833 14.278 -18.986 1.0 10.21 64 A 4 -ATOM 960 C CD2 . TYR A1 1 64 ? 0.917 16.203 -20.39 1.0 61.0 64 A 4 -ATOM 961 C CE1 . TYR A1 1 64 ? 1.737 13.634 -19.808 1.0 31.32 64 A 4 -ATOM 962 C CE2 . TYR A1 1 64 ? 1.82 15.565 -21.218 1.0 3.01 64 A 4 -ATOM 963 C CZ . TYR A1 1 64 ? 2.227 14.281 -20.923 1.0 35.43 64 A 4 -ATOM 964 O OH . TYR A1 1 64 ? 3.126 13.641 -21.745 1.0 23.32 64 A 4 -ATOM 965 H H . TYR A1 1 64 ? -2.731 14.291 -19.774 1.0 10.22 64 A 4 -ATOM 966 H HA . TYR A1 1 64 ? -1.87 14.7 -17.696 1.0 40.51 64 A 4 -ATOM 967 H HB2 . TYR A1 1 64 ? -0.704 17.283 -18.722 1.0 75.32 64 A 4 -ATOM 968 H HB3 . TYR A1 1 64 ? -0.159 16.305 -17.364 1.0 32.34 64 A 4 -ATOM 969 H HD1 . TYR A1 1 64 ? 0.446 13.774 -18.112 1.0 1.35 64 A 4 -ATOM 970 H HD2 . TYR A1 1 64 ? 0.596 17.209 -20.618 1.0 32.41 64 A 4 -ATOM 971 H HE1 . TYR A1 1 64 ? 2.055 12.628 -19.577 1.0 52.21 64 A 4 -ATOM 972 H HE2 . TYR A1 1 64 ? 2.204 16.072 -22.091 1.0 43.14 64 A 4 -ATOM 973 H HH . TYR A1 1 64 ? 2.695 12.899 -22.175 1.0 23.33 64 A 4 -ATOM 974 N N . ASN A1 1 65 ? -4.246 16.184 -17.799 1.0 61.21 65 A 4 -ATOM 975 C CA . ASN A1 1 65 ? -5.321 16.994 -17.237 1.0 70.22 65 A 4 -ATOM 976 C C . ASN A1 1 65 ? -6.33 16.12 -16.497 1.0 21.44 65 A 4 -ATOM 977 O O . ASN A1 1 65 ? -7.447 16.55 -16.21 1.0 22.24 65 A 4 -ATOM 978 C CB . ASN A1 1 65 ? -6.026 17.782 -18.343 1.0 30.31 65 A 4 -ATOM 979 C CG . ASN A1 1 65 ? -6.896 18.896 -17.794 1.0 75.23 65 A 4 -ATOM 980 O OD1 . ASN A1 1 65 ? -6.487 19.633 -16.896 1.0 74.2 65 A 4 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.103 19.025 -18.333 1.0 12.4 65 A 4 -ATOM 982 H H . ASN A1 1 65 ? -4.47 15.366 -18.29 1.0 72.01 65 A 4 -ATOM 983 H HA . ASN A1 1 65 ? -4.882 17.688 -16.536 1.0 43.44 65 A 4 -ATOM 984 H HB2 . ASN A1 1 65 ? -5.283 18.219 -18.994 1.0 12.24 65 A 4 -ATOM 985 H HB3 . ASN A1 1 65 ? -6.65 17.111 -18.914 1.0 73.02 65 A 4 -ATOM 986 H HD21 . ASN A1 1 65 ? -8.361 18.402 -19.045 1.0 23.44 65 A 4 -ATOM 987 H HD22 . ASN A1 1 65 ? -8.685 19.738 -17.998 1.0 32.24 65 A 4 -ATOM 988 N N . VAL A1 1 66 ? -5.928 14.891 -16.191 1.0 11.4 66 A 4 -ATOM 989 C CA . VAL A1 1 66 ? -6.795 13.957 -15.483 1.0 70.45 66 A 4 -ATOM 990 C C . VAL A1 1 66 ? -6.627 14.086 -13.973 1.0 73.11 66 A 4 -ATOM 991 O O . VAL A1 1 66 ? -5.513 14.008 -13.455 1.0 33.12 66 A 4 -ATOM 992 C CB . VAL A1 1 66 ? -6.509 12.501 -15.897 1.0 40.11 66 A 4 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.108 12.09 -15.471 1.0 32.21 66 A 4 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.552 11.565 -15.307 1.0 25.13 66 A 4 -ATOM 995 H H . VAL A1 1 66 ? -5.026 14.606 -16.446 1.0 25.31 66 A 4 -ATOM 996 H HA . VAL A1 1 66 ? -7.818 14.189 -15.743 1.0 44.24 66 A 4 -ATOM 997 H HB . VAL A1 1 66 ? -6.567 12.437 -16.974 1.0 65.05 66 A 4 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.167 11.496 -14.57 1.0 62.5 66 A 4 -ATOM 999 H HG12 . VAL A1 1 66 ? -4.648 11.509 -16.257 1.0 4.5 66 A 4 -ATOM 1000 H HG13 . VAL A1 1 66 ? -4.516 12.973 -15.281 1.0 12.32 66 A 4 -ATOM 1001 H HG21 . VAL A1 1 66 ? -7.319 10.547 -15.581 1.0 23.4 66 A 4 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.55 11.658 -14.231 1.0 64.2 66 A 4 -ATOM 1003 H HG23 . VAL A1 1 66 ? -8.529 11.826 -15.688 1.0 74.31 66 A 4 -ATOM 1004 N N . GLN A1 1 67 ? -7.739 14.285 -13.274 1.0 5.43 67 A 4 -ATOM 1005 C CA . GLN A1 1 67 ? -7.714 14.425 -11.823 1.0 15.5 67 A 4 -ATOM 1006 C C . GLN A1 1 67 ? -8.608 13.383 -11.16 1.0 62.54 67 A 4 -ATOM 1007 O O . GLN A1 1 67 ? -9.201 12.539 -11.832 1.0 44.01 67 A 4 -ATOM 1008 C CB . GLN A1 1 67 ? -8.162 15.831 -11.418 1.0 35.11 67 A 4 -ATOM 1009 C CG . GLN A1 1 67 ? -9.602 16.142 -11.793 1.0 11.21 67 A 4 -ATOM 1010 C CD . GLN A1 1 67 ? -10.257 17.117 -10.835 1.0 34.44 67 A 4 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.421 16.826 -9.65 1.0 41.54 67 A 4 -ATOM 1012 N NE2 . GLN A1 1 67 ? -10.636 18.284 -11.344 1.0 50.51 67 A 4 -ATOM 1013 H H . GLN A1 1 67 ? -8.597 14.338 -13.745 1.0 54.23 67 A 4 -ATOM 1014 H HA . GLN A1 1 67 ? -6.698 14.272 -11.493 1.0 21.13 67 A 4 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.061 15.933 -10.348 1.0 61.05 67 A 4 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.523 16.553 -11.903 1.0 21.05 67 A 4 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.618 16.57 -12.784 1.0 63.24 67 A 4 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.168 15.222 -11.791 1.0 63.02 67 A 4 -ATOM 1019 H HE21 . GLN A1 1 67 ? -10.475 18.446 -12.297 1.0 0.12 67 A 4 -ATOM 1020 H HE22 . GLN A1 1 67 ? -11.063 18.932 -10.747 1.0 72.41 67 A 4 -ATOM 1021 N N . LYS A1 1 68 ? -8.701 13.447 -9.836 1.0 63.33 68 A 4 -ATOM 1022 C CA . LYS A1 1 68 ? -9.523 12.509 -9.08 1.0 34.0 68 A 4 -ATOM 1023 C C . LYS A1 1 68 ? -11.006 12.756 -9.337 1.0 33.21 68 A 4 -ATOM 1024 O O . LYS A1 1 68 ? -11.814 11.829 -9.299 1.0 33.01 68 A 4 -ATOM 1025 C CB . LYS A1 1 68 ? -9.227 12.631 -7.583 1.0 41.41 68 A 4 -ATOM 1026 C CG . LYS A1 1 68 ? -9.689 11.433 -6.772 1.0 61.44 68 A 4 -ATOM 1027 C CD . LYS A1 1 68 ? -8.867 10.195 -7.087 1.0 43.41 68 A 4 -ATOM 1028 C CE . LYS A1 1 68 ? -7.57 10.17 -6.292 1.0 23.43 68 A 4 -ATOM 1029 N NZ . LYS A1 1 68 ? -7.82 10.152 -4.824 1.0 52.05 68 A 4 -ATOM 1030 H H . LYS A1 1 68 ? -8.204 14.142 -9.355 1.0 75.53 68 A 4 -ATOM 1031 H HA . LYS A1 1 68 ? -9.274 11.511 -9.407 1.0 31.4 68 A 4 -ATOM 1032 H HB2 . LYS A1 1 68 ? -8.161 12.742 -7.447 1.0 51.5 68 A 4 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.723 13.512 -7.201 1.0 62.4 68 A 4 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.589 11.661 -5.721 1.0 22.33 68 A 4 -ATOM 1035 H HG3 . LYS A1 1 68 ? -10.726 11.233 -7.002 1.0 45.02 68 A 4 -ATOM 1036 H HD2 . LYS A1 1 68 ? -9.444 9.317 -6.84 1.0 14.2 68 A 4 -ATOM 1037 H HD3 . LYS A1 1 68 ? -8.632 10.189 -8.142 1.0 13.53 68 A 4 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.013 9.287 -6.565 1.0 43.13 68 A 4 -ATOM 1039 H HE3 . LYS A1 1 68 ? -6.995 11.05 -6.54 1.0 63.42 68 A 4 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.233 9.423 -4.37 1.0 1.54 68 A 4 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -8.822 9.943 -4.635 1.0 73.32 68 A 4 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -7.587 11.077 -4.41 1.0 23.44 68 A 4 -ATOM 1043 N N . GLU A1 1 69 ? -11.356 14.011 -9.6 1.0 51.1 69 A 4 -ATOM 1044 C CA . GLU A1 1 69 ? -12.742 14.378 -9.864 1.0 15.41 69 A 4 -ATOM 1045 C C . GLU A1 1 69 ? -12.819 15.535 -10.857 1.0 20.25 69 A 4 -ATOM 1046 O O . GLU A1 1 69 ? -13.054 16.681 -10.474 1.0 55.15 69 A 4 -ATOM 1047 C CB . GLU A1 1 69 ? -13.448 14.761 -8.562 1.0 42.14 69 A 4 -ATOM 1048 C CG . GLU A1 1 69 ? -13.647 13.593 -7.611 1.0 32.44 69 A 4 -ATOM 1049 C CD . GLU A1 1 69 ? -14.052 14.037 -6.218 1.0 60.3 69 A 4 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.196 15.259 -6.004 1.0 52.11 69 A 4 -ATOM 1051 O OE2 . GLU A1 1 69 ? -14.225 13.163 -5.343 1.0 33.22 69 A 4 -ATOM 1052 H H . GLU A1 1 69 ? -10.665 14.707 -9.616 1.0 51.55 69 A 4 -ATOM 1053 H HA . GLU A1 1 69 ? -13.237 13.519 -10.291 1.0 21.13 69 A 4 -ATOM 1054 H HB2 . GLU A1 1 69 ? -12.862 15.515 -8.057 1.0 70.35 69 A 4 -ATOM 1055 H HB3 . GLU A1 1 69 ? -14.418 15.173 -8.801 1.0 25.14 69 A 4 -ATOM 1056 H HG2 . GLU A1 1 69 ? -14.42 12.951 -8.006 1.0 60.54 69 A 4 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.722 13.04 -7.542 1.0 2.43 69 A 4 -ATOM 1058 N N . SER A1 1 70 ? -12.619 15.225 -12.134 1.0 51.41 70 A 4 -ATOM 1059 C CA . SER A1 1 70 ? -12.661 16.238 -13.182 1.0 50.24 70 A 4 -ATOM 1060 C C . SER A1 1 70 ? -14.067 16.362 -13.761 1.0 72.1 70 A 4 -ATOM 1061 O O . SER A1 1 70 ? -14.678 15.37 -14.159 1.0 13.02 70 A 4 -ATOM 1062 C CB . SER A1 1 70 ? -11.668 15.894 -14.293 1.0 75.43 70 A 4 -ATOM 1063 O OG . SER A1 1 70 ? -12.31 15.851 -15.556 1.0 45.33 70 A 4 -ATOM 1064 H H . SER A1 1 70 ? -12.436 14.293 -12.376 1.0 42.55 70 A 4 -ATOM 1065 H HA . SER A1 1 70 ? -12.382 17.183 -12.741 1.0 61.25 70 A 4 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.891 16.643 -14.323 1.0 1.23 70 A 4 -ATOM 1067 H HB3 . SER A1 1 70 ? -11.229 14.927 -14.093 1.0 50.33 70 A 4 -ATOM 1068 H HG . SER A1 1 70 ? -12.385 16.741 -15.907 1.0 14.24 70 A 4 -ATOM 1069 N N . THR A1 1 71 ? -14.576 17.589 -13.805 1.0 52.55 71 A 4 -ATOM 1070 C CA . THR A1 1 71 ? -15.91 17.845 -14.333 1.0 43.33 71 A 4 -ATOM 1071 C C . THR A1 1 71 ? -15.854 18.222 -15.809 1.0 63.44 71 A 4 -ATOM 1072 O O . THR A1 1 71 ? -15.308 19.264 -16.175 1.0 13.52 71 A 4 -ATOM 1073 C CB . THR A1 1 71 ? -16.617 18.971 -13.555 1.0 4.41 71 A 4 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.681 20.007 -13.235 1.0 4.41 71 A 4 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.244 18.434 -12.277 1.0 4.35 71 A 4 -ATOM 1076 H H . THR A1 1 71 ? -14.041 18.34 -13.472 1.0 14.04 71 A 4 -ATOM 1077 H HA . THR A1 1 71 ? -16.491 16.941 -14.224 1.0 24.13 71 A 4 -ATOM 1078 H HB . THR A1 1 71 ? -17.398 19.383 -14.177 1.0 70.41 71 A 4 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.148 20.752 -12.848 1.0 53.11 71 A 4 -ATOM 1080 H HG21 . THR A1 1 71 ? -18.249 18.099 -12.484 1.0 12.42 71 A 4 -ATOM 1081 H HG22 . THR A1 1 71 ? -17.272 19.217 -11.534 1.0 75.2 71 A 4 -ATOM 1082 H HG23 . THR A1 1 71 ? -16.656 17.607 -11.908 1.0 31.12 71 A 4 -ATOM 1083 N N . LEU A1 1 72 ? -16.421 17.368 -16.655 1.0 74.32 72 A 4 -ATOM 1084 C CA . LEU A1 1 72 ? -16.436 17.612 -18.093 1.0 62.12 72 A 4 -ATOM 1085 C C . LEU A1 1 72 ? -17.848 17.479 -18.653 1.0 14.1 72 A 4 -ATOM 1086 O O . LEU A1 1 72 ? -18.679 16.754 -18.105 1.0 22.33 72 A 4 -ATOM 1087 C CB . LEU A1 1 72 ? -15.499 16.635 -18.805 1.0 54.24 72 A 4 -ATOM 1088 C CG . LEU A1 1 72 ? -16.122 15.313 -19.255 1.0 12.34 72 A 4 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.454 15.357 -20.739 1.0 71.53 72 A 4 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.188 14.152 -18.95 1.0 45.31 72 A 4 -ATOM 1091 H H . LEU A1 1 72 ? -16.84 16.555 -16.305 1.0 40.44 72 A 4 -ATOM 1092 H HA . LEU A1 1 72 ? -16.088 18.62 -18.262 1.0 22.23 72 A 4 -ATOM 1093 H HB2 . LEU A1 1 72 ? -15.108 17.131 -19.681 1.0 24.33 72 A 4 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.686 16.406 -18.131 1.0 64.44 72 A 4 -ATOM 1095 H HG . LEU A1 1 72 ? -17.044 15.154 -18.712 1.0 60.22 72 A 4 -ATOM 1096 H HD11 . LEU A1 1 72 ? -16.578 14.351 -21.11 1.0 22.12 72 A 4 -ATOM 1097 H HD12 . LEU A1 1 72 ? -15.65 15.842 -21.273 1.0 11.12 72 A 4 -ATOM 1098 H HD13 . LEU A1 1 72 ? -17.37 15.911 -20.886 1.0 74.11 72 A 4 -ATOM 1099 H HD21 . LEU A1 1 72 ? -15.725 13.221 -19.052 1.0 45.11 72 A 4 -ATOM 1100 H HD22 . LEU A1 1 72 ? -14.816 14.245 -17.94 1.0 64.51 72 A 4 -ATOM 1101 H HD23 . LEU A1 1 72 ? -14.357 14.167 -19.641 1.0 15.53 72 A 4 -ATOM 1102 N N . HIS A1 1 73 ? -18.113 18.182 -19.75 1.0 22.1 73 A 4 -ATOM 1103 C CA . HIS A1 1 73 ? -19.425 18.141 -20.386 1.0 43.22 73 A 4 -ATOM 1104 C C . HIS A1 1 73 ? -19.433 17.154 -21.55 1.0 1.12 73 A 4 -ATOM 1105 O O . HIS A1 1 73 ? -18.664 17.295 -22.502 1.0 41.41 73 A 4 -ATOM 1106 C CB . HIS A1 1 73 ? -19.82 19.533 -20.88 1.0 34.11 73 A 4 -ATOM 1107 C CG . HIS A1 1 73 ? -19.809 20.575 -19.805 1.0 25.31 73 A 4 -ATOM 1108 N ND1 . HIS A1 1 73 ? -19.72 21.926 -20.067 1.0 22.31 73 A 4 -ATOM 1109 C CD2 . HIS A1 1 73 ? -19.877 20.458 -18.458 1.0 30.12 73 A 4 -ATOM 1110 C CE1 . HIS A1 1 73 ? -19.733 22.595 -18.928 1.0 74.03 73 A 4 -ATOM 1111 N NE2 . HIS A1 1 73 ? -19.828 21.728 -17.936 1.0 22.32 73 A 4 -ATOM 1112 H H . HIS A1 1 73 ? -17.41 18.742 -20.14 1.0 41.1 73 A 4 -ATOM 1113 H HA . HIS A1 1 73 ? -20.141 17.813 -19.649 1.0 23.25 73 A 4 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.129 19.844 -21.65 1.0 51.13 73 A 4 -ATOM 1115 H HB3 . HIS A1 1 73 ? -20.818 19.492 -21.293 1.0 64.13 73 A 4 -ATOM 1116 H HD1 . HIS A1 1 73 ? -19.656 22.333 -20.955 1.0 63.31 73 A 4 -ATOM 1117 H HD2 . HIS A1 1 73 ? -19.955 19.538 -17.897 1.0 71.43 73 A 4 -ATOM 1118 H HE1 . HIS A1 1 73 ? -19.676 23.668 -18.824 1.0 3.34 73 A 4 -ATOM 1119 N N . LEU A1 1 74 ? -20.306 16.156 -21.467 1.0 31.4 74 A 4 -ATOM 1120 C CA . LEU A1 1 74 ? -20.413 15.145 -22.513 1.0 41.22 74 A 4 -ATOM 1121 C C . LEU A1 1 74 ? -21.662 15.369 -23.361 1.0 21.0 74 A 4 -ATOM 1122 O O . LEU A1 1 74 ? -22.784 15.318 -22.858 1.0 70.53 74 A 4 -ATOM 1123 C CB . LEU A1 1 74 ? -20.447 13.746 -21.896 1.0 42.32 74 A 4 -ATOM 1124 C CG . LEU A1 1 74 ? -21.164 12.669 -22.712 1.0 13.02 74 A 4 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.497 12.494 -24.067 1.0 50.12 74 A 4 -ATOM 1126 C CD2 . LEU A1 1 74 ? -21.186 11.351 -21.952 1.0 22.4 74 A 4 -ATOM 1127 H H . LEU A1 1 74 ? -20.892 16.097 -20.685 1.0 53.04 74 A 4 -ATOM 1128 H HA . LEU A1 1 74 ? -19.543 15.23 -23.147 1.0 65.43 74 A 4 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.427 13.425 -21.749 1.0 22.02 74 A 4 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.941 13.82 -20.938 1.0 20.31 74 A 4 -ATOM 1131 H HG . LEU A1 1 74 ? -22.187 12.976 -22.881 1.0 34.12 74 A 4 -ATOM 1132 H HD11 . LEU A1 1 74 ? -20.505 11.45 -24.34 1.0 33.01 74 A 4 -ATOM 1133 H HD12 . LEU A1 1 74 ? -19.477 12.844 -24.014 1.0 1.34 74 A 4 -ATOM 1134 H HD13 . LEU A1 1 74 ? -21.035 13.065 -24.81 1.0 63.14 74 A 4 -ATOM 1135 H HD21 . LEU A1 1 74 ? -20.179 11.078 -21.674 1.0 12.32 74 A 4 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.608 10.581 -22.581 1.0 54.43 74 A 4 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.789 11.459 -21.062 1.0 14.02 74 A 4 -ATOM 1138 N N . VAL A1 1 75 ? -21.458 15.616 -24.651 1.0 43.5 75 A 4 -ATOM 1139 C CA . VAL A1 1 75 ? -22.567 15.845 -25.57 1.0 52.32 75 A 4 -ATOM 1140 C C . VAL A1 1 75 ? -22.713 14.689 -26.553 1.0 61.15 75 A 4 -ATOM 1141 O O . VAL A1 1 75 ? -21.768 14.336 -27.259 1.0 54.31 75 A 4 -ATOM 1142 C CB . VAL A1 1 75 ? -22.381 17.155 -26.359 1.0 24.5 75 A 4 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.59 17.423 -27.242 1.0 55.3 75 A 4 -ATOM 1144 C CG2 . VAL A1 1 75 ? -22.136 18.318 -25.409 1.0 64.14 75 A 4 -ATOM 1145 H H . VAL A1 1 75 ? -20.54 15.644 -24.993 1.0 70.11 75 A 4 -ATOM 1146 H HA . VAL A1 1 75 ? -23.473 15.926 -24.987 1.0 60.52 75 A 4 -ATOM 1147 H HB . VAL A1 1 75 ? -21.515 17.048 -26.995 1.0 44.41 75 A 4 -ATOM 1148 H HG11 . VAL A1 1 75 ? -23.292 17.39 -28.279 1.0 31.54 75 A 4 -ATOM 1149 H HG12 . VAL A1 1 75 ? -24.344 16.671 -27.058 1.0 61.34 75 A 4 -ATOM 1150 H HG13 . VAL A1 1 75 ? -23.992 18.399 -27.014 1.0 54.52 75 A 4 -ATOM 1151 H HG21 . VAL A1 1 75 ? -22.002 19.225 -25.978 1.0 5.24 75 A 4 -ATOM 1152 H HG22 . VAL A1 1 75 ? -22.983 18.427 -24.749 1.0 61.35 75 A 4 -ATOM 1153 H HG23 . VAL A1 1 75 ? -21.247 18.125 -24.825 1.0 24.43 75 A 4 -ATOM 1154 N N . LEU A1 1 76 ? -23.904 14.102 -26.594 1.0 35.1 76 A 4 -ATOM 1155 C CA . LEU A1 1 76 ? -24.176 12.985 -27.492 1.0 22.53 76 A 4 -ATOM 1156 C C . LEU A1 1 76 ? -25.374 13.284 -28.387 1.0 2.14 76 A 4 -ATOM 1157 O O . LEU A1 1 76 ? -26.383 13.821 -27.931 1.0 21.5 76 A 4 -ATOM 1158 C CB . LEU A1 1 76 ? -24.432 11.709 -26.688 1.0 73.12 76 A 4 -ATOM 1159 C CG . LEU A1 1 76 ? -24.342 11.845 -25.167 1.0 64.45 76 A 4 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.61 12.474 -24.612 1.0 24.13 76 A 4 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.092 10.488 -24.524 1.0 22.03 76 A 4 -ATOM 1162 H H . LEU A1 1 76 ? -24.618 14.427 -26.008 1.0 44.32 76 A 4 -ATOM 1163 H HA . LEU A1 1 76 ? -23.305 12.84 -28.114 1.0 53.04 76 A 4 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.424 11.359 -26.93 1.0 71.31 76 A 4 -ATOM 1165 H HB3 . LEU A1 1 76 ? -23.706 10.971 -26.999 1.0 62.14 76 A 4 -ATOM 1166 H HG . LEU A1 1 76 ? -23.512 12.492 -24.918 1.0 42.11 76 A 4 -ATOM 1167 H HD11 . LEU A1 1 76 ? -26.437 12.261 -25.272 1.0 12.14 76 A 4 -ATOM 1168 H HD12 . LEU A1 1 76 ? -25.477 13.543 -24.534 1.0 23.21 76 A 4 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.815 12.066 -23.633 1.0 40.2 76 A 4 -ATOM 1170 H HD21 . LEU A1 1 76 ? -24.053 9.729 -25.291 1.0 53.24 76 A 4 -ATOM 1171 H HD22 . LEU A1 1 76 ? -24.893 10.264 -23.835 1.0 72.02 76 A 4 -ATOM 1172 H HD23 . LEU A1 1 76 ? -23.153 10.511 -23.991 1.0 63.4 76 A 4 -ATOM 1173 N N . ARG A1 1 77 ? -25.256 12.931 -29.663 1.0 50.44 77 A 4 -ATOM 1174 C CA . ARG A1 1 77 ? -26.33 13.162 -30.622 1.0 12.4 77 A 4 -ATOM 1175 C C . ARG A1 1 77 ? -26.916 11.84 -31.109 1.0 10.32 77 A 4 -ATOM 1176 O O . ARG A1 1 77 ? -26.773 11.479 -32.278 1.0 12.43 77 A 4 -ATOM 1177 C CB . ARG A1 1 77 ? -25.814 13.973 -31.812 1.0 55.35 77 A 4 -ATOM 1178 C CG . ARG A1 1 77 ? -24.539 13.415 -32.423 1.0 12.22 77 A 4 -ATOM 1179 C CD . ARG A1 1 77 ? -23.305 14.1 -31.857 1.0 60.22 77 A 4 -ATOM 1180 N NE . ARG A1 1 77 ? -23.258 15.518 -32.205 1.0 64.33 77 A 4 -ATOM 1181 C CZ . ARG A1 1 77 ? -22.183 16.28 -32.037 1.0 13.31 77 A 4 -ATOM 1182 N NH1 . ARG A1 1 77 ? -21.072 15.763 -31.53 1.0 63.3 77 A 4 -ATOM 1183 N NH2 . ARG A1 1 77 ? -22.217 17.562 -32.378 1.0 70.54 77 A 4 -ATOM 1184 H H . ARG A1 1 77 ? -24.426 12.507 -29.967 1.0 2.41 77 A 4 -ATOM 1185 H HA . ARG A1 1 77 ? -27.105 13.724 -30.123 1.0 53.23 77 A 4 -ATOM 1186 H HB2 . ARG A1 1 77 ? -26.576 13.991 -32.578 1.0 41.04 77 A 4 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.619 14.983 -31.486 1.0 23.23 77 A 4 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.481 12.358 -32.209 1.0 3.21 77 A 4 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.567 13.567 -33.492 1.0 45.32 77 A 4 -ATOM 1190 H HD2 . ARG A1 1 77 ? -23.317 14.003 -30.782 1.0 24.22 77 A 4 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.426 13.612 -32.253 1.0 55.12 77 A 4 -ATOM 1192 H HE . ARG A1 1 77 ? -24.067 15.92 -32.581 1.0 41.44 77 A 4 -ATOM 1193 H HH11 . ARG A1 1 77 ? -21.043 14.798 -31.273 1.0 31.24 77 A 4 -ATOM 1194 H HH12 . ARG A1 1 77 ? -20.264 16.339 -31.406 1.0 72.5 77 A 4 -ATOM 1195 H HH21 . ARG A1 1 77 ? -23.053 17.955 -32.761 1.0 71.34 77 A 4 -ATOM 1196 H HH22 . ARG A1 1 77 ? -21.408 18.135 -32.251 1.0 1.44 77 A 4 -ATOM 1197 N N . LEU A1 1 78 ? -27.575 11.122 -30.206 1.0 31.03 78 A 4 -ATOM 1198 C CA . LEU A1 1 78 ? -28.183 9.84 -30.544 1.0 51.32 78 A 4 -ATOM 1199 C C . LEU A1 1 78 ? -29.299 10.019 -31.567 1.0 14.11 78 A 4 -ATOM 1200 O O . LEU A1 1 78 ? -29.531 9.148 -32.407 1.0 12.31 78 A 4 -ATOM 1201 C CB . LEU A1 1 78 ? -28.732 9.166 -29.285 1.0 42.51 78 A 4 -ATOM 1202 C CG . LEU A1 1 78 ? -27.753 8.277 -28.518 1.0 51.45 78 A 4 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.593 9.1 -27.98 1.0 14.44 78 A 4 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.466 7.553 -27.385 1.0 25.32 78 A 4 -ATOM 1205 H H . LEU A1 1 78 ? -27.655 11.462 -29.291 1.0 75.31 78 A 4 -ATOM 1206 H HA . LEU A1 1 78 ? -27.415 9.212 -30.972 1.0 64.2 78 A 4 -ATOM 1207 H HB2 . LEU A1 1 78 ? -29.068 9.943 -28.615 1.0 61.14 78 A 4 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.575 8.557 -29.578 1.0 62.32 78 A 4 -ATOM 1209 H HG . LEU A1 1 78 ? -27.35 7.532 -29.19 1.0 53.42 78 A 4 -ATOM 1210 H HD11 . LEU A1 1 78 ? -25.967 8.477 -27.359 1.0 3.24 78 A 4 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.976 9.923 -27.395 1.0 74.14 78 A 4 -ATOM 1212 H HD13 . LEU A1 1 78 ? -26.012 9.485 -28.806 1.0 11.41 78 A 4 -ATOM 1213 H HD21 . LEU A1 1 78 ? -28.116 6.533 -27.333 1.0 65.32 78 A 4 -ATOM 1214 H HD22 . LEU A1 1 78 ? -29.531 7.56 -27.567 1.0 65.43 78 A 4 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.258 8.054 -26.45 1.0 34.04 78 A 4 -ATOM 1216 N N . ARG A1 1 79 ? -29.987 11.153 -31.493 1.0 44.5 79 A 4 -ATOM 1217 C CA . ARG A1 1 79 ? -31.079 11.447 -32.413 1.0 54.44 79 A 4 -ATOM 1218 C C . ARG A1 1 79 ? -30.591 11.427 -33.859 1.0 43.43 79 A 4 -ATOM 1219 O O . ARG A1 1 79 ? -31.355 11.136 -34.778 1.0 24.23 79 A 4 -ATOM 1220 C CB . ARG A1 1 79 ? -31.693 12.81 -32.09 1.0 53.1 79 A 4 -ATOM 1221 C CG . ARG A1 1 79 ? -33.179 12.749 -31.777 1.0 62.42 79 A 4 -ATOM 1222 C CD . ARG A1 1 79 ? -33.464 11.824 -30.604 1.0 15.2 79 A 4 -ATOM 1223 N NE . ARG A1 1 79 ? -34.776 12.074 -30.015 1.0 22.21 79 A 4 -ATOM 1224 C CZ . ARG A1 1 79 ? -35.417 11.199 -29.248 1.0 43.33 79 A 4 -ATOM 1225 N NH1 . ARG A1 1 79 ? -34.868 10.022 -28.979 1.0 51.34 79 A 4 -ATOM 1226 N NH2 . ARG A1 1 79 ? -36.609 11.499 -28.749 1.0 24.34 79 A 4 -ATOM 1227 H H . ARG A1 1 79 ? -29.755 11.809 -30.801 1.0 30.43 79 A 4 -ATOM 1228 H HA . ARG A1 1 79 ? -31.832 10.684 -32.289 1.0 75.12 79 A 4 -ATOM 1229 H HB2 . ARG A1 1 79 ? -31.184 13.228 -31.234 1.0 72.51 79 A 4 -ATOM 1230 H HB3 . ARG A1 1 79 ? -31.553 13.464 -32.938 1.0 62.3 79 A 4 -ATOM 1231 H HG2 . ARG A1 1 79 ? -33.527 13.742 -31.53 1.0 34.21 79 A 4 -ATOM 1232 H HG3 . ARG A1 1 79 ? -33.707 12.386 -32.646 1.0 51.44 79 A 4 -ATOM 1233 H HD2 . ARG A1 1 79 ? -33.424 10.802 -30.95 1.0 21.42 79 A 4 -ATOM 1234 H HD3 . ARG A1 1 79 ? -32.706 11.978 -29.85 1.0 24.22 79 A 4 -ATOM 1235 H HE . ARG A1 1 79 ? -35.2 12.937 -30.201 1.0 63.2 79 A 4 -ATOM 1236 H HH11 . ARG A1 1 79 ? -33.969 9.793 -29.353 1.0 0.03 79 A 4 -ATOM 1237 H HH12 . ARG A1 1 79 ? -35.352 9.365 -28.4 1.0 54.33 79 A 4 -ATOM 1238 H HH21 . ARG A1 1 79 ? -37.026 12.385 -28.95 1.0 72.3 79 A 4 -ATOM 1239 H HH22 . ARG A1 1 79 ? -37.09 10.84 -28.172 1.0 2.44 79 A 4 -ATOM 1240 N N . GLY A1 1 80 ? -29.313 11.737 -34.052 1.0 11.03 80 A 4 -ATOM 1241 C CA . GLY A1 1 80 ? -28.745 11.749 -35.387 1.0 3.12 80 A 4 -ATOM 1242 C C . GLY A1 1 80 ? -28.493 10.354 -35.922 1.0 52.34 80 A 4 -ATOM 1243 O O . GLY A1 1 80 ? -29.216 9.875 -36.795 1.0 43.44 80 A 4 -ATOM 1244 H H . GLY A1 1 80 ? -28.75 11.96 -33.28 1.0 0.24 80 A 4 -ATOM 1245 H HA2 . GLY A1 1 80 ? -29.426 12.26 -36.051 1.0 71.24 80 A 4 -ATOM 1246 H HA3 . GLY A1 1 80 ? -27.809 12.288 -35.364 1.0 43.14 80 A 4 -ATOM 1247 N N . GLY A1 1 81 ? -27.46 9.699 -35.399 1.0 43.34 81 A 4 -ATOM 1248 C CA . GLY A1 1 81 ? -27.131 8.357 -35.844 1.0 20.2 81 A 4 -ATOM 1249 C C . GLY A1 1 81 ? -26.628 8.326 -37.273 1.0 63.23 81 A 4 -ATOM 1250 O O . GLY A1 1 81 ? -26.772 9.302 -38.01 1.0 30.24 81 A 4 -ATOM 1251 H H . GLY A1 1 81 ? -26.918 10.13 -34.706 1.0 11.33 81 A 4 -ATOM 1252 H HA2 . GLY A1 1 81 ? -26.368 7.952 -35.196 1.0 30.51 81 A 4 -ATOM 1253 H HA3 . GLY A1 1 81 ? -28.015 7.74 -35.772 1.0 55.14 81 A 4 -ATOM 1254 N N . VAL A1 1 82 ? -26.036 7.204 -37.667 1.0 30.52 82 A 4 -ATOM 1255 C CA . VAL A1 1 82 ? -25.509 7.05 -39.018 1.0 4.45 82 A 4 -ATOM 1256 C C . VAL A1 1 82 ? -26.263 5.967 -39.782 1.0 63.52 82 A 4 -ATOM 1257 O O . VAL A1 1 82 ? -26.525 6.104 -40.977 1.0 12.52 82 A 4 -ATOM 1258 C CB . VAL A1 1 82 ? -24.01 6.699 -38.999 1.0 53.54 82 A 4 -ATOM 1259 C CG1 . VAL A1 1 82 ? -23.79 5.325 -38.385 1.0 33.31 82 A 4 -ATOM 1260 C CG2 . VAL A1 1 82 ? -23.43 6.764 -40.404 1.0 1.13 82 A 4 -ATOM 1261 H H . VAL A1 1 82 ? -25.952 6.46 -37.034 1.0 42.11 82 A 4 -ATOM 1262 H HA . VAL A1 1 82 ? -25.631 7.992 -39.533 1.0 65.12 82 A 4 -ATOM 1263 H HB . VAL A1 1 82 ? -23.498 7.428 -38.387 1.0 3.02 82 A 4 -ATOM 1264 H HG11 . VAL A1 1 82 ? -24.437 5.206 -37.529 1.0 71.54 82 A 4 -ATOM 1265 H HG12 . VAL A1 1 82 ? -24.016 4.563 -39.117 1.0 43.52 82 A 4 -ATOM 1266 H HG13 . VAL A1 1 82 ? -22.76 5.231 -38.074 1.0 60.31 82 A 4 -ATOM 1267 H HG21 . VAL A1 1 82 ? -23.442 7.786 -40.752 1.0 51.1 82 A 4 -ATOM 1268 H HG22 . VAL A1 1 82 ? -22.414 6.399 -40.391 1.0 43.42 82 A 4 -ATOM 1269 H HG23 . VAL A1 1 82 ? -24.024 6.152 -41.067 1.0 61.21 82 A 4 -ATOM 1 N N . GLY A1 1 1 ? -7.895 -5.399 -4.914 1.0 13.0 1 A 5 -ATOM 2 C CA . GLY A1 1 1 ? -7.708 -4.184 -4.141 1.0 45.03 1 A 5 -ATOM 3 C C . GLY A1 1 1 ? -6.451 -3.434 -4.534 1.0 65.21 1 A 5 -ATOM 4 O O . GLY A1 1 1 ? -5.48 -3.37 -3.78 1.0 33.34 1 A 5 -ATOM 5 H H1 . GLY A1 1 1 ? -7.317 -6.174 -4.752 1.0 52.4 1 A 5 -ATOM 6 H HA2 . GLY A1 1 1 ? -8.561 -3.54 -4.292 1.0 14.15 1 A 5 -ATOM 7 H HA3 . GLY A1 1 1 ? -7.646 -4.443 -3.094 1.0 34.23 1 A 5 -ATOM 8 N N . PRO A1 1 2 ? -6.458 -2.851 -5.742 1.0 55.32 2 A 5 -ATOM 9 C CA . PRO A1 1 2 ? -5.316 -2.093 -6.262 1.0 21.43 2 A 5 -ATOM 10 C C . PRO A1 1 2 ? -5.108 -0.777 -5.519 1.0 41.45 2 A 5 -ATOM 11 O O . PRO A1 1 2 ? -5.823 -0.472 -4.564 1.0 62.42 2 A 5 -ATOM 12 C CB . PRO A1 1 2 ? -5.7 -1.83 -7.72 1.0 51.45 2 A 5 -ATOM 13 C CG . PRO A1 1 2 ? -7.189 -1.876 -7.735 1.0 43.11 2 A 5 -ATOM 14 C CD . PRO A1 1 2 ? -7.581 -2.888 -6.693 1.0 64.14 2 A 5 -ATOM 15 H HA . PRO A1 1 2 ? -4.406 -2.673 -6.226 1.0 31.54 2 A 5 -ATOM 16 H HB2 . PRO A1 1 2 ? -5.331 -0.859 -8.022 1.0 42.4 2 A 5 -ATOM 17 H HB3 . PRO A1 1 2 ? -5.275 -2.595 -8.352 1.0 62.54 2 A 5 -ATOM 18 H HG2 . PRO A1 1 2 ? -7.589 -0.906 -7.485 1.0 3.22 2 A 5 -ATOM 19 H HG3 . PRO A1 1 2 ? -7.536 -2.188 -8.709 1.0 51.14 2 A 5 -ATOM 20 H HD2 . PRO A1 1 2 ? -8.503 -2.596 -6.213 1.0 11.0 2 A 5 -ATOM 21 H HD3 . PRO A1 1 2 ? -7.679 -3.868 -7.137 1.0 24.12 2 A 5 -ATOM 22 N N . LEU A1 1 3 ? -4.127 -0.001 -5.965 1.0 34.12 3 A 5 -ATOM 23 C CA . LEU A1 1 3 ? -3.825 1.284 -5.343 1.0 54.03 3 A 5 -ATOM 24 C C . LEU A1 1 3 ? -3.705 2.383 -6.394 1.0 63.21 3 A 5 -ATOM 25 O O . LEU A1 1 3 ? -3.364 2.119 -7.546 1.0 11.24 3 A 5 -ATOM 26 C CB . LEU A1 1 3 ? -2.529 1.19 -4.536 1.0 60.12 3 A 5 -ATOM 27 C CG . LEU A1 1 3 ? -2.679 1.248 -3.015 1.0 64.13 3 A 5 -ATOM 28 C CD1 . LEU A1 1 3 ? -2.66 -0.153 -2.424 1.0 62.25 3 A 5 -ATOM 29 C CD2 . LEU A1 1 3 ? -1.579 2.102 -2.403 1.0 0.12 3 A 5 -ATOM 30 H H . LEU A1 1 3 ? -3.592 -0.297 -6.73 1.0 52.35 3 A 5 -ATOM 31 H HA . LEU A1 1 3 ? -4.638 1.528 -4.676 1.0 43.13 3 A 5 -ATOM 32 H HB2 . LEU A1 1 3 ? -2.051 0.255 -4.786 1.0 74.24 3 A 5 -ATOM 33 H HB3 . LEU A1 1 3 ? -1.892 2.01 -4.838 1.0 72.41 3 A 5 -ATOM 34 H HG . LEU A1 1 3 ? -3.631 1.7 -2.771 1.0 43.5 3 A 5 -ATOM 35 H HD11 . LEU A1 1 3 ? -3.389 -0.767 -2.93 1.0 50.45 3 A 5 -ATOM 36 H HD12 . LEU A1 1 3 ? -2.9 -0.103 -1.372 1.0 4.34 3 A 5 -ATOM 37 H HD13 . LEU A1 1 3 ? -1.677 -0.583 -2.548 1.0 54.42 3 A 5 -ATOM 38 H HD21 . LEU A1 1 3 ? -0.633 1.59 -2.494 1.0 23.33 3 A 5 -ATOM 39 H HD22 . LEU A1 1 3 ? -1.797 2.275 -1.359 1.0 1.01 3 A 5 -ATOM 40 H HD23 . LEU A1 1 3 ? -1.529 3.049 -2.921 1.0 75.24 3 A 5 -ATOM 41 N N . GLY A1 1 4 ? -3.985 3.617 -5.987 1.0 4.21 4 A 5 -ATOM 42 C CA . GLY A1 1 4 ? -3.901 4.738 -6.905 1.0 43.34 4 A 5 -ATOM 43 C C . GLY A1 1 4 ? -5.136 4.87 -7.774 1.0 32.24 4 A 5 -ATOM 44 O O . GLY A1 1 4 ? -6.26 4.721 -7.295 1.0 73.31 4 A 5 -ATOM 45 H H . GLY A1 1 4 ? -4.252 3.768 -5.056 1.0 2.13 4 A 5 -ATOM 46 H HA2 . GLY A1 1 4 ? -3.776 5.647 -6.335 1.0 53.5 4 A 5 -ATOM 47 H HA3 . GLY A1 1 4 ? -3.039 4.602 -7.542 1.0 61.41 4 A 5 -ATOM 48 N N . SER A1 1 5 ? -4.928 5.151 -9.056 1.0 14.33 5 A 5 -ATOM 49 C CA . SER A1 1 5 ? -6.033 5.309 -9.994 1.0 12.42 5 A 5 -ATOM 50 C C . SER A1 1 5 ? -6.923 6.482 -9.593 1.0 43.22 5 A 5 -ATOM 51 O O . SER A1 1 5 ? -6.816 7.004 -8.484 1.0 33.52 5 A 5 -ATOM 52 C CB . SER A1 1 5 ? -6.862 4.024 -10.058 1.0 72.02 5 A 5 -ATOM 53 O OG . SER A1 1 5 ? -6.824 3.457 -11.356 1.0 21.35 5 A 5 -ATOM 54 H H . SER A1 1 5 ? -4.008 5.258 -9.379 1.0 31.12 5 A 5 -ATOM 55 H HA . SER A1 1 5 ? -5.615 5.506 -10.97 1.0 12.32 5 A 5 -ATOM 56 H HB2 . SER A1 1 5 ? -6.467 3.308 -9.354 1.0 41.01 5 A 5 -ATOM 57 H HB3 . SER A1 1 5 ? -7.888 4.248 -9.806 1.0 74.13 5 A 5 -ATOM 58 H HG . SER A1 1 5 ? -7.695 3.124 -11.586 1.0 33.45 5 A 5 -ATOM 59 N N . MET A1 1 6 ? -7.8 6.89 -10.504 1.0 14.01 6 A 5 -ATOM 60 C CA . MET A1 1 6 ? -8.709 8.0 -10.246 1.0 54.33 6 A 5 -ATOM 61 C C . MET A1 1 6 ? -10.032 7.801 -10.978 1.0 31.44 6 A 5 -ATOM 62 O O . MET A1 1 6 ? -10.26 6.76 -11.593 1.0 1.11 6 A 5 -ATOM 63 C CB . MET A1 1 6 ? -8.069 9.322 -10.675 1.0 70.21 6 A 5 -ATOM 64 C CG . MET A1 1 6 ? -7.267 9.219 -11.962 1.0 25.05 6 A 5 -ATOM 65 S SD . MET A1 1 6 ? -5.524 8.865 -11.667 1.0 3.44 6 A 5 -ATOM 66 C CE . MET A1 1 6 ? -4.759 10.328 -12.363 1.0 13.21 6 A 5 -ATOM 67 H H . MET A1 1 6 ? -7.838 6.433 -11.371 1.0 2.32 6 A 5 -ATOM 68 H HA . MET A1 1 6 ? -8.9 8.031 -9.183 1.0 5.22 6 A 5 -ATOM 69 H HB2 . MET A1 1 6 ? -8.848 10.055 -10.819 1.0 62.43 6 A 5 -ATOM 70 H HB3 . MET A1 1 6 ? -7.408 9.66 -9.891 1.0 63.34 6 A 5 -ATOM 71 H HG2 . MET A1 1 6 ? -7.682 8.427 -12.567 1.0 33.13 6 A 5 -ATOM 72 H HG3 . MET A1 1 6 ? -7.346 10.155 -12.494 1.0 12.41 6 A 5 -ATOM 73 H HE1 . MET A1 1 6 ? -4.584 10.175 -13.418 1.0 12.23 6 A 5 -ATOM 74 H HE2 . MET A1 1 6 ? -5.414 11.176 -12.226 1.0 52.54 6 A 5 -ATOM 75 H HE3 . MET A1 1 6 ? -3.819 10.514 -11.865 1.0 2.41 6 A 5 -ATOM 76 N N . GLN A1 1 7 ? -10.9 8.805 -10.906 1.0 13.12 7 A 5 -ATOM 77 C CA . GLN A1 1 7 ? -12.201 8.738 -11.562 1.0 13.2 7 A 5 -ATOM 78 C C . GLN A1 1 7 ? -12.551 10.072 -12.213 1.0 42.42 7 A 5 -ATOM 79 O O . GLN A1 1 7 ? -12.021 11.116 -11.835 1.0 71.33 7 A 5 -ATOM 80 C CB . GLN A1 1 7 ? -13.284 8.349 -10.554 1.0 42.01 7 A 5 -ATOM 81 C CG . GLN A1 1 7 ? -12.85 7.264 -9.582 1.0 12.34 7 A 5 -ATOM 82 C CD . GLN A1 1 7 ? -13.875 7.01 -8.494 1.0 44.31 7 A 5 -ATOM 83 O OE1 . GLN A1 1 7 ? -15.08 7.103 -8.728 1.0 33.44 7 A 5 -ATOM 84 N NE2 . GLN A1 1 7 ? -13.401 6.687 -7.297 1.0 73.32 7 A 5 -ATOM 85 H H . GLN A1 1 7 ? -10.661 9.609 -10.4 1.0 71.21 7 A 5 -ATOM 86 H HA . GLN A1 1 7 ? -12.147 7.98 -12.328 1.0 62.03 7 A 5 -ATOM 87 H HB2 . GLN A1 1 7 ? -13.56 9.224 -9.984 1.0 13.25 7 A 5 -ATOM 88 H HB3 . GLN A1 1 7 ? -14.149 7.993 -11.093 1.0 41.42 7 A 5 -ATOM 89 H HG2 . GLN A1 1 7 ? -12.696 6.347 -10.131 1.0 43.33 7 A 5 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.922 7.565 -9.118 1.0 33.21 7 A 5 -ATOM 91 H HE21 . GLN A1 1 7 ? -12.428 6.634 -7.184 1.0 52.01 7 A 5 -ATOM 92 H HE22 . GLN A1 1 7 ? -14.041 6.519 -6.576 1.0 55.43 7 A 5 -ATOM 93 N N . ILE A1 1 8 ? -13.447 10.028 -13.194 1.0 12.12 8 A 5 -ATOM 94 C CA . ILE A1 1 8 ? -13.868 11.233 -13.897 1.0 64.2 8 A 5 -ATOM 95 C C . ILE A1 1 8 ? -15.388 11.334 -13.954 1.0 0.33 8 A 5 -ATOM 96 O O . ILE A1 1 8 ? -16.093 10.334 -13.818 1.0 11.35 8 A 5 -ATOM 97 C CB . ILE A1 1 8 ? -13.309 11.272 -15.332 1.0 65.34 8 A 5 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.467 10.025 -15.609 1.0 72.33 8 A 5 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.484 12.533 -15.545 1.0 55.24 8 A 5 -ATOM 100 C CD1 . ILE A1 1 8 ? -12.044 9.889 -17.055 1.0 11.02 8 A 5 -ATOM 101 H H . ILE A1 1 8 ? -13.834 9.165 -13.45 1.0 43.45 8 A 5 -ATOM 102 H HA . ILE A1 1 8 ? -13.48 12.086 -13.358 1.0 41.41 8 A 5 -ATOM 103 H HB . ILE A1 1 8 ? -14.141 11.295 -16.018 1.0 13.24 8 A 5 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.573 10.06 -15.005 1.0 4.11 8 A 5 -ATOM 105 H HG13 . ILE A1 1 8 ? -13.04 9.148 -15.346 1.0 33.41 8 A 5 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.753 12.358 -16.321 1.0 12.11 8 A 5 -ATOM 107 H HG22 . ILE A1 1 8 ? -13.134 13.342 -15.84 1.0 14.43 8 A 5 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.979 12.793 -14.627 1.0 53.13 8 A 5 -ATOM 109 H HD11 . ILE A1 1 8 ? -10.984 9.684 -17.102 1.0 4.51 8 A 5 -ATOM 110 H HD12 . ILE A1 1 8 ? -12.588 9.077 -17.514 1.0 22.53 8 A 5 -ATOM 111 H HD13 . ILE A1 1 8 ? -12.256 10.809 -17.58 1.0 32.23 8 A 5 -ATOM 112 N N . PHE A1 1 9 ? -15.888 12.549 -14.155 1.0 44.42 9 A 5 -ATOM 113 C CA . PHE A1 1 9 ? -17.326 12.781 -14.231 1.0 45.42 9 A 5 -ATOM 114 C C . PHE A1 1 9 ? -17.737 13.193 -15.641 1.0 62.05 9 A 5 -ATOM 115 O O . PHE A1 1 9 ? -17.195 14.144 -16.205 1.0 33.13 9 A 5 -ATOM 116 C CB . PHE A1 1 9 ? -17.742 13.861 -13.23 1.0 42.3 9 A 5 -ATOM 117 C CG . PHE A1 1 9 ? -18.346 13.31 -11.97 1.0 44.44 9 A 5 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.615 12.753 -11.981 1.0 24.21 9 A 5 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.646 13.349 -10.775 1.0 24.11 9 A 5 -ATOM 120 C CE1 . PHE A1 1 9 ? -20.174 12.244 -10.823 1.0 54.33 9 A 5 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.2 12.842 -9.615 1.0 62.43 9 A 5 -ATOM 122 C CZ . PHE A1 1 9 ? -19.466 12.29 -9.639 1.0 72.21 9 A 5 -ATOM 123 H H . PHE A1 1 9 ? -15.275 13.307 -14.256 1.0 15.35 9 A 5 -ATOM 124 H HA . PHE A1 1 9 ? -17.823 11.858 -13.979 1.0 72.15 9 A 5 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.874 14.441 -12.954 1.0 13.22 9 A 5 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.471 14.509 -13.693 1.0 20.44 9 A 5 -ATOM 127 H HD1 . PHE A1 1 9 ? -20.171 12.717 -12.907 1.0 63.23 9 A 5 -ATOM 128 H HD2 . PHE A1 1 9 ? -16.656 13.781 -10.755 1.0 43.5 9 A 5 -ATOM 129 H HE1 . PHE A1 1 9 ? -21.164 11.814 -10.846 1.0 53.21 9 A 5 -ATOM 130 H HE2 . PHE A1 1 9 ? -17.644 12.879 -8.69 1.0 61.25 9 A 5 -ATOM 131 H HZ . PHE A1 1 9 ? -19.9 11.892 -8.733 1.0 11.33 9 A 5 -ATOM 132 N N . VAL A1 1 10 ? -18.7 12.471 -16.205 1.0 35.51 10 A 5 -ATOM 133 C CA . VAL A1 1 10 ? -19.185 12.76 -17.549 1.0 51.35 10 A 5 -ATOM 134 C C . VAL A1 1 10 ? -20.647 13.191 -17.524 1.0 20.3 10 A 5 -ATOM 135 O O . VAL A1 1 10 ? -21.5 12.502 -16.964 1.0 33.54 10 A 5 -ATOM 136 C CB . VAL A1 1 10 ? -19.037 11.538 -18.475 1.0 1.24 10 A 5 -ATOM 137 C CG1 . VAL A1 1 10 ? -19.034 11.97 -19.933 1.0 43.55 10 A 5 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.772 10.764 -18.136 1.0 70.41 10 A 5 -ATOM 139 H H . VAL A1 1 10 ? -19.093 11.726 -15.705 1.0 13.11 10 A 5 -ATOM 140 H HA . VAL A1 1 10 ? -18.589 13.566 -17.953 1.0 52.2 10 A 5 -ATOM 141 H HB . VAL A1 1 10 ? -19.885 10.888 -18.317 1.0 21.21 10 A 5 -ATOM 142 H HG11 . VAL A1 1 10 ? -20.023 12.3 -20.213 1.0 75.22 10 A 5 -ATOM 143 H HG12 . VAL A1 1 10 ? -18.331 12.78 -20.068 1.0 54.41 10 A 5 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.745 11.135 -20.555 1.0 61.31 10 A 5 -ATOM 145 H HG21 . VAL A1 1 10 ? -16.936 11.446 -18.081 1.0 13.24 10 A 5 -ATOM 146 H HG22 . VAL A1 1 10 ? -17.897 10.269 -17.185 1.0 62.44 10 A 5 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.584 10.027 -18.904 1.0 2.35 10 A 5 -ATOM 148 N N . LYS A1 1 11 ? -20.931 14.336 -18.136 1.0 23.3 11 A 5 -ATOM 149 C CA . LYS A1 1 11 ? -22.291 14.86 -18.187 1.0 10.31 11 A 5 -ATOM 150 C C . LYS A1 1 11 ? -22.886 14.695 -19.582 1.0 22.12 11 A 5 -ATOM 151 O O . LYS A1 1 11 ? -22.432 15.322 -20.54 1.0 63.21 11 A 5 -ATOM 152 C CB . LYS A1 1 11 ? -22.305 16.337 -17.786 1.0 34.41 11 A 5 -ATOM 153 C CG . LYS A1 1 11 ? -23.622 17.035 -18.083 1.0 63.11 11 A 5 -ATOM 154 C CD . LYS A1 1 11 ? -23.578 18.5 -17.684 1.0 3.15 11 A 5 -ATOM 155 C CE . LYS A1 1 11 ? -23.18 19.385 -18.855 1.0 2.52 11 A 5 -ATOM 156 N NZ . LYS A1 1 11 ? -23.337 20.831 -18.535 1.0 51.12 11 A 5 -ATOM 157 H H . LYS A1 1 11 ? -20.208 14.841 -18.565 1.0 4.15 11 A 5 -ATOM 158 H HA . LYS A1 1 11 ? -22.889 14.299 -17.485 1.0 44.21 11 A 5 -ATOM 159 H HB2 . LYS A1 1 11 ? -22.113 16.412 -16.726 1.0 75.01 11 A 5 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.521 16.851 -18.323 1.0 15.43 11 A 5 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.824 16.967 -19.141 1.0 73.24 11 A 5 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.411 16.544 -17.531 1.0 30.03 11 A 5 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.557 18.799 -17.338 1.0 63.51 11 A 5 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.859 18.626 -16.887 1.0 61.22 11 A 5 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.148 19.19 -19.102 1.0 70.24 11 A 5 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.805 19.142 -19.701 1.0 3.13 11 A 5 -ATOM 167 H HZ1 . LYS A1 1 11 ? -23.966 21.284 -19.228 1.0 1.34 11 A 5 -ATOM 168 H HZ2 . LYS A1 1 11 ? -22.411 21.305 -18.561 1.0 61.44 11 A 5 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.745 20.945 -17.586 1.0 12.11 11 A 5 -ATOM 170 N N . THR A1 1 12 ? -23.905 13.848 -19.689 1.0 60.33 12 A 5 -ATOM 171 C CA . THR A1 1 12 ? -24.562 13.601 -20.967 1.0 63.11 12 A 5 -ATOM 172 C C . THR A1 1 12 ? -25.429 14.786 -21.377 1.0 63.2 12 A 5 -ATOM 173 O O . THR A1 1 12 ? -25.79 15.622 -20.547 1.0 23.14 12 A 5 -ATOM 174 C CB . THR A1 1 12 ? -25.436 12.334 -20.913 1.0 13.53 12 A 5 -ATOM 175 O OG1 . THR A1 1 12 ? -26.489 12.505 -19.957 1.0 44.22 12 A 5 -ATOM 176 C CG2 . THR A1 1 12 ? -24.602 11.117 -20.544 1.0 44.25 12 A 5 -ATOM 177 H H . THR A1 1 12 ? -24.221 13.379 -18.889 1.0 50.31 12 A 5 -ATOM 178 H HA . THR A1 1 12 ? -23.796 13.453 -21.713 1.0 15.31 12 A 5 -ATOM 179 H HB . THR A1 1 12 ? -25.87 12.173 -21.889 1.0 3.11 12 A 5 -ATOM 180 H HG1 . THR A1 1 12 ? -27.121 11.787 -20.044 1.0 54.01 12 A 5 -ATOM 181 H HG21 . THR A1 1 12 ? -23.687 11.438 -20.071 1.0 54.24 12 A 5 -ATOM 182 H HG22 . THR A1 1 12 ? -24.369 10.556 -21.437 1.0 51.32 12 A 5 -ATOM 183 H HG23 . THR A1 1 12 ? -25.16 10.492 -19.862 1.0 74.05 12 A 5 -ATOM 184 N N . LEU A1 1 13 ? -25.763 14.852 -22.661 1.0 74.21 13 A 5 -ATOM 185 C CA . LEU A1 1 13 ? -26.589 15.936 -23.182 1.0 74.52 13 A 5 -ATOM 186 C C . LEU A1 1 13 ? -27.943 15.974 -22.479 1.0 25.21 13 A 5 -ATOM 187 O O . LEU A1 1 13 ? -28.638 16.991 -22.501 1.0 11.35 13 A 5 -ATOM 188 C CB . LEU A1 1 13 ? -26.789 15.771 -24.69 1.0 31.51 13 A 5 -ATOM 189 C CG . LEU A1 1 13 ? -27.448 16.947 -25.411 1.0 30.32 13 A 5 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.578 18.19 -25.312 1.0 44.31 13 A 5 -ATOM 191 C CD2 . LEU A1 1 13 ? -27.716 16.597 -26.868 1.0 64.01 13 A 5 -ATOM 192 H H . LEU A1 1 13 ? -25.446 14.157 -23.274 1.0 42.02 13 A 5 -ATOM 193 H HA . LEU A1 1 13 ? -26.073 16.866 -22.995 1.0 34.1 13 A 5 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.82 15.611 -25.136 1.0 62.11 13 A 5 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.406 14.898 -24.847 1.0 43.21 13 A 5 -ATOM 196 H HG . LEU A1 1 13 ? -28.396 17.166 -24.939 1.0 45.4 13 A 5 -ATOM 197 H HD11 . LEU A1 1 13 ? -26.656 18.759 -26.226 1.0 62.23 13 A 5 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.55 17.898 -25.156 1.0 23.44 13 A 5 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.909 18.796 -24.481 1.0 25.55 13 A 5 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.554 17.175 -27.229 1.0 62.14 13 A 5 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.943 15.544 -26.948 1.0 41.34 13 A 5 -ATOM 202 H HD23 . LEU A1 1 13 ? -26.84 16.822 -27.459 1.0 51.42 13 A 5 -ATOM 203 N N . THR A1 1 14 ? -28.311 14.86 -21.853 1.0 31.41 14 A 5 -ATOM 204 C CA . THR A1 1 14 ? -29.58 14.767 -21.143 1.0 30.33 14 A 5 -ATOM 205 C C . THR A1 1 14 ? -29.427 15.189 -19.686 1.0 22.13 14 A 5 -ATOM 206 O O . THR A1 1 14 ? -30.345 15.028 -18.883 1.0 5.31 14 A 5 -ATOM 207 C CB . THR A1 1 14 ? -30.148 13.336 -21.194 1.0 34.54 14 A 5 -ATOM 208 O OG1 . THR A1 1 14 ? -29.141 12.395 -20.803 1.0 3.22 14 A 5 -ATOM 209 C CG2 . THR A1 1 14 ? -30.647 13.001 -22.591 1.0 34.11 14 A 5 -ATOM 210 H H . THR A1 1 14 ? -27.714 14.084 -21.872 1.0 2.31 14 A 5 -ATOM 211 H HA . THR A1 1 14 ? -30.283 15.428 -21.628 1.0 25.44 14 A 5 -ATOM 212 H HB . THR A1 1 14 ? -30.978 13.27 -20.505 1.0 55.24 14 A 5 -ATOM 213 H HG1 . THR A1 1 14 ? -29.257 12.168 -19.878 1.0 24.42 14 A 5 -ATOM 214 H HG21 . THR A1 1 14 ? -31.192 13.844 -22.99 1.0 1.02 14 A 5 -ATOM 215 H HG22 . THR A1 1 14 ? -31.299 12.141 -22.544 1.0 12.23 14 A 5 -ATOM 216 H HG23 . THR A1 1 14 ? -29.806 12.781 -23.231 1.0 12.42 14 A 5 -ATOM 217 N N . GLY A1 1 15 ? -28.26 15.732 -19.351 1.0 61.2 15 A 5 -ATOM 218 C CA . GLY A1 1 15 ? -28.008 16.169 -17.991 1.0 25.44 15 A 5 -ATOM 219 C C . GLY A1 1 15 ? -27.898 15.01 -17.02 1.0 2.34 15 A 5 -ATOM 220 O O . GLY A1 1 15 ? -28.627 14.949 -16.029 1.0 24.03 15 A 5 -ATOM 221 H H . GLY A1 1 15 ? -27.564 15.835 -20.034 1.0 73.22 15 A 5 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.087 16.732 -17.97 1.0 10.15 15 A 5 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.818 16.811 -17.676 1.0 23.53 15 A 5 -ATOM 224 N N . LYS A1 1 16 ? -26.986 14.087 -17.304 1.0 11.21 16 A 5 -ATOM 225 C CA . LYS A1 1 16 ? -26.782 12.923 -16.45 1.0 34.13 16 A 5 -ATOM 226 C C . LYS A1 1 16 ? -25.337 12.848 -15.969 1.0 15.24 16 A 5 -ATOM 227 O O . LYS A1 1 16 ? -24.408 12.755 -16.772 1.0 50.04 16 A 5 -ATOM 228 C CB . LYS A1 1 16 ? -27.148 11.642 -17.202 1.0 31.42 16 A 5 -ATOM 229 C CG . LYS A1 1 16 ? -27.723 10.556 -16.31 1.0 73.35 16 A 5 -ATOM 230 C CD . LYS A1 1 16 ? -26.634 9.65 -15.762 1.0 50.3 16 A 5 -ATOM 231 C CE . LYS A1 1 16 ? -26.005 8.807 -16.86 1.0 52.44 16 A 5 -ATOM 232 N NZ . LYS A1 1 16 ? -26.393 7.373 -16.751 1.0 2.53 16 A 5 -ATOM 233 H H . LYS A1 1 16 ? -26.435 14.191 -18.109 1.0 52.54 16 A 5 -ATOM 234 H HA . LYS A1 1 16 ? -27.43 13.024 -15.592 1.0 34.34 16 A 5 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.879 11.88 -17.961 1.0 44.24 16 A 5 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.26 11.253 -17.68 1.0 12.13 16 A 5 -ATOM 237 H HG2 . LYS A1 1 16 ? -28.242 11.018 -15.483 1.0 3.41 16 A 5 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.418 9.96 -16.885 1.0 74.14 16 A 5 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.866 10.258 -15.307 1.0 63.23 16 A 5 -ATOM 240 H HD3 . LYS A1 1 16 ? -27.064 8.993 -15.018 1.0 14.51 16 A 5 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.328 9.186 -17.817 1.0 44.12 16 A 5 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.93 8.886 -16.786 1.0 75.31 16 A 5 -ATOM 243 H HZ1 . LYS A1 1 16 ? -26.096 6.856 -17.603 1.0 61.55 16 A 5 -ATOM 244 H HZ2 . LYS A1 1 16 ? -27.425 7.29 -16.65 1.0 23.15 16 A 5 -ATOM 245 H HZ3 . LYS A1 1 16 ? -25.94 6.942 -15.92 1.0 43.23 16 A 5 -ATOM 246 N N . THR A1 1 17 ? -25.153 12.887 -14.653 1.0 33.03 17 A 5 -ATOM 247 C CA . THR A1 1 17 ? -23.821 12.823 -14.065 1.0 61.21 17 A 5 -ATOM 248 C C . THR A1 1 17 ? -23.406 11.38 -13.798 1.0 13.11 17 A 5 -ATOM 249 O O . THR A1 1 17 ? -24.052 10.672 -13.025 1.0 32.24 17 A 5 -ATOM 250 C CB . THR A1 1 17 ? -23.749 13.617 -12.747 1.0 22.54 17 A 5 -ATOM 251 O OG1 . THR A1 1 17 ? -25.058 13.743 -12.179 1.0 24.32 17 A 5 -ATOM 252 C CG2 . THR A1 1 17 ? -23.157 14.999 -12.979 1.0 72.42 17 A 5 -ATOM 253 H H . THR A1 1 17 ? -25.933 12.962 -14.064 1.0 63.53 17 A 5 -ATOM 254 H HA . THR A1 1 17 ? -23.126 13.264 -14.765 1.0 15.15 17 A 5 -ATOM 255 H HB . THR A1 1 17 ? -23.115 13.081 -12.055 1.0 61.22 17 A 5 -ATOM 256 H HG1 . THR A1 1 17 ? -25.121 13.192 -11.395 1.0 54.0 17 A 5 -ATOM 257 H HG21 . THR A1 1 17 ? -22.149 15.028 -12.592 1.0 31.34 17 A 5 -ATOM 258 H HG22 . THR A1 1 17 ? -23.758 15.739 -12.472 1.0 12.24 17 A 5 -ATOM 259 H HG23 . THR A1 1 17 ? -23.142 15.211 -14.038 1.0 74.01 17 A 5 -ATOM 260 N N . ILE A1 1 18 ? -22.326 10.951 -14.443 1.0 21.15 18 A 5 -ATOM 261 C CA . ILE A1 1 18 ? -21.826 9.593 -14.273 1.0 42.23 18 A 5 -ATOM 262 C C . ILE A1 1 18 ? -20.361 9.596 -13.85 1.0 2.02 18 A 5 -ATOM 263 O O . ILE A1 1 18 ? -19.573 10.428 -14.303 1.0 34.24 18 A 5 -ATOM 264 C CB . ILE A1 1 18 ? -21.972 8.773 -15.569 1.0 20.13 18 A 5 -ATOM 265 C CG1 . ILE A1 1 18 ? -21.212 7.451 -15.45 1.0 0.43 18 A 5 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.471 9.573 -16.762 1.0 34.34 18 A 5 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.452 6.51 -16.609 1.0 41.12 18 A 5 -ATOM 268 H H . ILE A1 1 18 ? -21.855 11.563 -15.046 1.0 72.35 18 A 5 -ATOM 269 H HA . ILE A1 1 18 ? -22.411 9.116 -13.501 1.0 33.1 18 A 5 -ATOM 270 H HB . ILE A1 1 18 ? -23.02 8.565 -15.72 1.0 55.23 18 A 5 -ATOM 271 H HG12 . ILE A1 1 18 ? -20.154 7.654 -15.402 1.0 35.45 18 A 5 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.519 6.948 -14.544 1.0 15.51 18 A 5 -ATOM 273 H HG21 . ILE A1 1 18 ? -22.204 10.322 -17.026 1.0 31.24 18 A 5 -ATOM 274 H HG22 . ILE A1 1 18 ? -20.541 10.057 -16.505 1.0 60.32 18 A 5 -ATOM 275 H HG23 . ILE A1 1 18 ? -21.314 8.911 -17.599 1.0 71.44 18 A 5 -ATOM 276 H HD11 . ILE A1 1 18 ? -21.975 7.034 -17.396 1.0 32.31 18 A 5 -ATOM 277 H HD12 . ILE A1 1 18 ? -20.505 6.151 -16.985 1.0 60.24 18 A 5 -ATOM 278 H HD13 . ILE A1 1 18 ? -22.048 5.673 -16.277 1.0 25.35 18 A 5 -ATOM 279 N N . THR A1 1 19 ? -20.0 8.659 -12.979 1.0 42.32 19 A 5 -ATOM 280 C CA . THR A1 1 19 ? -18.629 8.552 -12.495 1.0 41.24 19 A 5 -ATOM 281 C C . THR A1 1 19 ? -17.974 7.264 -12.978 1.0 70.21 19 A 5 -ATOM 282 O O . THR A1 1 19 ? -18.594 6.2 -12.97 1.0 44.42 19 A 5 -ATOM 283 C CB . THR A1 1 19 ? -18.572 8.598 -10.956 1.0 2.4 19 A 5 -ATOM 284 O OG1 . THR A1 1 19 ? -19.813 9.087 -10.434 1.0 22.32 19 A 5 -ATOM 285 C CG2 . THR A1 1 19 ? -17.432 9.487 -10.483 1.0 13.14 19 A 5 -ATOM 286 H H . THR A1 1 19 ? -20.673 8.025 -12.655 1.0 1.15 19 A 5 -ATOM 287 H HA . THR A1 1 19 ? -18.073 9.395 -12.88 1.0 65.43 19 A 5 -ATOM 288 H HB . THR A1 1 19 ? -18.405 7.596 -10.587 1.0 44.24 19 A 5 -ATOM 289 H HG1 . THR A1 1 19 ? -19.991 8.668 -9.588 1.0 60.25 19 A 5 -ATOM 290 H HG21 . THR A1 1 19 ? -17.631 9.821 -9.476 1.0 73.33 19 A 5 -ATOM 291 H HG22 . THR A1 1 19 ? -17.348 10.343 -11.136 1.0 23.45 19 A 5 -ATOM 292 H HG23 . THR A1 1 19 ? -16.508 8.928 -10.501 1.0 51.03 19 A 5 -ATOM 293 N N . ILE A1 1 20 ? -16.717 7.366 -13.398 1.0 2.13 20 A 5 -ATOM 294 C CA . ILE A1 1 20 ? -15.978 6.208 -13.883 1.0 23.24 20 A 5 -ATOM 295 C C . ILE A1 1 20 ? -14.516 6.268 -13.452 1.0 21.51 20 A 5 -ATOM 296 O O . ILE A1 1 20 ? -13.856 7.296 -13.604 1.0 3.54 20 A 5 -ATOM 297 C CB . ILE A1 1 20 ? -16.044 6.099 -15.418 1.0 55.55 20 A 5 -ATOM 298 C CG1 . ILE A1 1 20 ? -16.023 7.492 -16.05 1.0 1.5 20 A 5 -ATOM 299 C CG2 . ILE A1 1 20 ? -17.292 5.338 -15.841 1.0 1.32 20 A 5 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.282 7.547 -17.368 1.0 2.4 20 A 5 -ATOM 301 H H . ILE A1 1 20 ? -16.277 8.241 -13.38 1.0 32.52 20 A 5 -ATOM 302 H HA . ILE A1 1 20 ? -16.43 5.322 -13.459 1.0 40.32 20 A 5 -ATOM 303 H HB . ILE A1 1 20 ? -15.182 5.545 -15.755 1.0 75.22 20 A 5 -ATOM 304 H HG12 . ILE A1 1 20 ? -17.037 7.816 -16.227 1.0 4.24 20 A 5 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.543 8.181 -15.37 1.0 20.02 20 A 5 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.127 4.887 -16.808 1.0 41.11 20 A 5 -ATOM 307 H HG22 . ILE A1 1 20 ? -17.506 4.567 -15.117 1.0 51.34 20 A 5 -ATOM 308 H HG23 . ILE A1 1 20 ? -18.127 6.02 -15.9 1.0 74.34 20 A 5 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.586 8.427 -17.916 1.0 44.23 20 A 5 -ATOM 310 H HD12 . ILE A1 1 20 ? -14.219 7.589 -17.181 1.0 43.31 20 A 5 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.512 6.666 -17.947 1.0 23.14 20 A 5 -ATOM 312 N N . ASP A1 1 21 ? -14.017 5.161 -12.915 1.0 44.41 21 A 5 -ATOM 313 C CA . ASP A1 1 21 ? -12.632 5.086 -12.464 1.0 13.43 21 A 5 -ATOM 314 C C . ASP A1 1 21 ? -11.697 4.784 -13.631 1.0 74.52 21 A 5 -ATOM 315 O O . ASP A1 1 21 ? -11.847 3.771 -14.314 1.0 3.25 21 A 5 -ATOM 316 C CB . ASP A1 1 21 ? -12.482 4.015 -11.383 1.0 40.32 21 A 5 -ATOM 317 C CG . ASP A1 1 21 ? -12.784 2.623 -11.902 1.0 70.32 21 A 5 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.973 2.324 -12.144 1.0 34.41 21 A 5 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.832 1.832 -12.066 1.0 4.34 21 A 5 -ATOM 320 H H . ASP A1 1 21 ? -14.594 4.374 -12.82 1.0 61.24 21 A 5 -ATOM 321 H HA . ASP A1 1 21 ? -12.367 6.046 -12.047 1.0 0.1 21 A 5 -ATOM 322 H HB2 . ASP A1 1 21 ? -11.468 4.028 -11.011 1.0 73.15 21 A 5 -ATOM 323 H HB3 . ASP A1 1 21 ? -13.161 4.233 -10.572 1.0 61.23 21 A 5 -ATOM 324 N N . VAL A1 1 22 ? -10.731 5.67 -13.853 1.0 30.34 22 A 5 -ATOM 325 C CA . VAL A1 1 22 ? -9.771 5.498 -14.937 1.0 1.34 22 A 5 -ATOM 326 C C . VAL A1 1 22 ? -8.349 5.773 -14.46 1.0 61.2 22 A 5 -ATOM 327 O O . VAL A1 1 22 ? -8.142 6.372 -13.405 1.0 34.03 22 A 5 -ATOM 328 C CB . VAL A1 1 22 ? -10.091 6.426 -16.124 1.0 60.13 22 A 5 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.551 6.854 -16.088 1.0 14.0 22 A 5 -ATOM 330 C CG2 . VAL A1 1 22 ? -9.172 7.638 -16.115 1.0 61.12 22 A 5 -ATOM 331 H H . VAL A1 1 22 ? -10.662 6.457 -13.275 1.0 71.0 22 A 5 -ATOM 332 H HA . VAL A1 1 22 ? -9.834 4.475 -15.28 1.0 41.13 22 A 5 -ATOM 333 H HB . VAL A1 1 22 ? -9.922 5.879 -17.039 1.0 23.42 22 A 5 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.814 7.313 -17.03 1.0 3.13 22 A 5 -ATOM 335 H HG12 . VAL A1 1 22 ? -12.176 5.989 -15.921 1.0 11.12 22 A 5 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.698 7.565 -15.289 1.0 2.3 22 A 5 -ATOM 337 H HG21 . VAL A1 1 22 ? -9.15 8.067 -15.124 1.0 43.3 22 A 5 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.175 7.335 -16.398 1.0 71.52 22 A 5 -ATOM 339 H HG23 . VAL A1 1 22 ? -9.538 8.374 -16.816 1.0 24.41 22 A 5 -ATOM 340 N N . ASP A1 1 23 ? -7.372 5.332 -15.246 1.0 73.14 23 A 5 -ATOM 341 C CA . ASP A1 1 23 ? -5.968 5.532 -14.905 1.0 0.33 23 A 5 -ATOM 342 C C . ASP A1 1 23 ? -5.293 6.464 -15.907 1.0 62.12 23 A 5 -ATOM 343 O O . ASP A1 1 23 ? -5.705 6.55 -17.064 1.0 35.34 23 A 5 -ATOM 344 C CB . ASP A1 1 23 ? -5.236 4.19 -14.863 1.0 24.44 23 A 5 -ATOM 345 C CG . ASP A1 1 23 ? -4.508 3.968 -13.552 1.0 11.25 23 A 5 -ATOM 346 O OD1 . ASP A1 1 23 ? -4.01 4.958 -12.975 1.0 71.52 23 A 5 -ATOM 347 O OD2 . ASP A1 1 23 ? -4.436 2.805 -13.102 1.0 54.12 23 A 5 -ATOM 348 H H . ASP A1 1 23 ? -7.601 4.862 -16.075 1.0 71.31 23 A 5 -ATOM 349 H HA . ASP A1 1 23 ? -5.926 5.985 -13.926 1.0 62.03 23 A 5 -ATOM 350 H HB2 . ASP A1 1 23 ? -5.952 3.392 -14.996 1.0 75.32 23 A 5 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.513 4.157 -15.665 1.0 32.1 23 A 5 -ATOM 352 N N . HIS A1 1 24 ? -4.255 7.16 -15.454 1.0 3.42 24 A 5 -ATOM 353 C CA . HIS A1 1 24 ? -3.523 8.086 -16.311 1.0 64.1 24 A 5 -ATOM 354 C C . HIS A1 1 24 ? -2.907 7.354 -17.499 1.0 13.22 24 A 5 -ATOM 355 O O . HIS A1 1 24 ? -2.499 7.976 -18.48 1.0 40.32 24 A 5 -ATOM 356 C CB . HIS A1 1 24 ? -2.431 8.797 -15.512 1.0 43.52 24 A 5 -ATOM 357 C CG . HIS A1 1 24 ? -1.423 7.865 -14.913 1.0 63.23 24 A 5 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.168 7.667 -15.448 1.0 33.23 24 A 5 -ATOM 359 C CD2 . HIS A1 1 24 ? -1.491 7.074 -13.816 1.0 70.35 24 A 5 -ATOM 360 C CE1 . HIS A1 1 24 ? 0.492 6.795 -14.708 1.0 52.22 24 A 5 -ATOM 361 N NE2 . HIS A1 1 24 ? -0.289 6.42 -13.711 1.0 51.1 24 A 5 -ATOM 362 H H . HIS A1 1 24 ? -3.975 7.047 -14.522 1.0 35.01 24 A 5 -ATOM 363 H HA . HIS A1 1 24 ? -4.223 8.82 -16.68 1.0 52.33 24 A 5 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.904 9.479 -16.164 1.0 74.33 24 A 5 -ATOM 365 H HB3 . HIS A1 1 24 ? -2.887 9.355 -14.708 1.0 2.24 24 A 5 -ATOM 366 H HD1 . HIS A1 1 24 ? 0.186 8.101 -16.252 1.0 61.24 24 A 5 -ATOM 367 H HD2 . HIS A1 1 24 ? -2.335 6.976 -13.147 1.0 14.35 24 A 5 -ATOM 368 H HE1 . HIS A1 1 24 ? 1.498 6.447 -14.887 1.0 73.24 24 A 5 -ATOM 369 N N . ALA A1 1 25 ? -2.841 6.03 -17.404 1.0 63.43 25 A 5 -ATOM 370 C CA . ALA A1 1 25 ? -2.276 5.214 -18.471 1.0 43.32 25 A 5 -ATOM 371 C C . ALA A1 1 25 ? -3.331 4.872 -19.518 1.0 33.54 25 A 5 -ATOM 372 O O . ALA A1 1 25 ? -3.081 4.083 -20.43 1.0 12.23 25 A 5 -ATOM 373 C CB . ALA A1 1 25 ? -1.666 3.944 -17.898 1.0 51.34 25 A 5 -ATOM 374 H H . ALA A1 1 25 ? -3.183 5.592 -16.597 1.0 55.41 25 A 5 -ATOM 375 H HA . ALA A1 1 25 ? -1.487 5.782 -18.943 1.0 23.12 25 A 5 -ATOM 376 H HB1 . ALA A1 1 25 ? -1.372 3.29 -18.706 1.0 42.21 25 A 5 -ATOM 377 H HB2 . ALA A1 1 25 ? -0.8 4.196 -17.305 1.0 3.14 25 A 5 -ATOM 378 H HB3 . ALA A1 1 25 ? -2.394 3.444 -17.278 1.0 44.44 25 A 5 -ATOM 379 N N . ASP A1 1 26 ? -4.51 5.468 -19.38 1.0 53.31 26 A 5 -ATOM 380 C CA . ASP A1 1 26 ? -5.603 5.225 -20.314 1.0 71.32 26 A 5 -ATOM 381 C C . ASP A1 1 26 ? -5.715 6.361 -21.326 1.0 31.24 26 A 5 -ATOM 382 O O . ASP A1 1 26 ? -4.818 7.197 -21.44 1.0 53.43 26 A 5 -ATOM 383 C CB . ASP A1 1 26 ? -6.923 5.068 -19.558 1.0 21.1 26 A 5 -ATOM 384 C CG . ASP A1 1 26 ? -6.841 4.024 -18.461 1.0 73.54 26 A 5 -ATOM 385 O OD1 . ASP A1 1 26 ? -5.85 3.264 -18.438 1.0 73.22 26 A 5 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.767 3.968 -17.625 1.0 2.02 26 A 5 -ATOM 387 H H . ASP A1 1 26 ? -4.648 6.086 -18.632 1.0 73.33 26 A 5 -ATOM 388 H HA . ASP A1 1 26 ? -5.39 4.309 -20.843 1.0 35.3 26 A 5 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.189 6.014 -19.109 1.0 71.15 26 A 5 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.696 4.774 -20.253 1.0 51.4 26 A 5 -ATOM 391 N N . THR A1 1 27 ? -6.823 6.386 -22.06 1.0 11.22 27 A 5 -ATOM 392 C CA . THR A1 1 27 ? -7.052 7.417 -23.064 1.0 12.11 27 A 5 -ATOM 393 C C . THR A1 1 27 ? -8.534 7.75 -23.183 1.0 24.55 27 A 5 -ATOM 394 O O . THR A1 1 27 ? -9.388 7.013 -22.69 1.0 14.34 27 A 5 -ATOM 395 C CB . THR A1 1 27 ? -6.522 6.985 -24.445 1.0 24.42 27 A 5 -ATOM 396 O OG1 . THR A1 1 27 ? -6.535 5.557 -24.549 1.0 51.41 27 A 5 -ATOM 397 C CG2 . THR A1 1 27 ? -5.109 7.502 -24.669 1.0 72.22 27 A 5 -ATOM 398 H H . THR A1 1 27 ? -7.501 5.692 -21.923 1.0 1.33 27 A 5 -ATOM 399 H HA . THR A1 1 27 ? -6.517 8.305 -22.759 1.0 54.42 27 A 5 -ATOM 400 H HB . THR A1 1 27 ? -7.166 7.4 -25.207 1.0 51.23 27 A 5 -ATOM 401 H HG1 . THR A1 1 27 ? -7.23 5.201 -23.991 1.0 23.44 27 A 5 -ATOM 402 H HG21 . THR A1 1 27 ? -4.739 7.14 -25.616 1.0 20.21 27 A 5 -ATOM 403 H HG22 . THR A1 1 27 ? -4.467 7.152 -23.874 1.0 40.31 27 A 5 -ATOM 404 H HG23 . THR A1 1 27 ? -5.118 8.582 -24.674 1.0 53.14 27 A 5 -ATOM 405 N N . VAL A1 1 28 ? -8.835 8.865 -23.842 1.0 70.04 28 A 5 -ATOM 406 C CA . VAL A1 1 28 ? -10.216 9.294 -24.027 1.0 40.12 28 A 5 -ATOM 407 C C . VAL A1 1 28 ? -11.044 8.206 -24.701 1.0 43.3 28 A 5 -ATOM 408 O O . VAL A1 1 28 ? -12.135 7.868 -24.242 1.0 51.44 28 A 5 -ATOM 409 C CB . VAL A1 1 28 ? -10.296 10.581 -24.87 1.0 70.14 28 A 5 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.701 11.162 -24.827 1.0 13.41 28 A 5 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.274 11.599 -24.386 1.0 73.55 28 A 5 -ATOM 412 H H . VAL A1 1 28 ? -8.111 9.411 -24.212 1.0 50.23 28 A 5 -ATOM 413 H HA . VAL A1 1 28 ? -10.635 9.501 -23.053 1.0 62.42 28 A 5 -ATOM 414 H HB . VAL A1 1 28 ? -10.065 10.33 -25.895 1.0 52.41 28 A 5 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.819 11.877 -25.628 1.0 72.32 28 A 5 -ATOM 416 H HG12 . VAL A1 1 28 ? -12.423 10.367 -24.943 1.0 75.12 28 A 5 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.857 11.655 -23.879 1.0 43.12 28 A 5 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.681 11.165 -23.594 1.0 22.23 28 A 5 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.631 11.88 -25.206 1.0 21.24 28 A 5 -ATOM 420 H HG23 . VAL A1 1 28 ? -9.786 12.474 -24.013 1.0 51.43 28 A 5 -ATOM 421 N N . GLY A1 1 29 ? -10.518 7.66 -25.793 1.0 51.02 29 A 5 -ATOM 422 C CA . GLY A1 1 29 ? -11.222 6.615 -26.513 1.0 24.21 29 A 5 -ATOM 423 C C . GLY A1 1 29 ? -11.679 5.492 -25.604 1.0 62.32 29 A 5 -ATOM 424 O O . GLY A1 1 29 ? -12.842 5.091 -25.639 1.0 1.41 29 A 5 -ATOM 425 H H . GLY A1 1 29 ? -9.645 7.97 -26.113 1.0 25.44 29 A 5 -ATOM 426 H HA2 . GLY A1 1 29 ? -12.085 7.046 -26.998 1.0 33.14 29 A 5 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.564 6.208 -27.267 1.0 61.11 29 A 5 -ATOM 428 N N . ALA A1 1 30 ? -10.762 4.982 -24.789 1.0 0.3 30 A 5 -ATOM 429 C CA . ALA A1 1 30 ? -11.077 3.898 -23.867 1.0 24.42 30 A 5 -ATOM 430 C C . ALA A1 1 30 ? -12.173 4.31 -22.889 1.0 23.15 30 A 5 -ATOM 431 O O . ALA A1 1 30 ? -13.076 3.53 -22.589 1.0 23.32 30 A 5 -ATOM 432 C CB . ALA A1 1 30 ? -9.828 3.467 -23.112 1.0 4.23 30 A 5 -ATOM 433 H H . ALA A1 1 30 ? -9.852 5.344 -24.808 1.0 13.0 30 A 5 -ATOM 434 H HA . ALA A1 1 30 ? -11.425 3.056 -24.448 1.0 42.35 30 A 5 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.964 2.464 -22.735 1.0 24.3 30 A 5 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.979 3.491 -23.778 1.0 15.25 30 A 5 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.657 4.142 -22.286 1.0 54.13 30 A 5 -ATOM 438 N N . VAL A1 1 31 ? -12.086 5.541 -22.395 1.0 44.02 31 A 5 -ATOM 439 C CA . VAL A1 1 31 ? -13.07 6.057 -21.452 1.0 44.43 31 A 5 -ATOM 440 C C . VAL A1 1 31 ? -14.464 6.082 -22.07 1.0 22.33 31 A 5 -ATOM 441 O O . VAL A1 1 31 ? -15.445 5.699 -21.432 1.0 41.34 31 A 5 -ATOM 442 C CB . VAL A1 1 31 ? -12.705 7.477 -20.98 1.0 42.01 31 A 5 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.824 8.063 -20.131 1.0 61.22 31 A 5 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.393 7.461 -20.21 1.0 34.2 31 A 5 -ATOM 445 H H . VAL A1 1 31 ? -11.343 6.117 -22.673 1.0 33.11 31 A 5 -ATOM 446 H HA . VAL A1 1 31 ? -13.081 5.406 -20.59 1.0 53.53 31 A 5 -ATOM 447 H HB . VAL A1 1 31 ? -12.579 8.103 -21.851 1.0 34.14 31 A 5 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.495 7.273 -19.827 1.0 24.43 31 A 5 -ATOM 449 H HG12 . VAL A1 1 31 ? -13.402 8.536 -19.256 1.0 62.24 31 A 5 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.368 8.794 -20.709 1.0 4.44 31 A 5 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.59 7.777 -20.859 1.0 32.4 31 A 5 -ATOM 452 H HG22 . VAL A1 1 31 ? -11.463 8.134 -19.368 1.0 31.51 31 A 5 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.196 6.46 -19.855 1.0 2.41 31 A 5 -ATOM 454 N N . LYS A1 1 32 ? -14.544 6.535 -23.316 1.0 44.33 32 A 5 -ATOM 455 C CA . LYS A1 1 32 ? -15.817 6.608 -24.024 1.0 33.41 32 A 5 -ATOM 456 C C . LYS A1 1 32 ? -16.502 5.246 -24.054 1.0 33.52 32 A 5 -ATOM 457 O O . LYS A1 1 32 ? -17.714 5.145 -23.865 1.0 55.22 32 A 5 -ATOM 458 C CB . LYS A1 1 32 ? -15.602 7.115 -25.452 1.0 21.43 32 A 5 -ATOM 459 C CG . LYS A1 1 32 ? -16.171 8.501 -25.697 1.0 62.04 32 A 5 -ATOM 460 C CD . LYS A1 1 32 ? -15.07 9.527 -25.906 1.0 13.3 32 A 5 -ATOM 461 C CE . LYS A1 1 32 ? -14.975 9.955 -27.362 1.0 61.02 32 A 5 -ATOM 462 N NZ . LYS A1 1 32 ? -16.239 10.584 -27.838 1.0 10.13 32 A 5 -ATOM 463 H H . LYS A1 1 32 ? -13.726 6.826 -23.773 1.0 0.43 32 A 5 -ATOM 464 H HA . LYS A1 1 32 ? -16.451 7.304 -23.495 1.0 20.21 32 A 5 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.542 7.142 -25.655 1.0 31.13 32 A 5 -ATOM 466 H HB3 . LYS A1 1 32 ? -16.074 6.428 -26.139 1.0 51.43 32 A 5 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.794 8.474 -26.579 1.0 34.55 32 A 5 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.765 8.793 -24.843 1.0 75.31 32 A 5 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.28 10.396 -25.3 1.0 62.53 32 A 5 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.126 9.095 -25.604 1.0 34.24 32 A 5 -ATOM 471 H HE2 . LYS A1 1 32 ? -14.169 10.666 -27.463 1.0 32.35 32 A 5 -ATOM 472 H HE3 . LYS A1 1 32 ? -14.766 9.085 -27.967 1.0 31.14 32 A 5 -ATOM 473 H HZ1 . LYS A1 1 32 ? -16.768 10.977 -27.034 1.0 3.34 32 A 5 -ATOM 474 H HZ2 . LYS A1 1 32 ? -16.831 9.876 -28.317 1.0 11.13 32 A 5 -ATOM 475 H HZ3 . LYS A1 1 32 ? -16.026 11.351 -28.508 1.0 13.55 32 A 5 -ATOM 476 N N . ALA A1 1 33 ? -15.718 4.199 -24.292 1.0 34.21 33 A 5 -ATOM 477 C CA . ALA A1 1 33 ? -16.249 2.843 -24.343 1.0 60.31 33 A 5 -ATOM 478 C C . ALA A1 1 33 ? -16.819 2.425 -22.992 1.0 31.03 33 A 5 -ATOM 479 O O . ALA A1 1 33 ? -17.869 1.786 -22.92 1.0 31.32 33 A 5 -ATOM 480 C CB . ALA A1 1 33 ? -15.167 1.869 -24.786 1.0 54.24 33 A 5 -ATOM 481 H H . ALA A1 1 33 ? -14.759 4.343 -24.434 1.0 43.1 33 A 5 -ATOM 482 H HA . ALA A1 1 33 ? -17.04 2.822 -25.079 1.0 53.01 33 A 5 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.278 2.026 -24.192 1.0 2.33 33 A 5 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.517 0.856 -24.65 1.0 61.23 33 A 5 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.938 2.035 -25.828 1.0 53.23 33 A 5 -ATOM 486 N N . LYS A1 1 34 ? -16.12 2.789 -21.922 1.0 30.14 34 A 5 -ATOM 487 C CA . LYS A1 1 34 ? -16.557 2.453 -20.572 1.0 3.41 34 A 5 -ATOM 488 C C . LYS A1 1 34 ? -17.931 3.048 -20.28 1.0 51.04 34 A 5 -ATOM 489 O O . LYS A1 1 34 ? -18.789 2.39 -19.692 1.0 30.3 34 A 5 -ATOM 490 C CB . LYS A1 1 34 ? -15.541 2.959 -19.545 1.0 63.02 34 A 5 -ATOM 491 C CG . LYS A1 1 34 ? -15.888 2.589 -18.113 1.0 24.43 34 A 5 -ATOM 492 C CD . LYS A1 1 34 ? -15.836 1.086 -17.898 1.0 44.42 34 A 5 -ATOM 493 C CE . LYS A1 1 34 ? -14.424 0.546 -18.068 1.0 34.12 34 A 5 -ATOM 494 N NZ . LYS A1 1 34 ? -14.244 -0.763 -17.382 1.0 13.0 34 A 5 -ATOM 495 H H . LYS A1 1 34 ? -15.291 3.298 -22.044 1.0 65.25 34 A 5 -ATOM 496 H HA . LYS A1 1 34 ? -16.621 1.378 -20.502 1.0 3.22 34 A 5 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.573 2.542 -19.778 1.0 71.03 34 A 5 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.486 4.036 -19.613 1.0 71.12 34 A 5 -ATOM 499 H HG2 . LYS A1 1 34 ? -15.182 3.062 -17.447 1.0 24.23 34 A 5 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.886 2.941 -17.892 1.0 22.21 34 A 5 -ATOM 501 H HD2 . LYS A1 1 34 ? -16.176 0.862 -16.898 1.0 63.43 34 A 5 -ATOM 502 H HD3 . LYS A1 1 34 ? -16.485 0.605 -18.617 1.0 75.33 34 A 5 -ATOM 503 H HE2 . LYS A1 1 34 ? -14.226 0.422 -19.122 1.0 34.14 34 A 5 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.728 1.26 -17.653 1.0 0.12 34 A 5 -ATOM 505 H HZ1 . LYS A1 1 34 ? -14.685 -1.522 -17.939 1.0 62.42 34 A 5 -ATOM 506 H HZ2 . LYS A1 1 34 ? -14.685 -0.736 -16.441 1.0 14.2 34 A 5 -ATOM 507 H HZ3 . LYS A1 1 34 ? -13.231 -0.972 -17.272 1.0 65.2 34 A 5 -ATOM 508 N N . ILE A1 1 35 ? -18.131 4.293 -20.696 1.0 14.42 35 A 5 -ATOM 509 C CA . ILE A1 1 35 ? -19.402 4.974 -20.482 1.0 22.32 35 A 5 -ATOM 510 C C . ILE A1 1 35 ? -20.516 4.33 -21.299 1.0 74.31 35 A 5 -ATOM 511 O O . ILE A1 1 35 ? -21.659 4.243 -20.85 1.0 33.23 35 A 5 -ATOM 512 C CB . ILE A1 1 35 ? -19.309 6.468 -20.847 1.0 42.5 35 A 5 -ATOM 513 C CG1 . ILE A1 1 35 ? -18.163 7.132 -20.083 1.0 22.04 35 A 5 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.627 7.168 -20.551 1.0 45.14 35 A 5 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.296 7.026 -18.58 1.0 11.1 35 A 5 -ATOM 516 H H . ILE A1 1 35 ? -17.409 4.765 -21.16 1.0 54.44 35 A 5 -ATOM 517 H HA . ILE A1 1 35 ? -19.649 4.896 -19.432 1.0 30.01 35 A 5 -ATOM 518 H HB . ILE A1 1 35 ? -19.119 6.544 -21.907 1.0 2.44 35 A 5 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.232 6.666 -20.366 1.0 3.24 35 A 5 -ATOM 520 H HG13 . ILE A1 1 35 ? -18.129 8.181 -20.341 1.0 0.11 35 A 5 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.513 8.231 -20.708 1.0 65.32 35 A 5 -ATOM 522 H HG22 . ILE A1 1 35 ? -21.393 6.788 -21.21 1.0 43.1 35 A 5 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.91 6.984 -19.526 1.0 75.41 35 A 5 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.745 7.829 -18.112 1.0 43.52 35 A 5 -ATOM 525 H HD12 . ILE A1 1 35 ? -19.338 7.098 -18.305 1.0 71.15 35 A 5 -ATOM 526 H HD13 . ILE A1 1 35 ? -17.901 6.077 -18.249 1.0 74.3 35 A 5 -ATOM 527 N N . TYR A1 1 36 ? -20.175 3.879 -22.501 1.0 62.53 36 A 5 -ATOM 528 C CA . TYR A1 1 36 ? -21.147 3.243 -23.383 1.0 64.44 36 A 5 -ATOM 529 C C . TYR A1 1 36 ? -21.801 2.046 -22.7 1.0 53.42 36 A 5 -ATOM 530 O O . TYR A1 1 36 ? -23.018 1.87 -22.761 1.0 34.33 36 A 5 -ATOM 531 C CB . TYR A1 1 36 ? -20.473 2.797 -24.682 1.0 74.42 36 A 5 -ATOM 532 C CG . TYR A1 1 36 ? -20.82 1.383 -25.09 1.0 43.51 36 A 5 -ATOM 533 C CD1 . TYR A1 1 36 ? -22.074 1.074 -25.6 1.0 62.31 36 A 5 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.892 0.356 -24.965 1.0 22.21 36 A 5 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.395 -0.217 -25.973 1.0 25.24 36 A 5 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.204 -0.937 -25.337 1.0 24.41 36 A 5 -ATOM 537 C CZ . TYR A1 1 36 ? -21.457 -1.219 -25.84 1.0 51.0 36 A 5 -ATOM 538 O OH . TYR A1 1 36 ? -21.772 -2.506 -26.211 1.0 31.41 36 A 5 -ATOM 539 H H . TYR A1 1 36 ? -19.248 3.977 -22.804 1.0 42.53 36 A 5 -ATOM 540 H HA . TYR A1 1 36 ? -21.91 3.971 -23.616 1.0 45.34 36 A 5 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.776 3.456 -25.481 1.0 32.41 36 A 5 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.401 2.855 -24.561 1.0 73.31 36 A 5 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.807 1.861 -25.704 1.0 14.41 36 A 5 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.911 0.58 -24.57 1.0 73.43 36 A 5 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.376 -0.438 -26.368 1.0 30.0 36 A 5 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.469 -1.722 -25.232 1.0 11.1 36 A 5 -ATOM 547 H HH . TYR A1 1 36 ? -22.289 -2.487 -27.02 1.0 20.21 36 A 5 -ATOM 548 N N . ASP A1 1 37 ? -20.984 1.226 -22.048 1.0 31.31 37 A 5 -ATOM 549 C CA . ASP A1 1 37 ? -21.481 0.046 -21.35 1.0 4.3 37 A 5 -ATOM 550 C C . ASP A1 1 37 ? -22.177 0.436 -20.05 1.0 30.32 37 A 5 -ATOM 551 O O . ASP A1 1 37 ? -23.119 -0.226 -19.614 1.0 62.0 37 A 5 -ATOM 552 C CB . ASP A1 1 37 ? -20.333 -0.922 -21.058 1.0 35.43 37 A 5 -ATOM 553 C CG . ASP A1 1 37 ? -20.635 -2.334 -21.518 1.0 34.32 37 A 5 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.328 -3.064 -20.778 1.0 31.12 37 A 5 -ATOM 555 O OD2 . ASP A1 1 37 ? -20.181 -2.71 -22.619 1.0 3.2 37 A 5 -ATOM 556 H H . ASP A1 1 37 ? -20.023 1.42 -22.035 1.0 51.42 37 A 5 -ATOM 557 H HA . ASP A1 1 37 ? -22.196 -0.443 -21.994 1.0 32.24 37 A 5 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.444 -0.58 -21.568 1.0 43.14 37 A 5 -ATOM 559 H HB3 . ASP A1 1 37 ? -20.148 -0.94 -19.994 1.0 34.23 37 A 5 -ATOM 560 N N . LYS A1 1 38 ? -21.706 1.515 -19.434 1.0 33.03 38 A 5 -ATOM 561 C CA . LYS A1 1 38 ? -22.282 1.995 -18.183 1.0 33.5 38 A 5 -ATOM 562 C C . LYS A1 1 38 ? -23.784 2.223 -18.328 1.0 62.1 38 A 5 -ATOM 563 O O . LYS A1 1 38 ? -24.568 1.808 -17.475 1.0 13.24 38 A 5 -ATOM 564 C CB . LYS A1 1 38 ? -21.599 3.293 -17.748 1.0 32.13 38 A 5 -ATOM 565 C CG . LYS A1 1 38 ? -20.812 3.162 -16.455 1.0 11.13 38 A 5 -ATOM 566 C CD . LYS A1 1 38 ? -19.35 2.846 -16.721 1.0 55.11 38 A 5 -ATOM 567 C CE . LYS A1 1 38 ? -19.123 1.351 -16.879 1.0 12.13 38 A 5 -ATOM 568 N NZ . LYS A1 1 38 ? -18.543 0.745 -15.649 1.0 62.42 38 A 5 -ATOM 569 H H . LYS A1 1 38 ? -20.953 2.002 -19.831 1.0 40.1 38 A 5 -ATOM 570 H HA . LYS A1 1 38 ? -22.116 1.24 -17.43 1.0 13.43 38 A 5 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.92 3.608 -18.527 1.0 53.44 38 A 5 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.353 4.055 -17.61 1.0 74.35 38 A 5 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.875 4.093 -15.91 1.0 72.35 38 A 5 -ATOM 574 H HG3 . LYS A1 1 38 ? -21.241 2.367 -15.863 1.0 65.33 38 A 5 -ATOM 575 H HD2 . LYS A1 1 38 ? -19.043 3.344 -17.629 1.0 31.44 38 A 5 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.756 3.206 -15.893 1.0 51.13 38 A 5 -ATOM 577 H HE2 . LYS A1 1 38 ? -20.069 0.877 -17.092 1.0 72.24 38 A 5 -ATOM 578 H HE3 . LYS A1 1 38 ? -18.445 1.189 -17.705 1.0 52.14 38 A 5 -ATOM 579 H HZ1 . LYS A1 1 38 ? -19.282 0.624 -14.928 1.0 12.21 38 A 5 -ATOM 580 H HZ2 . LYS A1 1 38 ? -17.796 1.36 -15.266 1.0 31.3 38 A 5 -ATOM 581 H HZ3 . LYS A1 1 38 ? -18.132 -0.185 -15.868 1.0 72.13 38 A 5 -ATOM 582 N N . GLU A1 1 39 ? -24.176 2.883 -19.413 1.0 74.33 39 A 5 -ATOM 583 C CA . GLU A1 1 39 ? -25.584 3.164 -19.668 1.0 31.43 39 A 5 -ATOM 584 C C . GLU A1 1 39 ? -26.092 2.359 -20.861 1.0 55.55 39 A 5 -ATOM 585 O O . GLU A1 1 39 ? -27.08 1.633 -20.758 1.0 44.25 39 A 5 -ATOM 586 C CB . GLU A1 1 39 ? -25.791 4.658 -19.922 1.0 31.12 39 A 5 -ATOM 587 C CG . GLU A1 1 39 ? -24.617 5.325 -20.62 1.0 22.34 39 A 5 -ATOM 588 C CD . GLU A1 1 39 ? -24.787 6.827 -20.742 1.0 34.02 39 A 5 -ATOM 589 O OE1 . GLU A1 1 39 ? -25.942 7.283 -20.88 1.0 60.52 39 A 5 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.767 7.546 -20.701 1.0 24.54 39 A 5 -ATOM 591 H H . GLU A1 1 39 ? -23.503 3.188 -20.056 1.0 53.12 39 A 5 -ATOM 592 H HA . GLU A1 1 39 ? -26.144 2.877 -18.791 1.0 24.23 39 A 5 -ATOM 593 H HB2 . GLU A1 1 39 ? -26.669 4.789 -20.536 1.0 13.32 39 A 5 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.948 5.154 -18.975 1.0 53.15 39 A 5 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.718 5.126 -20.055 1.0 73.51 39 A 5 -ATOM 596 H HG3 . GLU A1 1 39 ? -24.518 4.907 -21.61 1.0 55.55 39 A 5 -ATOM 597 N N . GLY A1 1 40 ? -25.409 2.494 -21.993 1.0 41.31 40 A 5 -ATOM 598 C CA . GLY A1 1 40 ? -25.806 1.775 -23.19 1.0 23.2 40 A 5 -ATOM 599 C C . GLY A1 1 40 ? -26.074 2.7 -24.36 1.0 54.31 40 A 5 -ATOM 600 O O . GLY A1 1 40 ? -27.114 2.602 -25.012 1.0 62.35 40 A 5 -ATOM 601 H H . GLY A1 1 40 ? -24.629 3.088 -22.017 1.0 1.31 40 A 5 -ATOM 602 H HA2 . GLY A1 1 40 ? -25.019 1.087 -23.46 1.0 42.33 40 A 5 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.704 1.213 -22.977 1.0 42.25 40 A 5 -ATOM 604 N N . ILE A1 1 41 ? -25.135 3.602 -24.627 1.0 11.45 41 A 5 -ATOM 605 C CA . ILE A1 1 41 ? -25.276 4.548 -25.726 1.0 13.21 41 A 5 -ATOM 606 C C . ILE A1 1 41 ? -24.065 4.501 -26.651 1.0 73.14 41 A 5 -ATOM 607 O O . ILE A1 1 41 ? -22.981 4.056 -26.273 1.0 54.03 41 A 5 -ATOM 608 C CB . ILE A1 1 41 ? -25.458 5.988 -25.21 1.0 13.54 41 A 5 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.578 6.227 -23.981 1.0 35.25 41 A 5 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.919 6.252 -24.881 1.0 15.54 41 A 5 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.997 7.622 -23.917 1.0 51.21 41 A 5 -ATOM 612 H H . ILE A1 1 41 ? -24.329 3.631 -24.071 1.0 10.31 41 A 5 -ATOM 613 H HA . ILE A1 1 41 ? -26.157 4.275 -26.29 1.0 22.4 41 A 5 -ATOM 614 H HB . ILE A1 1 41 ? -25.162 6.668 -25.994 1.0 2.22 41 A 5 -ATOM 615 H HG12 . ILE A1 1 41 ? -25.164 6.071 -23.09 1.0 53.25 41 A 5 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.756 5.525 -23.994 1.0 73.21 41 A 5 -ATOM 617 H HG21 . ILE A1 1 41 ? -27.466 6.436 -25.794 1.0 41.34 41 A 5 -ATOM 618 H HG22 . ILE A1 1 41 ? -27.336 5.391 -24.38 1.0 35.01 41 A 5 -ATOM 619 H HG23 . ILE A1 1 41 ? -26.993 7.115 -24.236 1.0 24.24 41 A 5 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.125 7.62 -23.279 1.0 13.35 41 A 5 -ATOM 621 H HD12 . ILE A1 1 41 ? -23.714 7.942 -24.909 1.0 5.02 41 A 5 -ATOM 622 H HD13 . ILE A1 1 41 ? -24.734 8.301 -23.515 1.0 73.01 41 A 5 -ATOM 623 N N . PRO A1 1 42 ? -24.25 4.971 -27.893 1.0 42.01 42 A 5 -ATOM 624 C CA . PRO A1 1 42 ? -23.183 4.995 -28.898 1.0 63.34 42 A 5 -ATOM 625 C C . PRO A1 1 42 ? -22.099 6.016 -28.568 1.0 4.23 42 A 5 -ATOM 626 O O . PRO A1 1 42 ? -22.334 7.225 -28.555 1.0 21.54 42 A 5 -ATOM 627 C CB . PRO A1 1 42 ? -23.915 5.389 -30.184 1.0 63.45 42 A 5 -ATOM 628 C CG . PRO A1 1 42 ? -25.115 6.14 -29.721 1.0 31.23 42 A 5 -ATOM 629 C CD . PRO A1 1 42 ? -25.516 5.516 -28.413 1.0 52.22 42 A 5 -ATOM 630 H HA . PRO A1 1 42 ? -22.733 4.021 -29.022 1.0 60.32 42 A 5 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.271 6.009 -30.792 1.0 50.23 42 A 5 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.192 4.501 -30.731 1.0 64.01 42 A 5 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.866 7.181 -29.579 1.0 0.11 42 A 5 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.912 6.039 -30.443 1.0 1.1 42 A 5 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.917 6.264 -27.745 1.0 11.32 42 A 5 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.236 4.728 -28.576 1.0 34.03 42 A 5 -ATOM 637 N N . PRO A1 1 43 ? -20.883 5.522 -28.296 1.0 1.41 43 A 5 -ATOM 638 C CA . PRO A1 1 43 ? -19.738 6.374 -27.961 1.0 62.53 43 A 5 -ATOM 639 C C . PRO A1 1 43 ? -19.249 7.183 -29.158 1.0 21.35 43 A 5 -ATOM 640 O O . PRO A1 1 43 ? -18.76 8.303 -29.005 1.0 73.42 43 A 5 -ATOM 641 C CB . PRO A1 1 43 ? -18.668 5.374 -27.519 1.0 74.43 43 A 5 -ATOM 642 C CG . PRO A1 1 43 ? -19.029 4.103 -28.206 1.0 42.11 43 A 5 -ATOM 643 C CD . PRO A1 1 43 ? -20.53 4.092 -28.293 1.0 32.53 43 A 5 -ATOM 644 H HA . PRO A1 1 43 ? -19.967 7.044 -27.145 1.0 3.1 43 A 5 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.693 5.727 -27.825 1.0 1.2 43 A 5 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.695 5.263 -26.445 1.0 52.2 43 A 5 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.596 4.084 -29.195 1.0 21.5 43 A 5 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.682 3.26 -27.627 1.0 41.32 43 A 5 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.852 3.614 -29.207 1.0 55.24 43 A 5 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.954 3.592 -27.434 1.0 31.14 43 A 5 -ATOM 651 N N . ASP A1 1 44 ? -19.384 6.61 -30.349 1.0 54.12 44 A 5 -ATOM 652 C CA . ASP A1 1 44 ? -18.957 7.279 -31.572 1.0 51.34 44 A 5 -ATOM 653 C C . ASP A1 1 44 ? -19.924 8.398 -31.946 1.0 65.34 44 A 5 -ATOM 654 O O . ASP A1 1 44 ? -19.597 9.27 -32.749 1.0 41.23 44 A 5 -ATOM 655 C CB . ASP A1 1 44 ? -18.854 6.272 -32.72 1.0 23.35 44 A 5 -ATOM 656 C CG . ASP A1 1 44 ? -17.933 6.748 -33.826 1.0 52.14 44 A 5 -ATOM 657 O OD1 . ASP A1 1 44 ? -17.242 7.768 -33.624 1.0 70.43 44 A 5 -ATOM 658 O OD2 . ASP A1 1 44 ? -17.904 6.1 -34.893 1.0 15.14 44 A 5 -ATOM 659 H H . ASP A1 1 44 ? -19.781 5.715 -30.406 1.0 64.31 44 A 5 -ATOM 660 H HA . ASP A1 1 44 ? -17.983 7.707 -31.393 1.0 72.42 44 A 5 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.473 5.337 -32.336 1.0 64.21 44 A 5 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.837 6.112 -33.138 1.0 74.33 44 A 5 -ATOM 663 N N . GLN A1 1 45 ? -21.115 8.364 -31.357 1.0 24.51 45 A 5 -ATOM 664 C CA . GLN A1 1 45 ? -22.13 9.375 -31.63 1.0 55.1 45 A 5 -ATOM 665 C C . GLN A1 1 45 ? -22.035 10.525 -30.633 1.0 65.33 45 A 5 -ATOM 666 O O . GLN A1 1 45 ? -22.644 11.577 -30.825 1.0 0.12 45 A 5 -ATOM 667 C CB . GLN A1 1 45 ? -23.527 8.753 -31.578 1.0 3.33 45 A 5 -ATOM 668 C CG . GLN A1 1 45 ? -23.967 8.134 -32.895 1.0 71.05 45 A 5 -ATOM 669 C CD . GLN A1 1 45 ? -25.066 7.106 -32.718 1.0 50.21 45 A 5 -ATOM 670 O OE1 . GLN A1 1 45 ? -26.167 7.427 -32.269 1.0 30.33 45 A 5 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.774 5.86 -33.072 1.0 54.11 45 A 5 -ATOM 672 H H . GLN A1 1 45 ? -21.317 7.643 -30.726 1.0 33.14 45 A 5 -ATOM 673 H HA . GLN A1 1 45 ? -21.955 9.761 -32.623 1.0 54.13 45 A 5 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.537 7.983 -30.822 1.0 72.22 45 A 5 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.239 9.519 -31.31 1.0 51.24 45 A 5 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.33 8.918 -33.543 1.0 11.31 45 A 5 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.115 7.655 -33.355 1.0 33.23 45 A 5 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.876 5.676 -33.421 1.0 35.4 45 A 5 -ATOM 679 H HE22 . GLN A1 1 45 ? -25.465 5.174 -32.967 1.0 53.4 45 A 5 -ATOM 680 N N . GLN A1 1 46 ? -21.268 10.316 -29.568 1.0 5.34 46 A 5 -ATOM 681 C CA . GLN A1 1 46 ? -21.095 11.336 -28.54 1.0 54.21 46 A 5 -ATOM 682 C C . GLN A1 1 46 ? -19.678 11.9 -28.566 1.0 23.33 46 A 5 -ATOM 683 O O . GLN A1 1 46 ? -18.757 11.268 -29.084 1.0 42.0 46 A 5 -ATOM 684 C CB . GLN A1 1 46 ? -21.4 10.754 -27.159 1.0 54.1 46 A 5 -ATOM 685 C CG . GLN A1 1 46 ? -20.61 9.495 -26.841 1.0 63.33 46 A 5 -ATOM 686 C CD . GLN A1 1 46 ? -20.559 9.197 -25.355 1.0 73.34 46 A 5 -ATOM 687 O OE1 . GLN A1 1 46 ? -21.594 9.034 -24.707 1.0 62.34 46 A 5 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.352 9.125 -24.806 1.0 52.51 46 A 5 -ATOM 689 H H . GLN A1 1 46 ? -20.808 9.457 -29.471 1.0 61.13 46 A 5 -ATOM 690 H HA . GLN A1 1 46 ? -21.791 12.135 -28.746 1.0 1.54 46 A 5 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.169 11.497 -26.41 1.0 70.34 46 A 5 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.452 10.516 -27.106 1.0 24.41 46 A 5 -ATOM 693 H HG2 . GLN A1 1 46 ? -21.072 8.659 -27.344 1.0 71.34 46 A 5 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.6 9.618 -27.203 1.0 12.44 46 A 5 -ATOM 695 H HE21 . GLN A1 1 46 ? -18.573 9.268 -25.384 1.0 61.21 46 A 5 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.29 8.935 -23.848 1.0 54.41 46 A 5 -ATOM 697 N N . ARG A1 1 47 ? -19.511 13.092 -28.004 1.0 11.31 47 A 5 -ATOM 698 C CA . ARG A1 1 47 ? -18.206 13.742 -27.964 1.0 74.42 47 A 5 -ATOM 699 C C . ARG A1 1 47 ? -17.982 14.428 -26.62 1.0 0.05 47 A 5 -ATOM 700 O O . ARG A1 1 47 ? -18.931 14.704 -25.885 1.0 62.43 47 A 5 -ATOM 701 C CB . ARG A1 1 47 ? -18.087 14.764 -29.097 1.0 53.24 47 A 5 -ATOM 702 C CG . ARG A1 1 47 ? -16.939 14.483 -30.052 1.0 25.13 47 A 5 -ATOM 703 C CD . ARG A1 1 47 ? -17.227 13.275 -30.93 1.0 74.31 47 A 5 -ATOM 704 N NE . ARG A1 1 47 ? -16.943 13.542 -32.337 1.0 72.02 47 A 5 -ATOM 705 C CZ . ARG A1 1 47 ? -16.912 12.599 -33.272 1.0 4.33 47 A 5 -ATOM 706 N NH1 . ARG A1 1 47 ? -17.147 11.334 -32.951 1.0 22.33 47 A 5 -ATOM 707 N NH2 . ARG A1 1 47 ? -16.646 12.92 -34.532 1.0 24.44 47 A 5 -ATOM 708 H H . ARG A1 1 47 ? -20.283 13.547 -27.608 1.0 14.32 47 A 5 -ATOM 709 H HA . ARG A1 1 47 ? -17.452 12.981 -28.097 1.0 52.1 47 A 5 -ATOM 710 H HB2 . ARG A1 1 47 ? -19.006 14.764 -29.664 1.0 12.43 47 A 5 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.938 15.743 -28.667 1.0 31.22 47 A 5 -ATOM 712 H HG2 . ARG A1 1 47 ? -16.789 15.346 -30.684 1.0 2.15 47 A 5 -ATOM 713 H HG3 . ARG A1 1 47 ? -16.043 14.295 -29.478 1.0 3.22 47 A 5 -ATOM 714 H HD2 . ARG A1 1 47 ? -16.613 12.451 -30.599 1.0 62.34 47 A 5 -ATOM 715 H HD3 . ARG A1 1 47 ? -18.269 13.012 -30.826 1.0 4.32 47 A 5 -ATOM 716 H HE . ARG A1 1 47 ? -16.767 14.47 -32.597 1.0 51.12 47 A 5 -ATOM 717 H HH11 . ARG A1 1 47 ? -17.348 11.089 -32.002 1.0 35.02 47 A 5 -ATOM 718 H HH12 . ARG A1 1 47 ? -17.124 10.626 -33.657 1.0 42.25 47 A 5 -ATOM 719 H HH21 . ARG A1 1 47 ? -16.469 13.872 -34.778 1.0 32.54 47 A 5 -ATOM 720 H HH22 . ARG A1 1 47 ? -16.623 12.209 -35.235 1.0 51.04 47 A 5 -ATOM 721 N N . LEU A1 1 48 ? -16.72 14.7 -26.304 1.0 13.42 48 A 5 -ATOM 722 C CA . LEU A1 1 48 ? -16.37 15.354 -25.048 1.0 63.04 48 A 5 -ATOM 723 C C . LEU A1 1 48 ? -16.026 16.822 -25.276 1.0 70.54 48 A 5 -ATOM 724 O O . LEU A1 1 48 ? -15.452 17.183 -26.304 1.0 13.22 48 A 5 -ATOM 725 C CB . LEU A1 1 48 ? -15.189 14.638 -24.39 1.0 73.22 48 A 5 -ATOM 726 C CG . LEU A1 1 48 ? -15.132 13.122 -24.582 1.0 23.01 48 A 5 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.519 12.514 -24.445 1.0 2.23 48 A 5 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.528 12.778 -25.935 1.0 62.5 48 A 5 -ATOM 729 H H . LEU A1 1 48 ? -16.007 14.457 -26.93 1.0 13.1 48 A 5 -ATOM 730 H HA . LEU A1 1 48 ? -17.227 15.295 -24.394 1.0 5.14 48 A 5 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.281 15.057 -24.795 1.0 14.35 48 A 5 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.233 14.837 -23.328 1.0 62.22 48 A 5 -ATOM 733 H HG . LEU A1 1 48 ? -14.503 12.692 -23.815 1.0 74.12 48 A 5 -ATOM 734 H HD11 . LEU A1 1 48 ? -16.98 12.447 -25.419 1.0 72.12 48 A 5 -ATOM 735 H HD12 . LEU A1 1 48 ? -17.124 13.137 -23.803 1.0 51.52 48 A 5 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.439 11.526 -24.015 1.0 50.13 48 A 5 -ATOM 737 H HD21 . LEU A1 1 48 ? -13.966 11.86 -25.856 1.0 32.51 48 A 5 -ATOM 738 H HD22 . LEU A1 1 48 ? -13.872 13.576 -26.249 1.0 4.35 48 A 5 -ATOM 739 H HD23 . LEU A1 1 48 ? -15.318 12.655 -26.662 1.0 44.23 48 A 5 -ATOM 740 N N . ILE A1 1 49 ? -16.378 17.664 -24.31 1.0 13.31 49 A 5 -ATOM 741 C CA . ILE A1 1 49 ? -16.104 19.092 -24.404 1.0 13.25 49 A 5 -ATOM 742 C C . ILE A1 1 49 ? -15.654 19.655 -23.06 1.0 73.24 49 A 5 -ATOM 743 O O . ILE A1 1 49 ? -16.355 19.528 -22.056 1.0 20.41 49 A 5 -ATOM 744 C CB . ILE A1 1 49 ? -17.34 19.873 -24.887 1.0 42.12 49 A 5 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.332 19.991 -26.412 1.0 21.4 49 A 5 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.381 21.251 -24.244 1.0 44.11 49 A 5 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.617 19.526 -27.061 1.0 30.32 49 A 5 -ATOM 748 H H . ILE A1 1 49 ? -16.833 17.316 -23.515 1.0 11.12 49 A 5 -ATOM 749 H HA . ILE A1 1 49 ? -15.31 19.232 -25.124 1.0 31.54 49 A 5 -ATOM 750 H HB . ILE A1 1 49 ? -18.222 19.332 -24.579 1.0 10.22 49 A 5 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.177 21.022 -26.687 1.0 52.53 49 A 5 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.524 19.392 -26.808 1.0 23.14 49 A 5 -ATOM 753 H HG21 . ILE A1 1 49 ? -18.092 21.872 -24.769 1.0 54.41 49 A 5 -ATOM 754 H HG22 . ILE A1 1 49 ? -17.682 21.157 -23.211 1.0 2.4 49 A 5 -ATOM 755 H HG23 . ILE A1 1 49 ? -16.402 21.702 -24.295 1.0 53.42 49 A 5 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.389 20.264 -26.899 1.0 43.14 49 A 5 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.459 19.399 -28.122 1.0 61.33 49 A 5 -ATOM 758 H HD13 . ILE A1 1 49 ? -18.921 18.586 -26.626 1.0 3.14 49 A 5 -ATOM 759 N N . PHE A1 1 50 ? -14.481 20.28 -23.048 1.0 0.44 50 A 5 -ATOM 760 C CA . PHE A1 1 50 ? -13.938 20.864 -21.828 1.0 63.4 50 A 5 -ATOM 761 C C . PHE A1 1 50 ? -13.571 22.329 -22.042 1.0 34.31 50 A 5 -ATOM 762 O O . PHE A1 1 50 ? -12.795 22.662 -22.937 1.0 24.03 50 A 5 -ATOM 763 C CB . PHE A1 1 50 ? -12.706 20.081 -21.367 1.0 1.31 50 A 5 -ATOM 764 C CG . PHE A1 1 50 ? -12.338 20.333 -19.933 1.0 63.44 50 A 5 -ATOM 765 C CD1 . PHE A1 1 50 ? -11.742 21.526 -19.556 1.0 63.22 50 A 5 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.587 19.377 -18.961 1.0 31.12 50 A 5 -ATOM 767 C CE1 . PHE A1 1 50 ? -11.402 21.761 -18.237 1.0 44.05 50 A 5 -ATOM 768 C CE2 . PHE A1 1 50 ? -12.25 19.607 -17.641 1.0 53.14 50 A 5 -ATOM 769 C CZ . PHE A1 1 50 ? -11.656 20.8 -17.279 1.0 64.24 50 A 5 -ATOM 770 H H . PHE A1 1 50 ? -13.968 20.349 -23.881 1.0 32.43 50 A 5 -ATOM 771 H HA . PHE A1 1 50 ? -14.699 20.803 -21.065 1.0 55.42 50 A 5 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.898 19.024 -21.479 1.0 72.21 50 A 5 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.863 20.357 -21.981 1.0 52.42 50 A 5 -ATOM 774 H HD1 . PHE A1 1 50 ? -11.543 22.279 -20.306 1.0 64.41 50 A 5 -ATOM 775 H HD2 . PHE A1 1 50 ? -13.051 18.443 -19.243 1.0 25.0 50 A 5 -ATOM 776 H HE1 . PHE A1 1 50 ? -10.938 22.695 -17.958 1.0 33.34 50 A 5 -ATOM 777 H HE2 . PHE A1 1 50 ? -12.449 18.853 -16.893 1.0 34.14 50 A 5 -ATOM 778 H HZ . PHE A1 1 50 ? -11.391 20.982 -16.248 1.0 42.2 50 A 5 -ATOM 779 N N . GLY A1 1 51 ? -14.137 23.202 -21.214 1.0 53.44 51 A 5 -ATOM 780 C CA . GLY A1 1 51 ? -13.859 24.622 -21.33 1.0 33.5 51 A 5 -ATOM 781 C C . GLY A1 1 51 ? -14.394 25.214 -22.618 1.0 34.32 51 A 5 -ATOM 782 O O . GLY A1 1 51 ? -14.09 26.357 -22.958 1.0 0.02 51 A 5 -ATOM 783 H H . GLY A1 1 51 ? -14.749 22.879 -20.519 1.0 14.34 51 A 5 -ATOM 784 H HA2 . GLY A1 1 51 ? -14.312 25.135 -20.494 1.0 71.3 51 A 5 -ATOM 785 H HA3 . GLY A1 1 51 ? -12.79 24.772 -21.295 1.0 2.33 51 A 5 -ATOM 786 N N . GLY A1 1 52 ? -15.194 24.434 -23.34 1.0 51.33 52 A 5 -ATOM 787 C CA . GLY A1 1 52 ? -15.758 24.906 -24.591 1.0 70.11 52 A 5 -ATOM 788 C C . GLY A1 1 52 ? -15.196 24.171 -25.793 1.0 64.35 52 A 5 -ATOM 789 O O . GLY A1 1 52 ? -15.877 24.011 -26.806 1.0 21.12 52 A 5 -ATOM 790 H H . GLY A1 1 52 ? -15.402 23.532 -23.02 1.0 52.33 52 A 5 -ATOM 791 H HA2 . GLY A1 1 52 ? -16.828 24.768 -24.566 1.0 34.31 52 A 5 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.543 25.959 -24.695 1.0 33.12 52 A 5 -ATOM 793 N N . LYS A1 1 53 ? -13.95 23.724 -25.682 1.0 4.12 53 A 5 -ATOM 794 C CA . LYS A1 1 53 ? -13.296 23.003 -26.767 1.0 20.15 53 A 5 -ATOM 795 C C . LYS A1 1 53 ? -13.456 21.496 -26.593 1.0 12.34 53 A 5 -ATOM 796 O O . LYS A1 1 53 ? -13.496 20.993 -25.471 1.0 53.3 53 A 5 -ATOM 797 C CB . LYS A1 1 53 ? -11.81 23.366 -26.825 1.0 12.13 53 A 5 -ATOM 798 C CG . LYS A1 1 53 ? -11.09 23.193 -25.499 1.0 34.42 53 A 5 -ATOM 799 C CD . LYS A1 1 53 ? -10.497 21.801 -25.364 1.0 44.0 53 A 5 -ATOM 800 C CE . LYS A1 1 53 ? -9.379 21.571 -26.369 1.0 75.53 53 A 5 -ATOM 801 N NZ . LYS A1 1 53 ? -8.367 22.663 -26.333 1.0 61.53 53 A 5 -ATOM 802 H H . LYS A1 1 53 ? -13.458 23.883 -24.848 1.0 32.12 53 A 5 -ATOM 803 H HA . LYS A1 1 53 ? -13.766 23.299 -27.693 1.0 74.23 53 A 5 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.327 22.737 -27.558 1.0 34.02 53 A 5 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.716 24.398 -27.131 1.0 32.22 53 A 5 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.293 23.92 -25.435 1.0 24.24 53 A 5 -ATOM 807 H HG3 . LYS A1 1 53 ? -11.793 23.355 -24.695 1.0 53.0 53 A 5 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.099 21.684 -24.367 1.0 22.42 53 A 5 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.275 21.07 -25.531 1.0 0.05 53 A 5 -ATOM 810 H HE2 . LYS A1 1 53 ? -8.893 20.635 -26.14 1.0 25.2 53 A 5 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.807 21.521 -27.359 1.0 75.24 53 A 5 -ATOM 812 H HZ1 . LYS A1 1 53 ? -8.53 23.328 -27.117 1.0 1.33 53 A 5 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.41 22.267 -26.422 1.0 14.14 53 A 5 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.433 23.182 -25.434 1.0 31.25 53 A 5 -ATOM 815 N N . GLN A1 1 54 ? -13.546 20.782 -27.711 1.0 32.1 54 A 5 -ATOM 816 C CA . GLN A1 1 54 ? -13.701 19.333 -27.681 1.0 3.14 54 A 5 -ATOM 817 C C . GLN A1 1 54 ? -12.426 18.66 -27.182 1.0 14.5 54 A 5 -ATOM 818 O O . GLN A1 1 54 ? -11.384 19.302 -27.046 1.0 22.04 54 A 5 -ATOM 819 C CB . GLN A1 1 54 ? -14.058 18.808 -29.072 1.0 14.03 54 A 5 -ATOM 820 C CG . GLN A1 1 54 ? -15.426 18.149 -29.141 1.0 52.41 54 A 5 -ATOM 821 C CD . GLN A1 1 54 ? -15.868 17.867 -30.564 1.0 44.23 54 A 5 -ATOM 822 O OE1 . GLN A1 1 54 ? -15.046 17.581 -31.436 1.0 25.33 54 A 5 -ATOM 823 N NE2 . GLN A1 1 54 ? -17.171 17.947 -30.806 1.0 63.1 54 A 5 -ATOM 824 H H . GLN A1 1 54 ? -13.508 21.241 -28.575 1.0 52.11 54 A 5 -ATOM 825 H HA . GLN A1 1 54 ? -14.506 19.1 -27.0 1.0 62.04 54 A 5 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.043 19.632 -29.77 1.0 31.24 54 A 5 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.317 18.081 -29.371 1.0 25.42 54 A 5 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.389 17.214 -28.601 1.0 52.11 54 A 5 -ATOM 829 H HG3 . GLN A1 1 54 ? -16.15 18.803 -28.677 1.0 53.52 54 A 5 -ATOM 830 H HE21 . GLN A1 1 54 ? -17.766 18.181 -30.063 1.0 45.55 54 A 5 -ATOM 831 H HE22 . GLN A1 1 54 ? -17.484 17.77 -31.717 1.0 62.42 54 A 5 -ATOM 832 N N . LEU A1 1 55 ? -12.516 17.363 -26.91 1.0 51.34 55 A 5 -ATOM 833 C CA . LEU A1 1 55 ? -11.37 16.601 -26.425 1.0 40.45 55 A 5 -ATOM 834 C C . LEU A1 1 55 ? -11.024 15.468 -27.386 1.0 63.5 55 A 5 -ATOM 835 O O . LEU A1 1 55 ? -11.885 14.672 -27.757 1.0 52.11 55 A 5 -ATOM 836 C CB . LEU A1 1 55 ? -11.66 16.036 -25.034 1.0 25.03 55 A 5 -ATOM 837 C CG . LEU A1 1 55 ? -12.269 17.011 -24.026 1.0 41.33 55 A 5 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.372 16.365 -22.653 1.0 33.24 55 A 5 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.447 18.289 -23.957 1.0 52.23 55 A 5 -ATOM 840 H H . LEU A1 1 55 ? -13.373 16.905 -27.037 1.0 12.34 55 A 5 -ATOM 841 H HA . LEU A1 1 55 ? -10.528 17.274 -26.363 1.0 22.21 55 A 5 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.344 15.209 -25.149 1.0 55.1 55 A 5 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.727 15.674 -24.624 1.0 51.11 55 A 5 -ATOM 844 H HG . LEU A1 1 55 ? -13.268 17.272 -24.347 1.0 72.12 55 A 5 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.574 15.649 -22.532 1.0 32.04 55 A 5 -ATOM 846 H HD12 . LEU A1 1 55 ? -13.323 15.863 -22.562 1.0 44.35 55 A 5 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.292 17.126 -21.891 1.0 32.21 55 A 5 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.237 18.527 -22.924 1.0 33.14 55 A 5 -ATOM 849 H HD22 . LEU A1 1 55 ? -12.002 19.099 -24.407 1.0 72.01 55 A 5 -ATOM 850 H HD23 . LEU A1 1 55 ? -10.518 18.149 -24.49 1.0 74.33 55 A 5 -ATOM 851 N N . GLU A1 1 56 ? -9.756 15.401 -27.782 1.0 12.02 56 A 5 -ATOM 852 C CA . GLU A1 1 56 ? -9.297 14.364 -28.698 1.0 31.33 56 A 5 -ATOM 853 C C . GLU A1 1 56 ? -9.356 12.99 -28.037 1.0 62.51 56 A 5 -ATOM 854 O O . GLU A1 1 56 ? -9.821 12.852 -26.906 1.0 51.02 56 A 5 -ATOM 855 C CB . GLU A1 1 56 ? -7.869 14.658 -29.162 1.0 62.01 56 A 5 -ATOM 856 C CG . GLU A1 1 56 ? -7.679 16.07 -29.69 1.0 21.02 56 A 5 -ATOM 857 C CD . GLU A1 1 56 ? -8.797 16.5 -30.62 1.0 1.0 56 A 5 -ATOM 858 O OE1 . GLU A1 1 56 ? -9.243 15.666 -31.436 1.0 61.34 56 A 5 -ATOM 859 O OE2 . GLU A1 1 56 ? -9.226 17.669 -30.533 1.0 22.01 56 A 5 -ATOM 860 H H . GLU A1 1 56 ? -9.116 16.065 -27.451 1.0 72.43 56 A 5 -ATOM 861 H HA . GLU A1 1 56 ? -9.952 14.366 -29.556 1.0 4.21 56 A 5 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.196 14.514 -28.329 1.0 41.11 56 A 5 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.609 13.964 -29.947 1.0 51.02 56 A 5 -ATOM 864 H HG2 . GLU A1 1 56 ? -7.645 16.752 -28.854 1.0 71.31 56 A 5 -ATOM 865 H HG3 . GLU A1 1 56 ? -6.744 16.116 -30.229 1.0 60.44 56 A 5 -ATOM 866 N N . ASP A1 1 57 ? -8.882 11.975 -28.752 1.0 71.03 57 A 5 -ATOM 867 C CA . ASP A1 1 57 ? -8.879 10.611 -28.236 1.0 63.41 57 A 5 -ATOM 868 C C . ASP A1 1 57 ? -7.821 10.443 -27.151 1.0 21.4 57 A 5 -ATOM 869 O O . ASP A1 1 57 ? -7.934 9.57 -26.29 1.0 43.31 57 A 5 -ATOM 870 C CB . ASP A1 1 57 ? -8.629 9.615 -29.37 1.0 45.31 57 A 5 -ATOM 871 C CG . ASP A1 1 57 ? -9.65 9.737 -30.484 1.0 55.43 57 A 5 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.832 9.418 -30.242 1.0 72.35 57 A 5 -ATOM 873 O OD2 . ASP A1 1 57 ? -9.266 10.151 -31.598 1.0 15.11 57 A 5 -ATOM 874 H H . ASP A1 1 57 ? -8.524 12.148 -29.648 1.0 23.12 57 A 5 -ATOM 875 H HA . ASP A1 1 57 ? -9.851 10.417 -27.807 1.0 62.14 57 A 5 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.647 9.792 -29.785 1.0 24.44 57 A 5 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.672 8.611 -28.974 1.0 64.03 57 A 5 -ATOM 878 N N . SER A1 1 58 ? -6.792 11.283 -27.199 1.0 32.51 58 A 5 -ATOM 879 C CA . SER A1 1 58 ? -5.71 11.224 -26.223 1.0 62.24 58 A 5 -ATOM 880 C C . SER A1 1 58 ? -5.746 12.437 -25.299 1.0 2.12 58 A 5 -ATOM 881 O O . SER A1 1 58 ? -4.872 12.61 -24.449 1.0 12.21 58 A 5 -ATOM 882 C CB . SER A1 1 58 ? -4.357 11.148 -26.933 1.0 65.11 58 A 5 -ATOM 883 O OG . SER A1 1 58 ? -3.312 10.89 -26.012 1.0 34.21 58 A 5 -ATOM 884 H H . SER A1 1 58 ? -6.759 11.957 -27.91 1.0 21.03 58 A 5 -ATOM 885 H HA . SER A1 1 58 ? -5.847 10.331 -25.631 1.0 33.55 58 A 5 -ATOM 886 H HB2 . SER A1 1 58 ? -4.381 10.355 -27.664 1.0 31.42 58 A 5 -ATOM 887 H HB3 . SER A1 1 58 ? -4.161 12.088 -27.428 1.0 40.4 58 A 5 -ATOM 888 H HG . SER A1 1 58 ? -2.517 11.35 -26.293 1.0 10.23 58 A 5 -ATOM 889 N N . ASN A1 1 59 ? -6.762 13.276 -25.472 1.0 35.41 59 A 5 -ATOM 890 C CA . ASN A1 1 59 ? -6.912 14.474 -24.655 1.0 52.34 59 A 5 -ATOM 891 C C . ASN A1 1 59 ? -7.634 14.155 -23.349 1.0 4.01 59 A 5 -ATOM 892 O O . ASN A1 1 59 ? -8.831 14.405 -23.213 1.0 42.21 59 A 5 -ATOM 893 C CB . ASN A1 1 59 ? -7.68 15.55 -25.426 1.0 21.1 59 A 5 -ATOM 894 C CG . ASN A1 1 59 ? -7.359 16.95 -24.939 1.0 14.54 59 A 5 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.91 17.139 -23.809 1.0 24.42 59 A 5 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.589 17.94 -25.794 1.0 14.44 59 A 5 -ATOM 897 H H . ASN A1 1 59 ? -7.427 13.084 -26.166 1.0 5.51 59 A 5 -ATOM 898 H HA . ASN A1 1 59 ? -5.924 14.844 -24.425 1.0 74.51 59 A 5 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.423 15.486 -26.473 1.0 43.43 59 A 5 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.74 15.381 -25.308 1.0 11.21 59 A 5 -ATOM 901 H HD21 . ASN A1 1 59 ? -7.947 17.715 -26.678 1.0 21.33 59 A 5 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.389 18.855 -25.506 1.0 12.0 59 A 5 -ATOM 903 N N . ALA A1 1 60 ? -6.897 13.602 -22.391 1.0 13.11 60 A 5 -ATOM 904 C CA . ALA A1 1 60 ? -7.466 13.252 -21.096 1.0 35.51 60 A 5 -ATOM 905 C C . ALA A1 1 60 ? -6.383 12.785 -20.129 1.0 74.01 60 A 5 -ATOM 906 O O . ALA A1 1 60 ? -5.922 13.55 -19.283 1.0 74.24 60 A 5 -ATOM 907 C CB . ALA A1 1 60 ? -8.529 12.176 -21.26 1.0 64.13 60 A 5 -ATOM 908 H H . ALA A1 1 60 ? -5.948 13.428 -22.56 1.0 31.12 60 A 5 -ATOM 909 H HA . ALA A1 1 60 ? -7.941 14.134 -20.69 1.0 20.01 60 A 5 -ATOM 910 H HB1 . ALA A1 1 60 ? -9.329 12.554 -21.88 1.0 72.33 60 A 5 -ATOM 911 H HB2 . ALA A1 1 60 ? -8.092 11.306 -21.726 1.0 25.02 60 A 5 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.922 11.907 -20.291 1.0 51.02 60 A 5 -ATOM 913 N N . MET A1 1 61 ? -5.983 11.525 -20.26 1.0 21.52 61 A 5 -ATOM 914 C CA . MET A1 1 61 ? -4.953 10.956 -19.398 1.0 32.03 61 A 5 -ATOM 915 C C . MET A1 1 61 ? -3.574 11.485 -19.777 1.0 55.14 61 A 5 -ATOM 916 O O . MET A1 1 61 ? -2.887 12.097 -18.958 1.0 73.23 61 A 5 -ATOM 917 C CB . MET A1 1 61 ? -4.969 9.429 -19.487 1.0 33.12 61 A 5 -ATOM 918 C CG . MET A1 1 61 ? -6.368 8.838 -19.546 1.0 10.31 61 A 5 -ATOM 919 S SD . MET A1 1 61 ? -7.46 9.511 -18.278 1.0 3.45 61 A 5 -ATOM 920 C CE . MET A1 1 61 ? -9.022 9.532 -19.154 1.0 11.34 61 A 5 -ATOM 921 H H . MET A1 1 61 ? -6.388 10.963 -20.954 1.0 44.35 61 A 5 -ATOM 922 H HA . MET A1 1 61 ? -5.172 11.251 -18.382 1.0 14.21 61 A 5 -ATOM 923 H HB2 . MET A1 1 61 ? -4.436 9.127 -20.376 1.0 14.23 61 A 5 -ATOM 924 H HB3 . MET A1 1 61 ? -4.467 9.024 -18.621 1.0 0.24 61 A 5 -ATOM 925 H HG2 . MET A1 1 61 ? -6.793 9.049 -20.515 1.0 62.14 61 A 5 -ATOM 926 H HG3 . MET A1 1 61 ? -6.298 7.769 -19.411 1.0 32.0 61 A 5 -ATOM 927 H HE1 . MET A1 1 61 ? -8.846 9.376 -20.208 1.0 54.23 61 A 5 -ATOM 928 H HE2 . MET A1 1 61 ? -9.658 8.745 -18.775 1.0 64.31 61 A 5 -ATOM 929 H HE3 . MET A1 1 61 ? -9.504 10.487 -19.007 1.0 24.11 61 A 5 -ATOM 930 N N . SER A1 1 62 ? -3.174 11.246 -21.021 1.0 73.15 62 A 5 -ATOM 931 C CA . SER A1 1 62 ? -1.874 11.695 -21.507 1.0 12.22 62 A 5 -ATOM 932 C C . SER A1 1 62 ? -1.736 13.208 -21.369 1.0 13.52 62 A 5 -ATOM 933 O O . SER A1 1 62 ? -0.643 13.723 -21.13 1.0 42.51 62 A 5 -ATOM 934 C CB . SER A1 1 62 ? -1.683 11.285 -22.969 1.0 62.33 62 A 5 -ATOM 935 O OG . SER A1 1 62 ? -0.771 12.149 -23.625 1.0 14.13 62 A 5 -ATOM 936 H H . SER A1 1 62 ? -3.767 10.753 -21.627 1.0 74.25 62 A 5 -ATOM 937 H HA . SER A1 1 62 ? -1.114 11.219 -20.906 1.0 74.15 62 A 5 -ATOM 938 H HB2 . SER A1 1 62 ? -1.3 10.277 -23.01 1.0 54.41 62 A 5 -ATOM 939 H HB3 . SER A1 1 62 ? -2.634 11.33 -23.479 1.0 23.45 62 A 5 -ATOM 940 H HG . SER A1 1 62 ? 0.055 11.685 -23.778 1.0 1.23 62 A 5 -ATOM 941 N N . ASP A1 1 63 ? -2.851 13.914 -21.52 1.0 34.33 63 A 5 -ATOM 942 C CA . ASP A1 1 63 ? -2.856 15.368 -21.411 1.0 10.21 63 A 5 -ATOM 943 C C . ASP A1 1 63 ? -2.454 15.809 -20.007 1.0 63.54 63 A 5 -ATOM 944 O O . ASP A1 1 63 ? -1.964 16.922 -19.811 1.0 31.33 63 A 5 -ATOM 945 C CB . ASP A1 1 63 ? -4.239 15.922 -21.757 1.0 21.1 63 A 5 -ATOM 946 C CG . ASP A1 1 63 ? -4.184 17.36 -22.232 1.0 12.2 63 A 5 -ATOM 947 O OD1 . ASP A1 1 63 ? -3.598 17.608 -23.307 1.0 53.24 63 A 5 -ATOM 948 O OD2 . ASP A1 1 63 ? -4.728 18.238 -21.53 1.0 3.13 63 A 5 -ATOM 949 H H . ASP A1 1 63 ? -3.691 13.445 -21.709 1.0 14.4 63 A 5 -ATOM 950 H HA . ASP A1 1 63 ? -2.137 15.756 -22.116 1.0 72.42 63 A 5 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.676 15.32 -22.54 1.0 63.34 63 A 5 -ATOM 952 H HB3 . ASP A1 1 63 ? -4.868 15.875 -20.88 1.0 44.51 63 A 5 -ATOM 953 N N . TYR A1 1 64 ? -2.665 14.93 -19.033 1.0 43.15 64 A 5 -ATOM 954 C CA . TYR A1 1 64 ? -2.328 15.23 -17.647 1.0 74.44 64 A 5 -ATOM 955 C C . TYR A1 1 64 ? -3.401 16.103 -17.002 1.0 35.31 64 A 5 -ATOM 956 O O . TYR A1 1 64 ? -3.127 16.851 -16.064 1.0 63.11 64 A 5 -ATOM 957 C CB . TYR A1 1 64 ? -0.971 15.932 -17.57 1.0 41.31 64 A 5 -ATOM 958 C CG . TYR A1 1 64 ? -0.087 15.421 -16.455 1.0 35.31 64 A 5 -ATOM 959 C CD1 . TYR A1 1 64 ? -0.606 15.174 -15.189 1.0 10.21 64 A 5 -ATOM 960 C CD2 . TYR A1 1 64 ? 1.266 15.186 -16.665 1.0 61.0 64 A 5 -ATOM 961 C CE1 . TYR A1 1 64 ? 0.198 14.707 -14.167 1.0 31.32 64 A 5 -ATOM 962 C CE2 . TYR A1 1 64 ? 2.076 14.719 -15.649 1.0 3.01 64 A 5 -ATOM 963 C CZ . TYR A1 1 64 ? 1.538 14.481 -14.402 1.0 35.43 64 A 5 -ATOM 964 O OH . TYR A1 1 64 ? 2.342 14.017 -13.386 1.0 23.32 64 A 5 -ATOM 965 H H . TYR A1 1 64 ? -3.058 14.06 -19.252 1.0 10.22 64 A 5 -ATOM 966 H HA . TYR A1 1 64 ? -2.269 14.295 -17.11 1.0 40.51 64 A 5 -ATOM 967 H HB2 . TYR A1 1 64 ? -0.445 15.787 -18.501 1.0 75.32 64 A 5 -ATOM 968 H HB3 . TYR A1 1 64 ? -1.128 16.989 -17.412 1.0 32.34 64 A 5 -ATOM 969 H HD1 . TYR A1 1 64 ? -1.656 15.352 -15.009 1.0 1.35 64 A 5 -ATOM 970 H HD2 . TYR A1 1 64 ? 1.685 15.374 -17.643 1.0 32.41 64 A 5 -ATOM 971 H HE1 . TYR A1 1 64 ? -0.224 14.521 -13.19 1.0 52.21 64 A 5 -ATOM 972 H HE2 . TYR A1 1 64 ? 3.126 14.542 -15.833 1.0 43.14 64 A 5 -ATOM 973 H HH . TYR A1 1 64 ? 3.158 13.671 -13.757 1.0 23.33 64 A 5 -ATOM 974 N N . ASN A1 1 65 ? -4.624 15.999 -17.512 1.0 61.21 65 A 5 -ATOM 975 C CA . ASN A1 1 65 ? -5.739 16.778 -16.987 1.0 70.22 65 A 5 -ATOM 976 C C . ASN A1 1 65 ? -6.75 15.875 -16.286 1.0 21.44 65 A 5 -ATOM 977 O O . ASN A1 1 65 ? -7.866 16.296 -15.98 1.0 22.24 65 A 5 -ATOM 978 C CB . ASN A1 1 65 ? -6.425 17.551 -18.115 1.0 30.31 65 A 5 -ATOM 979 C CG . ASN A1 1 65 ? -7.301 18.675 -17.597 1.0 75.23 65 A 5 -ATOM 980 O OD1 . ASN A1 1 65 ? -6.877 19.471 -16.758 1.0 74.2 65 A 5 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.529 18.746 -18.095 1.0 12.4 65 A 5 -ATOM 982 H H . ASN A1 1 65 ? -4.78 15.385 -18.26 1.0 72.01 65 A 5 -ATOM 983 H HA . ASN A1 1 65 ? -5.344 17.481 -16.269 1.0 43.44 65 A 5 -ATOM 984 H HB2 . ASN A1 1 65 ? -5.671 17.977 -18.761 1.0 12.24 65 A 5 -ATOM 985 H HB3 . ASN A1 1 65 ? -7.041 16.873 -18.686 1.0 73.02 65 A 5 -ATOM 986 H HD21 . ASN A1 1 65 ? -8.799 18.078 -18.76 1.0 23.44 65 A 5 -ATOM 987 H HD22 . ASN A1 1 65 ? -9.117 19.463 -17.778 1.0 32.24 65 A 5 -ATOM 988 N N . VAL A1 1 66 ? -6.352 14.632 -16.035 1.0 11.4 66 A 5 -ATOM 989 C CA . VAL A1 1 66 ? -7.222 13.67 -15.369 1.0 70.45 66 A 5 -ATOM 990 C C . VAL A1 1 66 ? -7.037 13.717 -13.857 1.0 73.11 66 A 5 -ATOM 991 O O . VAL A1 1 66 ? -5.925 13.563 -13.353 1.0 33.12 66 A 5 -ATOM 992 C CB . VAL A1 1 66 ? -6.955 12.236 -15.864 1.0 40.11 66 A 5 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.524 11.822 -15.554 1.0 32.21 66 A 5 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.947 11.265 -15.241 1.0 25.13 66 A 5 -ATOM 995 H H . VAL A1 1 66 ? -5.451 14.356 -16.304 1.0 25.31 66 A 5 -ATOM 996 H HA . VAL A1 1 66 ? -8.245 13.925 -15.606 1.0 44.24 66 A 5 -ATOM 997 H HB . VAL A1 1 66 ? -7.088 12.216 -16.936 1.0 65.05 66 A 5 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.422 11.648 -14.493 1.0 62.5 66 A 5 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.287 10.916 -16.093 1.0 4.5 66 A 5 -ATOM 1000 H HG13 . VAL A1 1 66 ? -4.849 12.609 -15.856 1.0 12.32 66 A 5 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.951 11.553 -15.513 1.0 23.4 66 A 5 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.747 10.267 -15.602 1.0 64.2 66 A 5 -ATOM 1003 H HG23 . VAL A1 1 66 ? -7.845 11.286 -14.166 1.0 74.31 66 A 5 -ATOM 1004 N N . GLN A1 1 67 ? -8.135 13.93 -13.139 1.0 5.43 67 A 5 -ATOM 1005 C CA . GLN A1 1 67 ? -8.093 13.998 -11.683 1.0 15.5 67 A 5 -ATOM 1006 C C . GLN A1 1 67 ? -9.034 12.97 -11.063 1.0 62.54 67 A 5 -ATOM 1007 O O . GLN A1 1 67 ? -9.674 12.192 -11.771 1.0 44.01 67 A 5 -ATOM 1008 C CB . GLN A1 1 67 ? -8.468 15.402 -11.205 1.0 35.11 67 A 5 -ATOM 1009 C CG . GLN A1 1 67 ? -9.873 15.825 -11.602 1.0 11.21 67 A 5 -ATOM 1010 C CD . GLN A1 1 67 ? -10.524 16.726 -10.572 1.0 34.44 67 A 5 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.509 16.434 -9.376 1.0 41.54 67 A 5 -ATOM 1012 N NE2 . GLN A1 1 67 ? -11.101 17.831 -11.031 1.0 50.51 67 A 5 -ATOM 1013 H H . GLN A1 1 67 ? -8.992 14.046 -13.598 1.0 54.23 67 A 5 -ATOM 1014 H HA . GLN A1 1 67 ? -7.084 13.778 -11.369 1.0 21.13 67 A 5 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.396 15.434 -10.128 1.0 61.05 67 A 5 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.77 16.11 -11.626 1.0 21.05 67 A 5 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.823 16.356 -12.542 1.0 63.24 67 A 5 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.481 14.941 -11.722 1.0 63.02 67 A 5 -ATOM 1019 H HE21 . GLN A1 1 67 ? -11.075 17.999 -11.997 1.0 0.12 67 A 5 -ATOM 1020 H HE22 . GLN A1 1 67 ? -11.53 18.431 -10.387 1.0 72.41 67 A 5 -ATOM 1021 N N . LYS A1 1 68 ? -9.112 12.971 -9.737 1.0 63.33 68 A 5 -ATOM 1022 C CA . LYS A1 1 68 ? -9.975 12.039 -9.02 1.0 34.0 68 A 5 -ATOM 1023 C C . LYS A1 1 68 ? -11.444 12.315 -9.323 1.0 33.21 68 A 5 -ATOM 1024 O O . LYS A1 1 68 ? -12.268 11.401 -9.328 1.0 33.01 68 A 5 -ATOM 1025 C CB . LYS A1 1 68 ? -9.727 12.138 -7.513 1.0 41.41 68 A 5 -ATOM 1026 C CG . LYS A1 1 68 ? -10.22 10.93 -6.735 1.0 61.44 68 A 5 -ATOM 1027 C CD . LYS A1 1 68 ? -9.39 9.694 -7.04 1.0 43.41 68 A 5 -ATOM 1028 C CE . LYS A1 1 68 ? -8.071 9.707 -6.282 1.0 23.43 68 A 5 -ATOM 1029 N NZ . LYS A1 1 68 ? -8.279 9.76 -4.808 1.0 52.05 68 A 5 -ATOM 1030 H H . LYS A1 1 68 ? -8.577 13.615 -9.227 1.0 75.53 68 A 5 -ATOM 1031 H HA . LYS A1 1 68 ? -9.733 11.04 -9.352 1.0 31.4 68 A 5 -ATOM 1032 H HB2 . LYS A1 1 68 ? -8.666 12.242 -7.341 1.0 51.5 68 A 5 -ATOM 1033 H HB3 . LYS A1 1 68 ? -10.232 13.014 -7.134 1.0 62.4 68 A 5 -ATOM 1034 H HG2 . LYS A1 1 68 ? -10.155 11.142 -5.678 1.0 22.33 68 A 5 -ATOM 1035 H HG3 . LYS A1 1 68 ? -11.249 10.736 -7.003 1.0 45.02 68 A 5 -ATOM 1036 H HD2 . LYS A1 1 68 ? -9.948 8.816 -6.752 1.0 14.2 68 A 5 -ATOM 1037 H HD3 . LYS A1 1 68 ? -9.185 9.661 -8.101 1.0 13.53 68 A 5 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.521 8.812 -6.527 1.0 43.13 68 A 5 -ATOM 1039 H HE3 . LYS A1 1 68 ? -7.504 10.574 -6.588 1.0 63.42 68 A 5 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.662 9.07 -4.335 1.0 1.54 68 A 5 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -9.269 9.538 -4.579 1.0 73.32 68 A 5 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.057 10.71 -4.45 1.0 23.44 68 A 5 -ATOM 1043 N N . GLU A1 1 69 ? -11.764 13.58 -9.577 1.0 51.1 69 A 5 -ATOM 1044 C CA . GLU A1 1 69 ? -13.135 13.974 -9.882 1.0 15.41 69 A 5 -ATOM 1045 C C . GLU A1 1 69 ? -13.159 15.175 -10.823 1.0 20.25 69 A 5 -ATOM 1046 O O . GLU A1 1 69 ? -13.301 16.317 -10.386 1.0 55.15 69 A 5 -ATOM 1047 C CB . GLU A1 1 69 ? -13.892 14.306 -8.594 1.0 42.14 69 A 5 -ATOM 1048 C CG . GLU A1 1 69 ? -13.102 15.176 -7.631 1.0 32.44 69 A 5 -ATOM 1049 C CD . GLU A1 1 69 ? -13.966 16.208 -6.933 1.0 60.3 69 A 5 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.856 16.783 -7.595 1.0 52.11 69 A 5 -ATOM 1051 O OE2 . GLU A1 1 69 ? -13.753 16.44 -5.725 1.0 33.22 69 A 5 -ATOM 1052 H H . GLU A1 1 69 ? -11.063 14.264 -9.559 1.0 51.55 69 A 5 -ATOM 1053 H HA . GLU A1 1 69 ? -13.619 13.141 -10.369 1.0 21.13 69 A 5 -ATOM 1054 H HB2 . GLU A1 1 69 ? -14.804 14.825 -8.851 1.0 70.35 69 A 5 -ATOM 1055 H HB3 . GLU A1 1 69 ? -14.142 13.384 -8.091 1.0 25.14 69 A 5 -ATOM 1056 H HG2 . GLU A1 1 69 ? -12.649 14.543 -6.882 1.0 60.54 69 A 5 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.327 15.69 -8.182 1.0 2.43 69 A 5 -ATOM 1058 N N . SER A1 1 70 ? -13.017 14.908 -12.117 1.0 51.41 70 A 5 -ATOM 1059 C CA . SER A1 1 70 ? -13.018 15.967 -13.121 1.0 50.24 70 A 5 -ATOM 1060 C C . SER A1 1 70 ? -14.389 16.09 -13.779 1.0 72.1 70 A 5 -ATOM 1061 O O . SER A1 1 70 ? -14.974 15.098 -14.215 1.0 13.02 70 A 5 -ATOM 1062 C CB . SER A1 1 70 ? -11.952 15.691 -14.184 1.0 75.43 70 A 5 -ATOM 1063 O OG . SER A1 1 70 ? -12.479 15.857 -15.489 1.0 45.33 70 A 5 -ATOM 1064 H H . SER A1 1 70 ? -12.907 13.977 -12.404 1.0 42.55 70 A 5 -ATOM 1065 H HA . SER A1 1 70 ? -12.785 16.896 -12.623 1.0 61.25 70 A 5 -ATOM 1066 H HB2 . SER A1 1 70 ? -11.13 16.377 -14.051 1.0 1.23 70 A 5 -ATOM 1067 H HB3 . SER A1 1 70 ? -11.596 14.677 -14.078 1.0 50.33 70 A 5 -ATOM 1068 H HG . SER A1 1 70 ? -11.919 16.455 -15.987 1.0 14.24 70 A 5 -ATOM 1069 N N . THR A1 1 71 ? -14.897 17.317 -13.847 1.0 52.55 71 A 5 -ATOM 1070 C CA . THR A1 1 71 ? -16.199 17.572 -14.449 1.0 43.33 71 A 5 -ATOM 1071 C C . THR A1 1 71 ? -16.059 17.958 -15.917 1.0 63.44 71 A 5 -ATOM 1072 O O . THR A1 1 71 ? -15.494 19.003 -16.244 1.0 13.52 71 A 5 -ATOM 1073 C CB . THR A1 1 71 ? -16.953 18.691 -13.706 1.0 4.41 71 A 5 -ATOM 1074 O OG1 . THR A1 1 71 ? -16.033 19.704 -13.282 1.0 4.41 71 A 5 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.694 18.135 -12.499 1.0 4.35 71 A 5 -ATOM 1076 H H . THR A1 1 71 ? -14.383 18.067 -13.481 1.0 14.04 71 A 5 -ATOM 1077 H HA . THR A1 1 71 ? -16.783 16.666 -14.379 1.0 24.13 71 A 5 -ATOM 1078 H HB . THR A1 1 71 ? -17.673 19.13 -14.381 1.0 70.41 71 A 5 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.384 20.569 -13.506 1.0 53.11 71 A 5 -ATOM 1080 H HG21 . THR A1 1 71 ? -17.775 18.901 -11.743 1.0 12.42 71 A 5 -ATOM 1081 H HG22 . THR A1 1 71 ? -17.15 17.292 -12.1 1.0 75.2 71 A 5 -ATOM 1082 H HG23 . THR A1 1 71 ? -18.682 17.818 -12.798 1.0 31.12 71 A 5 -ATOM 1083 N N . LEU A1 1 72 ? -16.578 17.111 -16.799 1.0 74.32 72 A 5 -ATOM 1084 C CA . LEU A1 1 72 ? -16.511 17.364 -18.234 1.0 62.12 72 A 5 -ATOM 1085 C C . LEU A1 1 72 ? -17.903 17.328 -18.859 1.0 14.1 72 A 5 -ATOM 1086 O O . LEU A1 1 72 ? -18.802 16.651 -18.358 1.0 22.33 72 A 5 -ATOM 1087 C CB . LEU A1 1 72 ? -15.609 16.332 -18.913 1.0 54.24 72 A 5 -ATOM 1088 C CG . LEU A1 1 72 ? -16.316 15.127 -19.533 1.0 12.34 72 A 5 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.606 15.377 -21.005 1.0 71.53 72 A 5 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.477 13.869 -19.36 1.0 45.31 72 A 5 -ATOM 1091 H H . LEU A1 1 72 ? -17.016 16.295 -16.479 1.0 40.44 72 A 5 -ATOM 1092 H HA . LEU A1 1 72 ? -16.091 18.348 -18.378 1.0 22.23 72 A 5 -ATOM 1093 H HB2 . LEU A1 1 72 ? -15.063 16.835 -19.696 1.0 24.33 72 A 5 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.913 15.964 -18.172 1.0 64.44 72 A 5 -ATOM 1095 H HG . LEU A1 1 72 ? -17.26 14.972 -19.029 1.0 60.22 72 A 5 -ATOM 1096 H HD11 . LEU A1 1 72 ? -16.193 14.573 -21.595 1.0 22.12 72 A 5 -ATOM 1097 H HD12 . LEU A1 1 72 ? -16.156 16.312 -21.306 1.0 11.12 72 A 5 -ATOM 1098 H HD13 . LEU A1 1 72 ? -17.674 15.426 -21.158 1.0 74.11 72 A 5 -ATOM 1099 H HD21 . LEU A1 1 72 ? -14.429 14.124 -19.417 1.0 45.11 72 A 5 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.719 13.164 -20.142 1.0 64.51 72 A 5 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.689 13.425 -18.398 1.0 15.53 72 A 5 -ATOM 1102 N N . HIS A1 1 73 ? -18.072 18.059 -19.956 1.0 22.1 73 A 5 -ATOM 1103 C CA . HIS A1 1 73 ? -19.354 18.109 -20.65 1.0 43.22 73 A 5 -ATOM 1104 C C . HIS A1 1 73 ? -19.371 17.14 -21.829 1.0 1.12 73 A 5 -ATOM 1105 O O . HIS A1 1 73 ? -18.554 17.246 -22.745 1.0 41.41 73 A 5 -ATOM 1106 C CB . HIS A1 1 73 ? -19.638 19.529 -21.139 1.0 34.11 73 A 5 -ATOM 1107 C CG . HIS A1 1 73 ? -21.061 19.747 -21.552 1.0 25.31 73 A 5 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.778 20.876 -21.217 1.0 22.31 73 A 5 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.901 18.972 -22.279 1.0 30.12 73 A 5 -ATOM 1110 C CE1 . HIS A1 1 73 ? -22.997 20.786 -21.719 1.0 74.03 73 A 5 -ATOM 1111 N NE2 . HIS A1 1 73 ? -23.097 19.64 -22.368 1.0 22.32 73 A 5 -ATOM 1112 H H . HIS A1 1 73 ? -17.318 18.577 -20.306 1.0 41.1 73 A 5 -ATOM 1113 H HA . HIS A1 1 73 ? -20.122 17.817 -19.95 1.0 23.25 73 A 5 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.414 20.227 -20.346 1.0 51.13 73 A 5 -ATOM 1115 H HB3 . HIS A1 1 73 ? -19.008 19.744 -21.99 1.0 64.13 73 A 5 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.444 21.63 -20.689 1.0 63.31 73 A 5 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.672 18.007 -22.709 1.0 71.43 73 A 5 -ATOM 1118 H HE1 . HIS A1 1 73 ? -23.779 21.523 -21.616 1.0 3.34 73 A 5 -ATOM 1119 N N . LEU A1 1 74 ? -20.305 16.196 -21.799 1.0 31.4 74 A 5 -ATOM 1120 C CA . LEU A1 1 74 ? -20.427 15.207 -22.865 1.0 41.22 74 A 5 -ATOM 1121 C C . LEU A1 1 74 ? -21.727 15.4 -23.639 1.0 21.0 74 A 5 -ATOM 1122 O O . LEU A1 1 74 ? -22.818 15.251 -23.089 1.0 70.53 74 A 5 -ATOM 1123 C CB . LEU A1 1 74 ? -20.371 13.793 -22.284 1.0 42.32 74 A 5 -ATOM 1124 C CG . LEU A1 1 74 ? -20.856 12.671 -23.203 1.0 13.02 74 A 5 -ATOM 1125 C CD1 . LEU A1 1 74 ? -19.964 12.563 -24.43 1.0 50.12 74 A 5 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.896 11.347 -22.452 1.0 22.4 74 A 5 -ATOM 1127 H H . LEU A1 1 74 ? -20.927 16.162 -21.043 1.0 53.04 74 A 5 -ATOM 1128 H HA . LEU A1 1 74 ? -19.596 15.343 -23.54 1.0 65.43 74 A 5 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.346 13.584 -22.02 1.0 22.02 74 A 5 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.981 13.778 -21.392 1.0 20.31 74 A 5 -ATOM 1131 H HG . LEU A1 1 74 ? -21.859 12.896 -23.539 1.0 34.12 74 A 5 -ATOM 1132 H HD11 . LEU A1 1 74 ? -19.044 13.1 -24.254 1.0 33.01 74 A 5 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.472 12.988 -25.283 1.0 1.34 74 A 5 -ATOM 1134 H HD13 . LEU A1 1 74 ? -19.743 11.523 -24.624 1.0 63.14 74 A 5 -ATOM 1135 H HD21 . LEU A1 1 74 ? -21.407 10.609 -23.052 1.0 12.32 74 A 5 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.422 11.48 -21.518 1.0 54.43 74 A 5 -ATOM 1137 H HD23 . LEU A1 1 74 ? -19.887 11.015 -22.254 1.0 14.02 74 A 5 -ATOM 1138 N N . VAL A1 1 75 ? -21.603 15.73 -24.921 1.0 43.5 75 A 5 -ATOM 1139 C CA . VAL A1 1 75 ? -22.768 15.939 -25.773 1.0 52.32 75 A 5 -ATOM 1140 C C . VAL A1 1 75 ? -22.875 14.851 -26.835 1.0 61.15 75 A 5 -ATOM 1141 O O . VAL A1 1 75 ? -21.869 14.414 -27.396 1.0 54.31 75 A 5 -ATOM 1142 C CB . VAL A1 1 75 ? -22.717 17.314 -26.465 1.0 24.5 75 A 5 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.954 17.527 -27.323 1.0 55.3 75 A 5 -ATOM 1144 C CG2 . VAL A1 1 75 ? -22.576 18.424 -25.434 1.0 64.14 75 A 5 -ATOM 1145 H H . VAL A1 1 75 ? -20.707 15.834 -25.303 1.0 70.11 75 A 5 -ATOM 1146 H HA . VAL A1 1 75 ? -23.649 15.907 -25.148 1.0 60.52 75 A 5 -ATOM 1147 H HB . VAL A1 1 75 ? -21.85 17.338 -27.109 1.0 44.41 75 A 5 -ATOM 1148 H HG11 . VAL A1 1 75 ? -24.205 18.577 -27.339 1.0 31.54 75 A 5 -ATOM 1149 H HG12 . VAL A1 1 75 ? -23.757 17.187 -28.33 1.0 61.34 75 A 5 -ATOM 1150 H HG13 . VAL A1 1 75 ? -24.78 16.967 -26.909 1.0 54.52 75 A 5 -ATOM 1151 H HG21 . VAL A1 1 75 ? -23.128 18.162 -24.544 1.0 5.24 75 A 5 -ATOM 1152 H HG22 . VAL A1 1 75 ? -21.533 18.554 -25.186 1.0 61.35 75 A 5 -ATOM 1153 H HG23 . VAL A1 1 75 ? -22.966 19.346 -25.841 1.0 24.43 75 A 5 -ATOM 1154 N N . LEU A1 1 76 ? -24.1 14.418 -27.109 1.0 35.1 76 A 5 -ATOM 1155 C CA . LEU A1 1 76 ? -24.34 13.38 -28.105 1.0 22.53 76 A 5 -ATOM 1156 C C . LEU A1 1 76 ? -25.324 13.861 -29.167 1.0 2.14 76 A 5 -ATOM 1157 O O . LEU A1 1 76 ? -26.317 14.518 -28.854 1.0 21.5 76 A 5 -ATOM 1158 C CB . LEU A1 1 76 ? -24.875 12.114 -27.434 1.0 73.12 76 A 5 -ATOM 1159 C CG . LEU A1 1 76 ? -24.98 12.156 -25.909 1.0 64.45 76 A 5 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.829 11.002 -25.4 1.0 24.13 76 A 5 -ATOM 1161 C CD2 . LEU A1 1 76 ? -23.595 12.121 -25.278 1.0 22.03 76 A 5 -ATOM 1162 H H . LEU A1 1 76 ? -24.863 14.804 -26.63 1.0 44.32 76 A 5 -ATOM 1163 H HA . LEU A1 1 76 ? -23.398 13.154 -28.582 1.0 53.04 76 A 5 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.862 11.923 -27.828 1.0 71.31 76 A 5 -ATOM 1165 H HB3 . LEU A1 1 76 ? -24.219 11.297 -27.699 1.0 62.14 76 A 5 -ATOM 1166 H HG . LEU A1 1 76 ? -25.46 13.079 -25.613 1.0 42.11 76 A 5 -ATOM 1167 H HD11 . LEU A1 1 76 ? -26.674 10.86 -26.056 1.0 12.14 76 A 5 -ATOM 1168 H HD12 . LEU A1 1 76 ? -26.18 11.225 -24.404 1.0 23.21 76 A 5 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.234 10.1 -25.378 1.0 40.2 76 A 5 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.335 11.101 -25.039 1.0 53.24 76 A 5 -ATOM 1171 H HD22 . LEU A1 1 76 ? -23.596 12.715 -24.376 1.0 72.02 76 A 5 -ATOM 1172 H HD23 . LEU A1 1 76 ? -22.873 12.525 -25.973 1.0 63.4 76 A 5 -ATOM 1173 N N . ARG A1 1 77 ? -25.043 13.528 -30.422 1.0 50.44 77 A 5 -ATOM 1174 C CA . ARG A1 1 77 ? -25.904 13.926 -31.529 1.0 12.4 77 A 5 -ATOM 1175 C C . ARG A1 1 77 ? -26.73 12.743 -32.027 1.0 10.32 77 A 5 -ATOM 1176 O O . ARG A1 1 77 ? -26.808 12.489 -33.23 1.0 12.43 77 A 5 -ATOM 1177 C CB . ARG A1 1 77 ? -25.066 14.495 -32.676 1.0 55.35 77 A 5 -ATOM 1178 C CG . ARG A1 1 77 ? -24.128 15.612 -32.249 1.0 12.22 77 A 5 -ATOM 1179 C CD . ARG A1 1 77 ? -22.671 15.196 -32.376 1.0 60.22 77 A 5 -ATOM 1180 N NE . ARG A1 1 77 ? -21.817 16.311 -32.776 1.0 64.33 77 A 5 -ATOM 1181 C CZ . ARG A1 1 77 ? -20.522 16.184 -33.048 1.0 13.31 77 A 5 -ATOM 1182 N NH1 . ARG A1 1 77 ? -19.937 14.997 -32.963 1.0 63.3 77 A 5 -ATOM 1183 N NH2 . ARG A1 1 77 ? -19.811 17.245 -33.406 1.0 70.54 77 A 5 -ATOM 1184 H H . ARG A1 1 77 ? -24.236 13.003 -30.608 1.0 2.41 77 A 5 -ATOM 1185 H HA . ARG A1 1 77 ? -26.574 14.692 -31.17 1.0 53.23 77 A 5 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.472 13.7 -33.102 1.0 41.04 77 A 5 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.73 14.882 -33.433 1.0 23.23 77 A 5 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.301 16.474 -32.876 1.0 3.21 77 A 5 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.333 15.867 -31.219 1.0 45.32 77 A 5 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.333 14.821 -31.421 1.0 24.22 77 A 5 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.598 14.414 -33.116 1.0 55.12 77 A 5 -ATOM 1192 H HE . ARG A1 1 77 ? -22.229 17.197 -32.845 1.0 41.44 77 A 5 -ATOM 1193 H HH11 . ARG A1 1 77 ? -20.471 14.196 -32.694 1.0 31.24 77 A 5 -ATOM 1194 H HH12 . ARG A1 1 77 ? -18.963 14.904 -33.169 1.0 72.5 77 A 5 -ATOM 1195 H HH21 . ARG A1 1 77 ? -20.249 18.141 -33.471 1.0 71.34 77 A 5 -ATOM 1196 H HH22 . ARG A1 1 77 ? -18.838 17.149 -33.61 1.0 1.44 77 A 5 -ATOM 1197 N N . LEU A1 1 78 ? -27.344 12.024 -31.095 1.0 31.03 78 A 5 -ATOM 1198 C CA . LEU A1 1 78 ? -28.164 10.867 -31.438 1.0 51.32 78 A 5 -ATOM 1199 C C . LEU A1 1 78 ? -29.309 11.267 -32.365 1.0 14.11 78 A 5 -ATOM 1200 O O . LEU A1 1 78 ? -29.574 10.599 -33.364 1.0 12.31 78 A 5 -ATOM 1201 C CB . LEU A1 1 78 ? -28.722 10.218 -30.171 1.0 42.51 78 A 5 -ATOM 1202 C CG . LEU A1 1 78 ? -28.046 8.92 -29.728 1.0 51.45 78 A 5 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.909 9.214 -28.761 1.0 14.44 78 A 5 -ATOM 1204 C CD2 . LEU A1 1 78 ? -29.06 7.981 -29.091 1.0 25.32 78 A 5 -ATOM 1205 H H . LEU A1 1 78 ? -27.245 12.275 -30.154 1.0 75.31 78 A 5 -ATOM 1206 H HA . LEU A1 1 78 ? -27.535 10.155 -31.951 1.0 64.2 78 A 5 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.629 10.931 -29.366 1.0 61.14 78 A 5 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.768 10.006 -30.341 1.0 62.32 78 A 5 -ATOM 1209 H HG . LEU A1 1 78 ? -27.628 8.426 -30.594 1.0 53.42 78 A 5 -ATOM 1210 H HD11 . LEU A1 1 78 ? -27.008 10.22 -28.384 1.0 3.24 78 A 5 -ATOM 1211 H HD12 . LEU A1 1 78 ? -25.965 9.114 -29.276 1.0 74.14 78 A 5 -ATOM 1212 H HD13 . LEU A1 1 78 ? -26.946 8.514 -27.939 1.0 11.41 78 A 5 -ATOM 1213 H HD21 . LEU A1 1 78 ? -29.891 7.837 -29.766 1.0 65.32 78 A 5 -ATOM 1214 H HD22 . LEU A1 1 78 ? -29.417 8.41 -28.166 1.0 65.43 78 A 5 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.591 7.029 -28.888 1.0 34.04 78 A 5 -ATOM 1216 N N . ARG A1 1 79 ? -29.982 12.362 -32.026 1.0 44.5 79 A 5 -ATOM 1217 C CA . ARG A1 1 79 ? -31.097 12.851 -32.828 1.0 54.44 79 A 5 -ATOM 1218 C C . ARG A1 1 79 ? -32.178 11.783 -32.965 1.0 43.43 79 A 5 -ATOM 1219 O O . ARG A1 1 79 ? -32.755 11.604 -34.037 1.0 24.23 79 A 5 -ATOM 1220 C CB . ARG A1 1 79 ? -30.608 13.278 -34.213 1.0 53.1 79 A 5 -ATOM 1221 C CG . ARG A1 1 79 ? -31.356 14.473 -34.781 1.0 62.42 79 A 5 -ATOM 1222 C CD . ARG A1 1 79 ? -30.408 15.611 -35.128 1.0 15.2 79 A 5 -ATOM 1223 N NE . ARG A1 1 79 ? -29.783 15.423 -36.435 1.0 22.21 79 A 5 -ATOM 1224 C CZ . ARG A1 1 79 ? -30.423 15.594 -37.586 1.0 43.33 79 A 5 -ATOM 1225 N NH1 . ARG A1 1 79 ? -31.698 15.955 -37.593 1.0 51.34 79 A 5 -ATOM 1226 N NH2 . ARG A1 1 79 ? -29.785 15.405 -38.735 1.0 24.34 79 A 5 -ATOM 1227 H H . ARG A1 1 79 ? -29.723 12.852 -31.218 1.0 30.43 79 A 5 -ATOM 1228 H HA . ARG A1 1 79 ? -31.517 13.709 -32.324 1.0 75.12 79 A 5 -ATOM 1229 H HB2 . ARG A1 1 79 ? -29.561 13.535 -34.15 1.0 72.51 79 A 5 -ATOM 1230 H HB3 . ARG A1 1 79 ? -30.727 12.45 -34.895 1.0 62.3 79 A 5 -ATOM 1231 H HG2 . ARG A1 1 79 ? -31.876 14.168 -35.677 1.0 34.21 79 A 5 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.069 14.821 -34.049 1.0 51.44 79 A 5 -ATOM 1233 H HD2 . ARG A1 1 79 ? -30.965 16.536 -35.135 1.0 21.42 79 A 5 -ATOM 1234 H HD3 . ARG A1 1 79 ? -29.637 15.661 -34.374 1.0 24.22 79 A 5 -ATOM 1235 H HE . ARG A1 1 79 ? -28.841 15.157 -36.453 1.0 63.2 79 A 5 -ATOM 1236 H HH11 . ARG A1 1 79 ? -32.181 16.1 -36.729 1.0 0.03 79 A 5 -ATOM 1237 H HH12 . ARG A1 1 79 ? -32.177 16.085 -38.462 1.0 54.33 79 A 5 -ATOM 1238 H HH21 . ARG A1 1 79 ? -28.824 15.133 -38.734 1.0 72.3 79 A 5 -ATOM 1239 H HH22 . ARG A1 1 79 ? -30.267 15.534 -39.601 1.0 2.44 79 A 5 -ATOM 1240 N N . GLY A1 1 80 ? -32.446 11.075 -31.872 1.0 11.03 80 A 5 -ATOM 1241 C CA . GLY A1 1 80 ? -33.456 10.033 -31.892 1.0 3.12 80 A 5 -ATOM 1242 C C . GLY A1 1 80 ? -32.976 8.774 -32.586 1.0 52.34 80 A 5 -ATOM 1243 O O . GLY A1 1 80 ? -33.115 8.636 -33.801 1.0 43.44 80 A 5 -ATOM 1244 H H . GLY A1 1 80 ? -31.954 11.262 -31.045 1.0 0.24 80 A 5 -ATOM 1245 H HA2 . GLY A1 1 80 ? -33.727 9.791 -30.875 1.0 71.24 80 A 5 -ATOM 1246 H HA3 . GLY A1 1 80 ? -34.329 10.405 -32.408 1.0 43.14 80 A 5 -ATOM 1247 N N . GLY A1 1 81 ? -32.409 7.853 -31.813 1.0 43.34 81 A 5 -ATOM 1248 C CA . GLY A1 1 81 ? -31.914 6.612 -32.38 1.0 20.2 81 A 5 -ATOM 1249 C C . GLY A1 1 81 ? -32.036 5.447 -31.418 1.0 63.23 81 A 5 -ATOM 1250 O O . GLY A1 1 81 ? -33.104 5.204 -30.856 1.0 30.24 81 A 5 -ATOM 1251 H H . GLY A1 1 81 ? -32.325 8.018 -30.851 1.0 11.33 81 A 5 -ATOM 1252 H HA2 . GLY A1 1 81 ? -32.476 6.387 -33.274 1.0 30.51 81 A 5 -ATOM 1253 H HA3 . GLY A1 1 81 ? -30.874 6.739 -32.643 1.0 55.14 81 A 5 -ATOM 1254 N N . VAL A1 1 82 ? -30.938 4.722 -31.227 1.0 30.52 82 A 5 -ATOM 1255 C CA . VAL A1 1 82 ? -30.926 3.575 -30.327 1.0 4.45 82 A 5 -ATOM 1256 C C . VAL A1 1 82 ? -31.164 4.006 -28.884 1.0 63.52 82 A 5 -ATOM 1257 O O . VAL A1 1 82 ? -31.004 5.177 -28.541 1.0 12.52 82 A 5 -ATOM 1258 C CB . VAL A1 1 82 ? -29.592 2.81 -30.409 1.0 53.54 82 A 5 -ATOM 1259 C CG1 . VAL A1 1 82 ? -29.59 1.633 -29.447 1.0 33.31 82 A 5 -ATOM 1260 C CG2 . VAL A1 1 82 ? -29.331 2.345 -31.834 1.0 1.13 82 A 5 -ATOM 1261 H H . VAL A1 1 82 ? -30.116 4.964 -31.703 1.0 42.11 82 A 5 -ATOM 1262 H HA . VAL A1 1 82 ? -31.719 2.906 -30.628 1.0 65.12 82 A 5 -ATOM 1263 H HB . VAL A1 1 82 ? -28.797 3.483 -30.122 1.0 3.02 82 A 5 -ATOM 1264 H HG11 . VAL A1 1 82 ? -29.738 1.992 -28.439 1.0 71.54 82 A 5 -ATOM 1265 H HG12 . VAL A1 1 82 ? -30.387 0.952 -29.708 1.0 43.52 82 A 5 -ATOM 1266 H HG13 . VAL A1 1 82 ? -28.642 1.118 -29.509 1.0 60.31 82 A 5 -ATOM 1267 H HG21 . VAL A1 1 82 ? -28.881 3.148 -32.399 1.0 51.1 82 A 5 -ATOM 1268 H HG22 . VAL A1 1 82 ? -28.664 1.496 -31.819 1.0 43.42 82 A 5 -ATOM 1269 H HG23 . VAL A1 1 82 ? -30.266 2.06 -32.296 1.0 61.21 82 A 5 -ATOM 1 N N . GLY A1 1 1 ? -15.425 -4.098 -5.149 1.0 13.0 1 A 6 -ATOM 2 C CA . GLY A1 1 1 ? -14.182 -3.541 -4.647 1.0 45.03 1 A 6 -ATOM 3 C C . GLY A1 1 1 ? -13.391 -2.824 -5.723 1.0 65.21 1 A 6 -ATOM 4 O O . GLY A1 1 1 ? -12.316 -3.264 -6.131 1.0 33.34 1 A 6 -ATOM 5 H H1 . GLY A1 1 1 ? -15.746 -3.849 -6.041 1.0 52.4 1 A 6 -ATOM 6 H HA2 . GLY A1 1 1 ? -14.407 -2.843 -3.855 1.0 14.15 1 A 6 -ATOM 7 H HA3 . GLY A1 1 1 ? -13.578 -4.342 -4.247 1.0 34.23 1 A 6 -ATOM 8 N N . PRO A1 1 2 ? -13.928 -1.692 -6.202 1.0 55.32 2 A 6 -ATOM 9 C CA . PRO A1 1 2 ? -13.283 -0.889 -7.245 1.0 21.43 2 A 6 -ATOM 10 C C . PRO A1 1 2 ? -12.022 -0.194 -6.744 1.0 41.45 2 A 6 -ATOM 11 O O . PRO A1 1 2 ? -11.953 0.236 -5.591 1.0 62.42 2 A 6 -ATOM 12 C CB . PRO A1 1 2 ? -14.353 0.143 -7.611 1.0 51.45 2 A 6 -ATOM 13 C CG . PRO A1 1 2 ? -15.202 0.257 -6.392 1.0 43.11 2 A 6 -ATOM 14 C CD . PRO A1 1 2 ? -15.207 -1.109 -5.762 1.0 64.14 2 A 6 -ATOM 15 H HA . PRO A1 1 2 ? -13.043 -1.485 -8.113 1.0 31.54 2 A 6 -ATOM 16 H HB2 . PRO A1 1 2 ? -13.88 1.085 -7.853 1.0 42.4 2 A 6 -ATOM 17 H HB3 . PRO A1 1 2 ? -14.923 -0.208 -8.457 1.0 62.54 2 A 6 -ATOM 18 H HG2 . PRO A1 1 2 ? -14.777 0.981 -5.714 1.0 3.22 2 A 6 -ATOM 19 H HG3 . PRO A1 1 2 ? -16.205 0.545 -6.67 1.0 51.14 2 A 6 -ATOM 20 H HD2 . PRO A1 1 2 ? -15.244 -1.028 -4.686 1.0 11.0 2 A 6 -ATOM 21 H HD3 . PRO A1 1 2 ? -16.041 -1.69 -6.127 1.0 24.12 2 A 6 -ATOM 22 N N . LEU A1 1 3 ? -11.025 -0.086 -7.616 1.0 34.12 3 A 6 -ATOM 23 C CA . LEU A1 1 3 ? -9.765 0.558 -7.262 1.0 54.03 3 A 6 -ATOM 24 C C . LEU A1 1 3 ? -8.955 0.892 -8.51 1.0 63.21 3 A 6 -ATOM 25 O O . LEU A1 1 3 ? -9.145 0.29 -9.565 1.0 11.24 3 A 6 -ATOM 26 C CB . LEU A1 1 3 ? -8.949 -0.347 -6.337 1.0 60.12 3 A 6 -ATOM 27 C CG . LEU A1 1 3 ? -8.726 0.171 -4.916 1.0 64.13 3 A 6 -ATOM 28 C CD1 . LEU A1 1 3 ? -8.564 -0.988 -3.945 1.0 62.25 3 A 6 -ATOM 29 C CD2 . LEU A1 1 3 ? -7.51 1.085 -4.866 1.0 0.12 3 A 6 -ATOM 30 H H . LEU A1 1 3 ? -11.139 -0.447 -8.519 1.0 52.35 3 A 6 -ATOM 31 H HA . LEU A1 1 3 ? -9.997 1.475 -6.741 1.0 43.13 3 A 6 -ATOM 32 H HB2 . LEU A1 1 3 ? -9.46 -1.295 -6.267 1.0 74.24 3 A 6 -ATOM 33 H HB3 . LEU A1 1 3 ? -7.98 -0.496 -6.793 1.0 72.41 3 A 6 -ATOM 34 H HG . LEU A1 1 3 ? -9.589 0.745 -4.609 1.0 43.5 3 A 6 -ATOM 35 H HD11 . LEU A1 1 3 ? -8.47 -1.911 -4.497 1.0 50.45 3 A 6 -ATOM 36 H HD12 . LEU A1 1 3 ? -9.429 -1.041 -3.3 1.0 4.34 3 A 6 -ATOM 37 H HD13 . LEU A1 1 3 ? -7.678 -0.835 -3.346 1.0 54.42 3 A 6 -ATOM 38 H HD21 . LEU A1 1 3 ? -6.613 0.498 -5.0 1.0 23.33 3 A 6 -ATOM 39 H HD22 . LEU A1 1 3 ? -7.475 1.584 -3.91 1.0 1.01 3 A 6 -ATOM 40 H HD23 . LEU A1 1 3 ? -7.58 1.82 -5.654 1.0 75.24 3 A 6 -ATOM 41 N N . GLY A1 1 4 ? -8.048 1.857 -8.38 1.0 4.21 4 A 6 -ATOM 42 C CA . GLY A1 1 4 ? -7.221 2.253 -9.505 1.0 43.34 4 A 6 -ATOM 43 C C . GLY A1 1 4 ? -6.41 3.501 -9.217 1.0 32.24 4 A 6 -ATOM 44 O O . GLY A1 1 4 ? -6.069 3.776 -8.066 1.0 73.31 4 A 6 -ATOM 45 H H . GLY A1 1 4 ? -7.941 2.303 -7.514 1.0 2.13 4 A 6 -ATOM 46 H HA2 . GLY A1 1 4 ? -6.546 1.445 -9.744 1.0 53.5 4 A 6 -ATOM 47 H HA3 . GLY A1 1 4 ? -7.858 2.441 -10.357 1.0 61.41 4 A 6 -ATOM 48 N N . SER A1 1 5 ? -6.098 4.257 -10.264 1.0 14.33 5 A 6 -ATOM 49 C CA . SER A1 1 5 ? -5.317 5.48 -10.119 1.0 12.42 5 A 6 -ATOM 50 C C . SER A1 1 5 ? -6.214 6.656 -9.744 1.0 43.22 5 A 6 -ATOM 51 O O . SER A1 1 5 ? -6.229 7.097 -8.595 1.0 33.52 5 A 6 -ATOM 52 C CB . SER A1 1 5 ? -4.568 5.789 -11.417 1.0 72.02 5 A 6 -ATOM 53 O OG . SER A1 1 5 ? -3.836 6.998 -11.308 1.0 21.35 5 A 6 -ATOM 54 H H . SER A1 1 5 ? -6.399 3.985 -11.157 1.0 31.12 5 A 6 -ATOM 55 H HA . SER A1 1 5 ? -4.6 5.323 -9.328 1.0 12.32 5 A 6 -ATOM 56 H HB2 . SER A1 1 5 ? -3.881 4.985 -11.633 1.0 41.01 5 A 6 -ATOM 57 H HB3 . SER A1 1 5 ? -5.278 5.883 -12.225 1.0 74.13 5 A 6 -ATOM 58 H HG . SER A1 1 5 ? -2.897 6.81 -11.368 1.0 33.45 5 A 6 -ATOM 59 N N . MET A1 1 6 ? -6.96 7.159 -10.722 1.0 14.01 6 A 6 -ATOM 60 C CA . MET A1 1 6 ? -7.861 8.283 -10.495 1.0 54.33 6 A 6 -ATOM 61 C C . MET A1 1 6 ? -9.212 8.04 -11.16 1.0 31.44 6 A 6 -ATOM 62 O O . MET A1 1 6 ? -9.43 6.998 -11.778 1.0 1.11 6 A 6 -ATOM 63 C CB . MET A1 1 6 ? -7.242 9.576 -11.03 1.0 70.21 6 A 6 -ATOM 64 C CG . MET A1 1 6 ? -7.021 9.567 -12.534 1.0 25.05 6 A 6 -ATOM 65 S SD . MET A1 1 6 ? -5.275 9.506 -12.979 1.0 3.44 6 A 6 -ATOM 66 C CE . MET A1 1 6 ? -4.662 10.969 -12.148 1.0 13.21 6 A 6 -ATOM 67 H H . MET A1 1 6 ? -6.905 6.764 -11.618 1.0 2.32 6 A 6 -ATOM 68 H HA . MET A1 1 6 ? -8.008 8.379 -9.43 1.0 5.22 6 A 6 -ATOM 69 H HB2 . MET A1 1 6 ? -7.895 10.401 -10.788 1.0 62.43 6 A 6 -ATOM 70 H HB3 . MET A1 1 6 ? -6.287 9.73 -10.549 1.0 63.34 6 A 6 -ATOM 71 H HG2 . MET A1 1 6 ? -7.514 8.703 -12.952 1.0 33.13 6 A 6 -ATOM 72 H HG3 . MET A1 1 6 ? -7.454 10.464 -12.952 1.0 12.41 6 A 6 -ATOM 73 H HE1 . MET A1 1 6 ? -5.496 11.564 -11.804 1.0 12.23 6 A 6 -ATOM 74 H HE2 . MET A1 1 6 ? -4.056 10.677 -11.303 1.0 52.54 6 A 6 -ATOM 75 H HE3 . MET A1 1 6 ? -4.065 11.55 -12.836 1.0 2.41 6 A 6 -ATOM 76 N N . GLN A1 1 7 ? -10.114 9.006 -11.027 1.0 13.12 7 A 6 -ATOM 77 C CA . GLN A1 1 7 ? -11.444 8.895 -11.614 1.0 13.2 7 A 6 -ATOM 78 C C . GLN A1 1 7 ? -11.877 10.219 -12.236 1.0 42.42 7 A 6 -ATOM 79 O O . GLN A1 1 7 ? -11.384 11.283 -11.86 1.0 71.33 7 A 6 -ATOM 80 C CB . GLN A1 1 7 ? -12.458 8.46 -10.555 1.0 42.01 7 A 6 -ATOM 81 C CG . GLN A1 1 7 ? -11.949 7.355 -9.644 1.0 12.34 7 A 6 -ATOM 82 C CD . GLN A1 1 7 ? -11.424 7.882 -8.323 1.0 44.31 7 A 6 -ATOM 83 O OE1 . GLN A1 1 7 ? -11.306 9.092 -8.128 1.0 33.44 7 A 6 -ATOM 84 N NE2 . GLN A1 1 7 ? -11.106 6.975 -7.407 1.0 73.32 7 A 6 -ATOM 85 H H . GLN A1 1 7 ? -9.88 9.812 -10.522 1.0 71.21 7 A 6 -ATOM 86 H HA . GLN A1 1 7 ? -11.403 8.145 -12.389 1.0 62.03 7 A 6 -ATOM 87 H HB2 . GLN A1 1 7 ? -12.711 9.314 -9.943 1.0 13.25 7 A 6 -ATOM 88 H HB3 . GLN A1 1 7 ? -13.35 8.106 -11.051 1.0 41.42 7 A 6 -ATOM 89 H HG2 . GLN A1 1 7 ? -12.76 6.67 -9.443 1.0 43.33 7 A 6 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.152 6.829 -10.148 1.0 33.21 7 A 6 -ATOM 91 H HE21 . GLN A1 1 7 ? -11.225 6.028 -7.633 1.0 52.01 7 A 6 -ATOM 92 H HE22 . GLN A1 1 7 ? -10.763 7.288 -6.545 1.0 55.43 7 A 6 -ATOM 93 N N . ILE A1 1 8 ? -12.8 10.146 -13.189 1.0 12.12 8 A 6 -ATOM 94 C CA . ILE A1 1 8 ? -13.299 11.338 -13.862 1.0 64.2 8 A 6 -ATOM 95 C C . ILE A1 1 8 ? -14.823 11.38 -13.848 1.0 0.33 8 A 6 -ATOM 96 O O . ILE A1 1 8 ? -15.481 10.36 -13.644 1.0 11.35 8 A 6 -ATOM 97 C CB . ILE A1 1 8 ? -12.809 11.409 -15.32 1.0 65.34 8 A 6 -ATOM 98 C CG1 . ILE A1 1 8 ? -11.931 10.198 -15.645 1.0 72.33 8 A 6 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.045 12.703 -15.56 1.0 55.24 8 A 6 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.571 10.089 -17.11 1.0 11.02 8 A 6 -ATOM 101 H H . ILE A1 1 8 ? -13.154 9.269 -13.445 1.0 43.45 8 A 6 -ATOM 102 H HA . ILE A1 1 8 ? -12.921 12.202 -13.334 1.0 41.41 8 A 6 -ATOM 103 H HB . ILE A1 1 8 ? -13.672 11.403 -15.968 1.0 13.24 8 A 6 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.013 10.266 -15.083 1.0 4.11 8 A 6 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.456 9.297 -15.363 1.0 33.41 8 A 6 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.36 12.569 -16.384 1.0 12.11 8 A 6 -ATOM 107 H HG22 . ILE A1 1 8 ? -12.742 13.492 -15.798 1.0 14.43 8 A 6 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.493 12.966 -14.671 1.0 53.13 8 A 6 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.167 9.313 -17.57 1.0 4.51 8 A 6 -ATOM 110 H HD12 . ILE A1 1 8 ? -11.767 11.031 -17.601 1.0 22.53 8 A 6 -ATOM 111 H HD13 . ILE A1 1 8 ? -10.524 9.843 -17.207 1.0 32.23 8 A 6 -ATOM 112 N N . PHE A1 1 9 ? -15.379 12.568 -14.067 1.0 44.42 9 A 6 -ATOM 113 C CA . PHE A1 1 9 ? -16.827 12.743 -14.08 1.0 45.42 9 A 6 -ATOM 114 C C . PHE A1 1 9 ? -17.308 13.191 -15.457 1.0 62.05 9 A 6 -ATOM 115 O O . PHE A1 1 9 ? -16.828 14.185 -16.002 1.0 33.13 9 A 6 -ATOM 116 C CB . PHE A1 1 9 ? -17.247 13.767 -13.023 1.0 42.3 9 A 6 -ATOM 117 C CG . PHE A1 1 9 ? -18.03 13.17 -11.889 1.0 44.44 9 A 6 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.284 12.622 -12.108 1.0 24.21 9 A 6 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.513 13.158 -10.604 1.0 24.11 9 A 6 -ATOM 120 C CE1 . PHE A1 1 9 ? -20.007 12.072 -11.066 1.0 54.33 9 A 6 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.231 12.609 -9.558 1.0 62.43 9 A 6 -ATOM 122 C CZ . PHE A1 1 9 ? -19.48 12.066 -9.79 1.0 72.21 9 A 6 -ATOM 123 H H . PHE A1 1 9 ? -14.801 13.344 -14.223 1.0 15.35 9 A 6 -ATOM 124 H HA . PHE A1 1 9 ? -17.277 11.791 -13.846 1.0 72.15 9 A 6 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.364 14.229 -12.609 1.0 13.22 9 A 6 -ATOM 126 H HB3 . PHE A1 1 9 ? -17.86 14.524 -13.49 1.0 20.44 9 A 6 -ATOM 127 H HD1 . PHE A1 1 9 ? -19.697 12.627 -13.107 1.0 63.23 9 A 6 -ATOM 128 H HD2 . PHE A1 1 9 ? -16.537 13.582 -10.421 1.0 43.5 9 A 6 -ATOM 129 H HE1 . PHE A1 1 9 ? -20.983 11.649 -11.251 1.0 53.21 9 A 6 -ATOM 130 H HE2 . PHE A1 1 9 ? -17.817 12.606 -8.561 1.0 61.25 9 A 6 -ATOM 131 H HZ . PHE A1 1 9 ? -20.043 11.637 -8.975 1.0 11.33 9 A 6 -ATOM 132 N N . VAL A1 1 10 ? -18.259 12.448 -16.015 1.0 35.51 10 A 6 -ATOM 133 C CA . VAL A1 1 10 ? -18.806 12.767 -17.328 1.0 51.35 10 A 6 -ATOM 134 C C . VAL A1 1 10 ? -20.284 13.131 -17.234 1.0 20.3 10 A 6 -ATOM 135 O O . VAL A1 1 10 ? -21.073 12.413 -16.62 1.0 33.54 10 A 6 -ATOM 136 C CB . VAL A1 1 10 ? -18.639 11.59 -18.307 1.0 1.24 10 A 6 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.209 12.091 -19.677 1.0 43.55 10 A 6 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.64 10.582 -17.761 1.0 70.41 10 A 6 -ATOM 139 H H . VAL A1 1 10 ? -18.601 11.668 -15.531 1.0 13.11 10 A 6 -ATOM 140 H HA . VAL A1 1 10 ? -18.261 13.614 -17.72 1.0 52.2 10 A 6 -ATOM 141 H HB . VAL A1 1 10 ? -19.595 11.097 -18.412 1.0 21.21 10 A 6 -ATOM 142 H HG11 . VAL A1 1 10 ? -18.576 13.097 -19.823 1.0 75.22 10 A 6 -ATOM 143 H HG12 . VAL A1 1 10 ? -17.131 12.086 -19.741 1.0 54.41 10 A 6 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.618 11.446 -20.441 1.0 61.31 10 A 6 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.358 9.893 -18.544 1.0 13.24 10 A 6 -ATOM 146 H HG22 . VAL A1 1 10 ? -16.763 11.102 -17.406 1.0 62.44 10 A 6 -ATOM 147 H HG23 . VAL A1 1 10 ? -18.089 10.034 -16.945 1.0 2.35 10 A 6 -ATOM 148 N N . LYS A1 1 11 ? -20.652 14.25 -17.848 1.0 23.3 11 A 6 -ATOM 149 C CA . LYS A1 1 11 ? -22.036 14.709 -17.836 1.0 10.31 11 A 6 -ATOM 150 C C . LYS A1 1 11 ? -22.688 14.507 -19.2 1.0 22.12 11 A 6 -ATOM 151 O O . LYS A1 1 11 ? -22.288 15.123 -20.189 1.0 63.21 11 A 6 -ATOM 152 C CB . LYS A1 1 11 ? -22.101 16.187 -17.442 1.0 34.41 11 A 6 -ATOM 153 C CG . LYS A1 1 11 ? -23.453 16.827 -17.704 1.0 63.11 11 A 6 -ATOM 154 C CD . LYS A1 1 11 ? -23.446 18.306 -17.356 1.0 3.15 11 A 6 -ATOM 155 C CE . LYS A1 1 11 ? -23.128 19.163 -18.572 1.0 2.52 11 A 6 -ATOM 156 N NZ . LYS A1 1 11 ? -23.198 20.618 -18.259 1.0 51.12 11 A 6 -ATOM 157 H H . LYS A1 1 11 ? -19.977 14.78 -18.322 1.0 4.15 11 A 6 -ATOM 158 H HA . LYS A1 1 11 ? -22.573 14.126 -17.104 1.0 44.21 11 A 6 -ATOM 159 H HB2 . LYS A1 1 11 ? -21.882 16.276 -16.388 1.0 75.01 11 A 6 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.354 16.73 -18.003 1.0 15.43 11 A 6 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.698 16.716 -18.75 1.0 73.24 11 A 6 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.2 16.329 -17.103 1.0 30.03 11 A 6 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.42 18.584 -16.98 1.0 63.51 11 A 6 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.7 18.485 -16.595 1.0 61.22 11 A 6 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.132 18.925 -18.913 1.0 70.24 11 A 6 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.84 18.937 -19.352 1.0 3.13 11 A 6 -ATOM 167 H HZ1 . LYS A1 1 11 ? -22.532 21.145 -18.859 1.0 1.34 11 A 6 -ATOM 168 H HZ2 . LYS A1 1 11 ? -22.954 20.78 -17.261 1.0 61.44 11 A 6 -ATOM 169 H HZ3 . LYS A1 1 11 ? -24.16 20.974 -18.431 1.0 12.11 11 A 6 -ATOM 170 N N . THR A1 1 12 ? -23.696 13.641 -19.247 1.0 60.33 12 A 6 -ATOM 171 C CA . THR A1 1 12 ? -24.403 13.358 -20.49 1.0 63.11 12 A 6 -ATOM 172 C C . THR A1 1 12 ? -25.329 14.508 -20.869 1.0 63.2 12 A 6 -ATOM 173 O O . THR A1 1 12 ? -25.701 15.324 -20.024 1.0 23.14 12 A 6 -ATOM 174 C CB . THR A1 1 12 ? -25.229 12.063 -20.384 1.0 13.53 12 A 6 -ATOM 175 O OG1 . THR A1 1 12 ? -26.206 12.188 -19.344 1.0 44.22 12 A 6 -ATOM 176 C CG2 . THR A1 1 12 ? -24.33 10.869 -20.1 1.0 44.25 12 A 6 -ATOM 177 H H . THR A1 1 12 ? -23.968 13.182 -18.426 1.0 50.31 12 A 6 -ATOM 178 H HA . THR A1 1 12 ? -23.668 13.229 -21.27 1.0 15.31 12 A 6 -ATOM 179 H HB . THR A1 1 12 ? -25.735 11.898 -21.324 1.0 3.11 12 A 6 -ATOM 180 H HG1 . THR A1 1 12 ? -26.94 11.595 -19.521 1.0 54.01 12 A 6 -ATOM 181 H HG21 . THR A1 1 12 ? -23.709 10.674 -20.961 1.0 54.24 12 A 6 -ATOM 182 H HG22 . THR A1 1 12 ? -24.938 10.002 -19.89 1.0 51.32 12 A 6 -ATOM 183 H HG23 . THR A1 1 12 ? -23.704 11.085 -19.247 1.0 74.05 12 A 6 -ATOM 184 N N . LEU A1 1 13 ? -25.699 14.568 -22.143 1.0 74.21 13 A 6 -ATOM 185 C CA . LEU A1 1 13 ? -26.584 15.619 -22.635 1.0 74.52 13 A 6 -ATOM 186 C C . LEU A1 1 13 ? -27.919 15.596 -21.897 1.0 25.21 13 A 6 -ATOM 187 O O . LEU A1 1 13 ? -28.662 16.578 -21.904 1.0 11.35 13 A 6 -ATOM 188 C CB . LEU A1 1 13 ? -26.817 15.455 -24.138 1.0 31.51 13 A 6 -ATOM 189 C CG . LEU A1 1 13 ? -27.528 16.614 -24.837 1.0 30.32 13 A 6 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.517 17.625 -25.357 1.0 44.31 13 A 6 -ATOM 191 C CD2 . LEU A1 1 13 ? -28.4 16.098 -25.972 1.0 64.01 13 A 6 -ATOM 192 H H . LEU A1 1 13 ? -25.371 13.89 -22.769 1.0 42.02 13 A 6 -ATOM 193 H HA . LEU A1 1 13 ? -26.103 16.568 -22.455 1.0 34.1 13 A 6 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.855 15.325 -24.609 1.0 62.11 13 A 6 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.411 14.564 -24.285 1.0 43.21 13 A 6 -ATOM 196 H HG . LEU A1 1 13 ? -28.167 17.118 -24.125 1.0 45.4 13 A 6 -ATOM 197 H HD11 . LEU A1 1 13 ? -27.032 18.401 -25.902 1.0 62.23 13 A 6 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.817 17.129 -26.012 1.0 23.44 13 A 6 -ATOM 199 H HD13 . LEU A1 1 13 ? -25.984 18.061 -24.524 1.0 25.55 13 A 6 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.023 15.144 -26.311 1.0 62.14 13 A 6 -ATOM 201 H HD22 . LEU A1 1 13 ? -28.381 16.803 -26.79 1.0 41.34 13 A 6 -ATOM 202 H HD23 . LEU A1 1 13 ? -29.415 15.98 -25.621 1.0 51.42 13 A 6 -ATOM 203 N N . THR A1 1 14 ? -28.217 14.469 -21.258 1.0 31.41 14 A 6 -ATOM 204 C CA . THR A1 1 14 ? -29.461 14.319 -20.514 1.0 30.33 14 A 6 -ATOM 205 C C . THR A1 1 14 ? -29.308 14.814 -19.081 1.0 22.13 14 A 6 -ATOM 206 O O . THR A1 1 14 ? -30.233 14.713 -18.276 1.0 5.31 14 A 6 -ATOM 207 C CB . THR A1 1 14 ? -29.928 12.851 -20.491 1.0 34.54 14 A 6 -ATOM 208 O OG1 . THR A1 1 14 ? -29.043 12.068 -19.682 1.0 3.22 14 A 6 -ATOM 209 C CG2 . THR A1 1 14 ? -29.978 12.277 -21.899 1.0 34.11 14 A 6 -ATOM 210 H H . THR A1 1 14 ? -27.585 13.721 -21.29 1.0 2.31 14 A 6 -ATOM 211 H HA . THR A1 1 14 ? -30.219 14.908 -21.009 1.0 25.44 14 A 6 -ATOM 212 H HB . THR A1 1 14 ? -30.921 12.812 -20.066 1.0 55.24 14 A 6 -ATOM 213 H HG1 . THR A1 1 14 ? -29.555 11.458 -19.145 1.0 24.42 14 A 6 -ATOM 214 H HG21 . THR A1 1 14 ? -30.779 11.556 -21.965 1.0 1.02 14 A 6 -ATOM 215 H HG22 . THR A1 1 14 ? -29.04 11.793 -22.124 1.0 12.23 14 A 6 -ATOM 216 H HG23 . THR A1 1 14 ? -30.152 13.074 -22.606 1.0 12.42 14 A 6 -ATOM 217 N N . GLY A1 1 15 ? -28.132 15.351 -18.767 1.0 61.2 15 A 6 -ATOM 218 C CA . GLY A1 1 15 ? -27.88 15.854 -17.43 1.0 25.44 15 A 6 -ATOM 219 C C . GLY A1 1 15 ? -27.64 14.743 -16.427 1.0 2.34 15 A 6 -ATOM 220 O O . GLY A1 1 15 ? -28.293 14.684 -15.385 1.0 24.03 15 A 6 -ATOM 221 H H . GLY A1 1 15 ? -27.431 15.405 -19.45 1.0 73.22 15 A 6 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.011 16.495 -17.456 1.0 10.15 15 A 6 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.733 16.434 -17.109 1.0 23.53 15 A 6 -ATOM 224 N N . LYS A1 1 16 ? -26.701 13.857 -16.742 1.0 11.21 16 A 6 -ATOM 225 C CA . LYS A1 1 16 ? -26.375 12.741 -15.862 1.0 34.13 16 A 6 -ATOM 226 C C . LYS A1 1 16 ? -24.875 12.682 -15.591 1.0 15.24 16 A 6 -ATOM 227 O O . LYS A1 1 16 ? -24.072 12.528 -16.513 1.0 50.04 16 A 6 -ATOM 228 C CB . LYS A1 1 16 ? -26.845 11.423 -16.481 1.0 31.42 16 A 6 -ATOM 229 C CG . LYS A1 1 16 ? -27.306 10.401 -15.457 1.0 73.35 16 A 6 -ATOM 230 C CD . LYS A1 1 16 ? -26.154 9.533 -14.977 1.0 50.3 16 A 6 -ATOM 231 C CE . LYS A1 1 16 ? -25.635 8.633 -16.088 1.0 52.44 16 A 6 -ATOM 232 N NZ . LYS A1 1 16 ? -25.99 7.205 -15.856 1.0 2.53 16 A 6 -ATOM 233 H H . LYS A1 1 16 ? -26.213 13.958 -17.587 1.0 52.54 16 A 6 -ATOM 234 H HA . LYS A1 1 16 ? -26.891 12.895 -14.927 1.0 34.34 16 A 6 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.667 11.627 -17.151 1.0 44.24 16 A 6 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.03 10.994 -17.046 1.0 12.13 16 A 6 -ATOM 237 H HG2 . LYS A1 1 16 ? -27.729 10.919 -14.609 1.0 3.41 16 A 6 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.058 9.768 -15.906 1.0 74.14 16 A 6 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.35 10.171 -14.641 1.0 63.23 16 A 6 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.496 8.918 -14.157 1.0 14.51 16 A 6 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.064 8.954 -17.024 1.0 44.12 16 A 6 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.56 8.725 -16.134 1.0 75.31 16 A 6 -ATOM 243 H HZ1 . LYS A1 1 16 ? -25.285 6.757 -15.237 1.0 61.55 16 A 6 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.017 6.693 -16.761 1.0 23.15 16 A 6 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.925 7.138 -15.405 1.0 43.23 16 A 6 -ATOM 246 N N . THR A1 1 17 ? -24.502 12.803 -14.321 1.0 33.03 17 A 6 -ATOM 247 C CA . THR A1 1 17 ? -23.099 12.763 -13.929 1.0 61.21 17 A 6 -ATOM 248 C C . THR A1 1 17 ? -22.665 11.343 -13.583 1.0 13.11 17 A 6 -ATOM 249 O O . THR A1 1 17 ? -23.202 10.727 -12.662 1.0 32.24 17 A 6 -ATOM 250 C CB . THR A1 1 17 ? -22.826 13.679 -12.722 1.0 22.54 17 A 6 -ATOM 251 O OG1 . THR A1 1 17 ? -23.573 13.229 -11.586 1.0 24.32 17 A 6 -ATOM 252 C CG2 . THR A1 1 17 ? -23.197 15.12 -13.041 1.0 72.42 17 A 6 -ATOM 253 H H . THR A1 1 17 ? -25.188 12.924 -13.632 1.0 63.53 17 A 6 -ATOM 254 H HA . THR A1 1 17 ? -22.509 13.116 -14.763 1.0 15.15 17 A 6 -ATOM 255 H HB . THR A1 1 17 ? -21.771 13.638 -12.489 1.0 61.22 17 A 6 -ATOM 256 H HG1 . THR A1 1 17 ? -22.975 12.844 -10.942 1.0 54.0 17 A 6 -ATOM 257 H HG21 . THR A1 1 17 ? -22.789 15.772 -12.284 1.0 31.34 17 A 6 -ATOM 258 H HG22 . THR A1 1 17 ? -24.272 15.219 -13.06 1.0 12.24 17 A 6 -ATOM 259 H HG23 . THR A1 1 17 ? -22.793 15.39 -14.005 1.0 74.01 17 A 6 -ATOM 260 N N . ILE A1 1 18 ? -21.691 10.829 -14.327 1.0 21.15 18 A 6 -ATOM 261 C CA . ILE A1 1 18 ? -21.184 9.482 -14.096 1.0 42.23 18 A 6 -ATOM 262 C C . ILE A1 1 18 ? -19.708 9.507 -13.717 1.0 2.02 18 A 6 -ATOM 263 O O . ILE A1 1 18 ? -18.926 10.284 -14.267 1.0 34.24 18 A 6 -ATOM 264 C CB . ILE A1 1 18 ? -21.368 8.591 -15.339 1.0 20.13 18 A 6 -ATOM 265 C CG1 . ILE A1 1 18 ? -20.483 7.348 -15.238 1.0 0.43 18 A 6 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.048 9.374 -16.604 1.0 34.34 18 A 6 -ATOM 267 C CD1 . ILE A1 1 18 ? -20.79 6.3 -16.285 1.0 41.12 18 A 6 -ATOM 268 H H . ILE A1 1 18 ? -21.303 11.369 -15.046 1.0 72.35 18 A 6 -ATOM 269 H HA . ILE A1 1 18 ? -21.747 9.049 -13.282 1.0 33.1 18 A 6 -ATOM 270 H HB . ILE A1 1 18 ? -22.402 8.286 -15.386 1.0 55.23 18 A 6 -ATOM 271 H HG12 . ILE A1 1 18 ? -19.45 7.638 -15.353 1.0 35.45 18 A 6 -ATOM 272 H HG13 . ILE A1 1 18 ? -20.619 6.896 -14.266 1.0 15.51 18 A 6 -ATOM 273 H HG21 . ILE A1 1 18 ? -20.029 9.728 -16.56 1.0 31.24 18 A 6 -ATOM 274 H HG22 . ILE A1 1 18 ? -21.17 8.733 -17.464 1.0 60.32 18 A 6 -ATOM 275 H HG23 . ILE A1 1 18 ? -21.718 10.217 -16.685 1.0 71.44 18 A 6 -ATOM 276 H HD11 . ILE A1 1 18 ? -21.006 6.785 -17.226 1.0 32.31 18 A 6 -ATOM 277 H HD12 . ILE A1 1 18 ? -19.937 5.649 -16.405 1.0 60.24 18 A 6 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.646 5.721 -15.975 1.0 25.35 18 A 6 -ATOM 279 N N . THR A1 1 19 ? -19.33 8.65 -12.773 1.0 42.32 19 A 6 -ATOM 280 C CA . THR A1 1 19 ? -17.947 8.573 -12.32 1.0 41.24 19 A 6 -ATOM 281 C C . THR A1 1 19 ? -17.277 7.296 -12.813 1.0 70.21 19 A 6 -ATOM 282 O O . THR A1 1 19 ? -17.873 6.219 -12.78 1.0 44.42 19 A 6 -ATOM 283 C CB . THR A1 1 19 ? -17.856 8.626 -10.783 1.0 2.4 19 A 6 -ATOM 284 O OG1 . THR A1 1 19 ? -19.144 8.909 -10.225 1.0 22.32 19 A 6 -ATOM 285 C CG2 . THR A1 1 19 ? -16.86 9.686 -10.336 1.0 13.14 19 A 6 -ATOM 286 H H . THR A1 1 19 ? -19.999 8.057 -12.372 1.0 1.15 19 A 6 -ATOM 287 H HA . THR A1 1 19 ? -17.417 9.424 -12.721 1.0 65.43 19 A 6 -ATOM 288 H HB . THR A1 1 19 ? -17.52 7.664 -10.424 1.0 44.24 19 A 6 -ATOM 289 H HG1 . THR A1 1 19 ? -19.112 8.795 -9.272 1.0 60.25 19 A 6 -ATOM 290 H HG21 . THR A1 1 19 ? -17.052 9.948 -9.307 1.0 73.33 19 A 6 -ATOM 291 H HG22 . THR A1 1 19 ? -16.967 10.564 -10.956 1.0 23.45 19 A 6 -ATOM 292 H HG23 . THR A1 1 19 ? -15.856 9.299 -10.429 1.0 51.03 19 A 6 -ATOM 293 N N . ILE A1 1 20 ? -16.036 7.423 -13.27 1.0 2.13 20 A 6 -ATOM 294 C CA . ILE A1 1 20 ? -15.285 6.277 -13.769 1.0 23.24 20 A 6 -ATOM 295 C C . ILE A1 1 20 ? -13.812 6.378 -13.388 1.0 21.51 20 A 6 -ATOM 296 O O . ILE A1 1 20 ? -13.183 7.42 -13.57 1.0 3.54 20 A 6 -ATOM 297 C CB . ILE A1 1 20 ? -15.401 6.151 -15.299 1.0 55.55 20 A 6 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.464 7.538 -15.944 1.0 1.5 20 A 6 -ATOM 299 C CG2 . ILE A1 1 20 ? -16.627 5.332 -15.672 1.0 1.32 20 A 6 -ATOM 300 C CD1 . ILE A1 1 20 ? -14.829 7.596 -17.316 1.0 2.4 20 A 6 -ATOM 301 H H . ILE A1 1 20 ? -15.615 8.307 -13.271 1.0 32.52 20 A 6 -ATOM 302 H HA . ILE A1 1 20 ? -15.702 5.386 -13.322 1.0 40.32 20 A 6 -ATOM 303 H HB . ILE A1 1 20 ? -14.527 5.632 -15.663 1.0 75.22 20 A 6 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.496 7.835 -16.044 1.0 4.24 20 A 6 -ATOM 305 H HG13 . ILE A1 1 20 ? -14.95 8.245 -15.309 1.0 20.02 20 A 6 -ATOM 306 H HG21 . ILE A1 1 20 ? -16.42 4.76 -16.565 1.0 41.11 20 A 6 -ATOM 307 H HG22 . ILE A1 1 20 ? -16.87 4.659 -14.863 1.0 51.34 20 A 6 -ATOM 308 H HG23 . ILE A1 1 20 ? -17.461 5.993 -15.854 1.0 74.34 20 A 6 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.142 6.738 -17.894 1.0 44.23 20 A 6 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.139 8.5 -17.819 1.0 43.31 20 A 6 -ATOM 311 H HD13 . ILE A1 1 20 ? -13.754 7.589 -17.216 1.0 23.14 20 A 6 -ATOM 312 N N . ASP A1 1 21 ? -13.267 5.287 -12.861 1.0 44.41 21 A 6 -ATOM 313 C CA . ASP A1 1 21 ? -11.866 5.25 -12.458 1.0 13.43 21 A 6 -ATOM 314 C C . ASP A1 1 21 ? -10.966 4.928 -13.647 1.0 74.52 21 A 6 -ATOM 315 O O . ASP A1 1 21 ? -11.096 3.874 -14.269 1.0 3.25 21 A 6 -ATOM 316 C CB . ASP A1 1 21 ? -11.659 4.216 -11.35 1.0 40.32 21 A 6 -ATOM 317 C CG . ASP A1 1 21 ? -11.97 2.805 -11.81 1.0 70.32 21 A 6 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.142 2.537 -12.148 1.0 34.41 21 A 6 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.043 1.969 -11.831 1.0 4.34 21 A 6 -ATOM 320 H H . ASP A1 1 21 ? -13.82 4.486 -12.742 1.0 61.24 21 A 6 -ATOM 321 H HA . ASP A1 1 21 ? -11.605 6.227 -12.079 1.0 0.1 21 A 6 -ATOM 322 H HB2 . ASP A1 1 21 ? -10.63 4.249 -11.023 1.0 73.15 21 A 6 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.305 4.455 -10.518 1.0 61.23 21 A 6 -ATOM 324 N N . VAL A1 1 22 ? -10.054 5.843 -13.957 1.0 30.34 22 A 6 -ATOM 325 C CA . VAL A1 1 22 ? -9.132 5.657 -15.071 1.0 1.34 22 A 6 -ATOM 326 C C . VAL A1 1 22 ? -7.691 5.903 -14.639 1.0 61.2 22 A 6 -ATOM 327 O O . VAL A1 1 22 ? -7.439 6.511 -13.599 1.0 34.03 22 A 6 -ATOM 328 C CB . VAL A1 1 22 ? -9.472 6.595 -16.244 1.0 60.13 22 A 6 -ATOM 329 C CG1 . VAL A1 1 22 ? -10.908 7.085 -16.138 1.0 14.0 22 A 6 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.503 7.767 -16.287 1.0 61.12 22 A 6 -ATOM 331 H H . VAL A1 1 22 ? -9.999 6.664 -13.424 1.0 71.0 22 A 6 -ATOM 332 H HA . VAL A1 1 22 ? -9.226 4.637 -15.415 1.0 41.13 22 A 6 -ATOM 333 H HB . VAL A1 1 22 ? -9.373 6.039 -17.165 1.0 23.42 22 A 6 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.559 6.249 -15.925 1.0 3.13 22 A 6 -ATOM 335 H HG12 . VAL A1 1 22 ? -10.983 7.812 -15.342 1.0 11.12 22 A 6 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.203 7.541 -17.071 1.0 2.3 22 A 6 -ATOM 337 H HG21 . VAL A1 1 22 ? -7.535 7.422 -16.618 1.0 43.3 22 A 6 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.873 8.515 -16.972 1.0 71.52 22 A 6 -ATOM 339 H HG23 . VAL A1 1 22 ? -8.413 8.197 -15.3 1.0 24.41 22 A 6 -ATOM 340 N N . ASP A1 1 23 ? -6.748 5.426 -15.445 1.0 73.14 23 A 6 -ATOM 341 C CA . ASP A1 1 23 ? -5.331 5.595 -15.147 1.0 0.33 23 A 6 -ATOM 342 C C . ASP A1 1 23 ? -4.645 6.427 -16.226 1.0 62.12 23 A 6 -ATOM 343 O O . ASP A1 1 23 ? -5.164 6.578 -17.332 1.0 35.34 23 A 6 -ATOM 344 C CB . ASP A1 1 23 ? -4.647 4.232 -15.024 1.0 24.44 23 A 6 -ATOM 345 C CG . ASP A1 1 23 ? -5.462 3.248 -14.209 1.0 11.25 23 A 6 -ATOM 346 O OD1 . ASP A1 1 23 ? -6.436 2.687 -14.754 1.0 71.52 23 A 6 -ATOM 347 O OD2 . ASP A1 1 23 ? -5.125 3.036 -13.025 1.0 54.12 23 A 6 -ATOM 348 H H . ASP A1 1 23 ? -7.012 4.949 -16.26 1.0 71.31 23 A 6 -ATOM 349 H HA . ASP A1 1 23 ? -5.25 6.114 -14.204 1.0 62.03 23 A 6 -ATOM 350 H HB2 . ASP A1 1 23 ? -4.502 3.819 -16.012 1.0 75.32 23 A 6 -ATOM 351 H HB3 . ASP A1 1 23 ? -3.687 4.36 -14.547 1.0 32.1 23 A 6 -ATOM 352 N N . HIS A1 1 24 ? -3.475 6.965 -15.896 1.0 3.42 24 A 6 -ATOM 353 C CA . HIS A1 1 24 ? -2.717 7.782 -16.837 1.0 64.1 24 A 6 -ATOM 354 C C . HIS A1 1 24 ? -2.377 6.989 -18.095 1.0 13.22 24 A 6 -ATOM 355 O O . HIS A1 1 24 ? -2.035 7.562 -19.129 1.0 40.32 24 A 6 -ATOM 356 C CB . HIS A1 1 24 ? -1.434 8.296 -16.182 1.0 43.52 24 A 6 -ATOM 357 C CG . HIS A1 1 24 ? -0.441 7.216 -15.883 1.0 63.23 24 A 6 -ATOM 358 N ND1 . HIS A1 1 24 ? 0.411 6.692 -16.833 1.0 33.23 24 A 6 -ATOM 359 C CD2 . HIS A1 1 24 ? -0.164 6.561 -14.731 1.0 70.35 24 A 6 -ATOM 360 C CE1 . HIS A1 1 24 ? 1.166 5.761 -16.279 1.0 52.22 24 A 6 -ATOM 361 N NE2 . HIS A1 1 24 ? 0.838 5.663 -15.003 1.0 51.1 24 A 6 -ATOM 362 H H . HIS A1 1 24 ? -3.112 6.809 -15.0 1.0 35.01 24 A 6 -ATOM 363 H HA . HIS A1 1 24 ? -3.332 8.625 -17.114 1.0 52.33 24 A 6 -ATOM 364 H HB2 . HIS A1 1 24 ? -0.961 9.008 -16.842 1.0 74.33 24 A 6 -ATOM 365 H HB3 . HIS A1 1 24 ? -1.684 8.785 -15.252 1.0 2.24 24 A 6 -ATOM 366 H HD1 . HIS A1 1 24 ? 0.453 6.962 -17.774 1.0 61.24 24 A 6 -ATOM 367 H HD2 . HIS A1 1 24 ? -0.643 6.716 -13.774 1.0 14.35 24 A 6 -ATOM 368 H HE1 . HIS A1 1 24 ? 1.925 5.18 -16.782 1.0 73.24 24 A 6 -ATOM 369 N N . ALA A1 1 25 ? -2.473 5.667 -17.999 1.0 63.43 25 A 6 -ATOM 370 C CA . ALA A1 1 25 ? -2.177 4.795 -19.129 1.0 43.32 25 A 6 -ATOM 371 C C . ALA A1 1 25 ? -3.424 4.546 -19.971 1.0 33.54 25 A 6 -ATOM 372 O O . ALA A1 1 25 ? -3.405 3.739 -20.902 1.0 12.23 25 A 6 -ATOM 373 C CB . ALA A1 1 25 ? -1.596 3.476 -18.64 1.0 51.34 25 A 6 -ATOM 374 H H . ALA A1 1 25 ? -2.751 5.268 -17.148 1.0 55.41 25 A 6 -ATOM 375 H HA . ALA A1 1 25 ? -1.433 5.283 -19.741 1.0 23.12 25 A 6 -ATOM 376 H HB1 . ALA A1 1 25 ? -2.275 3.025 -17.932 1.0 42.21 25 A 6 -ATOM 377 H HB2 . ALA A1 1 25 ? -1.456 2.812 -19.48 1.0 3.14 25 A 6 -ATOM 378 H HB3 . ALA A1 1 25 ? -0.645 3.658 -18.162 1.0 44.44 25 A 6 -ATOM 379 N N . ASP A1 1 26 ? -4.505 5.242 -19.639 1.0 53.31 26 A 6 -ATOM 380 C CA . ASP A1 1 26 ? -5.761 5.096 -20.366 1.0 71.32 26 A 6 -ATOM 381 C C . ASP A1 1 26 ? -6.112 6.382 -21.107 1.0 31.24 26 A 6 -ATOM 382 O O . ASP A1 1 26 ? -6.27 7.44 -20.497 1.0 53.43 26 A 6 -ATOM 383 C CB . ASP A1 1 26 ? -6.891 4.722 -19.404 1.0 21.1 26 A 6 -ATOM 384 C CG . ASP A1 1 26 ? -6.652 3.389 -18.722 1.0 73.54 26 A 6 -ATOM 385 O OD1 . ASP A1 1 26 ? -5.665 3.278 -17.964 1.0 73.22 26 A 6 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.453 2.458 -18.944 1.0 2.02 26 A 6 -ATOM 387 H H . ASP A1 1 26 ? -4.457 5.869 -18.887 1.0 73.33 26 A 6 -ATOM 388 H HA . ASP A1 1 26 ? -5.637 4.302 -21.087 1.0 35.3 26 A 6 -ATOM 389 H HB2 . ASP A1 1 26 ? -6.975 5.485 -18.644 1.0 71.15 26 A 6 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.818 4.664 -19.955 1.0 51.4 26 A 6 -ATOM 391 N N . THR A1 1 27 ? -6.233 6.284 -22.427 1.0 11.22 27 A 6 -ATOM 392 C CA . THR A1 1 27 ? -6.563 7.439 -23.253 1.0 12.11 27 A 6 -ATOM 393 C C . THR A1 1 27 ? -8.066 7.69 -23.272 1.0 24.55 27 A 6 -ATOM 394 O O . THR A1 1 27 ? -8.85 6.861 -22.807 1.0 14.34 27 A 6 -ATOM 395 C CB . THR A1 1 27 ? -6.066 7.256 -24.699 1.0 24.42 27 A 6 -ATOM 396 O OG1 . THR A1 1 27 ? -6.13 5.874 -25.068 1.0 51.41 27 A 6 -ATOM 397 C CG2 . THR A1 1 27 ? -4.639 7.761 -24.849 1.0 72.22 27 A 6 -ATOM 398 H H . THR A1 1 27 ? -6.095 5.413 -22.855 1.0 1.33 27 A 6 -ATOM 399 H HA . THR A1 1 27 ? -6.069 8.302 -22.831 1.0 54.42 27 A 6 -ATOM 400 H HB . THR A1 1 27 ? -6.705 7.827 -25.358 1.0 51.23 27 A 6 -ATOM 401 H HG1 . THR A1 1 27 ? -6.002 5.79 -26.016 1.0 23.44 27 A 6 -ATOM 402 H HG21 . THR A1 1 27 ? -4.329 7.663 -25.878 1.0 20.21 27 A 6 -ATOM 403 H HG22 . THR A1 1 27 ? -3.983 7.178 -24.219 1.0 40.31 27 A 6 -ATOM 404 H HG23 . THR A1 1 27 ? -4.591 8.799 -24.556 1.0 53.14 27 A 6 -ATOM 405 N N . VAL A1 1 28 ? -8.464 8.837 -23.812 1.0 70.04 28 A 6 -ATOM 406 C CA . VAL A1 1 28 ? -9.874 9.196 -23.893 1.0 40.12 28 A 6 -ATOM 407 C C . VAL A1 1 28 ? -10.688 8.082 -24.542 1.0 43.3 28 A 6 -ATOM 408 O O . VAL A1 1 28 ? -11.737 7.689 -24.034 1.0 51.44 28 A 6 -ATOM 409 C CB . VAL A1 1 28 ? -10.078 10.497 -24.692 1.0 70.14 28 A 6 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.466 11.065 -24.443 1.0 13.41 28 A 6 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.004 11.514 -24.335 1.0 73.55 28 A 6 -ATOM 412 H H . VAL A1 1 28 ? -7.792 9.457 -24.165 1.0 50.23 28 A 6 -ATOM 413 H HA . VAL A1 1 28 ? -10.237 9.355 -22.888 1.0 62.42 28 A 6 -ATOM 414 H HB . VAL A1 1 28 ? -9.99 10.267 -25.744 1.0 52.41 28 A 6 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.488 11.553 -23.48 1.0 72.32 28 A 6 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.707 11.781 -25.216 1.0 75.12 28 A 6 -ATOM 417 H HG13 . VAL A1 1 28 ? -12.191 10.264 -24.456 1.0 43.12 28 A 6 -ATOM 418 H HG21 . VAL A1 1 28 ? -9.315 12.496 -24.66 1.0 22.23 28 A 6 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.857 11.519 -23.265 1.0 21.24 28 A 6 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.079 11.249 -24.825 1.0 51.43 28 A 6 -ATOM 421 N N . GLY A1 1 29 ? -10.197 7.576 -25.669 1.0 51.02 29 A 6 -ATOM 422 C CA . GLY A1 1 29 ? -10.891 6.512 -26.369 1.0 24.21 29 A 6 -ATOM 423 C C . GLY A1 1 29 ? -11.347 5.406 -25.438 1.0 62.32 29 A 6 -ATOM 424 O O . GLY A1 1 29 ? -12.513 5.015 -25.453 1.0 1.41 29 A 6 -ATOM 425 H H . GLY A1 1 29 ? -9.355 7.929 -26.028 1.0 25.44 29 A 6 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.753 6.927 -26.869 1.0 33.14 29 A 6 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.226 6.091 -27.11 1.0 61.11 29 A 6 -ATOM 428 N N . ALA A1 1 30 ? -10.424 4.9 -24.626 1.0 0.3 30 A 6 -ATOM 429 C CA . ALA A1 1 30 ? -10.738 3.834 -23.683 1.0 24.42 30 A 6 -ATOM 430 C C . ALA A1 1 30 ? -11.807 4.276 -22.69 1.0 23.15 30 A 6 -ATOM 431 O O . ALA A1 1 30 ? -12.662 3.486 -22.29 1.0 23.32 30 A 6 -ATOM 432 C CB . ALA A1 1 30 ? -9.482 3.393 -22.948 1.0 4.23 30 A 6 -ATOM 433 H H . ALA A1 1 30 ? -9.511 5.254 -24.661 1.0 13.0 30 A 6 -ATOM 434 H HA . ALA A1 1 30 ? -11.111 2.99 -24.246 1.0 42.35 30 A 6 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.748 2.692 -22.17 1.0 24.3 30 A 6 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.805 2.919 -23.643 1.0 15.25 30 A 6 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.002 4.254 -22.508 1.0 54.13 30 A 6 -ATOM 438 N N . VAL A1 1 31 ? -11.753 5.544 -22.295 1.0 44.02 31 A 6 -ATOM 439 C CA . VAL A1 1 31 ? -12.717 6.091 -21.348 1.0 44.43 31 A 6 -ATOM 440 C C . VAL A1 1 31 ? -14.127 6.078 -21.929 1.0 22.33 31 A 6 -ATOM 441 O O . VAL A1 1 31 ? -15.083 5.687 -21.258 1.0 41.34 31 A 6 -ATOM 442 C CB . VAL A1 1 31 ? -12.353 7.533 -20.947 1.0 42.01 31 A 6 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.461 8.15 -20.106 1.0 61.22 31 A 6 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.028 7.56 -20.2 1.0 34.2 31 A 6 -ATOM 445 H H . VAL A1 1 31 ? -11.048 6.125 -22.649 1.0 33.11 31 A 6 -ATOM 446 H HA . VAL A1 1 31 ? -12.698 5.477 -20.459 1.0 53.53 31 A 6 -ATOM 447 H HB . VAL A1 1 31 ? -12.247 8.12 -21.847 1.0 34.14 31 A 6 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.157 7.379 -19.808 1.0 24.43 31 A 6 -ATOM 449 H HG12 . VAL A1 1 31 ? -13.033 8.61 -19.227 1.0 62.24 31 A 6 -ATOM 450 H HG13 . VAL A1 1 31 ? -13.98 8.897 -20.687 1.0 4.44 31 A 6 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.234 7.819 -20.884 1.0 32.4 31 A 6 -ATOM 452 H HG22 . VAL A1 1 31 ? -11.076 8.293 -19.409 1.0 31.51 31 A 6 -ATOM 453 H HG23 . VAL A1 1 31 ? -10.834 6.585 -19.776 1.0 2.41 31 A 6 -ATOM 454 N N . LYS A1 1 32 ? -14.249 6.506 -23.181 1.0 44.33 32 A 6 -ATOM 455 C CA . LYS A1 1 32 ? -15.541 6.541 -23.855 1.0 33.41 32 A 6 -ATOM 456 C C . LYS A1 1 32 ? -16.206 5.169 -23.831 1.0 33.52 32 A 6 -ATOM 457 O O . LYS A1 1 32 ? -17.407 5.054 -23.59 1.0 55.22 32 A 6 -ATOM 458 C CB . LYS A1 1 32 ? -15.372 7.013 -25.301 1.0 21.43 32 A 6 -ATOM 459 C CG . LYS A1 1 32 ? -15.938 8.399 -25.558 1.0 62.04 32 A 6 -ATOM 460 C CD . LYS A1 1 32 ? -14.84 9.447 -25.624 1.0 13.3 32 A 6 -ATOM 461 C CE . LYS A1 1 32 ? -14.545 9.856 -27.059 1.0 61.02 32 A 6 -ATOM 462 N NZ . LYS A1 1 32 ? -14.311 8.676 -27.936 1.0 10.13 32 A 6 -ATOM 463 H H . LYS A1 1 32 ? -13.449 6.804 -23.664 1.0 0.43 32 A 6 -ATOM 464 H HA . LYS A1 1 32 ? -16.171 7.242 -23.328 1.0 20.21 32 A 6 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.32 7.026 -25.542 1.0 31.13 32 A 6 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.874 6.315 -25.955 1.0 51.43 32 A 6 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.47 8.392 -26.498 1.0 34.55 32 A 6 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.619 8.654 -24.759 1.0 75.31 32 A 6 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.152 10.319 -25.07 1.0 62.53 32 A 6 -ATOM 470 H HD3 . LYS A1 1 32 ? -13.94 9.041 -25.183 1.0 34.24 32 A 6 -ATOM 471 H HE2 . LYS A1 1 32 ? -15.386 10.415 -27.44 1.0 32.35 32 A 6 -ATOM 472 H HE3 . LYS A1 1 32 ? -13.664 10.481 -27.067 1.0 31.14 32 A 6 -ATOM 473 H HZ1 . LYS A1 1 32 ? -15.219 8.271 -28.241 1.0 3.34 32 A 6 -ATOM 474 H HZ2 . LYS A1 1 32 ? -13.775 7.948 -27.42 1.0 11.13 32 A 6 -ATOM 475 H HZ3 . LYS A1 1 32 ? -13.768 8.958 -28.777 1.0 13.55 32 A 6 -ATOM 476 N N . ALA A1 1 33 ? -15.415 4.13 -24.081 1.0 34.21 33 A 6 -ATOM 477 C CA . ALA A1 1 33 ? -15.927 2.765 -24.084 1.0 60.31 33 A 6 -ATOM 478 C C . ALA A1 1 33 ? -16.436 2.365 -22.704 1.0 31.03 33 A 6 -ATOM 479 O O . ALA A1 1 33 ? -17.474 1.716 -22.577 1.0 31.32 33 A 6 -ATOM 480 C CB . ALA A1 1 33 ? -14.848 1.798 -24.551 1.0 54.24 33 A 6 -ATOM 481 H H . ALA A1 1 33 ? -14.466 4.285 -24.266 1.0 43.1 33 A 6 -ATOM 482 H HA . ALA A1 1 33 ? -16.746 2.717 -24.787 1.0 53.01 33 A 6 -ATOM 483 H HB1 . ALA A1 1 33 ? -13.948 1.96 -23.976 1.0 2.33 33 A 6 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.189 0.783 -24.41 1.0 61.23 33 A 6 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.642 1.967 -25.598 1.0 53.23 33 A 6 -ATOM 486 N N . LYS A1 1 34 ? -15.698 2.757 -21.67 1.0 30.14 34 A 6 -ATOM 487 C CA . LYS A1 1 34 ? -16.074 2.441 -20.297 1.0 3.41 34 A 6 -ATOM 488 C C . LYS A1 1 34 ? -17.442 3.026 -19.96 1.0 51.04 34 A 6 -ATOM 489 O O . LYS A1 1 34 ? -18.252 2.386 -19.289 1.0 30.3 34 A 6 -ATOM 490 C CB . LYS A1 1 34 ? -15.024 2.978 -19.322 1.0 63.02 34 A 6 -ATOM 491 C CG . LYS A1 1 34 ? -15.301 2.621 -17.872 1.0 24.43 34 A 6 -ATOM 492 C CD . LYS A1 1 34 ? -15.192 1.124 -17.636 1.0 44.42 34 A 6 -ATOM 493 C CE . LYS A1 1 34 ? -13.771 0.628 -17.854 1.0 34.12 34 A 6 -ATOM 494 N NZ . LYS A1 1 34 ? -13.443 -0.523 -16.968 1.0 13.0 34 A 6 -ATOM 495 H H . LYS A1 1 34 ? -14.881 3.273 -21.835 1.0 65.25 34 A 6 -ATOM 496 H HA . LYS A1 1 34 ? -16.123 1.367 -20.206 1.0 3.22 34 A 6 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.059 2.574 -19.593 1.0 71.03 34 A 6 -ATOM 498 H HB3 . LYS A1 1 34 ? -14.989 4.055 -19.406 1.0 71.12 34 A 6 -ATOM 499 H HG2 . LYS A1 1 34 ? -14.585 3.127 -17.243 1.0 24.23 34 A 6 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.3 2.945 -17.616 1.0 22.21 34 A 6 -ATOM 501 H HD2 . LYS A1 1 34 ? -15.484 0.907 -16.619 1.0 63.43 34 A 6 -ATOM 502 H HD3 . LYS A1 1 34 ? -15.853 0.611 -18.32 1.0 75.33 34 A 6 -ATOM 503 H HE2 . LYS A1 1 34 ? -13.666 0.32 -18.883 1.0 34.14 34 A 6 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.086 1.436 -17.649 1.0 0.12 34 A 6 -ATOM 505 H HZ1 . LYS A1 1 34 ? -14.206 -1.229 -17.002 1.0 62.42 34 A 6 -ATOM 506 H HZ2 . LYS A1 1 34 ? -13.33 -0.197 -15.987 1.0 14.2 34 A 6 -ATOM 507 H HZ3 . LYS A1 1 34 ? -12.557 -0.971 -17.277 1.0 65.2 34 A 6 -ATOM 508 N N . ILE A1 1 35 ? -17.692 4.243 -20.43 1.0 14.42 35 A 6 -ATOM 509 C CA . ILE A1 1 35 ? -18.963 4.912 -20.179 1.0 22.32 35 A 6 -ATOM 510 C C . ILE A1 1 35 ? -20.1 4.233 -20.936 1.0 74.31 35 A 6 -ATOM 511 O O . ILE A1 1 35 ? -21.224 4.145 -20.44 1.0 33.23 35 A 6 -ATOM 512 C CB . ILE A1 1 35 ? -18.907 6.397 -20.584 1.0 42.5 35 A 6 -ATOM 513 C CG1 . ILE A1 1 35 ? -17.757 7.102 -19.862 1.0 22.04 35 A 6 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.231 7.08 -20.274 1.0 45.14 35 A 6 -ATOM 515 C CD1 . ILE A1 1 35 ? -17.863 7.043 -18.355 1.0 11.1 35 A 6 -ATOM 516 H H . ILE A1 1 35 ? -17.007 4.702 -20.958 1.0 54.44 35 A 6 -ATOM 517 H HA . ILE A1 1 35 ? -19.166 4.856 -19.119 1.0 30.01 35 A 6 -ATOM 518 H HB . ILE A1 1 35 ? -18.742 6.451 -21.649 1.0 2.44 35 A 6 -ATOM 519 H HG12 . ILE A1 1 35 ? -16.825 6.639 -20.147 1.0 3.24 35 A 6 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.742 8.142 -20.155 1.0 0.11 35 A 6 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.072 7.856 -19.54 1.0 65.32 35 A 6 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.63 7.517 -21.178 1.0 43.1 35 A 6 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.929 6.354 -19.886 1.0 75.41 35 A 6 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.327 7.877 -17.924 1.0 43.52 35 A 6 -ATOM 525 H HD12 . ILE A1 1 35 ? -18.901 7.096 -18.064 1.0 71.15 35 A 6 -ATOM 526 H HD13 . ILE A1 1 35 ? -17.435 6.119 -17.998 1.0 74.3 35 A 6 -ATOM 527 N N . TYR A1 1 36 ? -19.8 3.753 -22.137 1.0 62.53 36 A 6 -ATOM 528 C CA . TYR A1 1 36 ? -20.797 3.082 -22.963 1.0 64.44 36 A 6 -ATOM 529 C C . TYR A1 1 36 ? -21.414 1.901 -22.22 1.0 53.42 36 A 6 -ATOM 530 O O . TYR A1 1 36 ? -22.63 1.713 -22.231 1.0 34.33 36 A 6 -ATOM 531 C CB . TYR A1 1 36 ? -20.167 2.603 -24.272 1.0 74.42 36 A 6 -ATOM 532 C CG . TYR A1 1 36 ? -20.506 1.171 -24.619 1.0 43.51 36 A 6 -ATOM 533 C CD1 . TYR A1 1 36 ? -21.768 0.83 -25.089 1.0 62.31 36 A 6 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.565 0.159 -24.475 1.0 22.21 36 A 6 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.083 -0.477 -25.407 1.0 25.24 36 A 6 -ATOM 536 C CE2 . TYR A1 1 36 ? -19.87 -1.151 -24.792 1.0 24.41 36 A 6 -ATOM 537 C CZ . TYR A1 1 36 ? -21.13 -1.464 -25.257 1.0 51.0 36 A 6 -ATOM 538 O OH . TYR A1 1 36 ? -21.439 -2.767 -25.572 1.0 31.41 36 A 6 -ATOM 539 H H . TYR A1 1 36 ? -18.887 3.854 -22.478 1.0 42.53 36 A 6 -ATOM 540 H HA . TYR A1 1 36 ? -21.575 3.796 -23.19 1.0 45.34 36 A 6 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.511 3.23 -25.08 1.0 32.41 36 A 6 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.092 2.681 -24.195 1.0 73.31 36 A 6 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.512 1.605 -25.206 1.0 14.41 36 A 6 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.579 0.408 -24.11 1.0 73.43 36 A 6 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.069 -0.723 -25.771 1.0 30.0 36 A 6 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.125 -1.923 -24.674 1.0 11.1 36 A 6 -ATOM 547 H HH . TYR A1 1 36 ? -20.86 -3.359 -25.086 1.0 20.21 36 A 6 -ATOM 548 N N . ASP A1 1 37 ? -20.565 1.107 -21.576 1.0 31.31 37 A 6 -ATOM 549 C CA . ASP A1 1 37 ? -21.025 -0.056 -20.826 1.0 4.3 37 A 6 -ATOM 550 C C . ASP A1 1 37 ? -21.671 0.367 -19.51 1.0 30.32 37 A 6 -ATOM 551 O O . ASP A1 1 37 ? -22.613 -0.269 -19.036 1.0 62.0 37 A 6 -ATOM 552 C CB . ASP A1 1 37 ? -19.859 -1.007 -20.553 1.0 35.43 37 A 6 -ATOM 553 C CG . ASP A1 1 37 ? -20.303 -2.452 -20.444 1.0 34.32 37 A 6 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.073 -2.767 -19.513 1.0 31.12 37 A 6 -ATOM 555 O OD2 . ASP A1 1 37 ? -19.881 -3.268 -21.29 1.0 3.2 37 A 6 -ATOM 556 H H . ASP A1 1 37 ? -19.606 1.309 -21.605 1.0 51.42 37 A 6 -ATOM 557 H HA . ASP A1 1 37 ? -21.762 -0.568 -21.426 1.0 32.24 37 A 6 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.143 -0.929 -21.358 1.0 43.14 37 A 6 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.382 -0.725 -19.625 1.0 34.23 37 A 6 -ATOM 560 N N . LYS A1 1 38 ? -21.159 1.444 -18.924 1.0 33.03 38 A 6 -ATOM 561 C CA . LYS A1 1 38 ? -21.685 1.953 -17.664 1.0 33.5 38 A 6 -ATOM 562 C C . LYS A1 1 38 ? -23.177 2.251 -17.777 1.0 62.1 38 A 6 -ATOM 563 O O . LYS A1 1 38 ? -23.966 1.844 -16.926 1.0 13.24 38 A 6 -ATOM 564 C CB . LYS A1 1 38 ? -20.932 3.219 -17.247 1.0 32.13 38 A 6 -ATOM 565 C CG . LYS A1 1 38 ? -20.113 3.05 -15.979 1.0 11.13 38 A 6 -ATOM 566 C CD . LYS A1 1 38 ? -18.648 2.796 -16.292 1.0 55.11 38 A 6 -ATOM 567 C CE . LYS A1 1 38 ? -18.368 1.313 -16.484 1.0 12.13 38 A 6 -ATOM 568 N NZ . LYS A1 1 38 ? -17.621 0.736 -15.332 1.0 62.42 38 A 6 -ATOM 569 H H . LYS A1 1 38 ? -20.408 1.909 -19.351 1.0 40.1 38 A 6 -ATOM 570 H HA . LYS A1 1 38 ? -21.538 1.193 -16.912 1.0 13.43 38 A 6 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.265 3.506 -18.046 1.0 53.44 38 A 6 -ATOM 572 H HB3 . LYS A1 1 38 ? -21.648 4.012 -17.085 1.0 74.35 38 A 6 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.193 3.949 -15.387 1.0 72.35 38 A 6 -ATOM 574 H HG3 . LYS A1 1 38 ? -20.503 2.211 -15.419 1.0 65.33 38 A 6 -ATOM 575 H HD2 . LYS A1 1 38 ? -18.386 3.32 -17.199 1.0 31.44 38 A 6 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.045 3.164 -15.474 1.0 51.13 38 A 6 -ATOM 577 H HE2 . LYS A1 1 38 ? -19.308 0.793 -16.59 1.0 72.24 38 A 6 -ATOM 578 H HE3 . LYS A1 1 38 ? -17.782 1.185 -17.383 1.0 52.14 38 A 6 -ATOM 579 H HZ1 . LYS A1 1 38 ? -17.248 -0.202 -15.582 1.0 12.21 38 A 6 -ATOM 580 H HZ2 . LYS A1 1 38 ? -18.252 0.639 -14.51 1.0 31.3 38 A 6 -ATOM 581 H HZ3 . LYS A1 1 38 ? -16.827 1.356 -15.074 1.0 72.13 38 A 6 -ATOM 582 N N . GLU A1 1 39 ? -23.555 2.962 -18.835 1.0 74.33 39 A 6 -ATOM 583 C CA . GLU A1 1 39 ? -24.953 3.312 -19.059 1.0 31.43 39 A 6 -ATOM 584 C C . GLU A1 1 39 ? -25.566 2.436 -20.148 1.0 55.55 39 A 6 -ATOM 585 O O . GLU A1 1 39 ? -26.572 1.764 -19.926 1.0 44.25 39 A 6 -ATOM 586 C CB . GLU A1 1 39 ? -25.076 4.787 -19.447 1.0 31.12 39 A 6 -ATOM 587 C CG . GLU A1 1 39 ? -23.879 5.627 -19.035 1.0 22.34 39 A 6 -ATOM 588 C CD . GLU A1 1 39 ? -23.763 5.781 -17.531 1.0 34.02 39 A 6 -ATOM 589 O OE1 . GLU A1 1 39 ? -23.936 4.772 -16.816 1.0 60.52 39 A 6 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.501 6.911 -17.069 1.0 24.54 39 A 6 -ATOM 591 H H . GLU A1 1 39 ? -22.879 3.258 -19.48 1.0 53.12 39 A 6 -ATOM 592 H HA . GLU A1 1 39 ? -25.488 3.146 -18.137 1.0 24.23 39 A 6 -ATOM 593 H HB2 . GLU A1 1 39 ? -25.188 4.857 -20.519 1.0 13.32 39 A 6 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.956 5.198 -18.975 1.0 53.15 39 A 6 -ATOM 595 H HG2 . GLU A1 1 39 ? -22.98 5.154 -19.403 1.0 73.51 39 A 6 -ATOM 596 H HG3 . GLU A1 1 39 ? -23.974 6.608 -19.477 1.0 55.55 39 A 6 -ATOM 597 N N . GLY A1 1 40 ? -24.951 2.45 -21.327 1.0 41.31 40 A 6 -ATOM 598 C CA . GLY A1 1 40 ? -25.449 1.654 -22.433 1.0 23.2 40 A 6 -ATOM 599 C C . GLY A1 1 40 ? -25.756 2.492 -23.658 1.0 54.31 40 A 6 -ATOM 600 O O . GLY A1 1 40 ? -26.808 2.335 -24.278 1.0 62.35 40 A 6 -ATOM 601 H H . GLY A1 1 40 ? -24.152 3.005 -21.446 1.0 1.31 40 A 6 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.708 0.913 -22.692 1.0 42.33 40 A 6 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.353 1.15 -22.121 1.0 42.25 40 A 6 -ATOM 604 N N . ILE A1 1 41 ? -24.836 3.384 -24.008 1.0 11.45 41 A 6 -ATOM 605 C CA . ILE A1 1 41 ? -25.014 4.25 -25.167 1.0 13.21 41 A 6 -ATOM 606 C C . ILE A1 1 41 ? -23.796 4.199 -26.084 1.0 73.14 41 A 6 -ATOM 607 O O . ILE A1 1 41 ? -22.696 3.828 -25.675 1.0 54.03 41 A 6 -ATOM 608 C CB . ILE A1 1 41 ? -25.263 5.711 -24.745 1.0 13.54 41 A 6 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.421 6.061 -23.517 1.0 35.25 41 A 6 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.741 5.935 -24.462 1.0 15.54 41 A 6 -ATOM 611 C CD1 . ILE A1 1 41 ? -24.551 7.506 -23.087 1.0 51.21 41 A 6 -ATOM 612 H H . ILE A1 1 41 ? -24.018 3.462 -23.474 1.0 10.31 41 A 6 -ATOM 613 H HA . ILE A1 1 41 ? -25.878 3.902 -25.713 1.0 22.4 41 A 6 -ATOM 614 H HB . ILE A1 1 41 ? -24.977 6.352 -25.564 1.0 2.22 41 A 6 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.727 5.441 -22.689 1.0 53.25 41 A 6 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.38 5.872 -23.738 1.0 73.21 41 A 6 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.928 5.811 -23.406 1.0 41.34 41 A 6 -ATOM 618 H HG22 . ILE A1 1 41 ? -27.017 6.935 -24.76 1.0 35.01 41 A 6 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.327 5.219 -25.018 1.0 24.24 41 A 6 -ATOM 620 H HD11 . ILE A1 1 41 ? -25.383 7.961 -23.604 1.0 13.35 41 A 6 -ATOM 621 H HD12 . ILE A1 1 41 ? -24.722 7.551 -22.022 1.0 5.02 41 A 6 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.643 8.037 -23.33 1.0 73.01 41 A 6 -ATOM 623 N N . PRO A1 1 42 ? -23.996 4.581 -27.354 1.0 42.01 42 A 6 -ATOM 624 C CA . PRO A1 1 42 ? -22.925 4.59 -28.355 1.0 63.34 42 A 6 -ATOM 625 C C . PRO A1 1 42 ? -21.89 5.676 -28.088 1.0 4.23 42 A 6 -ATOM 626 O O . PRO A1 1 42 ? -22.198 6.868 -28.059 1.0 21.54 42 A 6 -ATOM 627 C CB . PRO A1 1 42 ? -23.667 4.868 -29.665 1.0 63.45 42 A 6 -ATOM 628 C CG . PRO A1 1 42 ? -24.902 5.593 -29.254 1.0 31.23 42 A 6 -ATOM 629 C CD . PRO A1 1 42 ? -25.282 5.035 -27.91 1.0 52.22 42 A 6 -ATOM 630 H HA . PRO A1 1 42 ? -22.432 3.631 -28.416 1.0 60.32 42 A 6 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.048 5.476 -30.31 1.0 50.23 42 A 6 -ATOM 632 H HB3 . PRO A1 1 42 ? -23.901 3.936 -30.156 1.0 64.01 42 A 6 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.7 6.65 -29.177 1.0 0.11 42 A 6 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.69 5.411 -29.97 1.0 1.1 42 A 6 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.719 5.805 -27.292 1.0 11.32 42 A 6 -ATOM 636 H HD3 . PRO A1 1 42 ? -25.965 4.207 -28.024 1.0 34.03 42 A 6 -ATOM 637 N N . PRO A1 1 43 ? -20.631 5.259 -27.887 1.0 1.41 43 A 6 -ATOM 638 C CA . PRO A1 1 43 ? -19.524 6.182 -27.619 1.0 62.53 43 A 6 -ATOM 639 C C . PRO A1 1 43 ? -19.157 7.017 -28.841 1.0 21.35 43 A 6 -ATOM 640 O O . PRO A1 1 43 ? -18.964 8.229 -28.742 1.0 73.42 43 A 6 -ATOM 641 C CB . PRO A1 1 43 ? -18.37 5.251 -27.24 1.0 74.43 43 A 6 -ATOM 642 C CG . PRO A1 1 43 ? -18.691 3.958 -27.907 1.0 42.11 43 A 6 -ATOM 643 C CD . PRO A1 1 43 ? -20.191 3.854 -27.906 1.0 32.53 43 A 6 -ATOM 644 H HA . PRO A1 1 43 ? -19.747 6.838 -26.79 1.0 3.1 43 A 6 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.438 5.663 -27.602 1.0 1.2 43 A 6 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.328 5.142 -26.167 1.0 52.2 43 A 6 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.316 3.964 -28.919 1.0 21.5 43 A 6 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.259 3.141 -27.349 1.0 41.32 43 A 6 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.535 3.355 -28.8 1.0 55.24 43 A 6 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.533 3.332 -27.025 1.0 31.14 43 A 6 -ATOM 651 N N . ASP A1 1 44 ? -19.061 6.361 -29.992 1.0 54.12 44 A 6 -ATOM 652 C CA . ASP A1 1 44 ? -18.718 7.043 -31.235 1.0 51.34 44 A 6 -ATOM 653 C C . ASP A1 1 44 ? -19.763 8.099 -31.581 1.0 65.34 44 A 6 -ATOM 654 O O . ASP A1 1 44 ? -19.509 8.995 -32.387 1.0 41.23 44 A 6 -ATOM 655 C CB . ASP A1 1 44 ? -18.596 6.035 -32.378 1.0 23.35 44 A 6 -ATOM 656 C CG . ASP A1 1 44 ? -17.721 6.542 -33.507 1.0 52.14 44 A 6 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.86 7.408 -33.246 1.0 70.43 44 A 6 -ATOM 658 O OD2 . ASP A1 1 44 ? -17.897 6.075 -34.652 1.0 15.14 44 A 6 -ATOM 659 H H . ASP A1 1 44 ? -19.227 5.395 -30.007 1.0 64.31 44 A 6 -ATOM 660 H HA . ASP A1 1 44 ? -17.765 7.53 -31.093 1.0 72.42 44 A 6 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.166 5.119 -31.998 1.0 64.21 44 A 6 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.58 5.828 -32.774 1.0 74.33 44 A 6 -ATOM 663 N N . GLN A1 1 45 ? -20.936 7.987 -30.967 1.0 24.51 45 A 6 -ATOM 664 C CA . GLN A1 1 45 ? -22.019 8.932 -31.213 1.0 55.1 45 A 6 -ATOM 665 C C . GLN A1 1 45 ? -21.949 10.105 -30.24 1.0 65.33 45 A 6 -ATOM 666 O O . GLN A1 1 45 ? -22.631 11.114 -30.421 1.0 0.12 45 A 6 -ATOM 667 C CB . GLN A1 1 45 ? -23.374 8.232 -31.089 1.0 3.33 45 A 6 -ATOM 668 C CG . GLN A1 1 45 ? -23.844 7.585 -32.381 1.0 71.05 45 A 6 -ATOM 669 C CD . GLN A1 1 45 ? -25.009 6.638 -32.17 1.0 50.21 45 A 6 -ATOM 670 O OE1 . GLN A1 1 45 ? -26.056 7.029 -31.652 1.0 30.33 45 A 6 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.834 5.384 -32.569 1.0 54.11 45 A 6 -ATOM 672 H H . GLN A1 1 45 ? -21.077 7.252 -30.336 1.0 33.14 45 A 6 -ATOM 673 H HA . GLN A1 1 45 ? -21.91 9.308 -32.219 1.0 54.13 45 A 6 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.301 7.465 -30.333 1.0 72.22 45 A 6 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.114 8.957 -30.785 1.0 51.24 45 A 6 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.151 8.361 -33.067 1.0 11.31 45 A 6 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.023 7.031 -32.811 1.0 33.23 45 A 6 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.973 5.143 -32.972 1.0 35.4 45 A 6 -ATOM 679 H HE22 . GLN A1 1 45 ? -25.57 4.751 -32.444 1.0 53.4 45 A 6 -ATOM 680 N N . GLN A1 1 46 ? -21.122 9.964 -29.21 1.0 5.34 46 A 6 -ATOM 681 C CA . GLN A1 1 46 ? -20.965 11.012 -28.208 1.0 54.21 46 A 6 -ATOM 682 C C . GLN A1 1 46 ? -19.537 11.548 -28.2 1.0 23.33 46 A 6 -ATOM 683 O O . GLN A1 1 46 ? -18.598 10.846 -28.579 1.0 42.0 46 A 6 -ATOM 684 C CB . GLN A1 1 46 ? -21.33 10.481 -26.821 1.0 54.1 46 A 6 -ATOM 685 C CG . GLN A1 1 46 ? -20.554 9.236 -26.423 1.0 63.33 46 A 6 -ATOM 686 C CD . GLN A1 1 46 ? -20.509 9.032 -24.921 1.0 73.34 46 A 6 -ATOM 687 O OE1 . GLN A1 1 46 ? -21.546 8.981 -24.259 1.0 62.34 46 A 6 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.304 8.915 -24.375 1.0 52.51 46 A 6 -ATOM 689 H H . GLN A1 1 46 ? -20.606 9.136 -29.12 1.0 61.13 46 A 6 -ATOM 690 H HA . GLN A1 1 46 ? -21.636 11.818 -28.463 1.0 1.54 46 A 6 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.134 11.251 -26.09 1.0 70.34 46 A 6 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.383 10.241 -26.807 1.0 24.41 46 A 6 -ATOM 693 H HG2 . GLN A1 1 46 ? -21.023 8.374 -26.873 1.0 71.34 46 A 6 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.542 9.326 -26.789 1.0 12.44 46 A 6 -ATOM 695 H HE21 . GLN A1 1 46 ? -18.522 8.967 -24.964 1.0 61.21 46 A 6 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.246 8.783 -23.406 1.0 54.41 46 A 6 -ATOM 697 N N . ARG A1 1 47 ? -19.38 12.794 -27.768 1.0 11.31 47 A 6 -ATOM 698 C CA . ARG A1 1 47 ? -18.066 13.424 -27.712 1.0 74.42 47 A 6 -ATOM 699 C C . ARG A1 1 47 ? -17.878 14.174 -26.397 1.0 0.05 47 A 6 -ATOM 700 O O . ARG A1 1 47 ? -18.842 14.439 -25.677 1.0 62.43 47 A 6 -ATOM 701 C CB . ARG A1 1 47 ? -17.888 14.385 -28.889 1.0 53.24 47 A 6 -ATOM 702 C CG . ARG A1 1 47 ? -18.192 13.757 -30.24 1.0 25.13 47 A 6 -ATOM 703 C CD . ARG A1 1 47 ? -18.32 14.811 -31.328 1.0 74.31 47 A 6 -ATOM 704 N NE . ARG A1 1 47 ? -19.698 15.266 -31.491 1.0 72.02 47 A 6 -ATOM 705 C CZ . ARG A1 1 47 ? -20.045 16.308 -32.239 1.0 4.33 47 A 6 -ATOM 706 N NH1 . ARG A1 1 47 ? -19.119 16.998 -32.889 1.0 22.33 47 A 6 -ATOM 707 N NH2 . ARG A1 1 47 ? -21.32 16.66 -32.337 1.0 24.44 47 A 6 -ATOM 708 H H . ARG A1 1 47 ? -20.166 13.303 -27.48 1.0 14.32 47 A 6 -ATOM 709 H HA . ARG A1 1 47 ? -17.321 12.645 -27.779 1.0 52.1 47 A 6 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.547 15.229 -28.753 1.0 12.43 47 A 6 -ATOM 711 H HB3 . ARG A1 1 47 ? -16.866 14.735 -28.901 1.0 31.22 47 A 6 -ATOM 712 H HG2 . ARG A1 1 47 ? -17.391 13.082 -30.501 1.0 2.15 47 A 6 -ATOM 713 H HG3 . ARG A1 1 47 ? -19.119 13.209 -30.17 1.0 3.22 47 A 6 -ATOM 714 H HD2 . ARG A1 1 47 ? -17.701 15.657 -31.067 1.0 62.34 47 A 6 -ATOM 715 H HD3 . ARG A1 1 47 ? -17.977 14.389 -32.261 1.0 4.32 47 A 6 -ATOM 716 H HE . ARG A1 1 47 ? -20.398 14.77 -31.019 1.0 51.12 47 A 6 -ATOM 717 H HH11 . ARG A1 1 47 ? -18.157 16.735 -32.818 1.0 35.02 47 A 6 -ATOM 718 H HH12 . ARG A1 1 47 ? -19.383 17.782 -33.453 1.0 42.25 47 A 6 -ATOM 719 H HH21 . ARG A1 1 47 ? -22.021 16.141 -31.848 1.0 32.54 47 A 6 -ATOM 720 H HH22 . ARG A1 1 47 ? -21.58 17.444 -32.9 1.0 51.04 47 A 6 -ATOM 721 N N . LEU A1 1 48 ? -16.631 14.513 -26.088 1.0 13.42 48 A 6 -ATOM 722 C CA . LEU A1 1 48 ? -16.315 15.232 -24.859 1.0 63.04 48 A 6 -ATOM 723 C C . LEU A1 1 48 ? -16.037 16.704 -25.145 1.0 70.54 48 A 6 -ATOM 724 O O . LEU A1 1 48 ? -15.493 17.05 -26.195 1.0 13.22 48 A 6 -ATOM 725 C CB . LEU A1 1 48 ? -15.106 14.597 -24.17 1.0 73.22 48 A 6 -ATOM 726 C CG . LEU A1 1 48 ? -14.989 13.077 -24.285 1.0 23.01 48 A 6 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.355 12.424 -24.139 1.0 2.23 48 A 6 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.35 12.69 -25.61 1.0 62.5 48 A 6 -ATOM 729 H H . LEU A1 1 48 ? -15.905 14.274 -26.701 1.0 13.1 48 A 6 -ATOM 730 H HA . LEU A1 1 48 ? -17.171 15.16 -24.204 1.0 5.14 48 A 6 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.216 15.03 -24.599 1.0 14.35 48 A 6 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.156 14.848 -23.12 1.0 62.22 48 A 6 -ATOM 733 H HG . LEU A1 1 48 ? -14.358 12.709 -23.488 1.0 74.12 48 A 6 -ATOM 734 H HD11 . LEU A1 1 48 ? -16.781 12.259 -25.117 1.0 72.12 48 A 6 -ATOM 735 H HD12 . LEU A1 1 48 ? -17.005 13.071 -23.569 1.0 51.52 48 A 6 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.25 11.479 -23.627 1.0 50.13 48 A 6 -ATOM 737 H HD21 . LEU A1 1 48 ? -13.721 13.497 -25.956 1.0 32.51 48 A 6 -ATOM 738 H HD22 . LEU A1 1 48 ? -15.123 12.497 -26.34 1.0 4.35 48 A 6 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.753 11.799 -25.475 1.0 44.23 48 A 6 -ATOM 740 N N . ILE A1 1 49 ? -16.411 17.565 -24.205 1.0 13.31 49 A 6 -ATOM 741 C CA . ILE A1 1 49 ? -16.198 18.999 -24.356 1.0 13.25 49 A 6 -ATOM 742 C C . ILE A1 1 49 ? -15.745 19.628 -23.043 1.0 73.24 49 A 6 -ATOM 743 O O . ILE A1 1 49 ? -16.413 19.5 -22.017 1.0 20.41 49 A 6 -ATOM 744 C CB . ILE A1 1 49 ? -17.476 19.71 -24.838 1.0 42.12 49 A 6 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.522 19.742 -26.367 1.0 21.4 49 A 6 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.544 21.121 -24.271 1.0 44.11 49 A 6 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.837 19.263 -26.942 1.0 30.32 49 A 6 -ATOM 748 H H . ILE A1 1 49 ? -16.839 17.228 -23.391 1.0 11.12 49 A 6 -ATOM 749 H HA . ILE A1 1 49 ? -15.427 19.146 -25.098 1.0 31.54 49 A 6 -ATOM 750 H HB . ILE A1 1 49 ? -18.329 19.16 -24.471 1.0 10.22 49 A 6 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.362 20.754 -26.705 1.0 52.53 49 A 6 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.738 19.108 -26.756 1.0 23.14 49 A 6 -ATOM 753 H HG21 . ILE A1 1 49 ? -17.833 21.077 -23.232 1.0 54.41 49 A 6 -ATOM 754 H HG22 . ILE A1 1 49 ? -16.574 21.588 -24.355 1.0 2.4 49 A 6 -ATOM 755 H HG23 . ILE A1 1 49 ? -18.271 21.697 -24.824 1.0 53.42 49 A 6 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.449 18.855 -26.15 1.0 43.14 49 A 6 -ATOM 757 H HD12 . ILE A1 1 49 ? -19.352 20.093 -27.403 1.0 61.33 49 A 6 -ATOM 758 H HD13 . ILE A1 1 49 ? -18.65 18.499 -27.681 1.0 3.14 49 A 6 -ATOM 759 N N . PHE A1 1 50 ? -14.605 20.311 -23.082 1.0 0.44 50 A 6 -ATOM 760 C CA . PHE A1 1 50 ? -14.062 20.962 -21.896 1.0 63.4 50 A 6 -ATOM 761 C C . PHE A1 1 50 ? -13.76 22.431 -22.172 1.0 34.31 50 A 6 -ATOM 762 O O . PHE A1 1 50 ? -13.02 22.761 -23.098 1.0 24.03 50 A 6 -ATOM 763 C CB . PHE A1 1 50 ? -12.792 20.246 -21.432 1.0 1.31 50 A 6 -ATOM 764 C CG . PHE A1 1 50 ? -12.409 20.562 -20.014 1.0 63.44 50 A 6 -ATOM 765 C CD1 . PHE A1 1 50 ? -11.849 21.787 -19.691 1.0 63.22 50 A 6 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.611 19.634 -19.006 1.0 31.12 50 A 6 -ATOM 767 C CE1 . PHE A1 1 50 ? -11.495 22.079 -18.387 1.0 44.05 50 A 6 -ATOM 768 C CE2 . PHE A1 1 50 ? -12.259 19.921 -17.7 1.0 53.14 50 A 6 -ATOM 769 C CZ . PHE A1 1 50 ? -11.702 21.146 -17.39 1.0 64.24 50 A 6 -ATOM 770 H H . PHE A1 1 50 ? -14.118 20.378 -23.93 1.0 32.43 50 A 6 -ATOM 771 H HA . PHE A1 1 50 ? -14.805 20.9 -21.116 1.0 55.42 50 A 6 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.941 19.179 -21.505 1.0 72.21 50 A 6 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.971 20.535 -22.071 1.0 52.42 50 A 6 -ATOM 774 H HD1 . PHE A1 1 50 ? -11.687 22.518 -20.469 1.0 64.41 50 A 6 -ATOM 775 H HD2 . PHE A1 1 50 ? -13.047 18.675 -19.247 1.0 25.0 50 A 6 -ATOM 776 H HE1 . PHE A1 1 50 ? -11.06 23.038 -18.147 1.0 33.34 50 A 6 -ATOM 777 H HE2 . PHE A1 1 50 ? -12.423 19.188 -16.923 1.0 34.14 50 A 6 -ATOM 778 H HZ . PHE A1 1 50 ? -11.426 21.372 -16.371 1.0 42.2 50 A 6 -ATOM 779 N N . GLY A1 1 51 ? -14.338 23.311 -21.36 1.0 53.44 51 A 6 -ATOM 780 C CA . GLY A1 1 51 ? -14.12 24.736 -21.533 1.0 33.5 51 A 6 -ATOM 781 C C . GLY A1 1 51 ? -14.716 25.261 -22.824 1.0 34.32 51 A 6 -ATOM 782 O O . GLY A1 1 51 ? -14.472 26.404 -23.209 1.0 0.02 51 A 6 -ATOM 783 H H . GLY A1 1 51 ? -14.918 22.991 -20.638 1.0 14.34 51 A 6 -ATOM 784 H HA2 . GLY A1 1 51 ? -14.566 25.261 -20.702 1.0 71.3 51 A 6 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.057 24.927 -21.538 1.0 2.33 51 A 6 -ATOM 786 N N . GLY A1 1 52 ? -15.5 24.424 -23.496 1.0 51.33 52 A 6 -ATOM 787 C CA . GLY A1 1 52 ? -16.119 24.828 -24.745 1.0 70.11 52 A 6 -ATOM 788 C C . GLY A1 1 52 ? -15.563 24.076 -25.938 1.0 64.35 52 A 6 -ATOM 789 O O . GLY A1 1 52 ? -16.265 23.856 -26.925 1.0 21.12 52 A 6 -ATOM 790 H H . GLY A1 1 52 ? -15.66 23.524 -23.141 1.0 52.33 52 A 6 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.182 24.647 -24.682 1.0 34.31 52 A 6 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.952 25.885 -24.891 1.0 33.12 52 A 6 -ATOM 793 N N . LYS A1 1 53 ? -14.298 23.681 -25.848 1.0 4.12 53 A 6 -ATOM 794 C CA . LYS A1 1 53 ? -13.646 22.949 -26.928 1.0 20.15 53 A 6 -ATOM 795 C C . LYS A1 1 53 ? -13.742 21.444 -26.701 1.0 12.34 53 A 6 -ATOM 796 O O . LYS A1 1 53 ? -13.732 20.978 -25.563 1.0 53.3 53 A 6 -ATOM 797 C CB . LYS A1 1 53 ? -12.178 23.366 -27.041 1.0 12.13 53 A 6 -ATOM 798 C CG . LYS A1 1 53 ? -11.412 23.252 -25.734 1.0 34.42 53 A 6 -ATOM 799 C CD . LYS A1 1 53 ? -10.759 21.888 -25.587 1.0 44.0 53 A 6 -ATOM 800 C CE . LYS A1 1 53 ? -9.688 21.666 -26.643 1.0 75.53 53 A 6 -ATOM 801 N NZ . LYS A1 1 53 ? -8.476 21.012 -26.076 1.0 61.53 53 A 6 -ATOM 802 H H . LYS A1 1 53 ? -13.79 23.885 -25.035 1.0 32.12 53 A 6 -ATOM 803 H HA . LYS A1 1 53 ? -14.153 23.196 -27.849 1.0 74.23 53 A 6 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.693 22.738 -27.774 1.0 34.02 53 A 6 -ATOM 805 H HB3 . LYS A1 1 53 ? -12.132 24.393 -27.372 1.0 32.22 53 A 6 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.643 24.011 -25.71 1.0 24.24 53 A 6 -ATOM 807 H HG3 . LYS A1 1 53 ? -12.096 23.405 -24.912 1.0 53.0 53 A 6 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.305 21.819 -24.61 1.0 22.42 53 A 6 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.517 21.124 -25.688 1.0 0.05 53 A 6 -ATOM 810 H HE2 . LYS A1 1 53 ? -10.093 21.038 -27.422 1.0 25.2 53 A 6 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.409 22.622 -27.061 1.0 75.24 53 A 6 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.837 21.729 -25.677 1.0 1.33 53 A 6 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.972 20.488 -26.819 1.0 14.14 53 A 6 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.748 20.348 -25.323 1.0 31.25 53 A 6 -ATOM 815 N N . GLN A1 1 54 ? -13.834 20.69 -27.792 1.0 32.1 54 A 6 -ATOM 816 C CA . GLN A1 1 54 ? -13.932 19.238 -27.711 1.0 3.14 54 A 6 -ATOM 817 C C . GLN A1 1 54 ? -12.615 18.63 -27.24 1.0 14.5 54 A 6 -ATOM 818 O O . GLN A1 1 54 ? -11.603 19.323 -27.13 1.0 22.04 54 A 6 -ATOM 819 C CB . GLN A1 1 54 ? -14.319 18.654 -29.071 1.0 14.03 54 A 6 -ATOM 820 C CG . GLN A1 1 54 ? -15.71 18.043 -29.097 1.0 52.41 54 A 6 -ATOM 821 C CD . GLN A1 1 54 ? -16.155 17.662 -30.495 1.0 44.23 54 A 6 -ATOM 822 O OE1 . GLN A1 1 54 ? -17.159 18.165 -30.999 1.0 25.33 54 A 6 -ATOM 823 N NE2 . GLN A1 1 54 ? -15.406 16.768 -31.131 1.0 63.1 54 A 6 -ATOM 824 H H . GLN A1 1 54 ? -13.838 21.121 -28.672 1.0 52.11 54 A 6 -ATOM 825 H HA . GLN A1 1 54 ? -14.702 18.997 -26.994 1.0 62.04 54 A 6 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.28 19.44 -29.811 1.0 31.24 54 A 6 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.607 17.886 -29.336 1.0 25.42 54 A 6 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.711 17.155 -28.481 1.0 52.11 54 A 6 -ATOM 829 H HG3 . GLN A1 1 54 ? -16.411 18.759 -28.694 1.0 53.52 54 A 6 -ATOM 830 H HE21 . GLN A1 1 54 ? -14.621 16.408 -30.667 1.0 45.55 54 A 6 -ATOM 831 H HE22 . GLN A1 1 54 ? -15.671 16.503 -32.036 1.0 62.42 54 A 6 -ATOM 832 N N . LEU A1 1 55 ? -12.635 17.331 -26.962 1.0 51.34 55 A 6 -ATOM 833 C CA . LEU A1 1 55 ? -11.442 16.629 -26.502 1.0 40.45 55 A 6 -ATOM 834 C C . LEU A1 1 55 ? -11.109 15.459 -27.423 1.0 63.5 55 A 6 -ATOM 835 O O . LEU A1 1 55 ? -11.963 14.621 -27.71 1.0 52.11 55 A 6 -ATOM 836 C CB . LEU A1 1 55 ? -11.642 16.125 -25.071 1.0 25.03 55 A 6 -ATOM 837 C CG . LEU A1 1 55 ? -12.2 17.141 -24.074 1.0 41.33 55 A 6 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.22 16.557 -22.671 1.0 33.24 55 A 6 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.384 18.425 -24.108 1.0 52.23 55 A 6 -ATOM 840 H H . LEU A1 1 55 ? -13.47 16.831 -27.068 1.0 12.34 55 A 6 -ATOM 841 H HA . LEU A1 1 55 ? -10.619 17.328 -26.517 1.0 22.21 55 A 6 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.323 15.289 -25.107 1.0 55.1 55 A 6 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.683 15.791 -24.702 1.0 51.11 55 A 6 -ATOM 844 H HG . LEU A1 1 55 ? -13.218 17.384 -24.349 1.0 72.12 55 A 6 -ATOM 845 H HD11 . LEU A1 1 55 ? -13.19 16.127 -22.474 1.0 32.04 55 A 6 -ATOM 846 H HD12 . LEU A1 1 55 ? -12.02 17.338 -21.952 1.0 44.35 55 A 6 -ATOM 847 H HD13 . LEU A1 1 55 ? -11.463 15.791 -22.589 1.0 32.21 55 A 6 -ATOM 848 H HD21 . LEU A1 1 55 ? -11.879 19.15 -24.736 1.0 33.14 55 A 6 -ATOM 849 H HD22 . LEU A1 1 55 ? -10.401 18.216 -24.504 1.0 72.01 55 A 6 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.292 18.819 -23.106 1.0 74.33 55 A 6 -ATOM 851 N N . GLU A1 1 56 ? -9.862 15.408 -27.88 1.0 12.02 56 A 6 -ATOM 852 C CA . GLU A1 1 56 ? -9.417 14.34 -28.767 1.0 31.33 56 A 6 -ATOM 853 C C . GLU A1 1 56 ? -9.426 12.995 -28.047 1.0 62.51 56 A 6 -ATOM 854 O O . GLU A1 1 56 ? -9.791 12.91 -26.874 1.0 51.02 56 A 6 -ATOM 855 C CB . GLU A1 1 56 ? -8.013 14.638 -29.297 1.0 62.01 56 A 6 -ATOM 856 C CG . GLU A1 1 56 ? -7.832 14.301 -30.767 1.0 21.02 56 A 6 -ATOM 857 C CD . GLU A1 1 56 ? -7.948 15.519 -31.663 1.0 1.0 56 A 6 -ATOM 858 O OE1 . GLU A1 1 56 ? -8.495 16.544 -31.205 1.0 61.34 56 A 6 -ATOM 859 O OE2 . GLU A1 1 56 ? -7.492 15.446 -32.824 1.0 22.01 56 A 6 -ATOM 860 H H . GLU A1 1 56 ? -9.227 16.106 -27.616 1.0 72.43 56 A 6 -ATOM 861 H HA . GLU A1 1 56 ? -10.103 14.293 -29.6 1.0 4.21 56 A 6 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.805 15.689 -29.161 1.0 41.11 56 A 6 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.298 14.063 -28.727 1.0 51.02 56 A 6 -ATOM 864 H HG2 . GLU A1 1 56 ? -6.855 13.863 -30.906 1.0 71.31 56 A 6 -ATOM 865 H HG3 . GLU A1 1 56 ? -8.59 13.587 -31.055 1.0 60.44 56 A 6 -ATOM 866 N N . ASP A1 1 57 ? -9.023 11.947 -28.757 1.0 71.03 57 A 6 -ATOM 867 C CA . ASP A1 1 57 ? -8.984 10.606 -28.186 1.0 63.41 57 A 6 -ATOM 868 C C . ASP A1 1 57 ? -7.845 10.477 -27.179 1.0 21.4 57 A 6 -ATOM 869 O O . ASP A1 1 57 ? -7.837 9.568 -26.349 1.0 43.31 57 A 6 -ATOM 870 C CB . ASP A1 1 57 ? -8.823 9.562 -29.292 1.0 45.31 57 A 6 -ATOM 871 C CG . ASP A1 1 57 ? -9.736 9.826 -30.474 1.0 55.43 57 A 6 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.811 10.428 -30.27 1.0 72.35 57 A 6 -ATOM 873 O OD2 . ASP A1 1 57 ? -9.376 9.429 -31.602 1.0 15.11 57 A 6 -ATOM 874 H H . ASP A1 1 57 ? -8.744 12.079 -29.687 1.0 23.12 57 A 6 -ATOM 875 H HA . ASP A1 1 57 ? -9.92 10.435 -27.675 1.0 62.14 57 A 6 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.801 9.572 -29.642 1.0 24.44 57 A 6 -ATOM 877 H HB3 . ASP A1 1 57 ? -9.054 8.586 -28.893 1.0 64.03 57 A 6 -ATOM 878 N N . SER A1 1 58 ? -6.884 11.392 -27.26 1.0 32.51 58 A 6 -ATOM 879 C CA . SER A1 1 58 ? -5.738 11.378 -26.359 1.0 62.24 58 A 6 -ATOM 880 C C . SER A1 1 58 ? -5.803 12.544 -25.377 1.0 2.12 58 A 6 -ATOM 881 O O . SER A1 1 58 ? -4.889 12.751 -24.581 1.0 12.21 58 A 6 -ATOM 882 C CB . SER A1 1 58 ? -4.434 11.441 -27.157 1.0 65.11 58 A 6 -ATOM 883 O OG . SER A1 1 58 ? -3.307 11.365 -26.301 1.0 34.21 58 A 6 -ATOM 884 H H . SER A1 1 58 ? -6.947 12.092 -27.943 1.0 21.03 58 A 6 -ATOM 885 H HA . SER A1 1 58 ? -5.765 10.453 -25.802 1.0 33.55 58 A 6 -ATOM 886 H HB2 . SER A1 1 58 ? -4.4 10.615 -27.851 1.0 31.42 58 A 6 -ATOM 887 H HB3 . SER A1 1 58 ? -4.394 12.372 -27.703 1.0 40.4 58 A 6 -ATOM 888 H HG . SER A1 1 58 ? -3.471 10.715 -25.613 1.0 10.23 58 A 6 -ATOM 889 N N . ASN A1 1 59 ? -6.892 13.303 -25.442 1.0 35.41 59 A 6 -ATOM 890 C CA . ASN A1 1 59 ? -7.078 14.45 -24.561 1.0 52.34 59 A 6 -ATOM 891 C C . ASN A1 1 59 ? -7.559 14.004 -23.183 1.0 4.01 59 A 6 -ATOM 892 O O . ASN A1 1 59 ? -8.757 14.015 -22.899 1.0 42.21 59 A 6 -ATOM 893 C CB . ASN A1 1 59 ? -8.081 15.431 -25.171 1.0 21.1 59 A 6 -ATOM 894 C CG . ASN A1 1 59 ? -7.411 16.478 -26.039 1.0 14.54 59 A 6 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.497 16.172 -26.805 1.0 24.42 59 A 6 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.864 17.721 -25.924 1.0 14.44 59 A 6 -ATOM 897 H H . ASN A1 1 59 ? -7.587 13.088 -26.099 1.0 5.51 59 A 6 -ATOM 898 H HA . ASN A1 1 59 ? -6.124 14.944 -24.454 1.0 74.51 59 A 6 -ATOM 899 H HB2 . ASN A1 1 59 ? -8.786 14.884 -25.78 1.0 43.43 59 A 6 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.612 15.934 -24.377 1.0 11.21 59 A 6 -ATOM 901 H HD21 . ASN A1 1 59 ? -8.595 17.891 -25.293 1.0 21.33 59 A 6 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.449 18.417 -26.474 1.0 12.0 59 A 6 -ATOM 903 N N . ALA A1 1 60 ? -6.617 13.614 -22.331 1.0 13.11 60 A 6 -ATOM 904 C CA . ALA A1 1 60 ? -6.944 13.167 -20.983 1.0 35.51 60 A 6 -ATOM 905 C C . ALA A1 1 60 ? -5.68 12.878 -20.179 1.0 74.01 60 A 6 -ATOM 906 O O . ALA A1 1 60 ? -5.165 13.75 -19.48 1.0 74.24 60 A 6 -ATOM 907 C CB . ALA A1 1 60 ? -7.832 11.933 -21.036 1.0 64.13 60 A 6 -ATOM 908 H H . ALA A1 1 60 ? -5.68 13.628 -22.616 1.0 31.12 60 A 6 -ATOM 909 H HA . ALA A1 1 60 ? -7.496 13.957 -20.494 1.0 20.01 60 A 6 -ATOM 910 H HB1 . ALA A1 1 60 ? -7.398 11.207 -21.708 1.0 72.33 60 A 6 -ATOM 911 H HB2 . ALA A1 1 60 ? -7.914 11.506 -20.048 1.0 25.02 60 A 6 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.813 12.211 -21.391 1.0 51.02 60 A 6 -ATOM 913 N N . MET A1 1 61 ? -5.188 11.648 -20.282 1.0 21.52 61 A 6 -ATOM 914 C CA . MET A1 1 61 ? -3.984 11.244 -19.565 1.0 32.03 61 A 6 -ATOM 915 C C . MET A1 1 61 ? -2.826 12.188 -19.872 1.0 55.14 61 A 6 -ATOM 916 O O . MET A1 1 61 ? -2.168 12.694 -18.963 1.0 73.23 61 A 6 -ATOM 917 C CB . MET A1 1 61 ? -3.6 9.81 -19.935 1.0 33.12 61 A 6 -ATOM 918 C CG . MET A1 1 61 ? -3.906 9.454 -21.381 1.0 10.31 61 A 6 -ATOM 919 S SD . MET A1 1 61 ? -2.628 8.424 -22.128 1.0 3.45 61 A 6 -ATOM 920 C CE . MET A1 1 61 ? -1.973 9.542 -23.364 1.0 11.34 61 A 6 -ATOM 921 H H . MET A1 1 61 ? -5.643 10.996 -20.855 1.0 44.35 61 A 6 -ATOM 922 H HA . MET A1 1 61 ? -4.198 11.288 -18.508 1.0 14.21 61 A 6 -ATOM 923 H HB2 . MET A1 1 61 ? -2.541 9.68 -19.771 1.0 14.23 61 A 6 -ATOM 924 H HB3 . MET A1 1 61 ? -4.142 9.129 -19.297 1.0 0.24 61 A 6 -ATOM 925 H HG2 . MET A1 1 61 ? -4.844 8.919 -21.416 1.0 62.14 61 A 6 -ATOM 926 H HG3 . MET A1 1 61 ? -3.993 10.366 -21.951 1.0 32.0 61 A 6 -ATOM 927 H HE1 . MET A1 1 61 ? -1.125 10.073 -22.955 1.0 54.23 61 A 6 -ATOM 928 H HE2 . MET A1 1 61 ? -1.66 8.977 -24.23 1.0 64.31 61 A 6 -ATOM 929 H HE3 . MET A1 1 61 ? -2.737 10.248 -23.652 1.0 24.11 61 A 6 -ATOM 930 N N . SER A1 1 62 ? -2.583 12.421 -21.158 1.0 73.15 62 A 6 -ATOM 931 C CA . SER A1 1 62 ? -1.501 13.301 -21.584 1.0 12.22 62 A 6 -ATOM 932 C C . SER A1 1 62 ? -1.883 14.765 -21.388 1.0 13.52 62 A 6 -ATOM 933 O O . SER A1 1 62 ? -1.032 15.606 -21.097 1.0 42.51 62 A 6 -ATOM 934 C CB . SER A1 1 62 ? -1.155 13.045 -23.052 1.0 62.33 62 A 6 -ATOM 935 O OG . SER A1 1 62 ? -0.508 14.167 -23.627 1.0 14.13 62 A 6 -ATOM 936 H H . SER A1 1 62 ? -3.143 11.988 -21.836 1.0 74.25 62 A 6 -ATOM 937 H HA . SER A1 1 62 ? -0.636 13.082 -20.976 1.0 74.15 62 A 6 -ATOM 938 H HB2 . SER A1 1 62 ? -0.498 12.191 -23.121 1.0 54.41 62 A 6 -ATOM 939 H HB3 . SER A1 1 62 ? -2.063 12.846 -23.604 1.0 23.45 62 A 6 -ATOM 940 H HG . SER A1 1 62 ? -0.977 14.435 -24.421 1.0 1.23 62 A 6 -ATOM 941 N N . ASP A1 1 63 ? -3.167 15.062 -21.55 1.0 34.33 63 A 6 -ATOM 942 C CA . ASP A1 1 63 ? -3.664 16.423 -21.39 1.0 10.21 63 A 6 -ATOM 943 C C . ASP A1 1 63 ? -3.326 16.966 -20.004 1.0 63.54 63 A 6 -ATOM 944 O O . ASP A1 1 63 ? -3.218 18.177 -19.81 1.0 31.33 63 A 6 -ATOM 945 C CB . ASP A1 1 63 ? -5.176 16.467 -21.613 1.0 21.1 63 A 6 -ATOM 946 C CG . ASP A1 1 63 ? -5.673 17.862 -21.937 1.0 12.2 63 A 6 -ATOM 947 O OD1 . ASP A1 1 63 ? -5.635 18.244 -23.125 1.0 53.24 63 A 6 -ATOM 948 O OD2 . ASP A1 1 63 ? -6.1 18.573 -21.003 1.0 3.13 63 A 6 -ATOM 949 H H . ASP A1 1 63 ? -3.797 14.347 -21.782 1.0 14.4 63 A 6 -ATOM 950 H HA . ASP A1 1 63 ? -3.182 17.042 -22.132 1.0 72.42 63 A 6 -ATOM 951 H HB2 . ASP A1 1 63 ? -5.431 15.815 -22.435 1.0 63.34 63 A 6 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.676 16.125 -20.719 1.0 44.51 63 A 6 -ATOM 953 N N . TYR A1 1 64 ? -3.16 16.062 -19.045 1.0 43.15 64 A 6 -ATOM 954 C CA . TYR A1 1 64 ? -2.838 16.45 -17.677 1.0 74.44 64 A 6 -ATOM 955 C C . TYR A1 1 64 ? -4.059 17.036 -16.975 1.0 35.31 64 A 6 -ATOM 956 O O . TYR A1 1 64 ? -3.936 17.722 -15.961 1.0 63.11 64 A 6 -ATOM 957 C CB . TYR A1 1 64 ? -1.694 17.465 -17.668 1.0 41.31 64 A 6 -ATOM 958 C CG . TYR A1 1 64 ? -0.54 17.069 -16.776 1.0 35.31 64 A 6 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.299 16.016 -17.12 1.0 10.21 64 A 6 -ATOM 960 C CD2 . TYR A1 1 64 ? -0.288 17.746 -15.59 1.0 61.0 64 A 6 -ATOM 961 C CE1 . TYR A1 1 64 ? 1.355 15.649 -16.308 1.0 31.32 64 A 6 -ATOM 962 C CE2 . TYR A1 1 64 ? 0.767 17.388 -14.773 1.0 3.01 64 A 6 -ATOM 963 C CZ . TYR A1 1 64 ? 1.585 16.339 -15.136 1.0 35.43 64 A 6 -ATOM 964 O OH . TYR A1 1 64 ? 2.636 15.978 -14.324 1.0 23.32 64 A 6 -ATOM 965 H H . TYR A1 1 64 ? -3.259 15.111 -19.262 1.0 10.22 64 A 6 -ATOM 966 H HA . TYR A1 1 64 ? -2.523 15.563 -17.146 1.0 40.51 64 A 6 -ATOM 967 H HB2 . TYR A1 1 64 ? -1.314 17.577 -18.672 1.0 75.32 64 A 6 -ATOM 968 H HB3 . TYR A1 1 64 ? -2.07 18.417 -17.322 1.0 32.34 64 A 6 -ATOM 969 H HD1 . TYR A1 1 64 ? 0.117 15.477 -18.039 1.0 1.35 64 A 6 -ATOM 970 H HD2 . TYR A1 1 64 ? -0.931 18.567 -15.308 1.0 32.41 64 A 6 -ATOM 971 H HE1 . TYR A1 1 64 ? 1.997 14.828 -16.592 1.0 52.21 64 A 6 -ATOM 972 H HE2 . TYR A1 1 64 ? 0.946 17.927 -13.854 1.0 43.14 64 A 6 -ATOM 973 H HH . TYR A1 1 64 ? 3.066 16.767 -13.988 1.0 23.33 64 A 6 -ATOM 974 N N . ASN A1 1 65 ? -5.238 16.76 -17.523 1.0 61.21 65 A 6 -ATOM 975 C CA . ASN A1 1 65 ? -6.483 17.26 -16.951 1.0 70.22 65 A 6 -ATOM 976 C C . ASN A1 1 65 ? -7.293 16.123 -16.334 1.0 21.44 65 A 6 -ATOM 977 O O . ASN A1 1 65 ? -8.472 16.286 -16.019 1.0 22.24 65 A 6 -ATOM 978 C CB . ASN A1 1 65 ? -7.313 17.969 -18.022 1.0 30.31 65 A 6 -ATOM 979 C CG . ASN A1 1 65 ? -8.123 17.001 -18.862 1.0 75.23 65 A 6 -ATOM 980 O OD1 . ASN A1 1 65 ? -7.601 15.999 -19.352 1.0 74.2 65 A 6 -ATOM 981 N ND2 . ASN A1 1 65 ? -9.407 17.295 -19.031 1.0 12.4 65 A 6 -ATOM 982 H H . ASN A1 1 65 ? -5.272 16.208 -18.332 1.0 72.01 65 A 6 -ATOM 983 H HA . ASN A1 1 65 ? -6.231 17.968 -16.176 1.0 43.44 65 A 6 -ATOM 984 H HB2 . ASN A1 1 65 ? -7.994 18.658 -17.544 1.0 12.24 65 A 6 -ATOM 985 H HB3 . ASN A1 1 65 ? -6.652 18.519 -18.676 1.0 73.02 65 A 6 -ATOM 986 H HD21 . ASN A1 1 65 ? -9.755 18.11 -18.611 1.0 23.44 65 A 6 -ATOM 987 H HD22 . ASN A1 1 65 ? -9.954 16.686 -19.569 1.0 32.24 65 A 6 -ATOM 988 N N . VAL A1 1 66 ? -6.652 14.971 -16.164 1.0 11.4 66 A 6 -ATOM 989 C CA . VAL A1 1 66 ? -7.311 13.807 -15.584 1.0 70.45 66 A 6 -ATOM 990 C C . VAL A1 1 66 ? -6.99 13.677 -14.099 1.0 73.11 66 A 6 -ATOM 991 O O . VAL A1 1 66 ? -6.071 12.954 -13.715 1.0 33.12 66 A 6 -ATOM 992 C CB . VAL A1 1 66 ? -6.896 12.51 -16.304 1.0 40.11 66 A 6 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.382 12.418 -16.408 1.0 32.21 66 A 6 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.464 11.297 -15.583 1.0 25.13 66 A 6 -ATOM 995 H H . VAL A1 1 66 ? -5.712 14.903 -16.435 1.0 25.31 66 A 6 -ATOM 996 H HA . VAL A1 1 66 ? -8.377 13.934 -15.702 1.0 44.24 66 A 6 -ATOM 997 H HB . VAL A1 1 66 ? -7.303 12.532 -17.304 1.0 65.05 66 A 6 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.067 11.406 -16.199 1.0 62.5 66 A 6 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.072 12.694 -17.406 1.0 4.5 66 A 6 -ATOM 1000 H HG13 . VAL A1 1 66 ? -4.93 13.089 -15.692 1.0 12.32 66 A 6 -ATOM 1001 H HG21 . VAL A1 1 66 ? -7.512 10.462 -16.266 1.0 23.4 66 A 6 -ATOM 1002 H HG22 . VAL A1 1 66 ? -6.827 11.044 -14.748 1.0 64.2 66 A 6 -ATOM 1003 H HG23 . VAL A1 1 66 ? -8.456 11.524 -15.222 1.0 74.31 66 A 6 -ATOM 1004 N N . GLN A1 1 67 ? -7.753 14.381 -13.27 1.0 5.43 67 A 6 -ATOM 1005 C CA . GLN A1 1 67 ? -7.549 14.344 -11.827 1.0 15.5 67 A 6 -ATOM 1006 C C . GLN A1 1 67 ? -8.47 13.319 -11.173 1.0 62.54 67 A 6 -ATOM 1007 O O . GLN A1 1 67 ? -9.222 12.621 -11.854 1.0 44.01 67 A 6 -ATOM 1008 C CB . GLN A1 1 67 ? -7.793 15.727 -11.22 1.0 35.11 67 A 6 -ATOM 1009 C CG . GLN A1 1 67 ? -9.2 16.254 -11.454 1.0 11.21 67 A 6 -ATOM 1010 C CD . GLN A1 1 67 ? -9.212 17.687 -11.948 1.0 34.44 67 A 6 -ATOM 1011 O OE1 . GLN A1 1 67 ? -8.545 18.024 -12.926 1.0 41.54 67 A 6 -ATOM 1012 N NE2 . GLN A1 1 67 ? -9.973 18.54 -11.272 1.0 50.51 67 A 6 -ATOM 1013 H H . GLN A1 1 67 ? -8.47 14.939 -13.638 1.0 54.23 67 A 6 -ATOM 1014 H HA . GLN A1 1 67 ? -6.525 14.057 -11.645 1.0 21.13 67 A 6 -ATOM 1015 H HB2 . GLN A1 1 67 ? -7.624 15.675 -10.155 1.0 61.05 67 A 6 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.094 16.426 -11.654 1.0 21.05 67 A 6 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.686 15.632 -12.191 1.0 63.24 67 A 6 -ATOM 1018 H HG3 . GLN A1 1 67 ? -9.748 16.204 -10.525 1.0 63.02 67 A 6 -ATOM 1019 H HE21 . GLN A1 1 67 ? -10.476 18.201 -10.502 1.0 0.12 67 A 6 -ATOM 1020 H HE22 . GLN A1 1 67 ? -9.998 19.473 -11.569 1.0 72.41 67 A 6 -ATOM 1021 N N . LYS A1 1 68 ? -8.405 13.233 -9.849 1.0 63.33 68 A 6 -ATOM 1022 C CA . LYS A1 1 68 ? -9.233 12.294 -9.102 1.0 34.0 68 A 6 -ATOM 1023 C C . LYS A1 1 68 ? -10.714 12.532 -9.382 1.0 33.21 68 A 6 -ATOM 1024 O O . LYS A1 1 68 ? -11.518 11.601 -9.348 1.0 33.01 68 A 6 -ATOM 1025 C CB . LYS A1 1 68 ? -8.96 12.423 -7.601 1.0 41.41 68 A 6 -ATOM 1026 C CG . LYS A1 1 68 ? -9.495 11.261 -6.783 1.0 61.44 68 A 6 -ATOM 1027 C CD . LYS A1 1 68 ? -8.737 9.977 -7.077 1.0 43.41 68 A 6 -ATOM 1028 C CE . LYS A1 1 68 ? -7.404 9.938 -6.346 1.0 23.43 68 A 6 -ATOM 1029 N NZ . LYS A1 1 68 ? -7.577 10.02 -4.87 1.0 52.05 68 A 6 -ATOM 1030 H H . LYS A1 1 68 ? -7.786 13.817 -9.362 1.0 75.53 68 A 6 -ATOM 1031 H HA . LYS A1 1 68 ? -8.975 11.296 -9.421 1.0 31.4 68 A 6 -ATOM 1032 H HB2 . LYS A1 1 68 ? -7.893 12.485 -7.446 1.0 51.5 68 A 6 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.421 13.332 -7.241 1.0 62.4 68 A 6 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.394 11.494 -5.734 1.0 22.33 68 A 6 -ATOM 1035 H HG3 . LYS A1 1 68 ? -10.539 11.115 -7.022 1.0 45.02 68 A 6 -ATOM 1036 H HD2 . LYS A1 1 68 ? -9.334 9.136 -6.757 1.0 14.2 68 A 6 -ATOM 1037 H HD3 . LYS A1 1 68 ? -8.558 9.91 -8.14 1.0 13.53 68 A 6 -ATOM 1038 H HE2 . LYS A1 1 68 ? -6.902 9.014 -6.59 1.0 43.13 68 A 6 -ATOM 1039 H HE3 . LYS A1 1 68 ? -6.803 10.773 -6.677 1.0 63.42 68 A 6 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.661 11.013 -4.574 1.0 1.54 68 A 6 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -6.759 9.594 -4.39 1.0 73.32 68 A 6 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.437 9.51 -4.582 1.0 23.44 68 A 6 -ATOM 1043 N N . GLU A1 1 69 ? -11.066 13.783 -9.66 1.0 51.1 69 A 6 -ATOM 1044 C CA . GLU A1 1 69 ? -12.45 14.141 -9.947 1.0 15.41 69 A 6 -ATOM 1045 C C . GLU A1 1 69 ? -12.518 15.305 -10.931 1.0 20.25 69 A 6 -ATOM 1046 O O . GLU A1 1 69 ? -12.65 16.462 -10.532 1.0 55.15 69 A 6 -ATOM 1047 C CB . GLU A1 1 69 ? -13.183 14.507 -8.655 1.0 42.14 69 A 6 -ATOM 1048 C CG . GLU A1 1 69 ? -12.433 15.508 -7.792 1.0 32.44 69 A 6 -ATOM 1049 C CD . GLU A1 1 69 ? -13.361 16.47 -7.074 1.0 60.3 69 A 6 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.521 16.091 -6.812 1.0 52.11 69 A 6 -ATOM 1051 O OE2 . GLU A1 1 69 ? -12.925 17.601 -6.775 1.0 33.22 69 A 6 -ATOM 1052 H H . GLU A1 1 69 ? -10.379 14.482 -9.672 1.0 51.55 69 A 6 -ATOM 1053 H HA . GLU A1 1 69 ? -12.929 13.282 -10.391 1.0 21.13 69 A 6 -ATOM 1054 H HB2 . GLU A1 1 69 ? -14.145 14.93 -8.908 1.0 70.35 69 A 6 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.337 13.609 -8.076 1.0 25.14 69 A 6 -ATOM 1056 H HG2 . GLU A1 1 69 ? -11.859 14.969 -7.054 1.0 60.54 69 A 6 -ATOM 1057 H HG3 . GLU A1 1 69 ? -11.765 16.078 -8.421 1.0 2.43 69 A 6 -ATOM 1058 N N . SER A1 1 70 ? -12.427 14.99 -12.219 1.0 51.41 70 A 6 -ATOM 1059 C CA . SER A1 1 70 ? -12.473 16.009 -13.261 1.0 50.24 70 A 6 -ATOM 1060 C C . SER A1 1 70 ? -13.877 16.124 -13.846 1.0 72.1 70 A 6 -ATOM 1061 O O . SER A1 1 70 ? -14.482 15.127 -14.242 1.0 13.02 70 A 6 -ATOM 1062 C CB . SER A1 1 70 ? -11.471 15.682 -14.369 1.0 75.43 70 A 6 -ATOM 1063 O OG . SER A1 1 70 ? -10.676 16.81 -14.687 1.0 45.33 70 A 6 -ATOM 1064 H H . SER A1 1 70 ? -12.323 14.049 -12.474 1.0 42.55 70 A 6 -ATOM 1065 H HA . SER A1 1 70 ? -12.205 16.954 -12.812 1.0 61.25 70 A 6 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.825 14.882 -14.042 1.0 1.23 70 A 6 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.007 15.373 -15.255 1.0 50.33 70 A 6 -ATOM 1068 H HG . SER A1 1 70 ? -11.244 17.561 -14.873 1.0 14.24 70 A 6 -ATOM 1069 N N . THR A1 1 71 ? -14.392 17.349 -13.897 1.0 52.55 71 A 6 -ATOM 1070 C CA . THR A1 1 71 ? -15.725 17.596 -14.433 1.0 43.33 71 A 6 -ATOM 1071 C C . THR A1 1 71 ? -15.664 17.975 -15.908 1.0 63.44 71 A 6 -ATOM 1072 O O . THR A1 1 71 ? -15.064 18.986 -16.275 1.0 13.52 71 A 6 -ATOM 1073 C CB . THR A1 1 71 ? -16.444 18.715 -13.656 1.0 4.41 71 A 6 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.503 19.719 -13.261 1.0 4.41 71 A 6 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.144 18.157 -12.426 1.0 4.35 71 A 6 -ATOM 1076 H H . THR A1 1 71 ? -13.862 18.103 -13.566 1.0 14.04 71 A 6 -ATOM 1077 H HA . THR A1 1 71 ? -16.3 16.687 -14.328 1.0 24.13 71 A 6 -ATOM 1078 H HB . THR A1 1 71 ? -17.186 19.162 -14.303 1.0 70.41 71 A 6 -ATOM 1079 H HG1 . THR A1 1 71 ? -15.832 20.585 -13.515 1.0 53.11 71 A 6 -ATOM 1080 H HG21 . THR A1 1 71 ? -16.585 17.316 -12.044 1.0 12.42 71 A 6 -ATOM 1081 H HG22 . THR A1 1 71 ? -18.14 17.834 -12.694 1.0 75.2 71 A 6 -ATOM 1082 H HG23 . THR A1 1 71 ? -17.206 18.923 -11.668 1.0 31.12 71 A 6 -ATOM 1083 N N . LEU A1 1 72 ? -16.288 17.159 -16.75 1.0 74.32 72 A 6 -ATOM 1084 C CA . LEU A1 1 72 ? -16.305 17.409 -18.187 1.0 62.12 72 A 6 -ATOM 1085 C C . LEU A1 1 72 ? -17.72 17.286 -18.744 1.0 14.1 72 A 6 -ATOM 1086 O O . LEU A1 1 72 ? -18.554 16.565 -18.196 1.0 22.33 72 A 6 -ATOM 1087 C CB . LEU A1 1 72 ? -15.374 16.432 -18.906 1.0 54.24 72 A 6 -ATOM 1088 C CG . LEU A1 1 72 ? -16.02 15.145 -19.42 1.0 12.34 72 A 6 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.4 15.286 -20.886 1.0 71.53 72 A 6 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.083 13.962 -19.222 1.0 45.31 72 A 6 -ATOM 1091 H H . LEU A1 1 72 ? -16.749 16.369 -16.398 1.0 40.44 72 A 6 -ATOM 1092 H HA . LEU A1 1 72 ? -15.953 18.417 -18.352 1.0 22.23 72 A 6 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.944 16.946 -19.752 1.0 24.33 72 A 6 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.588 16.157 -18.217 1.0 64.44 72 A 6 -ATOM 1095 H HG . LEU A1 1 72 ? -16.924 14.954 -18.858 1.0 60.22 72 A 6 -ATOM 1096 H HD11 . LEU A1 1 72 ? -17.468 15.419 -20.969 1.0 22.12 72 A 6 -ATOM 1097 H HD12 . LEU A1 1 72 ? -16.105 14.396 -21.421 1.0 11.12 72 A 6 -ATOM 1098 H HD13 . LEU A1 1 72 ? -15.895 16.143 -21.307 1.0 74.11 72 A 6 -ATOM 1099 H HD21 . LEU A1 1 72 ? -14.06 14.308 -19.228 1.0 45.11 72 A 6 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.227 13.251 -20.021 1.0 64.51 72 A 6 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.297 13.488 -18.275 1.0 15.53 72 A 6 -ATOM 1102 N N . HIS A1 1 73 ? -17.983 17.992 -19.84 1.0 22.1 73 A 6 -ATOM 1103 C CA . HIS A1 1 73 ? -19.296 17.959 -20.474 1.0 43.22 73 A 6 -ATOM 1104 C C . HIS A1 1 73 ? -19.316 16.962 -21.629 1.0 1.12 73 A 6 -ATOM 1105 O O . HIS A1 1 73 ? -18.549 17.087 -22.584 1.0 41.41 73 A 6 -ATOM 1106 C CB . HIS A1 1 73 ? -19.677 19.351 -20.979 1.0 34.11 73 A 6 -ATOM 1107 C CG . HIS A1 1 73 ? -21.121 19.477 -21.354 1.0 25.31 73 A 6 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.953 18.39 -21.524 1.0 22.31 73 A 6 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.882 20.572 -21.589 1.0 30.12 73 A 6 -ATOM 1110 C CE1 . HIS A1 1 73 ? -23.162 18.811 -21.85 1.0 74.03 73 A 6 -ATOM 1111 N NE2 . HIS A1 1 73 ? -23.146 20.131 -21.896 1.0 22.32 73 A 6 -ATOM 1112 H H . HIS A1 1 73 ? -17.277 18.547 -20.231 1.0 41.1 73 A 6 -ATOM 1113 H HA . HIS A1 1 73 ? -20.014 17.645 -19.732 1.0 23.25 73 A 6 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.47 20.076 -20.206 1.0 51.13 73 A 6 -ATOM 1115 H HB3 . HIS A1 1 73 ? -19.085 19.584 -21.852 1.0 64.13 73 A 6 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.694 17.451 -21.423 1.0 63.31 73 A 6 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.556 21.601 -21.545 1.0 71.43 73 A 6 -ATOM 1118 H HE1 . HIS A1 1 73 ? -24.018 18.183 -22.045 1.0 3.34 73 A 6 -ATOM 1119 N N . LEU A1 1 74 ? -20.198 15.973 -21.535 1.0 31.4 74 A 6 -ATOM 1120 C CA . LEU A1 1 74 ? -20.319 14.954 -22.572 1.0 41.22 74 A 6 -ATOM 1121 C C . LEU A1 1 74 ? -21.635 15.1 -23.329 1.0 21.0 74 A 6 -ATOM 1122 O O . LEU A1 1 74 ? -22.714 14.957 -22.753 1.0 70.53 74 A 6 -ATOM 1123 C CB . LEU A1 1 74 ? -20.224 13.557 -21.955 1.0 42.32 74 A 6 -ATOM 1124 C CG . LEU A1 1 74 ? -20.696 12.401 -22.837 1.0 13.02 74 A 6 -ATOM 1125 C CD1 . LEU A1 1 74 ? -19.894 12.353 -24.129 1.0 50.12 74 A 6 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.586 11.08 -22.089 1.0 22.4 74 A 6 -ATOM 1127 H H . LEU A1 1 74 ? -20.783 15.926 -20.751 1.0 53.04 74 A 6 -ATOM 1128 H HA . LEU A1 1 74 ? -19.502 15.089 -23.265 1.0 65.43 74 A 6 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.19 13.378 -21.701 1.0 22.02 74 A 6 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.821 13.553 -21.055 1.0 20.31 74 A 6 -ATOM 1131 H HG . LEU A1 1 74 ? -21.735 12.554 -23.096 1.0 34.12 74 A 6 -ATOM 1132 H HD11 . LEU A1 1 74 ? -18.964 12.883 -23.995 1.0 33.01 74 A 6 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.462 12.816 -24.922 1.0 1.34 74 A 6 -ATOM 1134 H HD13 . LEU A1 1 74 ? -19.689 11.324 -24.387 1.0 63.14 74 A 6 -ATOM 1135 H HD21 . LEU A1 1 74 ? -21.324 10.39 -22.468 1.0 12.32 74 A 6 -ATOM 1136 H HD22 . LEU A1 1 74 ? -20.755 11.249 -21.036 1.0 54.43 74 A 6 -ATOM 1137 H HD23 . LEU A1 1 74 ? -19.598 10.667 -22.233 1.0 14.02 74 A 6 -ATOM 1138 N N . VAL A1 1 75 ? -21.539 15.384 -24.624 1.0 43.5 75 A 6 -ATOM 1139 C CA . VAL A1 1 75 ? -22.722 15.546 -25.461 1.0 52.32 75 A 6 -ATOM 1140 C C . VAL A1 1 75 ? -22.837 14.413 -26.474 1.0 61.15 75 A 6 -ATOM 1141 O O . VAL A1 1 75 ? -21.843 13.994 -27.07 1.0 54.31 75 A 6 -ATOM 1142 C CB . VAL A1 1 75 ? -22.699 16.891 -26.211 1.0 24.5 75 A 6 -ATOM 1143 C CG1 . VAL A1 1 75 ? -22.979 18.04 -25.255 1.0 55.3 75 A 6 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.365 17.085 -26.915 1.0 64.14 75 A 6 -ATOM 1145 H H . VAL A1 1 75 ? -20.651 15.486 -25.026 1.0 70.11 75 A 6 -ATOM 1146 H HA . VAL A1 1 75 ? -23.59 15.53 -24.818 1.0 60.52 75 A 6 -ATOM 1147 H HB . VAL A1 1 75 ? -23.478 16.876 -26.959 1.0 44.41 75 A 6 -ATOM 1148 H HG11 . VAL A1 1 75 ? -23.653 17.707 -24.479 1.0 31.54 75 A 6 -ATOM 1149 H HG12 . VAL A1 1 75 ? -22.052 18.373 -24.81 1.0 61.34 75 A 6 -ATOM 1150 H HG13 . VAL A1 1 75 ? -23.432 18.857 -25.797 1.0 54.52 75 A 6 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.216 16.291 -27.631 1.0 5.24 75 A 6 -ATOM 1152 H HG22 . VAL A1 1 75 ? -21.363 18.036 -27.426 1.0 61.35 75 A 6 -ATOM 1153 H HG23 . VAL A1 1 75 ? -20.567 17.066 -26.187 1.0 24.43 75 A 6 -ATOM 1154 N N . LEU A1 1 76 ? -24.056 13.92 -26.667 1.0 35.1 76 A 6 -ATOM 1155 C CA . LEU A1 1 76 ? -24.302 12.835 -27.61 1.0 22.53 76 A 6 -ATOM 1156 C C . LEU A1 1 76 ? -25.355 13.235 -28.638 1.0 2.14 76 A 6 -ATOM 1157 O O . LEU A1 1 76 ? -26.368 13.847 -28.297 1.0 21.5 76 A 6 -ATOM 1158 C CB . LEU A1 1 76 ? -24.752 11.577 -26.864 1.0 73.12 76 A 6 -ATOM 1159 C CG . LEU A1 1 76 ? -24.477 11.553 -25.36 1.0 64.45 76 A 6 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.622 12.2 -24.598 1.0 24.13 76 A 6 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.253 10.126 -24.882 1.0 22.03 76 A 6 -ATOM 1162 H H . LEU A1 1 76 ? -24.808 14.294 -26.163 1.0 44.32 76 A 6 -ATOM 1163 H HA . LEU A1 1 76 ? -23.376 12.626 -28.124 1.0 53.04 76 A 6 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.817 11.472 -27.007 1.0 71.31 76 A 6 -ATOM 1165 H HB3 . LEU A1 1 76 ? -24.246 10.732 -27.308 1.0 62.14 76 A 6 -ATOM 1166 H HG . LEU A1 1 76 ? -23.579 12.12 -25.157 1.0 42.11 76 A 6 -ATOM 1167 H HD11 . LEU A1 1 76 ? -25.617 11.851 -23.576 1.0 12.14 76 A 6 -ATOM 1168 H HD12 . LEU A1 1 76 ? -26.56 11.936 -25.064 1.0 23.21 76 A 6 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.504 13.274 -24.612 1.0 40.2 76 A 6 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.884 9.526 -25.7 1.0 53.24 76 A 6 -ATOM 1171 H HD22 . LEU A1 1 76 ? -25.186 9.716 -24.526 1.0 72.02 76 A 6 -ATOM 1172 H HD23 . LEU A1 1 76 ? -23.53 10.125 -24.079 1.0 63.4 76 A 6 -ATOM 1173 N N . ARG A1 1 77 ? -25.111 12.883 -29.896 1.0 50.44 77 A 6 -ATOM 1174 C CA . ARG A1 1 77 ? -26.039 13.205 -30.973 1.0 12.4 77 A 6 -ATOM 1175 C C . ARG A1 1 77 ? -26.915 12.003 -31.313 1.0 10.32 77 A 6 -ATOM 1176 O O . ARG A1 1 77 ? -27.106 11.672 -32.484 1.0 12.43 77 A 6 -ATOM 1177 C CB . ARG A1 1 77 ? -25.272 13.659 -32.217 1.0 55.35 77 A 6 -ATOM 1178 C CG . ARG A1 1 77 ? -24.248 12.646 -32.704 1.0 12.22 77 A 6 -ATOM 1179 C CD . ARG A1 1 77 ? -22.835 13.202 -32.626 1.0 60.22 77 A 6 -ATOM 1180 N NE . ARG A1 1 77 ? -22.505 14.025 -33.786 1.0 64.33 77 A 6 -ATOM 1181 C CZ . ARG A1 1 77 ? -22.124 13.527 -34.957 1.0 13.31 77 A 6 -ATOM 1182 N NH1 . ARG A1 1 77 ? -22.026 12.215 -35.122 1.0 63.3 77 A 6 -ATOM 1183 N NH2 . ARG A1 1 77 ? -21.841 14.341 -35.965 1.0 70.54 77 A 6 -ATOM 1184 H H . ARG A1 1 77 ? -24.286 12.397 -30.105 1.0 2.41 77 A 6 -ATOM 1185 H HA . ARG A1 1 77 ? -26.671 14.013 -30.637 1.0 53.23 77 A 6 -ATOM 1186 H HB2 . ARG A1 1 77 ? -25.977 13.837 -33.015 1.0 41.04 77 A 6 -ATOM 1187 H HB3 . ARG A1 1 77 ? -24.756 14.58 -31.991 1.0 23.23 77 A 6 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.31 11.761 -32.089 1.0 3.21 77 A 6 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.469 12.39 -33.73 1.0 45.32 77 A 6 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.747 13.803 -31.733 1.0 24.22 77 A 6 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.141 12.376 -32.573 1.0 55.12 77 A 6 -ATOM 1192 H HE . ARG A1 1 77 ? -22.571 14.997 -33.686 1.0 41.44 77 A 6 -ATOM 1193 H HH11 . ARG A1 1 77 ? -22.239 11.599 -34.364 1.0 31.24 77 A 6 -ATOM 1194 H HH12 . ARG A1 1 77 ? -21.74 11.842 -36.005 1.0 72.5 77 A 6 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.914 15.33 -35.844 1.0 71.34 77 A 6 -ATOM 1196 H HH22 . ARG A1 1 77 ? -21.554 13.965 -36.846 1.0 1.44 77 A 6 -ATOM 1197 N N . LEU A1 1 78 ? -27.445 11.354 -30.283 1.0 31.03 78 A 6 -ATOM 1198 C CA . LEU A1 1 78 ? -28.301 10.188 -30.471 1.0 51.32 78 A 6 -ATOM 1199 C C . LEU A1 1 78 ? -29.544 10.55 -31.278 1.0 14.11 78 A 6 -ATOM 1200 O O . LEU A1 1 78 ? -29.923 9.836 -32.206 1.0 12.31 78 A 6 -ATOM 1201 C CB . LEU A1 1 78 ? -28.71 9.606 -29.117 1.0 42.51 78 A 6 -ATOM 1202 C CG . LEU A1 1 78 ? -27.928 8.378 -28.65 1.0 51.45 78 A 6 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.575 8.789 -28.09 1.0 14.44 78 A 6 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.724 7.602 -27.611 1.0 25.32 78 A 6 -ATOM 1205 H H . LEU A1 1 78 ? -27.257 11.665 -29.373 1.0 75.31 78 A 6 -ATOM 1206 H HA . LEU A1 1 78 ? -27.736 9.447 -31.016 1.0 64.2 78 A 6 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.586 10.379 -28.374 1.0 61.14 78 A 6 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.754 9.332 -29.177 1.0 62.32 78 A 6 -ATOM 1209 H HG . LEU A1 1 78 ? -27.755 7.727 -29.495 1.0 53.42 78 A 6 -ATOM 1210 H HD11 . LEU A1 1 78 ? -26.698 9.149 -27.08 1.0 3.24 78 A 6 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.154 9.572 -28.703 1.0 74.14 78 A 6 -ATOM 1212 H HD13 . LEU A1 1 78 ? -25.911 7.936 -28.09 1.0 11.41 78 A 6 -ATOM 1213 H HD21 . LEU A1 1 78 ? -28.907 6.601 -27.972 1.0 65.32 78 A 6 -ATOM 1214 H HD22 . LEU A1 1 78 ? -29.666 8.1 -27.435 1.0 65.43 78 A 6 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.163 7.556 -26.689 1.0 34.04 78 A 6 -ATOM 1216 N N . ARG A1 1 79 ? -30.172 11.665 -30.919 1.0 44.5 79 A 6 -ATOM 1217 C CA . ARG A1 1 79 ? -31.372 12.122 -31.611 1.0 54.44 79 A 6 -ATOM 1218 C C . ARG A1 1 79 ? -32.49 11.09 -31.5 1.0 43.43 79 A 6 -ATOM 1219 O O . ARG A1 1 79 ? -32.364 10.097 -30.785 1.0 24.23 79 A 6 -ATOM 1220 C CB . ARG A1 1 79 ? -31.063 12.4 -33.083 1.0 53.1 79 A 6 -ATOM 1221 C CG . ARG A1 1 79 ? -31.704 13.673 -33.61 1.0 62.42 79 A 6 -ATOM 1222 C CD . ARG A1 1 79 ? -30.715 14.828 -33.629 1.0 15.2 79 A 6 -ATOM 1223 N NE . ARG A1 1 79 ? -30.531 15.369 -34.973 1.0 22.21 79 A 6 -ATOM 1224 C CZ . ARG A1 1 79 ? -29.679 16.347 -35.261 1.0 43.33 79 A 6 -ATOM 1225 N NH1 . ARG A1 1 79 ? -28.937 16.887 -34.305 1.0 51.34 79 A 6 -ATOM 1226 N NH2 . ARG A1 1 79 ? -29.568 16.785 -36.509 1.0 24.34 79 A 6 -ATOM 1227 H H . ARG A1 1 79 ? -29.822 12.192 -30.171 1.0 30.43 79 A 6 -ATOM 1228 H HA . ARG A1 1 79 ? -31.696 13.038 -31.141 1.0 75.12 79 A 6 -ATOM 1229 H HB2 . ARG A1 1 79 ? -29.993 12.485 -33.205 1.0 72.51 79 A 6 -ATOM 1230 H HB3 . ARG A1 1 79 ? -31.419 11.571 -33.675 1.0 62.3 79 A 6 -ATOM 1231 H HG2 . ARG A1 1 79 ? -32.055 13.498 -34.617 1.0 34.21 79 A 6 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.538 13.934 -32.976 1.0 51.44 79 A 6 -ATOM 1233 H HD2 . ARG A1 1 79 ? -31.085 15.611 -32.984 1.0 21.42 79 A 6 -ATOM 1234 H HD3 . ARG A1 1 79 ? -29.764 14.476 -33.259 1.0 24.22 79 A 6 -ATOM 1235 H HE . ARG A1 1 79 ? -31.07 14.984 -35.695 1.0 63.2 79 A 6 -ATOM 1236 H HH11 . ARG A1 1 79 ? -29.017 16.558 -33.364 1.0 0.03 79 A 6 -ATOM 1237 H HH12 . ARG A1 1 79 ? -28.295 17.622 -34.525 1.0 54.33 79 A 6 -ATOM 1238 H HH21 . ARG A1 1 79 ? -30.126 16.38 -37.232 1.0 72.3 79 A 6 -ATOM 1239 H HH22 . ARG A1 1 79 ? -28.927 17.521 -36.725 1.0 2.44 79 A 6 -ATOM 1240 N N . GLY A1 1 80 ? -33.585 11.332 -32.214 1.0 11.03 80 A 6 -ATOM 1241 C CA . GLY A1 1 80 ? -34.71 10.416 -32.182 1.0 3.12 80 A 6 -ATOM 1242 C C . GLY A1 1 80 ? -34.695 9.439 -33.341 1.0 52.34 80 A 6 -ATOM 1243 O O . GLY A1 1 80 ? -35.619 9.415 -34.154 1.0 43.44 80 A 6 -ATOM 1244 H H . GLY A1 1 80 ? -33.63 12.14 -32.767 1.0 0.24 80 A 6 -ATOM 1245 H HA2 . GLY A1 1 80 ? -34.681 9.86 -31.257 1.0 71.24 80 A 6 -ATOM 1246 H HA3 . GLY A1 1 80 ? -35.626 10.987 -32.219 1.0 43.14 80 A 6 -ATOM 1247 N N . GLY A1 1 81 ? -33.642 8.631 -33.42 1.0 43.34 81 A 6 -ATOM 1248 C CA . GLY A1 1 81 ? -33.53 7.661 -34.493 1.0 20.2 81 A 6 -ATOM 1249 C C . GLY A1 1 81 ? -32.108 7.516 -34.997 1.0 63.23 81 A 6 -ATOM 1250 O O . GLY A1 1 81 ? -31.664 8.28 -35.854 1.0 30.24 81 A 6 -ATOM 1251 H H . GLY A1 1 81 ? -32.935 8.695 -32.744 1.0 11.33 81 A 6 -ATOM 1252 H HA2 . GLY A1 1 81 ? -33.873 6.702 -34.134 1.0 30.51 81 A 6 -ATOM 1253 H HA3 . GLY A1 1 81 ? -34.16 7.974 -35.313 1.0 55.14 81 A 6 -ATOM 1254 N N . VAL A1 1 82 ? -31.389 6.533 -34.464 1.0 30.52 82 A 6 -ATOM 1255 C CA . VAL A1 1 82 ? -30.009 6.291 -34.864 1.0 4.45 82 A 6 -ATOM 1256 C C . VAL A1 1 82 ? -29.143 7.523 -34.627 1.0 63.52 82 A 6 -ATOM 1257 O O . VAL A1 1 82 ? -28.251 7.513 -33.779 1.0 12.52 82 A 6 -ATOM 1258 C CB . VAL A1 1 82 ? -29.917 5.891 -36.349 1.0 53.54 82 A 6 -ATOM 1259 C CG1 . VAL A1 1 82 ? -28.47 5.646 -36.748 1.0 33.31 82 A 6 -ATOM 1260 C CG2 . VAL A1 1 82 ? -30.769 4.661 -36.622 1.0 1.13 82 A 6 -ATOM 1261 H H . VAL A1 1 82 ? -31.798 5.957 -33.785 1.0 42.11 82 A 6 -ATOM 1262 H HA . VAL A1 1 82 ? -29.627 5.474 -34.269 1.0 65.12 82 A 6 -ATOM 1263 H HB . VAL A1 1 82 ? -30.298 6.707 -36.945 1.0 3.02 82 A 6 -ATOM 1264 H HG11 . VAL A1 1 82 ? -27.877 5.47 -35.862 1.0 71.54 82 A 6 -ATOM 1265 H HG12 . VAL A1 1 82 ? -28.415 4.783 -37.395 1.0 43.52 82 A 6 -ATOM 1266 H HG13 . VAL A1 1 82 ? -28.089 6.512 -37.269 1.0 60.31 82 A 6 -ATOM 1267 H HG21 . VAL A1 1 82 ? -31.806 4.952 -36.705 1.0 51.1 82 A 6 -ATOM 1268 H HG22 . VAL A1 1 82 ? -30.449 4.2 -37.545 1.0 43.42 82 A 6 -ATOM 1269 H HG23 . VAL A1 1 82 ? -30.657 3.956 -35.811 1.0 61.21 82 A 6 -ATOM 1 N N . GLY A1 1 1 ? -16.213 -2.755 -4.123 1.0 13.0 1 A 7 -ATOM 2 C CA . GLY A1 1 1 ? -14.78 -2.971 -4.2 1.0 45.03 1 A 7 -ATOM 3 C C . GLY A1 1 1 ? -14.121 -2.115 -5.264 1.0 65.21 1 A 7 -ATOM 4 O O . GLY A1 1 1 ? -13.649 -2.613 -6.286 1.0 33.34 1 A 7 -ATOM 5 H H1 . GLY A1 1 1 ? -16.621 -2.484 -3.274 1.0 52.4 1 A 7 -ATOM 6 H HA2 . GLY A1 1 1 ? -14.34 -2.738 -3.242 1.0 14.15 1 A 7 -ATOM 7 H HA3 . GLY A1 1 1 ? -14.596 -4.011 -4.426 1.0 34.23 1 A 7 -ATOM 8 N N . PRO A1 1 2 ? -14.084 -0.795 -5.028 1.0 55.32 2 A 7 -ATOM 9 C CA . PRO A1 1 2 ? -13.482 0.159 -5.963 1.0 21.43 2 A 7 -ATOM 10 C C . PRO A1 1 2 ? -11.964 0.029 -6.027 1.0 41.45 2 A 7 -ATOM 11 O O . PRO A1 1 2 ? -11.329 -0.42 -5.072 1.0 62.42 2 A 7 -ATOM 12 C CB . PRO A1 1 2 ? -13.878 1.52 -5.386 1.0 51.45 2 A 7 -ATOM 13 C CG . PRO A1 1 2 ? -14.091 1.268 -3.933 1.0 43.11 2 A 7 -ATOM 14 C CD . PRO A1 1 2 ? -14.628 -0.133 -3.83 1.0 64.14 2 A 7 -ATOM 15 H HA . PRO A1 1 2 ? -13.893 0.054 -6.957 1.0 31.54 2 A 7 -ATOM 16 H HB2 . PRO A1 1 2 ? -13.081 2.231 -5.552 1.0 42.4 2 A 7 -ATOM 17 H HB3 . PRO A1 1 2 ? -14.783 1.868 -5.862 1.0 62.54 2 A 7 -ATOM 18 H HG2 . PRO A1 1 2 ? -13.153 1.35 -3.405 1.0 3.22 2 A 7 -ATOM 19 H HG3 . PRO A1 1 2 ? -14.808 1.973 -3.539 1.0 51.14 2 A 7 -ATOM 20 H HD2 . PRO A1 1 2 ? -14.269 -0.61 -2.93 1.0 11.0 2 A 7 -ATOM 21 H HD3 . PRO A1 1 2 ? -15.708 -0.126 -3.851 1.0 24.12 2 A 7 -ATOM 22 N N . LEU A1 1 3 ? -11.387 0.426 -7.156 1.0 34.12 3 A 7 -ATOM 23 C CA . LEU A1 1 3 ? -9.943 0.354 -7.344 1.0 54.03 3 A 7 -ATOM 24 C C . LEU A1 1 3 ? -9.527 1.044 -8.639 1.0 63.21 3 A 7 -ATOM 25 O O . LEU A1 1 3 ? -10.21 0.941 -9.656 1.0 11.24 3 A 7 -ATOM 26 C CB . LEU A1 1 3 ? -9.482 -1.105 -7.359 1.0 60.12 3 A 7 -ATOM 27 C CG . LEU A1 1 3 ? -8.224 -1.42 -6.55 1.0 64.13 3 A 7 -ATOM 28 C CD1 . LEU A1 1 3 ? -7.058 -0.564 -7.021 1.0 62.25 3 A 7 -ATOM 29 C CD2 . LEU A1 1 3 ? -8.477 -1.208 -5.065 1.0 0.12 3 A 7 -ATOM 30 H H . LEU A1 1 3 ? -11.946 0.775 -7.881 1.0 52.35 3 A 7 -ATOM 31 H HA . LEU A1 1 3 ? -9.475 0.862 -6.513 1.0 43.13 3 A 7 -ATOM 32 H HB2 . LEU A1 1 3 ? -10.286 -1.709 -6.969 1.0 74.24 3 A 7 -ATOM 33 H HB3 . LEU A1 1 3 ? -9.293 -1.38 -8.387 1.0 72.41 3 A 7 -ATOM 34 H HG . LEU A1 1 3 ? -7.957 -2.457 -6.7 1.0 43.5 3 A 7 -ATOM 35 H HD11 . LEU A1 1 3 ? -7.061 0.373 -6.486 1.0 50.45 3 A 7 -ATOM 36 H HD12 . LEU A1 1 3 ? -7.155 -0.375 -8.08 1.0 4.34 3 A 7 -ATOM 37 H HD13 . LEU A1 1 3 ? -6.13 -1.085 -6.832 1.0 54.42 3 A 7 -ATOM 38 H HD21 . LEU A1 1 3 ? -7.534 -1.172 -4.54 1.0 23.33 3 A 7 -ATOM 39 H HD22 . LEU A1 1 3 ? -9.072 -2.024 -4.682 1.0 1.01 3 A 7 -ATOM 40 H HD23 . LEU A1 1 3 ? -9.007 -0.277 -4.92 1.0 75.24 3 A 7 -ATOM 41 N N . GLY A1 1 4 ? -8.399 1.748 -8.593 1.0 4.21 4 A 7 -ATOM 42 C CA . GLY A1 1 4 ? -7.911 2.443 -9.77 1.0 43.34 4 A 7 -ATOM 43 C C . GLY A1 1 4 ? -7.184 3.727 -9.424 1.0 32.24 4 A 7 -ATOM 44 O O . GLY A1 1 4 ? -7.356 4.272 -8.333 1.0 73.31 4 A 7 -ATOM 45 H H . GLY A1 1 4 ? -7.895 1.795 -7.754 1.0 2.13 4 A 7 -ATOM 46 H HA2 . GLY A1 1 4 ? -7.235 1.792 -10.304 1.0 53.5 4 A 7 -ATOM 47 H HA3 . GLY A1 1 4 ? -8.749 2.678 -10.409 1.0 61.41 4 A 7 -ATOM 48 N N . SER A1 1 5 ? -6.367 4.212 -10.354 1.0 14.33 5 A 7 -ATOM 49 C CA . SER A1 1 5 ? -5.607 5.438 -10.14 1.0 12.42 5 A 7 -ATOM 50 C C . SER A1 1 5 ? -6.534 6.598 -9.79 1.0 43.22 5 A 7 -ATOM 51 O O . SER A1 1 5 ? -6.616 7.015 -8.635 1.0 33.52 5 A 7 -ATOM 52 C CB . SER A1 1 5 ? -4.791 5.782 -11.387 1.0 72.02 5 A 7 -ATOM 53 O OG . SER A1 1 5 ? -4.221 7.075 -11.284 1.0 21.35 5 A 7 -ATOM 54 H H . SER A1 1 5 ? -6.272 3.733 -11.203 1.0 31.12 5 A 7 -ATOM 55 H HA . SER A1 1 5 ? -4.933 5.27 -9.313 1.0 12.32 5 A 7 -ATOM 56 H HB2 . SER A1 1 5 ? -3.997 5.06 -11.504 1.0 41.01 5 A 7 -ATOM 57 H HB3 . SER A1 1 5 ? -5.434 5.753 -12.254 1.0 74.13 5 A 7 -ATOM 58 H HG . SER A1 1 5 ? -3.843 7.189 -10.409 1.0 33.45 5 A 7 -ATOM 59 N N . MET A1 1 6 ? -7.231 7.115 -10.796 1.0 14.01 6 A 7 -ATOM 60 C CA . MET A1 1 6 ? -8.154 8.226 -10.595 1.0 54.33 6 A 7 -ATOM 61 C C . MET A1 1 6 ? -9.479 7.967 -11.305 1.0 31.44 6 A 7 -ATOM 62 O O . MET A1 1 6 ? -9.656 6.934 -11.95 1.0 1.11 6 A 7 -ATOM 63 C CB . MET A1 1 6 ? -7.535 9.529 -11.105 1.0 70.21 6 A 7 -ATOM 64 C CG . MET A1 1 6 ? -7.19 9.5 -12.585 1.0 25.05 6 A 7 -ATOM 65 S SD . MET A1 1 6 ? -5.413 9.452 -12.883 1.0 3.44 6 A 7 -ATOM 66 C CE . MET A1 1 6 ? -4.889 10.95 -12.053 1.0 13.21 6 A 7 -ATOM 67 H H . MET A1 1 6 ? -7.124 6.74 -11.695 1.0 2.32 6 A 7 -ATOM 68 H HA . MET A1 1 6 ? -8.338 8.316 -9.535 1.0 5.22 6 A 7 -ATOM 69 H HB2 . MET A1 1 6 ? -8.233 10.335 -10.936 1.0 62.43 6 A 7 -ATOM 70 H HB3 . MET A1 1 6 ? -6.63 9.725 -10.551 1.0 63.34 6 A 7 -ATOM 71 H HG2 . MET A1 1 6 ? -7.639 8.623 -13.029 1.0 33.13 6 A 7 -ATOM 72 H HG3 . MET A1 1 6 ? -7.597 10.385 -13.053 1.0 12.41 6 A 7 -ATOM 73 H HE1 . MET A1 1 6 ? -5.74 11.408 -11.568 1.0 12.23 6 A 7 -ATOM 74 H HE2 . MET A1 1 6 ? -4.14 10.709 -11.313 1.0 52.54 6 A 7 -ATOM 75 H HE3 . MET A1 1 6 ? -4.474 11.636 -12.776 1.0 2.41 6 A 7 -ATOM 76 N N . GLN A1 1 7 ? -10.407 8.911 -11.18 1.0 13.12 7 A 7 -ATOM 77 C CA . GLN A1 1 7 ? -11.716 8.783 -11.809 1.0 13.2 7 A 7 -ATOM 78 C C . GLN A1 1 7 ? -12.157 10.108 -12.422 1.0 42.42 7 A 7 -ATOM 79 O O . GLN A1 1 7 ? -11.703 11.176 -12.009 1.0 71.33 7 A 7 -ATOM 80 C CB . GLN A1 1 7 ? -12.752 8.311 -10.787 1.0 42.01 7 A 7 -ATOM 81 C CG . GLN A1 1 7 ? -12.248 7.201 -9.878 1.0 12.34 7 A 7 -ATOM 82 C CD . GLN A1 1 7 ? -11.771 7.718 -8.535 1.0 44.31 7 A 7 -ATOM 83 O OE1 . GLN A1 1 7 ? -11.653 8.926 -8.328 1.0 33.44 7 A 7 -ATOM 84 N NE2 . GLN A1 1 7 ? -11.493 6.803 -7.613 1.0 73.32 7 A 7 -ATOM 85 H H . GLN A1 1 7 ? -10.206 9.712 -10.652 1.0 71.21 7 A 7 -ATOM 86 H HA . GLN A1 1 7 ? -11.636 8.047 -12.593 1.0 62.03 7 A 7 -ATOM 87 H HB2 . GLN A1 1 7 ? -13.04 9.149 -10.17 1.0 13.25 7 A 7 -ATOM 88 H HB3 . GLN A1 1 7 ? -13.621 7.947 -11.315 1.0 41.42 7 A 7 -ATOM 89 H HG2 . GLN A1 1 7 ? -13.05 6.498 -9.711 1.0 43.33 7 A 7 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.426 6.699 -10.367 1.0 33.21 7 A 7 -ATOM 91 H HE21 . GLN A1 1 7 ? -11.61 5.859 -7.85 1.0 52.01 7 A 7 -ATOM 92 H HE22 . GLN A1 1 7 ? -11.182 7.109 -6.737 1.0 55.43 7 A 7 -ATOM 93 N N . ILE A1 1 8 ? -13.043 10.032 -13.409 1.0 12.12 8 A 7 -ATOM 94 C CA . ILE A1 1 8 ? -13.546 11.225 -14.078 1.0 64.2 8 A 7 -ATOM 95 C C . ILE A1 1 8 ? -15.07 11.233 -14.117 1.0 0.33 8 A 7 -ATOM 96 O O . ILE A1 1 8 ? -15.711 10.191 -13.974 1.0 11.35 8 A 7 -ATOM 97 C CB . ILE A1 1 8 ? -13.007 11.333 -15.517 1.0 65.34 8 A 7 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.09 10.149 -15.831 1.0 72.33 8 A 7 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.266 12.648 -15.708 1.0 55.24 8 A 7 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.677 10.073 -17.284 1.0 11.02 8 A 7 -ATOM 101 H H . ILE A1 1 8 ? -13.367 9.152 -13.693 1.0 43.45 8 A 7 -ATOM 102 H HA . ILE A1 1 8 ? -13.206 12.087 -13.522 1.0 41.41 8 A 7 -ATOM 103 H HB . ILE A1 1 8 ? -13.846 11.319 -16.194 1.0 13.24 8 A 7 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.194 10.227 -15.236 1.0 4.11 8 A 7 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.603 9.231 -15.583 1.0 33.41 8 A 7 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.753 12.908 -14.793 1.0 12.11 8 A 7 -ATOM 107 H HG22 . ILE A1 1 8 ? -11.546 12.543 -16.505 1.0 14.43 8 A 7 -ATOM 108 H HG23 . ILE A1 1 8 ? -12.972 13.426 -15.959 1.0 53.13 8 A 7 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.249 9.303 -17.781 1.0 4.51 8 A 7 -ATOM 110 H HD12 . ILE A1 1 8 ? -11.865 11.024 -17.762 1.0 22.53 8 A 7 -ATOM 111 H HD13 . ILE A1 1 8 ? -10.625 9.839 -17.349 1.0 32.23 8 A 7 -ATOM 112 N N . PHE A1 1 9 ? -15.645 12.415 -14.312 1.0 44.42 9 A 7 -ATOM 113 C CA . PHE A1 1 9 ? -17.095 12.559 -14.37 1.0 45.42 9 A 7 -ATOM 114 C C . PHE A1 1 9 ? -17.542 13.009 -15.758 1.0 62.05 9 A 7 -ATOM 115 O O . PHE A1 1 9 ? -17.065 14.017 -16.28 1.0 33.13 9 A 7 -ATOM 116 C CB . PHE A1 1 9 ? -17.572 13.564 -13.319 1.0 42.3 9 A 7 -ATOM 117 C CG . PHE A1 1 9 ? -17.571 13.014 -11.921 1.0 44.44 9 A 7 -ATOM 118 C CD1 . PHE A1 1 9 ? -16.384 12.864 -11.222 1.0 24.21 9 A 7 -ATOM 119 C CD2 . PHE A1 1 9 ? -18.758 12.648 -11.306 1.0 24.11 9 A 7 -ATOM 120 C CE1 . PHE A1 1 9 ? -16.38 12.359 -9.935 1.0 54.33 9 A 7 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.76 12.143 -10.019 1.0 62.43 9 A 7 -ATOM 122 C CZ . PHE A1 1 9 ? -17.57 11.997 -9.334 1.0 72.21 9 A 7 -ATOM 123 H H . PHE A1 1 9 ? -15.081 13.21 -14.418 1.0 15.35 9 A 7 -ATOM 124 H HA . PHE A1 1 9 ? -17.532 11.596 -14.159 1.0 72.15 9 A 7 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.923 14.427 -13.336 1.0 13.22 9 A 7 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.579 13.871 -13.556 1.0 20.44 9 A 7 -ATOM 127 H HD1 . PHE A1 1 9 ? -15.453 13.146 -11.692 1.0 63.23 9 A 7 -ATOM 128 H HD2 . PHE A1 1 9 ? -19.689 12.76 -11.841 1.0 43.5 9 A 7 -ATOM 129 H HE1 . PHE A1 1 9 ? -15.448 12.246 -9.402 1.0 53.21 9 A 7 -ATOM 130 H HE2 . PHE A1 1 9 ? -19.691 11.86 -9.551 1.0 61.25 9 A 7 -ATOM 131 H HZ . PHE A1 1 9 ? -17.569 11.603 -8.328 1.0 11.33 9 A 7 -ATOM 132 N N . VAL A1 1 10 ? -18.46 12.252 -16.352 1.0 35.51 10 A 7 -ATOM 133 C CA . VAL A1 1 10 ? -18.972 12.572 -17.679 1.0 51.35 10 A 7 -ATOM 134 C C . VAL A1 1 10 ? -20.449 12.942 -17.623 1.0 20.3 10 A 7 -ATOM 135 O O . VAL A1 1 10 ? -21.254 12.244 -17.006 1.0 33.54 10 A 7 -ATOM 136 C CB . VAL A1 1 10 ? -18.786 11.391 -18.651 1.0 1.24 10 A 7 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.466 11.896 -20.05 1.0 43.55 10 A 7 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.696 10.456 -18.15 1.0 70.41 10 A 7 -ATOM 139 H H . VAL A1 1 10 ? -18.801 11.461 -15.885 1.0 13.11 10 A 7 -ATOM 140 H HA . VAL A1 1 10 ? -18.413 13.415 -18.059 1.0 52.2 10 A 7 -ATOM 141 H HB . VAL A1 1 10 ? -19.713 10.839 -18.696 1.0 21.21 10 A 7 -ATOM 142 H HG11 . VAL A1 1 10 ? -17.394 11.971 -20.168 1.0 75.22 10 A 7 -ATOM 143 H HG12 . VAL A1 1 10 ? -18.863 11.208 -20.781 1.0 54.41 10 A 7 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.911 12.87 -20.191 1.0 61.31 10 A 7 -ATOM 145 H HG21 . VAL A1 1 10 ? -16.868 11.036 -17.773 1.0 13.24 10 A 7 -ATOM 146 H HG22 . VAL A1 1 10 ? -18.091 9.835 -17.36 1.0 62.44 10 A 7 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.356 9.831 -18.963 1.0 2.35 10 A 7 -ATOM 148 N N . LYS A1 1 11 ? -20.801 14.047 -18.273 1.0 23.3 11 A 7 -ATOM 149 C CA . LYS A1 1 11 ? -22.183 14.511 -18.301 1.0 10.31 11 A 7 -ATOM 150 C C . LYS A1 1 11 ? -22.799 14.305 -19.68 1.0 22.12 11 A 7 -ATOM 151 O O . LYS A1 1 11 ? -22.4 14.945 -20.653 1.0 63.21 11 A 7 -ATOM 152 C CB . LYS A1 1 11 ? -22.253 15.991 -17.915 1.0 34.41 11 A 7 -ATOM 153 C CG . LYS A1 1 11 ? -23.631 16.603 -18.1 1.0 63.11 11 A 7 -ATOM 154 C CD . LYS A1 1 11 ? -23.564 17.9 -18.888 1.0 3.15 11 A 7 -ATOM 155 C CE . LYS A1 1 11 ? -23.362 17.64 -20.373 1.0 2.52 11 A 7 -ATOM 156 N NZ . LYS A1 1 11 ? -23.796 18.798 -21.202 1.0 51.12 11 A 7 -ATOM 157 H H . LYS A1 1 11 ? -20.115 14.561 -18.747 1.0 4.15 11 A 7 -ATOM 158 H HA . LYS A1 1 11 ? -22.742 13.934 -17.58 1.0 44.21 11 A 7 -ATOM 159 H HB2 . LYS A1 1 11 ? -21.972 16.094 -16.878 1.0 75.01 11 A 7 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.553 16.543 -18.526 1.0 15.43 11 A 7 -ATOM 161 H HG2 . LYS A1 1 11 ? -24.258 15.903 -18.632 1.0 73.24 11 A 7 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.058 16.804 -17.127 1.0 30.03 11 A 7 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.488 18.442 -18.751 1.0 63.51 11 A 7 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.738 18.493 -18.519 1.0 61.22 11 A 7 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.315 17.452 -20.553 1.0 70.24 11 A 7 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.938 16.771 -20.654 1.0 3.13 11 A 7 -ATOM 167 H HZ1 . LYS A1 1 11 ? -23.755 19.674 -20.643 1.0 1.34 11 A 7 -ATOM 168 H HZ2 . LYS A1 1 11 ? -24.772 18.656 -21.532 1.0 61.44 11 A 7 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.174 18.898 -22.03 1.0 12.11 11 A 7 -ATOM 170 N N . THR A1 1 12 ? -23.777 13.407 -19.759 1.0 60.33 12 A 7 -ATOM 171 C CA . THR A1 1 12 ? -24.449 13.116 -21.019 1.0 63.11 12 A 7 -ATOM 172 C C . THR A1 1 12 ? -25.405 14.239 -21.404 1.0 63.2 12 A 7 -ATOM 173 O O . THR A1 1 12 ? -25.859 15.002 -20.55 1.0 23.14 12 A 7 -ATOM 174 C CB . THR A1 1 12 ? -25.232 11.792 -20.946 1.0 13.53 12 A 7 -ATOM 175 O OG1 . THR A1 1 12 ? -26.378 11.947 -20.102 1.0 44.22 12 A 7 -ATOM 176 C CG2 . THR A1 1 12 ? -24.352 10.671 -20.414 1.0 44.25 12 A 7 -ATOM 177 H H . THR A1 1 12 ? -24.051 12.929 -18.949 1.0 50.31 12 A 7 -ATOM 178 H HA . THR A1 1 12 ? -23.693 13.022 -21.786 1.0 15.31 12 A 7 -ATOM 179 H HB . THR A1 1 12 ? -25.561 11.53 -21.942 1.0 3.11 12 A 7 -ATOM 180 H HG1 . THR A1 1 12 ? -26.092 12.112 -19.2 1.0 54.01 12 A 7 -ATOM 181 H HG21 . THR A1 1 12 ? -23.344 10.804 -20.776 1.0 54.24 12 A 7 -ATOM 182 H HG22 . THR A1 1 12 ? -24.735 9.721 -20.755 1.0 51.32 12 A 7 -ATOM 183 H HG23 . THR A1 1 12 ? -24.353 10.694 -19.334 1.0 74.05 12 A 7 -ATOM 184 N N . LEU A1 1 13 ? -25.709 14.336 -22.694 1.0 74.21 13 A 7 -ATOM 185 C CA . LEU A1 1 13 ? -26.613 15.366 -23.192 1.0 74.52 13 A 7 -ATOM 186 C C . LEU A1 1 13 ? -28.002 15.213 -22.58 1.0 25.21 13 A 7 -ATOM 187 O O . LEU A1 1 13 ? -28.815 16.138 -22.618 1.0 11.35 13 A 7 -ATOM 188 C CB . LEU A1 1 13 ? -26.705 15.297 -24.717 1.0 31.51 13 A 7 -ATOM 189 C CG . LEU A1 1 13 ? -27.244 16.547 -25.414 1.0 30.32 13 A 7 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.255 17.696 -25.289 1.0 44.31 13 A 7 -ATOM 191 C CD2 . LEU A1 1 13 ? -27.542 16.255 -26.877 1.0 64.01 13 A 7 -ATOM 192 H H . LEU A1 1 13 ? -25.316 13.699 -23.327 1.0 42.02 13 A 7 -ATOM 193 H HA . LEU A1 1 13 ? -26.211 16.326 -22.906 1.0 34.1 13 A 7 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.714 15.107 -25.1 1.0 62.11 13 A 7 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.352 14.47 -24.972 1.0 43.21 13 A 7 -ATOM 196 H HG . LEU A1 1 13 ? -28.166 16.848 -24.937 1.0 45.4 13 A 7 -ATOM 197 H HD11 . LEU A1 1 13 ? -25.907 17.98 -26.271 1.0 62.23 13 A 7 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.415 17.384 -24.685 1.0 23.44 13 A 7 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.741 18.54 -24.821 1.0 25.55 13 A 7 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.457 16.752 -27.164 1.0 62.14 13 A 7 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.652 15.19 -27.016 1.0 41.34 13 A 7 -ATOM 202 H HD23 . LEU A1 1 13 ? -26.728 16.616 -27.49 1.0 51.42 13 A 7 -ATOM 203 N N . THR A1 1 14 ? -28.268 14.04 -22.014 1.0 31.41 14 A 7 -ATOM 204 C CA . THR A1 1 14 ? -29.558 13.766 -21.393 1.0 30.33 14 A 7 -ATOM 205 C C . THR A1 1 14 ? -29.6 14.287 -19.961 1.0 22.13 14 A 7 -ATOM 206 O O . THR A1 1 14 ? -30.643 14.254 -19.309 1.0 5.31 14 A 7 -ATOM 207 C CB . THR A1 1 14 ? -29.871 12.258 -21.389 1.0 34.54 14 A 7 -ATOM 208 O OG1 . THR A1 1 14 ? -29.033 11.587 -20.442 1.0 3.22 14 A 7 -ATOM 209 C CG2 . THR A1 1 14 ? -29.663 11.659 -22.772 1.0 34.11 14 A 7 -ATOM 210 H H . THR A1 1 14 ? -27.58 13.343 -22.016 1.0 2.31 14 A 7 -ATOM 211 H HA . THR A1 1 14 ? -30.32 14.269 -21.971 1.0 25.44 14 A 7 -ATOM 212 H HB . THR A1 1 14 ? -30.905 12.121 -21.105 1.0 55.24 14 A 7 -ATOM 213 H HG1 . THR A1 1 14 ? -29.301 10.667 -20.372 1.0 24.42 14 A 7 -ATOM 214 H HG21 . THR A1 1 14 ? -30.246 10.754 -22.863 1.0 1.02 14 A 7 -ATOM 215 H HG22 . THR A1 1 14 ? -28.617 11.428 -22.911 1.0 12.23 14 A 7 -ATOM 216 H HG23 . THR A1 1 14 ? -29.978 12.368 -23.523 1.0 12.42 14 A 7 -ATOM 217 N N . GLY A1 1 15 ? -28.459 14.767 -19.477 1.0 61.2 15 A 7 -ATOM 218 C CA . GLY A1 1 15 ? -28.387 15.288 -18.124 1.0 25.44 15 A 7 -ATOM 219 C C . GLY A1 1 15 ? -28.157 14.199 -17.095 1.0 2.34 15 A 7 -ATOM 220 O O . GLY A1 1 15 ? -28.999 13.966 -16.227 1.0 24.03 15 A 7 -ATOM 221 H H . GLY A1 1 15 ? -27.658 14.767 -20.043 1.0 73.22 15 A 7 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.578 16.0 -18.067 1.0 10.15 15 A 7 -ATOM 223 H HA3 . GLY A1 1 15 ? -29.315 15.792 -17.896 1.0 23.53 15 A 7 -ATOM 224 N N . LYS A1 1 16 ? -27.015 13.527 -17.192 1.0 11.21 16 A 7 -ATOM 225 C CA . LYS A1 1 16 ? -26.675 12.456 -16.263 1.0 34.13 16 A 7 -ATOM 226 C C . LYS A1 1 16 ? -25.181 12.457 -15.954 1.0 15.24 16 A 7 -ATOM 227 O O . LYS A1 1 16 ? -24.349 12.498 -16.86 1.0 50.04 16 A 7 -ATOM 228 C CB . LYS A1 1 16 ? -27.086 11.101 -16.842 1.0 31.42 16 A 7 -ATOM 229 C CG . LYS A1 1 16 ? -27.399 10.057 -15.785 1.0 73.35 16 A 7 -ATOM 230 C CD . LYS A1 1 16 ? -26.156 9.278 -15.385 1.0 50.3 16 A 7 -ATOM 231 C CE . LYS A1 1 16 ? -25.653 8.408 -16.526 1.0 52.44 16 A 7 -ATOM 232 N NZ . LYS A1 1 16 ? -25.985 6.971 -16.316 1.0 2.53 16 A 7 -ATOM 233 H H . LYS A1 1 16 ? -26.384 13.759 -17.906 1.0 52.54 16 A 7 -ATOM 234 H HA . LYS A1 1 16 ? -27.22 12.627 -15.347 1.0 34.34 16 A 7 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.964 11.237 -17.456 1.0 44.24 16 A 7 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.281 10.728 -17.459 1.0 12.13 16 A 7 -ATOM 237 H HG2 . LYS A1 1 16 ? -27.798 10.55 -14.911 1.0 3.41 16 A 7 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.133 9.368 -16.178 1.0 74.14 16 A 7 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.379 9.975 -15.109 1.0 63.23 16 A 7 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.394 8.648 -14.54 1.0 14.51 16 A 7 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.108 8.743 -17.445 1.0 44.12 16 A 7 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.58 8.514 -16.596 1.0 75.31 16 A 7 -ATOM 243 H HZ1 . LYS A1 1 16 ? -26.147 6.504 -17.231 1.0 61.55 16 A 7 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.845 6.885 -15.738 1.0 23.15 16 A 7 -ATOM 245 H HZ3 . LYS A1 1 16 ? -25.203 6.491 -15.827 1.0 43.23 16 A 7 -ATOM 246 N N . THR A1 1 17 ? -24.847 12.411 -14.668 1.0 33.03 17 A 7 -ATOM 247 C CA . THR A1 1 17 ? -23.454 12.406 -14.239 1.0 61.21 17 A 7 -ATOM 248 C C . THR A1 1 17 ? -22.97 10.988 -13.958 1.0 13.11 17 A 7 -ATOM 249 O O . THR A1 1 17 ? -23.497 10.305 -13.08 1.0 32.24 17 A 7 -ATOM 250 C CB . THR A1 1 17 ? -23.252 13.265 -12.977 1.0 22.54 17 A 7 -ATOM 251 O OG1 . THR A1 1 17 ? -24.483 13.372 -12.254 1.0 24.32 17 A 7 -ATOM 252 C CG2 . THR A1 1 17 ? -22.75 14.654 -13.342 1.0 72.42 17 A 7 -ATOM 253 H H . THR A1 1 17 ? -25.556 12.38 -13.992 1.0 63.53 17 A 7 -ATOM 254 H HA . THR A1 1 17 ? -22.859 12.828 -15.036 1.0 15.15 17 A 7 -ATOM 255 H HB . THR A1 1 17 ? -22.514 12.786 -12.349 1.0 61.22 17 A 7 -ATOM 256 H HG1 . THR A1 1 17 ? -24.305 13.34 -11.311 1.0 54.0 17 A 7 -ATOM 257 H HG21 . THR A1 1 17 ? -23.268 15.391 -12.747 1.0 31.34 17 A 7 -ATOM 258 H HG22 . THR A1 1 17 ? -22.939 14.841 -14.389 1.0 12.24 17 A 7 -ATOM 259 H HG23 . THR A1 1 17 ? -21.69 14.716 -13.15 1.0 74.01 17 A 7 -ATOM 260 N N . ILE A1 1 18 ? -21.964 10.552 -14.709 1.0 21.15 18 A 7 -ATOM 261 C CA . ILE A1 1 18 ? -21.409 9.215 -14.539 1.0 42.23 18 A 7 -ATOM 262 C C . ILE A1 1 18 ? -19.939 9.278 -14.136 1.0 2.02 18 A 7 -ATOM 263 O O . ILE A1 1 18 ? -19.178 10.099 -14.648 1.0 34.24 18 A 7 -ATOM 264 C CB . ILE A1 1 18 ? -21.542 8.382 -15.827 1.0 20.13 18 A 7 -ATOM 265 C CG1 . ILE A1 1 18 ? -20.646 7.144 -15.754 1.0 0.43 18 A 7 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.189 9.226 -17.042 1.0 34.34 18 A 7 -ATOM 267 C CD1 . ILE A1 1 18 ? -20.909 6.142 -16.856 1.0 41.12 18 A 7 -ATOM 268 H H . ILE A1 1 18 ? -21.587 11.143 -15.393 1.0 72.35 18 A 7 -ATOM 269 H HA . ILE A1 1 18 ? -21.965 8.721 -13.755 1.0 33.1 18 A 7 -ATOM 270 H HB . ILE A1 1 18 ? -22.57 8.068 -15.922 1.0 55.23 18 A 7 -ATOM 271 H HG12 . ILE A1 1 18 ? -19.614 7.449 -15.823 1.0 35.45 18 A 7 -ATOM 272 H HG13 . ILE A1 1 18 ? -20.807 6.647 -14.808 1.0 15.51 18 A 7 -ATOM 273 H HG21 . ILE A1 1 18 ? -21.878 10.054 -17.117 1.0 31.24 18 A 7 -ATOM 274 H HG22 . ILE A1 1 18 ? -20.184 9.604 -16.938 1.0 60.32 18 A 7 -ATOM 275 H HG23 . ILE A1 1 18 ? -21.256 8.62 -17.934 1.0 71.44 18 A 7 -ATOM 276 H HD11 . ILE A1 1 18 ? -21.303 6.654 -17.722 1.0 32.31 18 A 7 -ATOM 277 H HD12 . ILE A1 1 18 ? -19.986 5.647 -17.121 1.0 60.24 18 A 7 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.625 5.41 -16.515 1.0 25.35 18 A 7 -ATOM 279 N N . THR A1 1 19 ? -19.545 8.403 -13.216 1.0 42.32 19 A 7 -ATOM 280 C CA . THR A1 1 19 ? -18.167 8.358 -12.745 1.0 41.24 19 A 7 -ATOM 281 C C . THR A1 1 19 ? -17.459 7.1 -13.236 1.0 70.21 19 A 7 -ATOM 282 O O . THR A1 1 19 ? -18.036 6.013 -13.238 1.0 44.42 19 A 7 -ATOM 283 C CB . THR A1 1 19 ? -18.097 8.406 -11.207 1.0 2.4 19 A 7 -ATOM 284 O OG1 . THR A1 1 19 ? -19.204 9.152 -10.689 1.0 22.32 19 A 7 -ATOM 285 C CG2 . THR A1 1 19 ? -16.792 9.036 -10.744 1.0 13.14 19 A 7 -ATOM 286 H H . THR A1 1 19 ? -20.199 7.774 -12.846 1.0 1.15 19 A 7 -ATOM 287 H HA . THR A1 1 19 ? -17.652 9.225 -13.135 1.0 65.43 19 A 7 -ATOM 288 H HB . THR A1 1 19 ? -18.145 7.395 -10.828 1.0 44.24 19 A 7 -ATOM 289 H HG1 . THR A1 1 19 ? -19.192 9.118 -9.729 1.0 60.25 19 A 7 -ATOM 290 H HG21 . THR A1 1 19 ? -15.979 8.347 -10.913 1.0 73.33 19 A 7 -ATOM 291 H HG22 . THR A1 1 19 ? -16.857 9.264 -9.69 1.0 23.45 19 A 7 -ATOM 292 H HG23 . THR A1 1 19 ? -16.615 9.946 -11.299 1.0 51.03 19 A 7 -ATOM 293 N N . ILE A1 1 20 ? -16.206 7.256 -13.65 1.0 2.13 20 A 7 -ATOM 294 C CA . ILE A1 1 20 ? -15.419 6.132 -14.142 1.0 23.24 20 A 7 -ATOM 295 C C . ILE A1 1 20 ? -13.962 6.25 -13.71 1.0 21.51 20 A 7 -ATOM 296 O O . ILE A1 1 20 ? -13.343 7.304 -13.859 1.0 3.54 20 A 7 -ATOM 297 C CB . ILE A1 1 20 ? -15.481 6.029 -15.677 1.0 55.55 20 A 7 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.547 7.425 -16.301 1.0 1.5 20 A 7 -ATOM 299 C CG2 . ILE A1 1 20 ? -16.68 5.195 -16.104 1.0 1.32 20 A 7 -ATOM 300 C CD1 . ILE A1 1 20 ? -14.872 7.516 -17.651 1.0 2.4 20 A 7 -ATOM 301 H H . ILE A1 1 20 ? -15.801 8.148 -13.624 1.0 32.52 20 A 7 -ATOM 302 H HA . ILE A1 1 20 ? -15.835 5.226 -13.723 1.0 40.32 20 A 7 -ATOM 303 H HB . ILE A1 1 20 ? -14.587 5.532 -16.019 1.0 75.22 20 A 7 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.58 7.708 -16.427 1.0 4.24 20 A 7 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.064 8.13 -15.639 1.0 20.02 20 A 7 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.565 5.815 -16.113 1.0 41.11 20 A 7 -ATOM 307 H HG22 . ILE A1 1 20 ? -16.508 4.8 -17.094 1.0 51.34 20 A 7 -ATOM 308 H HG23 . ILE A1 1 20 ? -16.818 4.381 -15.41 1.0 74.34 20 A 7 -ATOM 309 H HD11 . ILE A1 1 20 ? -13.803 7.591 -17.515 1.0 44.23 20 A 7 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.098 6.631 -18.228 1.0 43.31 20 A 7 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.229 8.389 -18.175 1.0 23.14 20 A 7 -ATOM 312 N N . ASP A1 1 21 ? -13.419 5.162 -13.175 1.0 44.41 21 A 7 -ATOM 313 C CA . ASP A1 1 21 ? -12.032 5.142 -12.724 1.0 13.43 21 A 7 -ATOM 314 C C . ASP A1 1 21 ? -11.087 4.845 -13.884 1.0 74.52 21 A 7 -ATOM 315 O O . ASP A1 1 21 ? -11.178 3.793 -14.518 1.0 3.25 21 A 7 -ATOM 316 C CB . ASP A1 1 21 ? -11.847 4.1 -11.62 1.0 40.32 21 A 7 -ATOM 317 C CG . ASP A1 1 21 ? -12.287 2.715 -12.051 1.0 70.32 21 A 7 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.481 2.392 -11.879 1.0 34.41 21 A 7 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.438 1.954 -12.56 1.0 4.34 21 A 7 -ATOM 320 H H . ASP A1 1 21 ? -13.963 4.352 -13.083 1.0 61.24 21 A 7 -ATOM 321 H HA . ASP A1 1 21 ? -11.798 6.119 -12.328 1.0 0.1 21 A 7 -ATOM 322 H HB2 . ASP A1 1 21 ? -10.803 4.057 -11.345 1.0 73.15 21 A 7 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.43 4.392 -10.758 1.0 61.23 21 A 7 -ATOM 324 N N . VAL A1 1 22 ? -10.181 5.778 -14.157 1.0 30.34 22 A 7 -ATOM 325 C CA . VAL A1 1 22 ? -9.219 5.616 -15.241 1.0 1.34 22 A 7 -ATOM 326 C C . VAL A1 1 22 ? -7.795 5.848 -14.751 1.0 61.2 22 A 7 -ATOM 327 O O . VAL A1 1 22 ? -7.58 6.435 -13.69 1.0 34.03 22 A 7 -ATOM 328 C CB . VAL A1 1 22 ? -9.514 6.584 -16.403 1.0 60.13 22 A 7 -ATOM 329 C CG1 . VAL A1 1 22 ? -10.954 7.07 -16.34 1.0 14.0 22 A 7 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.545 7.756 -16.378 1.0 61.12 22 A 7 -ATOM 331 H H . VAL A1 1 22 ? -10.158 6.595 -13.616 1.0 71.0 22 A 7 -ATOM 332 H HA . VAL A1 1 22 ? -9.302 4.605 -15.613 1.0 41.13 22 A 7 -ATOM 333 H HB . VAL A1 1 22 ? -9.378 6.05 -17.332 1.0 23.42 22 A 7 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.055 7.791 -15.542 1.0 3.13 22 A 7 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.22 7.532 -17.279 1.0 11.12 22 A 7 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.609 6.232 -16.152 1.0 2.3 22 A 7 -ATOM 337 H HG21 . VAL A1 1 22 ? -8.494 8.161 -15.379 1.0 43.3 22 A 7 -ATOM 338 H HG22 . VAL A1 1 22 ? -7.565 7.418 -16.681 1.0 71.52 22 A 7 -ATOM 339 H HG23 . VAL A1 1 22 ? -8.888 8.521 -17.059 1.0 24.41 22 A 7 -ATOM 340 N N . ASP A1 1 23 ? -6.824 5.383 -15.53 1.0 73.14 23 A 7 -ATOM 341 C CA . ASP A1 1 23 ? -5.418 5.541 -15.176 1.0 0.33 23 A 7 -ATOM 342 C C . ASP A1 1 23 ? -4.685 6.376 -16.221 1.0 62.12 23 A 7 -ATOM 343 O O . ASP A1 1 23 ? -5.157 6.533 -17.347 1.0 35.34 23 A 7 -ATOM 344 C CB . ASP A1 1 23 ? -4.748 4.172 -15.037 1.0 24.44 23 A 7 -ATOM 345 C CG . ASP A1 1 23 ? -3.698 4.15 -13.944 1.0 11.25 23 A 7 -ATOM 346 O OD1 . ASP A1 1 23 ? -2.806 5.024 -13.961 1.0 71.52 23 A 7 -ATOM 347 O OD2 . ASP A1 1 23 ? -3.767 3.258 -13.072 1.0 54.12 23 A 7 -ATOM 348 H H . ASP A1 1 23 ? -7.059 4.923 -16.363 1.0 71.31 23 A 7 -ATOM 349 H HA . ASP A1 1 23 ? -5.37 6.052 -14.226 1.0 62.03 23 A 7 -ATOM 350 H HB2 . ASP A1 1 23 ? -5.5 3.433 -14.803 1.0 75.32 23 A 7 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.275 3.914 -15.973 1.0 32.1 23 A 7 -ATOM 352 N N . HIS A1 1 24 ? -3.529 6.91 -15.839 1.0 3.42 24 A 7 -ATOM 353 C CA . HIS A1 1 24 ? -2.731 7.731 -16.744 1.0 64.1 24 A 7 -ATOM 354 C C . HIS A1 1 24 ? -2.337 6.941 -17.988 1.0 13.22 24 A 7 -ATOM 355 O O . HIS A1 1 24 ? -1.948 7.518 -19.003 1.0 40.32 24 A 7 -ATOM 356 C CB . HIS A1 1 24 ? -1.478 8.24 -16.031 1.0 43.52 24 A 7 -ATOM 357 C CG . HIS A1 1 24 ? -0.655 7.152 -15.415 1.0 63.23 24 A 7 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.431 7.054 -14.057 1.0 33.23 24 A 7 -ATOM 359 C CD2 . HIS A1 1 24 ? -0.001 6.109 -15.978 1.0 70.35 24 A 7 -ATOM 360 C CE1 . HIS A1 1 24 ? 0.326 6.0 -13.813 1.0 52.22 24 A 7 -ATOM 361 N NE2 . HIS A1 1 24 ? 0.6 5.408 -14.961 1.0 51.1 24 A 7 -ATOM 362 H H . HIS A1 1 24 ? -3.206 6.749 -14.929 1.0 35.01 24 A 7 -ATOM 363 H HA . HIS A1 1 24 ? -3.332 8.575 -17.044 1.0 52.33 24 A 7 -ATOM 364 H HB2 . HIS A1 1 24 ? -0.855 8.764 -16.742 1.0 74.33 24 A 7 -ATOM 365 H HB3 . HIS A1 1 24 ? -1.77 8.922 -15.246 1.0 2.24 24 A 7 -ATOM 366 H HD1 . HIS A1 1 24 ? -0.774 7.668 -13.375 1.0 61.24 24 A 7 -ATOM 367 H HD2 . HIS A1 1 24 ? 0.04 5.871 -17.032 1.0 14.35 24 A 7 -ATOM 368 H HE1 . HIS A1 1 24 ? 0.663 5.675 -12.84 1.0 73.24 24 A 7 -ATOM 369 N N . ALA A1 1 25 ? -2.441 5.619 -17.902 1.0 63.43 25 A 7 -ATOM 370 C CA . ALA A1 1 25 ? -2.097 4.751 -19.022 1.0 43.32 25 A 7 -ATOM 371 C C . ALA A1 1 25 ? -3.311 4.491 -19.908 1.0 33.54 25 A 7 -ATOM 372 O O . ALA A1 1 25 ? -3.249 3.691 -20.841 1.0 12.23 25 A 7 -ATOM 373 C CB . ALA A1 1 25 ? -1.521 3.438 -18.514 1.0 51.34 25 A 7 -ATOM 374 H H . ALA A1 1 25 ? -2.757 5.218 -17.066 1.0 55.41 25 A 7 -ATOM 375 H HA . ALA A1 1 25 ? -1.336 5.247 -19.607 1.0 23.12 25 A 7 -ATOM 376 H HB1 . ALA A1 1 25 ? -1.343 2.776 -19.349 1.0 42.21 25 A 7 -ATOM 377 H HB2 . ALA A1 1 25 ? -0.591 3.628 -18.0 1.0 3.14 25 A 7 -ATOM 378 H HB3 . ALA A1 1 25 ? -2.221 2.977 -17.833 1.0 44.44 25 A 7 -ATOM 379 N N . ASP A1 1 26 ? -4.412 5.171 -19.609 1.0 53.31 26 A 7 -ATOM 380 C CA . ASP A1 1 26 ? -5.64 5.014 -20.379 1.0 71.32 26 A 7 -ATOM 381 C C . ASP A1 1 26 ? -5.973 6.295 -21.138 1.0 31.24 26 A 7 -ATOM 382 O O . ASP A1 1 26 ? -6.165 7.353 -20.539 1.0 53.43 26 A 7 -ATOM 383 C CB . ASP A1 1 26 ? -6.801 4.637 -19.457 1.0 21.1 26 A 7 -ATOM 384 C CG . ASP A1 1 26 ? -6.58 3.307 -18.763 1.0 73.54 26 A 7 -ATOM 385 O OD1 . ASP A1 1 26 ? -6.587 2.268 -19.455 1.0 73.22 26 A 7 -ATOM 386 O OD2 . ASP A1 1 26 ? -6.4 3.305 -17.527 1.0 2.02 26 A 7 -ATOM 387 H H . ASP A1 1 26 ? -4.398 5.795 -18.853 1.0 73.33 26 A 7 -ATOM 388 H HA . ASP A1 1 26 ? -5.485 4.218 -21.092 1.0 35.3 26 A 7 -ATOM 389 H HB2 . ASP A1 1 26 ? -6.915 5.401 -18.702 1.0 71.15 26 A 7 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.708 4.572 -20.039 1.0 51.4 26 A 7 -ATOM 391 N N . THR A1 1 27 ? -6.039 6.192 -22.462 1.0 11.22 27 A 7 -ATOM 392 C CA . THR A1 1 27 ? -6.347 7.341 -23.304 1.0 12.11 27 A 7 -ATOM 393 C C . THR A1 1 27 ? -7.85 7.579 -23.381 1.0 24.55 27 A 7 -ATOM 394 O O . THR A1 1 27 ? -8.645 6.744 -22.949 1.0 14.34 27 A 7 -ATOM 395 C CB . THR A1 1 27 ? -5.793 7.158 -24.729 1.0 24.42 27 A 7 -ATOM 396 O OG1 . THR A1 1 27 ? -5.862 5.778 -25.108 1.0 51.41 27 A 7 -ATOM 397 C CG2 . THR A1 1 27 ? -4.354 7.642 -24.818 1.0 72.22 27 A 7 -ATOM 398 H H . THR A1 1 27 ? -5.877 5.321 -22.881 1.0 1.33 27 A 7 -ATOM 399 H HA . THR A1 1 27 ? -5.876 8.21 -22.866 1.0 54.42 27 A 7 -ATOM 400 H HB . THR A1 1 27 ? -6.396 7.74 -25.411 1.0 51.23 27 A 7 -ATOM 401 H HG1 . THR A1 1 27 ? -5.909 5.71 -26.064 1.0 23.44 27 A 7 -ATOM 402 H HG21 . THR A1 1 27 ? -3.995 7.52 -25.829 1.0 20.21 27 A 7 -ATOM 403 H HG22 . THR A1 1 27 ? -3.738 7.064 -24.145 1.0 40.31 27 A 7 -ATOM 404 H HG23 . THR A1 1 27 ? -4.308 8.685 -24.542 1.0 53.14 27 A 7 -ATOM 405 N N . VAL A1 1 28 ? -8.236 8.725 -23.935 1.0 70.04 28 A 7 -ATOM 406 C CA . VAL A1 1 28 ? -9.645 9.072 -24.071 1.0 40.12 28 A 7 -ATOM 407 C C . VAL A1 1 28 ? -10.423 7.954 -24.755 1.0 43.3 28 A 7 -ATOM 408 O O . VAL A1 1 28 ? -11.491 7.553 -24.293 1.0 51.44 28 A 7 -ATOM 409 C CB . VAL A1 1 28 ? -9.827 10.374 -24.874 1.0 70.14 28 A 7 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.221 10.944 -24.657 1.0 13.41 28 A 7 -ATOM 411 C CG2 . VAL A1 1 28 ? -8.761 11.389 -24.49 1.0 73.55 28 A 7 -ATOM 412 H H . VAL A1 1 28 ? -7.556 9.35 -24.261 1.0 50.23 28 A 7 -ATOM 413 H HA . VAL A1 1 28 ? -10.049 9.225 -23.081 1.0 62.42 28 A 7 -ATOM 414 H HB . VAL A1 1 28 ? -9.715 10.145 -25.923 1.0 52.41 28 A 7 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.437 11.669 -25.429 1.0 72.32 28 A 7 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.947 10.146 -24.697 1.0 75.12 28 A 7 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.267 11.425 -23.691 1.0 43.12 28 A 7 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.615 11.372 -23.42 1.0 22.23 28 A 7 -ATOM 419 H HG22 . VAL A1 1 28 ? -7.834 11.141 -24.985 1.0 21.24 28 A 7 -ATOM 420 H HG23 . VAL A1 1 28 ? -9.078 12.377 -24.793 1.0 51.43 28 A 7 -ATOM 421 N N . GLY A1 1 29 ? -9.88 7.452 -25.86 1.0 51.02 29 A 7 -ATOM 422 C CA . GLY A1 1 29 ? -10.537 6.384 -26.591 1.0 24.21 29 A 7 -ATOM 423 C C . GLY A1 1 29 ? -11.019 5.271 -25.681 1.0 62.32 29 A 7 -ATOM 424 O O . GLY A1 1 29 ? -12.18 4.866 -25.747 1.0 1.41 29 A 7 -ATOM 425 H H . GLY A1 1 29 ? -9.027 7.81 -26.182 1.0 25.44 29 A 7 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.383 6.793 -27.122 1.0 33.14 29 A 7 -ATOM 427 H HA3 . GLY A1 1 29 ? -9.84 5.971 -27.306 1.0 61.11 29 A 7 -ATOM 428 N N . ALA A1 1 30 ? -10.127 4.775 -24.831 1.0 0.3 30 A 7 -ATOM 429 C CA . ALA A1 1 30 ? -10.468 3.703 -23.904 1.0 24.42 30 A 7 -ATOM 430 C C . ALA A1 1 30 ? -11.585 4.13 -22.958 1.0 23.15 30 A 7 -ATOM 431 O O . ALA A1 1 30 ? -12.441 3.326 -22.588 1.0 23.32 30 A 7 -ATOM 432 C CB . ALA A1 1 30 ? -9.239 3.276 -23.115 1.0 4.23 30 A 7 -ATOM 433 H H . ALA A1 1 30 ? -9.217 5.139 -24.826 1.0 13.0 30 A 7 -ATOM 434 H HA . ALA A1 1 30 ? -10.806 2.855 -24.484 1.0 42.35 30 A 7 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.51 2.488 -22.428 1.0 24.3 30 A 7 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.482 2.916 -23.796 1.0 15.25 30 A 7 -ATOM 437 H HB3 . ALA A1 1 30 ? -8.855 4.12 -22.563 1.0 54.13 30 A 7 -ATOM 438 N N . VAL A1 1 31 ? -11.57 5.4 -22.568 1.0 44.02 31 A 7 -ATOM 439 C CA . VAL A1 1 31 ? -12.582 5.935 -21.664 1.0 44.43 31 A 7 -ATOM 440 C C . VAL A1 1 31 ? -13.962 5.912 -22.31 1.0 22.33 31 A 7 -ATOM 441 O O . VAL A1 1 31 ? -14.945 5.511 -21.686 1.0 41.34 31 A 7 -ATOM 442 C CB . VAL A1 1 31 ? -12.25 7.378 -21.24 1.0 42.01 31 A 7 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.378 7.962 -20.404 1.0 61.22 31 A 7 -ATOM 444 C CG2 . VAL A1 1 31 ? -10.934 7.419 -20.478 1.0 34.2 31 A 7 -ATOM 445 H H . VAL A1 1 31 ? -10.862 5.993 -22.896 1.0 33.11 31 A 7 -ATOM 446 H HA . VAL A1 1 31 ? -12.598 5.316 -20.778 1.0 53.53 31 A 7 -ATOM 447 H HB . VAL A1 1 31 ? -12.144 7.978 -22.131 1.0 34.14 31 A 7 -ATOM 448 H HG11 . VAL A1 1 31 ? -12.972 8.386 -19.498 1.0 24.43 31 A 7 -ATOM 449 H HG12 . VAL A1 1 31 ? -13.884 8.731 -20.968 1.0 62.24 31 A 7 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.08 7.18 -20.151 1.0 4.44 31 A 7 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.137 7.702 -21.149 1.0 32.4 31 A 7 -ATOM 452 H HG22 . VAL A1 1 31 ? -11.004 8.141 -19.678 1.0 31.51 31 A 7 -ATOM 453 H HG23 . VAL A1 1 31 ? -10.726 6.443 -20.064 1.0 2.41 31 A 7 -ATOM 454 N N . LYS A1 1 32 ? -14.03 6.343 -23.565 1.0 44.33 32 A 7 -ATOM 455 C CA . LYS A1 1 32 ? -15.29 6.371 -24.298 1.0 33.41 32 A 7 -ATOM 456 C C . LYS A1 1 32 ? -15.945 4.994 -24.307 1.0 33.52 32 A 7 -ATOM 457 O O . LYS A1 1 32 ? -17.156 4.87 -24.126 1.0 55.22 32 A 7 -ATOM 458 C CB . LYS A1 1 32 ? -15.058 6.847 -25.734 1.0 21.43 32 A 7 -ATOM 459 C CG . LYS A1 1 32 ? -15.779 8.141 -26.07 1.0 62.04 32 A 7 -ATOM 460 C CD . LYS A1 1 32 ? -14.853 9.341 -25.956 1.0 13.3 32 A 7 -ATOM 461 C CE . LYS A1 1 32 ? -14.328 9.771 -27.317 1.0 61.02 32 A 7 -ATOM 462 N NZ . LYS A1 1 32 ? -13.756 8.626 -28.079 1.0 10.13 32 A 7 -ATOM 463 H H . LYS A1 1 32 ? -13.211 6.65 -24.009 1.0 0.43 32 A 7 -ATOM 464 H HA . LYS A1 1 32 ? -15.949 7.066 -23.8 1.0 20.21 32 A 7 -ATOM 465 H HB2 . LYS A1 1 32 ? -13.999 7.0 -25.883 1.0 31.13 32 A 7 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.401 6.081 -26.414 1.0 51.43 32 A 7 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.151 8.082 -27.082 1.0 34.55 32 A 7 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.606 8.269 -25.387 1.0 75.31 32 A 7 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.397 10.163 -25.516 1.0 62.53 32 A 7 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.017 9.08 -25.323 1.0 34.24 32 A 7 -ATOM 471 H HE2 . LYS A1 1 32 ? -15.141 10.198 -27.884 1.0 32.35 32 A 7 -ATOM 472 H HE3 . LYS A1 1 32 ? -13.56 10.516 -27.173 1.0 31.14 32 A 7 -ATOM 473 H HZ1 . LYS A1 1 32 ? -13.059 8.121 -27.495 1.0 3.34 32 A 7 -ATOM 474 H HZ2 . LYS A1 1 32 ? -13.288 8.969 -28.942 1.0 11.13 32 A 7 -ATOM 475 H HZ3 . LYS A1 1 32 ? -14.511 7.963 -28.348 1.0 13.55 32 A 7 -ATOM 476 N N . ALA A1 1 33 ? -15.136 3.96 -24.517 1.0 34.21 33 A 7 -ATOM 477 C CA . ALA A1 1 33 ? -15.636 2.592 -24.546 1.0 60.31 33 A 7 -ATOM 478 C C . ALA A1 1 33 ? -16.213 2.189 -23.193 1.0 31.03 33 A 7 -ATOM 479 O O . ALA A1 1 33 ? -17.254 1.536 -23.119 1.0 31.32 33 A 7 -ATOM 480 C CB . ALA A1 1 33 ? -14.528 1.633 -24.956 1.0 54.24 33 A 7 -ATOM 481 H H . ALA A1 1 33 ? -14.179 4.122 -24.655 1.0 43.1 33 A 7 -ATOM 482 H HA . ALA A1 1 33 ? -16.418 2.538 -25.29 1.0 53.01 33 A 7 -ATOM 483 H HB1 . ALA A1 1 33 ? -13.655 1.811 -24.345 1.0 2.33 33 A 7 -ATOM 484 H HB2 . ALA A1 1 33 ? -14.863 0.616 -24.819 1.0 61.23 33 A 7 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.279 1.794 -25.995 1.0 53.23 33 A 7 -ATOM 486 N N . LYS A1 1 34 ? -15.529 2.582 -22.124 1.0 30.14 34 A 7 -ATOM 487 C CA . LYS A1 1 34 ? -15.972 2.263 -20.772 1.0 3.41 34 A 7 -ATOM 488 C C . LYS A1 1 34 ? -17.356 2.846 -20.501 1.0 51.04 34 A 7 -ATOM 489 O O . LYS A1 1 34 ? -18.217 2.182 -19.924 1.0 30.3 34 A 7 -ATOM 490 C CB . LYS A1 1 34 ? -14.972 2.799 -19.745 1.0 63.02 34 A 7 -ATOM 491 C CG . LYS A1 1 34 ? -15.329 2.453 -18.31 1.0 24.43 34 A 7 -ATOM 492 C CD . LYS A1 1 34 ? -14.168 2.718 -17.367 1.0 44.42 34 A 7 -ATOM 493 C CE . LYS A1 1 34 ? -14.599 2.622 -15.911 1.0 34.12 34 A 7 -ATOM 494 N NZ . LYS A1 1 34 ? -14.026 1.423 -15.241 1.0 13.0 34 A 7 -ATOM 495 H H . LYS A1 1 34 ? -14.706 3.1 -22.247 1.0 65.25 34 A 7 -ATOM 496 H HA . LYS A1 1 34 ? -16.025 1.189 -20.685 1.0 3.22 34 A 7 -ATOM 497 H HB2 . LYS A1 1 34 ? -13.997 2.387 -19.961 1.0 71.03 34 A 7 -ATOM 498 H HB3 . LYS A1 1 34 ? -14.926 3.875 -19.833 1.0 71.12 34 A 7 -ATOM 499 H HG2 . LYS A1 1 34 ? -16.173 3.054 -18.003 1.0 24.23 34 A 7 -ATOM 500 H HG3 . LYS A1 1 34 ? -15.593 1.406 -18.257 1.0 22.21 34 A 7 -ATOM 501 H HD2 . LYS A1 1 34 ? -13.393 1.989 -17.549 1.0 63.43 34 A 7 -ATOM 502 H HD3 . LYS A1 1 34 ? -13.783 3.71 -17.554 1.0 75.33 34 A 7 -ATOM 503 H HE2 . LYS A1 1 34 ? -14.266 3.508 -15.392 1.0 34.14 34 A 7 -ATOM 504 H HE3 . LYS A1 1 34 ? -15.677 2.566 -15.872 1.0 0.12 34 A 7 -ATOM 505 H HZ1 . LYS A1 1 34 ? -13.07 1.233 -15.604 1.0 62.42 34 A 7 -ATOM 506 H HZ2 . LYS A1 1 34 ? -14.625 0.592 -15.421 1.0 14.2 34 A 7 -ATOM 507 H HZ3 . LYS A1 1 34 ? -13.971 1.579 -14.214 1.0 65.2 34 A 7 -ATOM 508 N N . ILE A1 1 35 ? -17.562 4.089 -20.924 1.0 14.42 35 A 7 -ATOM 509 C CA . ILE A1 1 35 ? -18.842 4.759 -20.729 1.0 22.32 35 A 7 -ATOM 510 C C . ILE A1 1 35 ? -19.944 4.085 -21.539 1.0 74.31 35 A 7 -ATOM 511 O O . ILE A1 1 35 ? -21.089 3.997 -21.096 1.0 33.23 35 A 7 -ATOM 512 C CB . ILE A1 1 35 ? -18.765 6.245 -21.125 1.0 42.5 35 A 7 -ATOM 513 C CG1 . ILE A1 1 35 ? -17.633 6.94 -20.365 1.0 22.04 35 A 7 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.094 6.935 -20.854 1.0 45.14 35 A 7 -ATOM 515 C CD1 . ILE A1 1 35 ? -17.789 6.88 -18.861 1.0 11.1 35 A 7 -ATOM 516 H H . ILE A1 1 35 ? -16.837 4.566 -21.378 1.0 54.44 35 A 7 -ATOM 517 H HA . ILE A1 1 35 ? -19.093 4.699 -19.68 1.0 30.01 35 A 7 -ATOM 518 H HB . ILE A1 1 35 ? -18.566 6.303 -22.184 1.0 2.44 35 A 7 -ATOM 519 H HG12 . ILE A1 1 35 ? -16.696 6.471 -20.62 1.0 3.24 35 A 7 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.601 7.981 -20.655 1.0 0.11 35 A 7 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.819 6.204 -20.528 1.0 65.32 35 A 7 -ATOM 522 H HG22 . ILE A1 1 35 ? -19.962 7.678 -20.082 1.0 43.1 35 A 7 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.443 7.411 -21.757 1.0 75.41 35 A 7 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.331 7.752 -18.417 1.0 43.52 35 A 7 -ATOM 525 H HD12 . ILE A1 1 35 ? -18.839 6.858 -18.608 1.0 71.15 35 A 7 -ATOM 526 H HD13 . ILE A1 1 35 ? -17.308 5.99 -18.484 1.0 74.3 35 A 7 -ATOM 527 N N . TYR A1 1 36 ? -19.59 3.61 -22.728 1.0 62.53 36 A 7 -ATOM 528 C CA . TYR A1 1 36 ? -20.549 2.944 -23.601 1.0 64.44 36 A 7 -ATOM 529 C C . TYR A1 1 36 ? -21.198 1.758 -22.894 1.0 53.42 36 A 7 -ATOM 530 O O . TYR A1 1 36 ? -22.414 1.574 -22.954 1.0 34.33 36 A 7 -ATOM 531 C CB . TYR A1 1 36 ? -19.862 2.473 -24.884 1.0 74.42 36 A 7 -ATOM 532 C CG . TYR A1 1 36 ? -20.204 1.051 -25.267 1.0 43.51 36 A 7 -ATOM 533 C CD1 . TYR A1 1 36 ? -21.453 0.73 -25.783 1.0 62.31 36 A 7 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.276 0.027 -25.113 1.0 22.21 36 A 7 -ATOM 535 C CE1 . TYR A1 1 36 ? -21.769 -0.568 -26.134 1.0 25.24 36 A 7 -ATOM 536 C CE2 . TYR A1 1 36 ? -19.583 -1.274 -25.462 1.0 24.41 36 A 7 -ATOM 537 C CZ . TYR A1 1 36 ? -20.831 -1.566 -25.971 1.0 51.0 36 A 7 -ATOM 538 O OH . TYR A1 1 36 ? -21.142 -2.861 -26.32 1.0 31.41 36 A 7 -ATOM 539 H H . TYR A1 1 36 ? -18.662 3.71 -23.027 1.0 42.53 36 A 7 -ATOM 540 H HA . TYR A1 1 36 ? -21.317 3.659 -23.858 1.0 45.34 36 A 7 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.157 3.115 -25.699 1.0 32.41 36 A 7 -ATOM 542 H HB3 . TYR A1 1 36 ? -18.791 2.534 -24.753 1.0 73.31 36 A 7 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.185 1.514 -25.909 1.0 14.41 36 A 7 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.299 0.26 -24.713 1.0 73.43 36 A 7 -ATOM 545 H HE1 . TYR A1 1 36 ? -22.746 -0.798 -26.533 1.0 30.0 36 A 7 -ATOM 546 H HE2 . TYR A1 1 36 ? -18.849 -2.056 -25.335 1.0 11.1 36 A 7 -ATOM 547 H HH . TYR A1 1 36 ? -20.334 -3.346 -26.5 1.0 20.21 36 A 7 -ATOM 548 N N . ASP A1 1 37 ? -20.378 0.957 -22.223 1.0 31.31 37 A 7 -ATOM 549 C CA . ASP A1 1 37 ? -20.87 -0.211 -21.501 1.0 4.3 37 A 7 -ATOM 550 C C . ASP A1 1 37 ? -21.566 0.203 -20.208 1.0 30.32 37 A 7 -ATOM 551 O O . ASP A1 1 37 ? -22.528 -0.434 -19.777 1.0 62.0 37 A 7 -ATOM 552 C CB . ASP A1 1 37 ? -19.718 -1.168 -21.191 1.0 35.43 37 A 7 -ATOM 553 C CG . ASP A1 1 37 ? -20.021 -2.593 -21.611 1.0 34.32 37 A 7 -ATOM 554 O OD1 . ASP A1 1 37 ? -19.874 -2.901 -22.812 1.0 31.12 37 A 7 -ATOM 555 O OD2 . ASP A1 1 37 ? -20.405 -3.4 -20.739 1.0 3.2 37 A 7 -ATOM 556 H H . ASP A1 1 37 ? -19.418 1.156 -22.212 1.0 51.42 37 A 7 -ATOM 557 H HA . ASP A1 1 37 ? -21.584 -0.715 -22.134 1.0 32.24 37 A 7 -ATOM 558 H HB2 . ASP A1 1 37 ? -18.833 -0.838 -21.716 1.0 43.14 37 A 7 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.526 -1.158 -20.128 1.0 34.23 37 A 7 -ATOM 560 N N . LYS A1 1 38 ? -21.073 1.272 -19.593 1.0 33.03 38 A 7 -ATOM 561 C CA . LYS A1 1 38 ? -21.647 1.772 -18.349 1.0 33.5 38 A 7 -ATOM 562 C C . LYS A1 1 38 ? -23.131 2.08 -18.519 1.0 62.1 38 A 7 -ATOM 563 O O . LYS A1 1 38 ? -23.955 1.676 -17.7 1.0 13.24 38 A 7 -ATOM 564 C CB . LYS A1 1 38 ? -20.904 3.029 -17.89 1.0 32.13 38 A 7 -ATOM 565 C CG . LYS A1 1 38 ? -20.195 2.863 -16.557 1.0 11.13 38 A 7 -ATOM 566 C CD . LYS A1 1 38 ? -18.734 2.49 -16.745 1.0 55.11 38 A 7 -ATOM 567 C CE . LYS A1 1 38 ? -18.518 0.991 -16.602 1.0 12.13 38 A 7 -ATOM 568 N NZ . LYS A1 1 38 ? -17.837 0.412 -17.793 1.0 62.42 38 A 7 -ATOM 569 H H . LYS A1 1 38 ? -20.305 1.737 -19.986 1.0 40.1 38 A 7 -ATOM 570 H HA . LYS A1 1 38 ? -21.534 1.003 -17.6 1.0 13.43 38 A 7 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.168 3.29 -18.636 1.0 53.44 38 A 7 -ATOM 572 H HB3 . LYS A1 1 38 ? -21.614 3.838 -17.798 1.0 74.35 38 A 7 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.25 3.793 -16.012 1.0 72.35 38 A 7 -ATOM 574 H HG3 . LYS A1 1 38 ? -20.686 2.083 -15.993 1.0 65.33 38 A 7 -ATOM 575 H HD2 . LYS A1 1 38 ? -18.418 2.794 -17.732 1.0 31.44 38 A 7 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.141 3.003 -16.001 1.0 51.13 38 A 7 -ATOM 577 H HE2 . LYS A1 1 38 ? -17.912 0.81 -15.727 1.0 72.24 38 A 7 -ATOM 578 H HE3 . LYS A1 1 38 ? -19.479 0.513 -16.479 1.0 52.14 38 A 7 -ATOM 579 H HZ1 . LYS A1 1 38 ? -18.416 -0.349 -18.201 1.0 12.21 38 A 7 -ATOM 580 H HZ2 . LYS A1 1 38 ? -16.912 0.021 -17.52 1.0 31.3 38 A 7 -ATOM 581 H HZ3 . LYS A1 1 38 ? -17.691 1.147 -18.513 1.0 72.13 38 A 7 -ATOM 582 N N . GLU A1 1 39 ? -23.464 2.795 -19.589 1.0 74.33 39 A 7 -ATOM 583 C CA . GLU A1 1 39 ? -24.849 3.156 -19.866 1.0 31.43 39 A 7 -ATOM 584 C C . GLU A1 1 39 ? -25.42 2.298 -20.992 1.0 55.55 39 A 7 -ATOM 585 O O . GLU A1 1 39 ? -26.437 1.628 -20.822 1.0 44.25 39 A 7 -ATOM 586 C CB . GLU A1 1 39 ? -24.95 4.637 -20.236 1.0 31.12 39 A 7 -ATOM 587 C CG . GLU A1 1 39 ? -23.779 5.469 -19.743 1.0 22.34 39 A 7 -ATOM 588 C CD . GLU A1 1 39 ? -23.755 5.606 -18.233 1.0 34.02 39 A 7 -ATOM 589 O OE1 . GLU A1 1 39 ? -23.895 4.576 -17.541 1.0 60.52 39 A 7 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.597 6.744 -17.743 1.0 24.54 39 A 7 -ATOM 591 H H . GLU A1 1 39 ? -22.761 3.088 -20.206 1.0 53.12 39 A 7 -ATOM 592 H HA . GLU A1 1 39 ? -25.423 2.979 -18.969 1.0 24.23 39 A 7 -ATOM 593 H HB2 . GLU A1 1 39 ? -25.0 4.724 -21.312 1.0 13.32 39 A 7 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.856 5.041 -19.81 1.0 53.15 39 A 7 -ATOM 595 H HG2 . GLU A1 1 39 ? -22.86 4.998 -20.06 1.0 73.51 39 A 7 -ATOM 596 H HG3 . GLU A1 1 39 ? -23.845 6.455 -20.178 1.0 55.55 39 A 7 -ATOM 597 N N . GLY A1 1 40 ? -24.756 2.327 -22.144 1.0 41.31 40 A 7 -ATOM 598 C CA . GLY A1 1 40 ? -25.212 1.549 -23.282 1.0 23.2 40 A 7 -ATOM 599 C C . GLY A1 1 40 ? -25.48 2.409 -24.501 1.0 54.31 40 A 7 -ATOM 600 O O . GLY A1 1 40 ? -26.515 2.266 -25.153 1.0 62.35 40 A 7 -ATOM 601 H H . GLY A1 1 40 ? -23.951 2.88 -22.222 1.0 1.31 40 A 7 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.457 0.818 -23.529 1.0 42.33 40 A 7 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.122 1.035 -23.011 1.0 42.25 40 A 7 -ATOM 604 N N . ILE A1 1 41 ? -24.548 3.304 -24.809 1.0 11.45 41 A 7 -ATOM 605 C CA . ILE A1 1 41 ? -24.69 4.19 -25.957 1.0 13.21 41 A 7 -ATOM 606 C C . ILE A1 1 41 ? -23.46 4.126 -26.856 1.0 73.14 41 A 7 -ATOM 607 O O . ILE A1 1 41 ? -22.376 3.719 -26.439 1.0 54.03 41 A 7 -ATOM 608 C CB . ILE A1 1 41 ? -24.916 5.649 -25.518 1.0 13.54 41 A 7 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.104 5.957 -24.258 1.0 35.25 41 A 7 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.396 5.907 -25.278 1.0 15.54 41 A 7 -ATOM 611 C CD1 . ILE A1 1 41 ? -24.213 7.397 -23.806 1.0 51.21 41 A 7 -ATOM 612 H H . ILE A1 1 41 ? -23.745 3.37 -24.25 1.0 10.31 41 A 7 -ATOM 613 H HA . ILE A1 1 41 ? -25.553 3.868 -26.522 1.0 22.4 41 A 7 -ATOM 614 H HB . ILE A1 1 41 ? -24.587 6.297 -26.317 1.0 2.22 41 A 7 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.451 5.33 -23.452 1.0 53.25 41 A 7 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.062 5.746 -24.45 1.0 73.21 41 A 7 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.974 5.092 -25.688 1.0 41.34 41 A 7 -ATOM 618 H HG22 . ILE A1 1 41 ? -26.58 5.98 -24.217 1.0 35.01 41 A 7 -ATOM 619 H HG23 . ILE A1 1 41 ? -26.683 6.83 -25.758 1.0 24.24 41 A 7 -ATOM 620 H HD11 . ILE A1 1 41 ? -24.994 7.891 -24.366 1.0 13.35 41 A 7 -ATOM 621 H HD12 . ILE A1 1 41 ? -24.452 7.427 -22.753 1.0 5.02 41 A 7 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.274 7.9 -23.978 1.0 73.01 41 A 7 -ATOM 623 N N . PRO A1 1 42 ? -23.629 4.54 -28.121 1.0 42.01 42 A 7 -ATOM 624 C CA . PRO A1 1 42 ? -22.543 4.542 -29.105 1.0 63.34 42 A 7 -ATOM 625 C C . PRO A1 1 42 ? -21.485 5.595 -28.799 1.0 4.23 42 A 7 -ATOM 626 O O . PRO A1 1 42 ? -21.751 6.797 -28.803 1.0 21.54 42 A 7 -ATOM 627 C CB . PRO A1 1 42 ? -23.257 4.867 -30.42 1.0 63.45 42 A 7 -ATOM 628 C CG . PRO A1 1 42 ? -24.479 5.614 -30.013 1.0 31.23 42 A 7 -ATOM 629 C CD . PRO A1 1 42 ? -24.894 5.039 -28.687 1.0 52.22 42 A 7 -ATOM 630 H HA . PRO A1 1 42 ? -22.073 3.572 -29.179 1.0 60.32 42 A 7 -ATOM 631 H HB2 . PRO A1 1 42 ? -22.612 5.472 -31.042 1.0 50.23 42 A 7 -ATOM 632 H HB3 . PRO A1 1 42 ? -23.507 3.951 -30.934 1.0 64.01 42 A 7 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.251 6.664 -29.911 1.0 0.11 42 A 7 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.26 5.468 -30.745 1.0 1.1 42 A 7 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.321 5.806 -28.059 1.0 11.32 42 A 7 -ATOM 636 H HD3 . PRO A1 1 42 ? -25.597 4.231 -28.829 1.0 34.03 42 A 7 -ATOM 637 N N . PRO A1 1 43 ? -20.254 5.137 -28.527 1.0 1.41 43 A 7 -ATOM 638 C CA . PRO A1 1 43 ? -19.13 6.025 -28.214 1.0 62.53 43 A 7 -ATOM 639 C C . PRO A1 1 43 ? -18.67 6.827 -29.427 1.0 21.35 43 A 7 -ATOM 640 O O . PRO A1 1 43 ? -18.194 7.954 -29.293 1.0 73.42 43 A 7 -ATOM 641 C CB . PRO A1 1 43 ? -18.031 5.06 -27.763 1.0 74.43 43 A 7 -ATOM 642 C CG . PRO A1 1 43 ? -18.363 3.769 -28.427 1.0 42.11 43 A 7 -ATOM 643 C CD . PRO A1 1 43 ? -19.864 3.717 -28.504 1.0 32.53 43 A 7 -ATOM 644 H HA . PRO A1 1 43 ? -19.371 6.701 -27.407 1.0 3.1 43 A 7 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.068 5.433 -28.081 1.0 1.2 43 A 7 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.049 4.966 -26.687 1.0 52.2 43 A 7 -ATOM 647 H HG2 . PRO A1 1 43 ? -17.936 3.745 -29.418 1.0 21.5 43 A 7 -ATOM 648 H HG3 . PRO A1 1 43 ? -17.99 2.945 -27.837 1.0 41.32 43 A 7 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.179 3.216 -29.407 1.0 55.24 43 A 7 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.27 3.221 -27.634 1.0 31.14 43 A 7 -ATOM 651 N N . ASP A1 1 44 ? -18.814 6.238 -30.609 1.0 54.12 44 A 7 -ATOM 652 C CA . ASP A1 1 44 ? -18.414 6.898 -31.846 1.0 51.34 44 A 7 -ATOM 653 C C . ASP A1 1 44 ? -19.398 8.005 -32.213 1.0 65.34 44 A 7 -ATOM 654 O O . ASP A1 1 44 ? -19.095 8.868 -33.037 1.0 41.23 44 A 7 -ATOM 655 C CB . ASP A1 1 44 ? -18.322 5.882 -32.985 1.0 23.35 44 A 7 -ATOM 656 C CG . ASP A1 1 44 ? -17.501 6.393 -34.152 1.0 52.14 44 A 7 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.278 6.574 -33.982 1.0 70.43 44 A 7 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.082 6.613 -35.236 1.0 15.14 44 A 7 -ATOM 659 H H . ASP A1 1 44 ? -19.2 5.337 -30.65 1.0 64.31 44 A 7 -ATOM 660 H HA . ASP A1 1 44 ? -17.441 7.337 -31.688 1.0 72.42 44 A 7 -ATOM 661 H HB2 . ASP A1 1 44 ? -17.863 4.977 -32.615 1.0 64.21 44 A 7 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.318 5.657 -33.339 1.0 74.33 44 A 7 -ATOM 663 N N . GLN A1 1 45 ? -20.575 7.972 -31.598 1.0 24.51 45 A 7 -ATOM 664 C CA . GLN A1 1 45 ? -21.603 8.972 -31.862 1.0 55.1 45 A 7 -ATOM 665 C C . GLN A1 1 45 ? -21.565 10.081 -30.816 1.0 65.33 45 A 7 -ATOM 666 O O . GLN A1 1 45 ? -22.194 11.126 -30.983 1.0 0.12 45 A 7 -ATOM 667 C CB . GLN A1 1 45 ? -22.987 8.319 -31.88 1.0 3.33 45 A 7 -ATOM 668 C CG . GLN A1 1 45 ? -23.389 7.783 -33.244 1.0 71.05 45 A 7 -ATOM 669 C CD . GLN A1 1 45 ? -24.403 6.66 -33.154 1.0 50.21 45 A 7 -ATOM 670 O OE1 . GLN A1 1 45 ? -25.506 6.844 -32.639 1.0 30.33 45 A 7 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.035 5.487 -33.657 1.0 54.11 45 A 7 -ATOM 672 H H . GLN A1 1 45 ? -20.757 7.259 -30.951 1.0 33.14 45 A 7 -ATOM 673 H HA . GLN A1 1 45 ? -21.406 9.402 -32.832 1.0 54.13 45 A 7 -ATOM 674 H HB2 . GLN A1 1 45 ? -22.993 7.498 -31.178 1.0 72.22 45 A 7 -ATOM 675 H HB3 . GLN A1 1 45 ? -23.72 9.05 -31.574 1.0 51.24 45 A 7 -ATOM 676 H HG2 . GLN A1 1 45 ? -23.818 8.589 -33.821 1.0 11.31 45 A 7 -ATOM 677 H HG3 . GLN A1 1 45 ? -22.506 7.413 -33.745 1.0 33.23 45 A 7 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.14 5.414 -34.051 1.0 35.4 45 A 7 -ATOM 679 H HE22 . GLN A1 1 45 ? -24.67 4.744 -33.612 1.0 53.4 45 A 7 -ATOM 680 N N . GLN A1 1 46 ? -20.824 9.847 -29.738 1.0 5.34 46 A 7 -ATOM 681 C CA . GLN A1 1 46 ? -20.705 10.827 -28.665 1.0 54.21 46 A 7 -ATOM 682 C C . GLN A1 1 46 ? -19.275 11.346 -28.558 1.0 23.33 46 A 7 -ATOM 683 O O . GLN A1 1 46 ? -18.321 10.638 -28.88 1.0 42.0 46 A 7 -ATOM 684 C CB . GLN A1 1 46 ? -21.138 10.211 -27.333 1.0 54.1 46 A 7 -ATOM 685 C CG . GLN A1 1 46 ? -20.292 9.021 -26.91 1.0 63.33 46 A 7 -ATOM 686 C CD . GLN A1 1 46 ? -20.183 8.889 -25.404 1.0 73.34 46 A 7 -ATOM 687 O OE1 . GLN A1 1 46 ? -21.161 8.579 -24.724 1.0 62.34 46 A 7 -ATOM 688 N NE2 . GLN A1 1 46 ? -18.988 9.124 -24.874 1.0 52.51 46 A 7 -ATOM 689 H H . GLN A1 1 46 ? -20.346 8.995 -29.663 1.0 61.13 46 A 7 -ATOM 690 H HA . GLN A1 1 46 ? -21.359 11.654 -28.898 1.0 1.54 46 A 7 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.071 10.965 -26.563 1.0 70.34 46 A 7 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.164 9.884 -27.418 1.0 24.41 46 A 7 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.739 8.12 -27.303 1.0 71.34 46 A 7 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.3 9.137 -27.32 1.0 12.44 46 A 7 -ATOM 695 H HE21 . GLN A1 1 46 ? -18.254 9.368 -25.478 1.0 61.21 46 A 7 -ATOM 696 H HE22 . GLN A1 1 46 ? -18.889 9.047 -23.903 1.0 54.41 46 A 7 -ATOM 697 N N . ARG A1 1 47 ? -19.134 12.587 -28.104 1.0 11.31 47 A 7 -ATOM 698 C CA . ARG A1 1 47 ? -17.821 13.202 -27.956 1.0 74.42 47 A 7 -ATOM 699 C C . ARG A1 1 47 ? -17.72 13.958 -26.634 1.0 0.05 47 A 7 -ATOM 700 O O . ARG A1 1 47 ? -18.73 14.233 -25.985 1.0 62.43 47 A 7 -ATOM 701 C CB . ARG A1 1 47 ? -17.545 14.153 -29.122 1.0 53.24 47 A 7 -ATOM 702 C CG . ARG A1 1 47 ? -17.727 13.511 -30.487 1.0 25.13 47 A 7 -ATOM 703 C CD . ARG A1 1 47 ? -17.195 14.404 -31.598 1.0 74.31 47 A 7 -ATOM 704 N NE . ARG A1 1 47 ? -17.435 13.834 -32.921 1.0 72.02 47 A 7 -ATOM 705 C CZ . ARG A1 1 47 ? -17.357 14.533 -34.047 1.0 4.33 47 A 7 -ATOM 706 N NH1 . ARG A1 1 47 ? -17.046 15.821 -34.012 1.0 22.33 47 A 7 -ATOM 707 N NH2 . ARG A1 1 47 ? -17.589 13.943 -35.213 1.0 24.44 47 A 7 -ATOM 708 H H . ARG A1 1 47 ? -19.933 13.102 -27.863 1.0 14.32 47 A 7 -ATOM 709 H HA . ARG A1 1 47 ? -17.083 12.414 -27.963 1.0 52.1 47 A 7 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.218 14.995 -29.052 1.0 12.43 47 A 7 -ATOM 711 H HB3 . ARG A1 1 47 ? -16.528 14.509 -29.048 1.0 31.22 47 A 7 -ATOM 712 H HG2 . ARG A1 1 47 ? -17.192 12.573 -30.508 1.0 2.15 47 A 7 -ATOM 713 H HG3 . ARG A1 1 47 ? -18.779 13.332 -30.653 1.0 3.22 47 A 7 -ATOM 714 H HD2 . ARG A1 1 47 ? -17.685 15.364 -31.536 1.0 62.34 47 A 7 -ATOM 715 H HD3 . ARG A1 1 47 ? -16.132 14.533 -31.459 1.0 4.32 47 A 7 -ATOM 716 H HE . ARG A1 1 47 ? -17.666 12.883 -32.97 1.0 51.12 47 A 7 -ATOM 717 H HH11 . ARG A1 1 47 ? -16.869 16.268 -33.135 1.0 35.02 47 A 7 -ATOM 718 H HH12 . ARG A1 1 47 ? -16.986 16.345 -34.862 1.0 42.25 47 A 7 -ATOM 719 H HH21 . ARG A1 1 47 ? -17.824 12.972 -35.244 1.0 32.54 47 A 7 -ATOM 720 H HH22 . ARG A1 1 47 ? -17.53 14.47 -36.06 1.0 51.04 47 A 7 -ATOM 721 N N . LEU A1 1 48 ? -16.496 14.291 -26.241 1.0 13.42 48 A 7 -ATOM 722 C CA . LEU A1 1 48 ? -16.262 15.015 -24.996 1.0 63.04 48 A 7 -ATOM 723 C C . LEU A1 1 48 ? -15.955 16.484 -25.27 1.0 70.54 48 A 7 -ATOM 724 O O . LEU A1 1 48 ? -15.359 16.823 -26.292 1.0 13.22 48 A 7 -ATOM 725 C CB . LEU A1 1 48 ? -15.108 14.377 -24.22 1.0 73.22 48 A 7 -ATOM 726 C CG . LEU A1 1 48 ? -14.991 12.856 -24.322 1.0 23.01 48 A 7 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.368 12.21 -24.278 1.0 2.23 48 A 7 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.256 12.462 -25.595 1.0 62.5 48 A 7 -ATOM 729 H H . LEU A1 1 48 ? -15.73 14.045 -26.8 1.0 13.1 48 A 7 -ATOM 730 H HA . LEU A1 1 48 ? -17.162 14.952 -24.403 1.0 5.14 48 A 7 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.188 14.804 -24.587 1.0 14.35 48 A 7 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.232 14.631 -23.177 1.0 62.22 48 A 7 -ATOM 733 H HG . LEU A1 1 48 ? -14.423 12.487 -23.479 1.0 74.12 48 A 7 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.057 12.867 -23.769 1.0 72.12 48 A 7 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.308 11.271 -23.748 1.0 51.52 48 A 7 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.715 12.033 -25.285 1.0 50.13 48 A 7 -ATOM 737 H HD21 . LEU A1 1 48 ? -13.612 13.271 -25.904 1.0 32.51 48 A 7 -ATOM 738 H HD22 . LEU A1 1 48 ? -14.974 12.254 -26.375 1.0 4.35 48 A 7 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.662 11.578 -25.409 1.0 44.23 48 A 7 -ATOM 740 N N . ILE A1 1 49 ? -16.364 17.35 -24.349 1.0 13.31 49 A 7 -ATOM 741 C CA . ILE A1 1 49 ? -16.13 18.782 -24.489 1.0 13.25 49 A 7 -ATOM 742 C C . ILE A1 1 49 ? -15.741 19.409 -23.155 1.0 73.24 49 A 7 -ATOM 743 O O . ILE A1 1 49 ? -16.429 19.232 -22.15 1.0 20.41 49 A 7 -ATOM 744 C CB . ILE A1 1 49 ? -17.373 19.504 -25.041 1.0 42.12 49 A 7 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.475 19.307 -26.555 1.0 21.4 49 A 7 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.322 20.985 -24.696 1.0 44.11 49 A 7 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.74 18.6 -26.988 1.0 30.32 49 A 7 -ATOM 748 H H . ILE A1 1 49 ? -16.834 17.018 -23.555 1.0 11.12 49 A 7 -ATOM 749 H HA . ILE A1 1 49 ? -15.318 18.919 -25.19 1.0 31.54 49 A 7 -ATOM 750 H HB . ILE A1 1 49 ? -18.247 19.08 -24.57 1.0 10.22 49 A 7 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.452 20.27 -27.039 1.0 52.53 49 A 7 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.633 18.719 -26.891 1.0 23.14 49 A 7 -ATOM 753 H HG21 . ILE A1 1 49 ? -17.512 21.116 -23.641 1.0 54.41 49 A 7 -ATOM 754 H HG22 . ILE A1 1 49 ? -16.344 21.376 -24.936 1.0 2.4 49 A 7 -ATOM 755 H HG23 . ILE A1 1 49 ? -18.071 21.514 -25.265 1.0 53.42 49 A 7 -ATOM 756 H HD11 . ILE A1 1 49 ? -18.516 17.934 -27.809 1.0 43.14 49 A 7 -ATOM 757 H HD12 . ILE A1 1 49 ? -19.136 18.029 -26.161 1.0 61.33 49 A 7 -ATOM 758 H HD13 . ILE A1 1 49 ? -19.47 19.329 -27.306 1.0 3.14 49 A 7 -ATOM 759 N N . PHE A1 1 50 ? -14.635 20.145 -23.153 1.0 0.44 50 A 7 -ATOM 760 C CA . PHE A1 1 50 ? -14.154 20.8 -21.943 1.0 63.4 50 A 7 -ATOM 761 C C . PHE A1 1 50 ? -14.117 22.315 -22.122 1.0 34.31 50 A 7 -ATOM 762 O O . PHE A1 1 50 ? -13.281 22.844 -22.853 1.0 24.03 50 A 7 -ATOM 763 C CB . PHE A1 1 50 ? -12.761 20.284 -21.577 1.0 1.31 50 A 7 -ATOM 764 C CG . PHE A1 1 50 ? -12.344 20.626 -20.175 1.0 63.44 50 A 7 -ATOM 765 C CD1 . PHE A1 1 50 ? -13.088 20.189 -19.091 1.0 63.22 50 A 7 -ATOM 766 C CD2 . PHE A1 1 50 ? -11.209 21.386 -19.941 1.0 31.12 50 A 7 -ATOM 767 C CE1 . PHE A1 1 50 ? -12.707 20.502 -17.799 1.0 44.05 50 A 7 -ATOM 768 C CE2 . PHE A1 1 50 ? -10.823 21.701 -18.652 1.0 53.14 50 A 7 -ATOM 769 C CZ . PHE A1 1 50 ? -11.573 21.26 -17.58 1.0 64.24 50 A 7 -ATOM 770 H H . PHE A1 1 50 ? -14.129 20.249 -23.987 1.0 32.43 50 A 7 -ATOM 771 H HA . PHE A1 1 50 ? -14.839 20.561 -21.143 1.0 55.42 50 A 7 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.746 19.209 -21.674 1.0 72.21 50 A 7 -ATOM 773 H HB3 . PHE A1 1 50 ? -12.037 20.713 -22.253 1.0 52.42 50 A 7 -ATOM 774 H HD1 . PHE A1 1 50 ? -13.975 19.596 -19.261 1.0 64.41 50 A 7 -ATOM 775 H HD2 . PHE A1 1 50 ? -10.621 21.733 -20.779 1.0 25.0 50 A 7 -ATOM 776 H HE1 . PHE A1 1 50 ? -13.296 20.155 -16.963 1.0 33.34 50 A 7 -ATOM 777 H HE2 . PHE A1 1 50 ? -9.936 22.294 -18.484 1.0 34.14 50 A 7 -ATOM 778 H HZ . PHE A1 1 50 ? -11.273 21.504 -16.572 1.0 42.2 50 A 7 -ATOM 779 N N . GLY A1 1 51 ? -15.031 23.007 -21.449 1.0 53.44 51 A 7 -ATOM 780 C CA . GLY A1 1 51 ? -15.087 24.454 -21.548 1.0 33.5 51 A 7 -ATOM 781 C C . GLY A1 1 51 ? -15.652 24.923 -22.874 1.0 34.32 51 A 7 -ATOM 782 O O . GLY A1 1 51 ? -15.829 26.121 -23.092 1.0 0.02 51 A 7 -ATOM 783 H H . GLY A1 1 51 ? -15.673 22.532 -20.882 1.0 14.34 51 A 7 -ATOM 784 H HA2 . GLY A1 1 51 ? -15.706 24.835 -20.75 1.0 71.3 51 A 7 -ATOM 785 H HA3 . GLY A1 1 51 ? -14.088 24.85 -21.435 1.0 2.33 51 A 7 -ATOM 786 N N . GLY A1 1 52 ? -15.934 23.977 -23.764 1.0 51.33 52 A 7 -ATOM 787 C CA . GLY A1 1 52 ? -16.477 24.32 -25.065 1.0 70.11 52 A 7 -ATOM 788 C C . GLY A1 1 52 ? -15.736 23.641 -26.2 1.0 64.35 52 A 7 -ATOM 789 O O . GLY A1 1 52 ? -16.289 23.442 -27.282 1.0 21.12 52 A 7 -ATOM 790 H H . GLY A1 1 52 ? -15.772 23.037 -23.535 1.0 52.33 52 A 7 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.515 24.024 -25.099 1.0 34.31 52 A 7 -ATOM 792 H HA3 . GLY A1 1 52 ? -16.413 25.39 -25.198 1.0 33.12 52 A 7 -ATOM 793 N N . LYS A1 1 53 ? -14.479 23.286 -25.955 1.0 4.12 53 A 7 -ATOM 794 C CA . LYS A1 1 53 ? -13.66 22.626 -26.965 1.0 20.15 53 A 7 -ATOM 795 C C . LYS A1 1 53 ? -13.745 21.109 -26.828 1.0 12.34 53 A 7 -ATOM 796 O O . LYS A1 1 53 ? -13.847 20.582 -25.721 1.0 53.3 53 A 7 -ATOM 797 C CB . LYS A1 1 53 ? -12.203 23.078 -26.844 1.0 12.13 53 A 7 -ATOM 798 C CG . LYS A1 1 53 ? -11.586 22.787 -25.486 1.0 34.42 53 A 7 -ATOM 799 C CD . LYS A1 1 53 ? -10.872 21.446 -25.474 1.0 44.0 53 A 7 -ATOM 800 C CE . LYS A1 1 53 ? -9.693 21.434 -26.435 1.0 75.53 53 A 7 -ATOM 801 N NZ . LYS A1 1 53 ? -8.392 21.354 -25.715 1.0 61.53 53 A 7 -ATOM 802 H H . LYS A1 1 53 ? -14.094 23.472 -25.073 1.0 32.12 53 A 7 -ATOM 803 H HA . LYS A1 1 53 ? -14.036 22.91 -27.935 1.0 74.23 53 A 7 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.618 22.573 -27.597 1.0 34.02 53 A 7 -ATOM 805 H HB3 . LYS A1 1 53 ? -12.154 24.144 -27.017 1.0 32.22 53 A 7 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.874 23.564 -25.25 1.0 24.24 53 A 7 -ATOM 807 H HG3 . LYS A1 1 53 ? -12.369 22.775 -24.741 1.0 53.0 53 A 7 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.511 21.25 -24.476 1.0 22.42 53 A 7 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.571 20.674 -25.764 1.0 0.05 53 A 7 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.787 20.579 -27.087 1.0 25.2 53 A 7 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.716 22.339 -27.023 1.0 75.24 53 A 7 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.676 20.903 -26.319 1.0 1.33 53 A 7 -ATOM 813 H HZ2 . LYS A1 1 53 ? -8.499 20.795 -24.845 1.0 14.14 53 A 7 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.065 22.308 -25.462 1.0 31.25 53 A 7 -ATOM 815 N N . GLN A1 1 54 ? -13.702 20.414 -27.96 1.0 32.1 54 A 7 -ATOM 816 C CA . GLN A1 1 54 ? -13.774 18.958 -27.966 1.0 3.14 54 A 7 -ATOM 817 C C . GLN A1 1 54 ? -12.476 18.347 -27.448 1.0 14.5 54 A 7 -ATOM 818 O O . GLN A1 1 54 ? -11.445 19.018 -27.38 1.0 22.04 54 A 7 -ATOM 819 C CB . GLN A1 1 54 ? -14.065 18.446 -29.377 1.0 14.03 54 A 7 -ATOM 820 C CG . GLN A1 1 54 ? -15.501 17.987 -29.574 1.0 52.41 54 A 7 -ATOM 821 C CD . GLN A1 1 54 ? -16.46 19.142 -29.778 1.0 44.23 54 A 7 -ATOM 822 O OE1 . GLN A1 1 54 ? -16.198 20.266 -29.348 1.0 25.33 54 A 7 -ATOM 823 N NE2 . GLN A1 1 54 ? -17.58 18.872 -30.439 1.0 63.1 54 A 7 -ATOM 824 H H . GLN A1 1 54 ? -13.62 20.892 -28.812 1.0 52.11 54 A 7 -ATOM 825 H HA . GLN A1 1 54 ? -14.581 18.664 -27.312 1.0 62.04 54 A 7 -ATOM 826 H HB2 . GLN A1 1 54 ? -13.863 19.237 -30.083 1.0 31.24 54 A 7 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.412 17.612 -29.587 1.0 25.42 54 A 7 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.545 17.345 -30.441 1.0 52.11 54 A 7 -ATOM 829 H HG3 . GLN A1 1 54 ? -15.81 17.431 -28.7 1.0 53.52 54 A 7 -ATOM 830 H HE21 . GLN A1 1 54 ? -17.723 17.954 -30.752 1.0 45.55 54 A 7 -ATOM 831 H HE22 . GLN A1 1 54 ? -18.219 19.6 -30.585 1.0 62.42 54 A 7 -ATOM 832 N N . LEU A1 1 55 ? -12.533 17.071 -27.084 1.0 51.34 55 A 7 -ATOM 833 C CA . LEU A1 1 55 ? -11.361 16.369 -26.571 1.0 40.45 55 A 7 -ATOM 834 C C . LEU A1 1 55 ? -10.943 15.246 -27.515 1.0 63.5 55 A 7 -ATOM 835 O O . LEU A1 1 55 ? -11.757 14.401 -27.887 1.0 52.11 55 A 7 -ATOM 836 C CB . LEU A1 1 55 ? -11.65 15.8 -25.181 1.0 25.03 55 A 7 -ATOM 837 C CG . LEU A1 1 55 ? -12.203 16.789 -24.153 1.0 41.33 55 A 7 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.328 16.127 -22.79 1.0 33.24 55 A 7 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.318 18.023 -24.071 1.0 52.23 55 A 7 -ATOM 840 H H . LEU A1 1 55 ? -13.382 16.589 -27.16 1.0 12.34 55 A 7 -ATOM 841 H HA . LEU A1 1 55 ? -10.553 17.081 -26.499 1.0 22.21 55 A 7 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.369 15.003 -25.292 1.0 55.1 55 A 7 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.726 15.398 -24.79 1.0 51.11 55 A 7 -ATOM 844 H HG . LEU A1 1 55 ? -13.191 17.104 -24.462 1.0 72.12 55 A 7 -ATOM 845 H HD11 . LEU A1 1 55 ? -12.198 16.869 -22.017 1.0 32.04 55 A 7 -ATOM 846 H HD12 . LEU A1 1 55 ? -11.569 15.365 -22.689 1.0 44.35 55 A 7 -ATOM 847 H HD13 . LEU A1 1 55 ? -13.305 15.676 -22.696 1.0 32.21 55 A 7 -ATOM 848 H HD21 . LEU A1 1 55 ? -10.339 17.741 -23.712 1.0 33.14 55 A 7 -ATOM 849 H HD22 . LEU A1 1 55 ? -11.759 18.737 -23.391 1.0 72.01 55 A 7 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.228 18.468 -25.051 1.0 74.33 55 A 7 -ATOM 851 N N . GLU A1 1 56 ? -9.67 15.243 -27.897 1.0 12.02 56 A 7 -ATOM 852 C CA . GLU A1 1 56 ? -9.145 14.223 -28.796 1.0 31.33 56 A 7 -ATOM 853 C C . GLU A1 1 56 ? -9.161 12.85 -28.131 1.0 62.51 56 A 7 -ATOM 854 O O . GLU A1 1 56 ? -9.572 12.712 -26.978 1.0 51.02 56 A 7 -ATOM 855 C CB . GLU A1 1 56 ? -7.719 14.576 -29.227 1.0 62.01 56 A 7 -ATOM 856 C CG . GLU A1 1 56 ? -7.578 15.991 -29.762 1.0 21.02 56 A 7 -ATOM 857 C CD . GLU A1 1 56 ? -6.163 16.307 -30.207 1.0 1.0 56 A 7 -ATOM 858 O OE1 . GLU A1 1 56 ? -5.31 15.396 -30.161 1.0 61.34 56 A 7 -ATOM 859 O OE2 . GLU A1 1 56 ? -5.909 17.465 -30.599 1.0 22.01 56 A 7 -ATOM 860 H H . GLU A1 1 56 ? -9.07 15.944 -27.566 1.0 72.43 56 A 7 -ATOM 861 H HA . GLU A1 1 56 ? -9.778 14.194 -29.67 1.0 4.21 56 A 7 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.062 14.467 -28.377 1.0 41.11 56 A 7 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.41 13.888 -30.0 1.0 51.02 56 A 7 -ATOM 864 H HG2 . GLU A1 1 56 ? -8.239 16.11 -30.607 1.0 71.31 56 A 7 -ATOM 865 H HG3 . GLU A1 1 56 ? -7.859 16.686 -28.985 1.0 60.44 56 A 7 -ATOM 866 N N . ASP A1 1 57 ? -8.713 11.838 -28.865 1.0 71.03 57 A 7 -ATOM 867 C CA . ASP A1 1 57 ? -8.676 10.475 -28.346 1.0 63.41 57 A 7 -ATOM 868 C C . ASP A1 1 57 ? -7.57 10.319 -27.307 1.0 21.4 57 A 7 -ATOM 869 O O . ASP A1 1 57 ? -7.608 9.412 -26.476 1.0 43.31 57 A 7 -ATOM 870 C CB . ASP A1 1 57 ? -8.465 9.478 -29.487 1.0 45.31 57 A 7 -ATOM 871 C CG . ASP A1 1 57 ? -9.215 9.871 -30.745 1.0 55.43 57 A 7 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.337 10.405 -30.624 1.0 72.35 57 A 7 -ATOM 873 O OD2 . ASP A1 1 57 ? -8.68 9.644 -31.851 1.0 15.11 57 A 7 -ATOM 874 H H . ASP A1 1 57 ? -8.399 12.011 -29.777 1.0 23.12 57 A 7 -ATOM 875 H HA . ASP A1 1 57 ? -9.626 10.273 -27.875 1.0 62.14 57 A 7 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.411 9.426 -29.721 1.0 24.44 57 A 7 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.809 8.504 -29.173 1.0 64.03 57 A 7 -ATOM 878 N N . SER A1 1 58 ? -6.584 11.209 -27.361 1.0 32.51 58 A 7 -ATOM 879 C CA . SER A1 1 58 ? -5.465 11.168 -26.428 1.0 62.24 58 A 7 -ATOM 880 C C . SER A1 1 58 ? -5.519 12.346 -25.46 1.0 2.12 58 A 7 -ATOM 881 O O . SER A1 1 58 ? -4.624 12.53 -24.638 1.0 12.21 58 A 7 -ATOM 882 C CB . SER A1 1 58 ? -4.138 11.179 -27.189 1.0 65.11 58 A 7 -ATOM 883 O OG . SER A1 1 58 ? -3.052 10.886 -26.327 1.0 34.21 58 A 7 -ATOM 884 H H . SER A1 1 58 ? -6.61 11.909 -28.047 1.0 21.03 58 A 7 -ATOM 885 H HA . SER A1 1 58 ? -5.538 10.25 -25.863 1.0 33.55 58 A 7 -ATOM 886 H HB2 . SER A1 1 58 ? -4.169 10.439 -27.973 1.0 31.42 58 A 7 -ATOM 887 H HB3 . SER A1 1 58 ? -3.984 12.157 -27.623 1.0 40.4 58 A 7 -ATOM 888 H HG . SER A1 1 58 ? -2.424 10.321 -26.783 1.0 10.23 58 A 7 -ATOM 889 N N . ASN A1 1 59 ? -6.578 13.142 -25.567 1.0 35.41 59 A 7 -ATOM 890 C CA . ASN A1 1 59 ? -6.751 14.304 -24.703 1.0 52.34 59 A 7 -ATOM 891 C C . ASN A1 1 59 ? -7.307 13.893 -23.343 1.0 4.01 59 A 7 -ATOM 892 O O . ASN A1 1 59 ? -8.517 13.919 -23.122 1.0 42.21 59 A 7 -ATOM 893 C CB . ASN A1 1 59 ? -7.686 15.321 -25.361 1.0 21.1 59 A 7 -ATOM 894 C CG . ASN A1 1 59 ? -7.249 16.752 -25.114 1.0 14.54 59 A 7 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.06 17.032 -24.963 1.0 24.42 59 A 7 -ATOM 896 N ND2 . ASN A1 1 59 ? -8.211 17.666 -25.073 1.0 14.44 59 A 7 -ATOM 897 H H . ASN A1 1 59 ? -7.26 12.944 -26.243 1.0 5.51 59 A 7 -ATOM 898 H HA . ASN A1 1 59 ? -5.782 14.758 -24.56 1.0 74.51 59 A 7 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.701 15.149 -26.428 1.0 43.43 59 A 7 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.682 15.195 -24.966 1.0 11.21 59 A 7 -ATOM 901 H HD21 . ASN A1 1 59 ? -9.137 17.37 -25.202 1.0 21.33 59 A 7 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.957 18.599 -24.915 1.0 12.0 59 A 7 -ATOM 903 N N . ALA A1 1 60 ? -6.413 13.514 -22.435 1.0 13.11 60 A 7 -ATOM 904 C CA . ALA A1 1 60 ? -6.814 13.099 -21.096 1.0 35.51 60 A 7 -ATOM 905 C C . ALA A1 1 60 ? -5.596 12.807 -20.225 1.0 74.01 60 A 7 -ATOM 906 O O . ALA A1 1 60 ? -5.098 13.686 -19.523 1.0 74.24 60 A 7 -ATOM 907 C CB . ALA A1 1 60 ? -7.718 11.878 -21.169 1.0 64.13 60 A 7 -ATOM 908 H H . ALA A1 1 60 ? -5.462 13.514 -22.671 1.0 31.12 60 A 7 -ATOM 909 H HA . ALA A1 1 60 ? -7.376 13.907 -20.65 1.0 20.01 60 A 7 -ATOM 910 H HB1 . ALA A1 1 60 ? -7.261 11.131 -21.802 1.0 72.33 60 A 7 -ATOM 911 H HB2 . ALA A1 1 60 ? -7.859 11.475 -20.178 1.0 25.02 60 A 7 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.674 12.163 -21.582 1.0 51.02 60 A 7 -ATOM 913 N N . MET A1 1 61 ? -5.123 11.566 -20.275 1.0 21.52 61 A 7 -ATOM 914 C CA . MET A1 1 61 ? -3.964 11.158 -19.491 1.0 32.03 61 A 7 -ATOM 915 C C . MET A1 1 61 ? -2.798 12.118 -19.705 1.0 55.14 61 A 7 -ATOM 916 O O . MET A1 1 61 ? -2.227 12.64 -18.747 1.0 73.23 61 A 7 -ATOM 917 C CB . MET A1 1 61 ? -3.543 9.735 -19.864 1.0 33.12 61 A 7 -ATOM 918 C CG . MET A1 1 61 ? -3.79 9.392 -21.324 1.0 10.31 61 A 7 -ATOM 919 S SD . MET A1 1 61 ? -2.48 8.374 -22.029 1.0 3.45 61 A 7 -ATOM 920 C CE . MET A1 1 61 ? -1.89 9.442 -23.341 1.0 11.34 61 A 7 -ATOM 921 H H . MET A1 1 61 ? -5.563 10.909 -20.854 1.0 44.35 61 A 7 -ATOM 922 H HA . MET A1 1 61 ? -4.245 11.179 -18.449 1.0 14.21 61 A 7 -ATOM 923 H HB2 . MET A1 1 61 ? -2.489 9.62 -19.663 1.0 14.23 61 A 7 -ATOM 924 H HB3 . MET A1 1 61 ? -4.097 9.037 -19.254 1.0 0.24 61 A 7 -ATOM 925 H HG2 . MET A1 1 61 ? -4.724 8.855 -21.401 1.0 62.14 61 A 7 -ATOM 926 H HG3 . MET A1 1 61 ? -3.858 10.31 -21.889 1.0 32.0 61 A 7 -ATOM 927 H HE1 . MET A1 1 61 ? -1.615 8.842 -24.196 1.0 54.23 61 A 7 -ATOM 928 H HE2 . MET A1 1 61 ? -2.671 10.132 -23.622 1.0 64.31 61 A 7 -ATOM 929 H HE3 . MET A1 1 61 ? -1.028 9.993 -22.995 1.0 24.11 61 A 7 -ATOM 930 N N . SER A1 1 62 ? -2.448 12.346 -20.967 1.0 73.15 62 A 7 -ATOM 931 C CA . SER A1 1 62 ? -1.348 13.24 -21.306 1.0 12.22 62 A 7 -ATOM 932 C C . SER A1 1 62 ? -1.765 14.699 -21.149 1.0 13.52 62 A 7 -ATOM 933 O O . SER A1 1 62 ? -0.953 15.553 -20.792 1.0 42.51 62 A 7 -ATOM 934 C CB . SER A1 1 62 ? -0.877 12.983 -22.739 1.0 62.33 62 A 7 -ATOM 935 O OG . SER A1 1 62 ? -0.353 14.164 -23.323 1.0 14.13 62 A 7 -ATOM 936 H H . SER A1 1 62 ? -2.942 11.9 -21.687 1.0 74.25 62 A 7 -ATOM 937 H HA . SER A1 1 62 ? -0.533 13.036 -20.627 1.0 74.15 62 A 7 -ATOM 938 H HB2 . SER A1 1 62 ? -0.107 12.227 -22.732 1.0 54.41 62 A 7 -ATOM 939 H HB3 . SER A1 1 62 ? -1.712 12.642 -23.333 1.0 23.45 62 A 7 -ATOM 940 H HG . SER A1 1 62 ? -0.832 14.36 -24.132 1.0 1.23 62 A 7 -ATOM 941 N N . ASP A1 1 63 ? -3.036 14.977 -21.419 1.0 34.33 63 A 7 -ATOM 942 C CA . ASP A1 1 63 ? -3.563 16.332 -21.308 1.0 10.21 63 A 7 -ATOM 943 C C . ASP A1 1 63 ? -3.346 16.885 -19.903 1.0 63.54 63 A 7 -ATOM 944 O O . ASP A1 1 63 ? -3.275 18.099 -19.707 1.0 31.33 63 A 7 -ATOM 945 C CB . ASP A1 1 63 ? -5.052 16.352 -21.654 1.0 21.1 63 A 7 -ATOM 946 C CG . ASP A1 1 63 ? -5.539 17.737 -22.033 1.0 12.2 63 A 7 -ATOM 947 O OD1 . ASP A1 1 63 ? -4.781 18.471 -22.702 1.0 53.24 63 A 7 -ATOM 948 O OD2 . ASP A1 1 63 ? -6.679 18.087 -21.662 1.0 3.13 63 A 7 -ATOM 949 H H . ASP A1 1 63 ? -3.634 14.252 -21.7 1.0 14.4 63 A 7 -ATOM 950 H HA . ASP A1 1 63 ? -3.031 16.954 -22.012 1.0 72.42 63 A 7 -ATOM 951 H HB2 . ASP A1 1 63 ? -5.231 15.688 -22.487 1.0 63.34 63 A 7 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.618 16.012 -20.799 1.0 44.51 63 A 7 -ATOM 953 N N . TYR A1 1 64 ? -3.244 15.988 -18.929 1.0 43.15 64 A 7 -ATOM 954 C CA . TYR A1 1 64 ? -3.039 16.386 -17.541 1.0 74.44 64 A 7 -ATOM 955 C C . TYR A1 1 64 ? -4.328 16.935 -16.936 1.0 35.31 64 A 7 -ATOM 956 O O . TYR A1 1 64 ? -4.304 17.632 -15.923 1.0 63.11 64 A 7 -ATOM 957 C CB . TYR A1 1 64 ? -1.932 17.437 -17.448 1.0 41.31 64 A 7 -ATOM 958 C CG . TYR A1 1 64 ? -1.237 17.468 -16.106 1.0 35.31 64 A 7 -ATOM 959 C CD1 . TYR A1 1 64 ? -0.354 16.461 -15.736 1.0 10.21 64 A 7 -ATOM 960 C CD2 . TYR A1 1 64 ? -1.464 18.503 -15.207 1.0 61.0 64 A 7 -ATOM 961 C CE1 . TYR A1 1 64 ? 0.283 16.484 -14.51 1.0 31.32 64 A 7 -ATOM 962 C CE2 . TYR A1 1 64 ? -0.831 18.535 -13.98 1.0 3.01 64 A 7 -ATOM 963 C CZ . TYR A1 1 64 ? 0.041 17.523 -13.636 1.0 35.43 64 A 7 -ATOM 964 O OH . TYR A1 1 64 ? 0.673 17.551 -12.413 1.0 23.32 64 A 7 -ATOM 965 H H . TYR A1 1 64 ? -3.309 15.035 -19.147 1.0 10.22 64 A 7 -ATOM 966 H HA . TYR A1 1 64 ? -2.738 15.51 -16.985 1.0 40.51 64 A 7 -ATOM 967 H HB2 . TYR A1 1 64 ? -1.187 17.233 -18.202 1.0 75.32 64 A 7 -ATOM 968 H HB3 . TYR A1 1 64 ? -2.357 18.415 -17.625 1.0 32.34 64 A 7 -ATOM 969 H HD1 . TYR A1 1 64 ? -0.167 15.648 -16.422 1.0 1.35 64 A 7 -ATOM 970 H HD2 . TYR A1 1 64 ? -2.148 19.293 -15.48 1.0 32.41 64 A 7 -ATOM 971 H HE1 . TYR A1 1 64 ? 0.966 15.692 -14.24 1.0 52.21 64 A 7 -ATOM 972 H HE2 . TYR A1 1 64 ? -1.02 19.348 -13.295 1.0 43.14 64 A 7 -ATOM 973 H HH . TYR A1 1 64 ? 0.885 18.458 -12.184 1.0 23.33 64 A 7 -ATOM 974 N N . ASN A1 1 65 ? -5.453 16.613 -17.566 1.0 61.21 65 A 7 -ATOM 975 C CA . ASN A1 1 65 ? -6.753 17.072 -17.091 1.0 70.22 65 A 7 -ATOM 976 C C . ASN A1 1 65 ? -7.554 15.918 -16.495 1.0 21.44 65 A 7 -ATOM 977 O O . ASN A1 1 65 ? -8.765 16.022 -16.304 1.0 22.24 65 A 7 -ATOM 978 C CB . ASN A1 1 65 ? -7.54 17.716 -18.235 1.0 30.31 65 A 7 -ATOM 979 C CG . ASN A1 1 65 ? -8.783 18.435 -17.749 1.0 75.23 65 A 7 -ATOM 980 O OD1 . ASN A1 1 65 ? -8.722 19.248 -16.827 1.0 74.2 65 A 7 -ATOM 981 N ND2 . ASN A1 1 65 ? -9.919 18.139 -18.37 1.0 12.4 65 A 7 -ATOM 982 H H . ASN A1 1 65 ? -5.409 16.053 -18.369 1.0 72.01 65 A 7 -ATOM 983 H HA . ASN A1 1 65 ? -6.583 17.811 -16.323 1.0 43.44 65 A 7 -ATOM 984 H HB2 . ASN A1 1 65 ? -6.907 18.431 -18.74 1.0 12.24 65 A 7 -ATOM 985 H HB3 . ASN A1 1 65 ? -7.839 16.949 -18.934 1.0 73.02 65 A 7 -ATOM 986 H HD21 . ASN A1 1 65 ? -9.891 17.481 -19.097 1.0 23.44 65 A 7 -ATOM 987 H HD22 . ASN A1 1 65 ? -10.737 18.59 -18.077 1.0 32.24 65 A 7 -ATOM 988 N N . VAL A1 1 66 ? -6.868 14.818 -16.203 1.0 11.4 66 A 7 -ATOM 989 C CA . VAL A1 1 66 ? -7.513 13.644 -15.628 1.0 70.45 66 A 7 -ATOM 990 C C . VAL A1 1 66 ? -7.239 13.544 -14.131 1.0 73.11 66 A 7 -ATOM 991 O O . VAL A1 1 66 ? -6.303 12.868 -13.706 1.0 33.12 66 A 7 -ATOM 992 C CB . VAL A1 1 66 ? -7.038 12.349 -16.313 1.0 40.11 66 A 7 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.519 12.302 -16.371 1.0 32.21 66 A 7 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.591 11.13 -15.59 1.0 25.13 66 A 7 -ATOM 995 H H . VAL A1 1 66 ? -5.904 14.795 -16.379 1.0 25.31 66 A 7 -ATOM 996 H HA . VAL A1 1 66 ? -8.578 13.739 -15.783 1.0 44.24 66 A 7 -ATOM 997 H HB . VAL A1 1 66 ? -7.415 12.342 -17.325 1.0 65.05 66 A 7 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.189 12.562 -17.365 1.0 62.5 66 A 7 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.109 13.003 -15.658 1.0 4.5 66 A 7 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.181 11.304 -16.129 1.0 12.32 66 A 7 -ATOM 1001 H HG21 . VAL A1 1 66 ? -6.871 10.785 -14.863 1.0 23.4 66 A 7 -ATOM 1002 H HG22 . VAL A1 1 66 ? -8.51 11.396 -15.088 1.0 64.2 66 A 7 -ATOM 1003 H HG23 . VAL A1 1 66 ? -7.786 10.344 -16.305 1.0 74.31 66 A 7 -ATOM 1004 N N . GLN A1 1 67 ? -8.062 14.222 -13.338 1.0 5.43 67 A 7 -ATOM 1005 C CA . GLN A1 1 67 ? -7.907 14.21 -11.888 1.0 15.5 67 A 7 -ATOM 1006 C C . GLN A1 1 67 ? -8.802 13.151 -11.254 1.0 62.54 67 A 7 -ATOM 1007 O O . GLN A1 1 67 ? -9.491 12.405 -11.952 1.0 44.01 67 A 7 -ATOM 1008 C CB . GLN A1 1 67 ? -8.235 15.586 -11.307 1.0 35.11 67 A 7 -ATOM 1009 C CG . GLN A1 1 67 ? -9.607 16.104 -11.708 1.0 11.21 67 A 7 -ATOM 1010 C CD . GLN A1 1 67 ? -9.947 17.427 -11.049 1.0 34.44 67 A 7 -ATOM 1011 O OE1 . GLN A1 1 67 ? -9.556 17.685 -9.91 1.0 41.54 67 A 7 -ATOM 1012 N NE2 . GLN A1 1 67 ? -10.679 18.274 -11.764 1.0 50.51 67 A 7 -ATOM 1013 H H . GLN A1 1 67 ? -8.789 14.743 -13.736 1.0 54.23 67 A 7 -ATOM 1014 H HA . GLN A1 1 67 ? -6.877 13.972 -11.667 1.0 21.13 67 A 7 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.197 15.528 -10.23 1.0 61.05 67 A 7 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.494 16.294 -11.648 1.0 21.05 67 A 7 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.629 16.238 -12.779 1.0 63.24 67 A 7 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.35 15.375 -11.422 1.0 63.02 67 A 7 -ATOM 1019 H HE21 . GLN A1 1 67 ? -10.956 18.0 -12.664 1.0 0.12 67 A 7 -ATOM 1020 H HE22 . GLN A1 1 67 ? -10.913 19.135 -11.362 1.0 72.41 67 A 7 -ATOM 1021 N N . LYS A1 1 68 ? -8.789 13.089 -9.927 1.0 63.33 68 A 7 -ATOM 1022 C CA . LYS A1 1 68 ? -9.6 12.121 -9.197 1.0 34.0 68 A 7 -ATOM 1023 C C . LYS A1 1 68 ? -11.083 12.33 -9.483 1.0 33.21 68 A 7 -ATOM 1024 O O . LYS A1 1 68 ? -11.866 11.38 -9.472 1.0 33.01 68 A 7 -ATOM 1025 C CB . LYS A1 1 68 ? -9.338 12.236 -7.694 1.0 41.41 68 A 7 -ATOM 1026 C CG . LYS A1 1 68 ? -9.867 11.059 -6.892 1.0 61.44 68 A 7 -ATOM 1027 C CD . LYS A1 1 68 ? -9.097 9.785 -7.198 1.0 43.41 68 A 7 -ATOM 1028 C CE . LYS A1 1 68 ? -7.779 9.736 -6.44 1.0 23.43 68 A 7 -ATOM 1029 N NZ . LYS A1 1 68 ? -7.985 9.777 -4.965 1.0 52.05 68 A 7 -ATOM 1030 H H . LYS A1 1 68 ? -8.219 13.71 -9.425 1.0 75.53 68 A 7 -ATOM 1031 H HA . LYS A1 1 68 ? -9.317 11.134 -9.529 1.0 31.4 68 A 7 -ATOM 1032 H HB2 . LYS A1 1 68 ? -8.272 12.306 -7.53 1.0 51.5 68 A 7 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.809 13.136 -7.326 1.0 62.4 68 A 7 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.773 11.28 -5.84 1.0 22.33 68 A 7 -ATOM 1035 H HG3 . LYS A1 1 68 ? -10.908 10.907 -7.138 1.0 45.02 68 A 7 -ATOM 1036 H HD2 . LYS A1 1 68 ? -9.696 8.935 -6.91 1.0 14.2 68 A 7 -ATOM 1037 H HD3 . LYS A1 1 68 ? -8.894 9.743 -8.258 1.0 13.53 68 A 7 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.265 8.823 -6.697 1.0 43.13 68 A 7 -ATOM 1039 H HE3 . LYS A1 1 68 ? -7.177 10.583 -6.734 1.0 63.42 68 A 7 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.624 10.672 -4.579 1.0 1.54 68 A 7 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.481 8.988 -4.512 1.0 73.32 68 A 7 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.998 9.699 -4.744 1.0 23.44 68 A 7 -ATOM 1043 N N . GLU A1 1 69 ? -11.463 13.578 -9.738 1.0 51.1 69 A 7 -ATOM 1044 C CA . GLU A1 1 69 ? -12.853 13.91 -10.027 1.0 15.41 69 A 7 -ATOM 1045 C C . GLU A1 1 69 ? -12.942 15.1 -10.978 1.0 20.25 69 A 7 -ATOM 1046 O O . GLU A1 1 69 ? -13.22 16.223 -10.559 1.0 55.15 69 A 7 -ATOM 1047 C CB . GLU A1 1 69 ? -13.606 14.22 -8.732 1.0 42.14 69 A 7 -ATOM 1048 C CG . GLU A1 1 69 ? -12.851 15.149 -7.796 1.0 32.44 69 A 7 -ATOM 1049 C CD . GLU A1 1 69 ? -13.776 16.009 -6.957 1.0 60.3 69 A 7 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.421 16.914 -7.526 1.0 52.11 69 A 7 -ATOM 1051 O OE2 . GLU A1 1 69 ? -13.853 15.778 -5.732 1.0 33.22 69 A 7 -ATOM 1052 H H . GLU A1 1 69 ? -10.792 14.293 -9.732 1.0 51.55 69 A 7 -ATOM 1053 H HA . GLU A1 1 69 ? -13.307 13.052 -10.5 1.0 21.13 69 A 7 -ATOM 1054 H HB2 . GLU A1 1 69 ? -14.55 14.682 -8.981 1.0 70.35 69 A 7 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.796 13.294 -8.21 1.0 25.14 69 A 7 -ATOM 1056 H HG2 . GLU A1 1 69 ? -12.24 14.554 -7.135 1.0 60.54 69 A 7 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.218 15.796 -8.385 1.0 2.43 69 A 7 -ATOM 1058 N N . SER A1 1 70 ? -12.704 14.844 -12.261 1.0 51.41 70 A 7 -ATOM 1059 C CA . SER A1 1 70 ? -12.753 15.894 -13.271 1.0 50.24 70 A 7 -ATOM 1060 C C . SER A1 1 70 ? -14.137 15.971 -13.909 1.0 72.1 70 A 7 -ATOM 1061 O O . SER A1 1 70 ? -14.682 14.963 -14.36 1.0 13.02 70 A 7 -ATOM 1062 C CB . SER A1 1 70 ? -11.696 15.645 -14.348 1.0 75.43 70 A 7 -ATOM 1063 O OG . SER A1 1 70 ? -11.012 16.841 -14.679 1.0 45.33 70 A 7 -ATOM 1064 H H . SER A1 1 70 ? -12.488 13.928 -12.533 1.0 42.55 70 A 7 -ATOM 1065 H HA . SER A1 1 70 ? -12.542 16.834 -12.783 1.0 61.25 70 A 7 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.979 14.924 -13.985 1.0 1.23 70 A 7 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.175 15.26 -15.237 1.0 50.33 70 A 7 -ATOM 1068 H HG . SER A1 1 70 ? -11.646 17.504 -14.962 1.0 14.24 70 A 7 -ATOM 1069 N N . THR A1 1 71 ? -14.701 17.174 -13.942 1.0 52.55 71 A 7 -ATOM 1070 C CA . THR A1 1 71 ? -16.021 17.384 -14.523 1.0 43.33 71 A 7 -ATOM 1071 C C . THR A1 1 71 ? -15.918 17.806 -15.984 1.0 63.44 71 A 7 -ATOM 1072 O O . THR A1 1 71 ? -15.306 18.826 -16.305 1.0 13.52 71 A 7 -ATOM 1073 C CB . THR A1 1 71 ? -16.813 18.452 -13.746 1.0 4.41 71 A 7 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.94 19.514 -13.344 1.0 4.41 71 A 7 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.48 17.846 -12.52 1.0 4.35 71 A 7 -ATOM 1076 H H . THR A1 1 71 ? -14.216 17.938 -13.567 1.0 14.04 71 A 7 -ATOM 1077 H HA . THR A1 1 71 ? -16.563 16.451 -14.465 1.0 24.13 71 A 7 -ATOM 1078 H HB . THR A1 1 71 ? -17.58 18.852 -14.394 1.0 70.41 71 A 7 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.393 20.079 -12.714 1.0 53.11 71 A 7 -ATOM 1080 H HG21 . THR A1 1 71 ? -18.462 17.486 -12.787 1.0 12.42 71 A 7 -ATOM 1081 H HG22 . THR A1 1 71 ? -17.57 18.598 -11.75 1.0 75.2 71 A 7 -ATOM 1082 H HG23 . THR A1 1 71 ? -16.882 17.025 -12.154 1.0 31.12 71 A 7 -ATOM 1083 N N . LEU A1 1 72 ? -16.521 17.018 -16.867 1.0 74.32 72 A 7 -ATOM 1084 C CA . LEU A1 1 72 ? -16.498 17.311 -18.296 1.0 62.12 72 A 7 -ATOM 1085 C C . LEU A1 1 72 ? -17.891 17.172 -18.902 1.0 14.1 72 A 7 -ATOM 1086 O O . LEU A1 1 72 ? -18.724 16.415 -18.404 1.0 22.33 72 A 7 -ATOM 1087 C CB . LEU A1 1 72 ? -15.522 16.376 -19.012 1.0 54.24 72 A 7 -ATOM 1088 C CG . LEU A1 1 72 ? -16.108 15.064 -19.534 1.0 12.34 72 A 7 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.482 15.192 -21.002 1.0 71.53 72 A 7 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.124 13.921 -19.329 1.0 45.31 72 A 7 -ATOM 1091 H H . LEU A1 1 72 ? -16.993 16.219 -16.551 1.0 40.44 72 A 7 -ATOM 1092 H HA . LEU A1 1 72 ? -16.165 18.33 -18.419 1.0 22.23 72 A 7 -ATOM 1093 H HB2 . LEU A1 1 72 ? -15.11 16.911 -19.854 1.0 24.33 72 A 7 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.729 16.134 -18.319 1.0 64.44 72 A 7 -ATOM 1095 H HG . LEU A1 1 72 ? -17.009 14.835 -18.98 1.0 60.22 72 A 7 -ATOM 1096 H HD11 . LEU A1 1 72 ? -15.907 15.988 -21.451 1.0 22.12 72 A 7 -ATOM 1097 H HD12 . LEU A1 1 72 ? -17.535 15.416 -21.088 1.0 11.12 72 A 7 -ATOM 1098 H HD13 . LEU A1 1 72 ? -16.269 14.263 -21.51 1.0 74.11 72 A 7 -ATOM 1099 H HD21 . LEU A1 1 72 ? -15.403 13.089 -19.958 1.0 45.11 72 A 7 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.142 13.613 -18.294 1.0 64.51 72 A 7 -ATOM 1101 H HD23 . LEU A1 1 72 ? -14.129 14.253 -19.589 1.0 15.53 72 A 7 -ATOM 1102 N N . HIS A1 1 73 ? -18.136 17.906 -19.983 1.0 22.1 73 A 7 -ATOM 1103 C CA . HIS A1 1 73 ? -19.427 17.863 -20.66 1.0 43.22 73 A 7 -ATOM 1104 C C . HIS A1 1 73 ? -19.386 16.905 -21.846 1.0 1.12 73 A 7 -ATOM 1105 O O . HIS A1 1 73 ? -18.591 17.078 -22.771 1.0 41.41 73 A 7 -ATOM 1106 C CB . HIS A1 1 73 ? -19.826 19.262 -21.132 1.0 34.11 73 A 7 -ATOM 1107 C CG . HIS A1 1 73 ? -20.201 20.187 -20.016 1.0 25.31 73 A 7 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.267 21.058 -20.087 1.0 22.31 73 A 7 -ATOM 1109 C CD2 . HIS A1 1 73 ? -19.646 20.372 -18.795 1.0 30.12 73 A 7 -ATOM 1110 C CE1 . HIS A1 1 73 ? -21.351 21.741 -18.959 1.0 74.03 73 A 7 -ATOM 1111 N NE2 . HIS A1 1 73 ? -20.379 21.343 -18.158 1.0 22.32 73 A 7 -ATOM 1112 H H . HIS A1 1 73 ? -17.432 18.491 -20.333 1.0 41.1 73 A 7 -ATOM 1113 H HA . HIS A1 1 73 ? -20.161 17.509 -19.952 1.0 23.25 73 A 7 -ATOM 1114 H HB2 . HIS A1 1 73 ? -18.997 19.704 -21.665 1.0 51.13 73 A 7 -ATOM 1115 H HB3 . HIS A1 1 73 ? -20.674 19.182 -21.797 1.0 64.13 73 A 7 -ATOM 1116 H HD1 . HIS A1 1 73 ? -21.872 21.162 -20.851 1.0 63.31 73 A 7 -ATOM 1117 H HD2 . HIS A1 1 73 ? -18.786 19.853 -18.396 1.0 71.43 73 A 7 -ATOM 1118 H HE1 . HIS A1 1 73 ? -22.088 22.495 -18.729 1.0 3.34 73 A 7 -ATOM 1119 N N . LEU A1 1 74 ? -20.248 15.894 -21.814 1.0 31.4 74 A 7 -ATOM 1120 C CA . LEU A1 1 74 ? -20.31 14.907 -22.886 1.0 41.22 74 A 7 -ATOM 1121 C C . LEU A1 1 74 ? -21.574 15.089 -23.721 1.0 21.0 74 A 7 -ATOM 1122 O O . LEU A1 1 74 ? -22.689 14.964 -23.214 1.0 70.53 74 A 7 -ATOM 1123 C CB . LEU A1 1 74 ? -20.267 13.492 -22.307 1.0 42.32 74 A 7 -ATOM 1124 C CG . LEU A1 1 74 ? -20.883 12.393 -23.174 1.0 13.02 74 A 7 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.164 12.301 -24.51 1.0 50.12 74 A 7 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.84 11.056 -22.449 1.0 22.4 74 A 7 -ATOM 1127 H H . LEU A1 1 74 ? -20.856 15.808 -21.051 1.0 53.04 74 A 7 -ATOM 1128 H HA . LEU A1 1 74 ? -19.449 15.053 -23.522 1.0 65.43 74 A 7 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.233 13.236 -22.135 1.0 22.02 74 A 7 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.795 13.506 -21.364 1.0 20.31 74 A 7 -ATOM 1131 H HG . LEU A1 1 74 ? -21.919 12.635 -23.369 1.0 34.12 74 A 7 -ATOM 1132 H HD11 . LEU A1 1 74 ? -20.154 11.274 -24.843 1.0 33.01 74 A 7 -ATOM 1133 H HD12 . LEU A1 1 74 ? -19.149 12.653 -24.398 1.0 1.34 74 A 7 -ATOM 1134 H HD13 . LEU A1 1 74 ? -20.678 12.912 -25.238 1.0 63.14 74 A 7 -ATOM 1135 H HD21 . LEU A1 1 74 ? -19.828 10.681 -22.445 1.0 12.32 74 A 7 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.483 10.351 -22.956 1.0 54.43 74 A 7 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.181 11.186 -21.432 1.0 14.02 74 A 7 -ATOM 1138 N N . VAL A1 1 75 ? -21.392 15.384 -25.004 1.0 43.5 75 A 7 -ATOM 1139 C CA . VAL A1 1 75 ? -22.517 15.58 -25.911 1.0 52.32 75 A 7 -ATOM 1140 C C . VAL A1 1 75 ? -22.567 14.483 -26.969 1.0 61.15 75 A 7 -ATOM 1141 O O . VAL A1 1 75 ? -21.555 14.156 -27.589 1.0 54.31 75 A 7 -ATOM 1142 C CB . VAL A1 1 75 ? -22.442 16.95 -26.61 1.0 24.5 75 A 7 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.649 17.156 -27.513 1.0 55.3 75 A 7 -ATOM 1144 C CG2 . VAL A1 1 75 ? -22.337 18.067 -25.583 1.0 64.14 75 A 7 -ATOM 1145 H H . VAL A1 1 75 ? -20.479 15.471 -25.35 1.0 70.11 75 A 7 -ATOM 1146 H HA . VAL A1 1 75 ? -23.425 15.546 -25.327 1.0 60.52 75 A 7 -ATOM 1147 H HB . VAL A1 1 75 ? -21.553 16.97 -27.224 1.0 44.41 75 A 7 -ATOM 1148 H HG11 . VAL A1 1 75 ? -23.85 18.213 -27.609 1.0 31.54 75 A 7 -ATOM 1149 H HG12 . VAL A1 1 75 ? -23.446 16.736 -28.487 1.0 61.34 75 A 7 -ATOM 1150 H HG13 . VAL A1 1 75 ? -24.509 16.665 -27.081 1.0 54.52 75 A 7 -ATOM 1151 H HG21 . VAL A1 1 75 ? -22.289 17.642 -24.592 1.0 5.24 75 A 7 -ATOM 1152 H HG22 . VAL A1 1 75 ? -21.446 18.646 -25.772 1.0 61.35 75 A 7 -ATOM 1153 H HG23 . VAL A1 1 75 ? -23.205 18.708 -25.658 1.0 24.43 75 A 7 -ATOM 1154 N N . LEU A1 1 76 ? -23.753 13.919 -27.171 1.0 35.1 76 A 7 -ATOM 1155 C CA . LEU A1 1 76 ? -23.937 12.858 -28.155 1.0 22.53 76 A 7 -ATOM 1156 C C . LEU A1 1 76 ? -24.901 13.295 -29.253 1.0 2.14 76 A 7 -ATOM 1157 O O . LEU A1 1 76 ? -25.926 13.921 -28.98 1.0 21.5 76 A 7 -ATOM 1158 C CB . LEU A1 1 76 ? -24.46 11.591 -27.477 1.0 73.12 76 A 7 -ATOM 1159 C CG . LEU A1 1 76 ? -24.23 11.493 -25.968 1.0 64.45 76 A 7 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.42 12.059 -25.21 1.0 24.13 76 A 7 -ATOM 1161 C CD2 . LEU A1 1 76 ? -23.972 10.05 -25.56 1.0 22.03 76 A 7 -ATOM 1162 H H . LEU A1 1 76 ? -24.523 14.221 -26.647 1.0 44.32 76 A 7 -ATOM 1163 H HA . LEU A1 1 76 ? -22.975 12.648 -28.6 1.0 53.04 76 A 7 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.523 11.536 -27.653 1.0 71.31 76 A 7 -ATOM 1165 H HB3 . LEU A1 1 76 ? -23.975 10.744 -27.942 1.0 62.14 76 A 7 -ATOM 1166 H HG . LEU A1 1 76 ? -23.359 12.077 -25.705 1.0 42.11 76 A 7 -ATOM 1167 H HD11 . LEU A1 1 76 ? -25.415 11.682 -24.198 1.0 12.14 76 A 7 -ATOM 1168 H HD12 . LEU A1 1 76 ? -26.335 11.761 -25.7 1.0 23.21 76 A 7 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.357 13.137 -25.193 1.0 40.2 76 A 7 -ATOM 1170 H HD21 . LEU A1 1 76 ? -24.557 9.814 -24.684 1.0 53.24 76 A 7 -ATOM 1171 H HD22 . LEU A1 1 76 ? -22.923 9.922 -25.339 1.0 72.02 76 A 7 -ATOM 1172 H HD23 . LEU A1 1 76 ? -24.252 9.392 -26.37 1.0 63.4 76 A 7 -ATOM 1173 N N . ARG A1 1 77 ? -24.567 12.961 -30.495 1.0 50.44 77 A 7 -ATOM 1174 C CA . ARG A1 1 77 ? -25.404 13.318 -31.634 1.0 12.4 77 A 7 -ATOM 1175 C C . ARG A1 1 77 ? -26.52 12.297 -31.83 1.0 10.32 77 A 7 -ATOM 1176 O O . ARG A1 1 77 ? -26.672 11.727 -32.912 1.0 12.43 77 A 7 -ATOM 1177 C CB . ARG A1 1 77 ? -24.558 13.415 -32.905 1.0 55.35 77 A 7 -ATOM 1178 C CG . ARG A1 1 77 ? -23.165 13.976 -32.669 1.0 12.22 77 A 7 -ATOM 1179 C CD . ARG A1 1 77 ? -23.216 15.296 -31.916 1.0 60.22 77 A 7 -ATOM 1180 N NE . ARG A1 1 77 ? -24.244 16.188 -32.445 1.0 64.33 77 A 7 -ATOM 1181 C CZ . ARG A1 1 77 ? -24.098 16.9 -33.557 1.0 13.31 77 A 7 -ATOM 1182 N NH1 . ARG A1 1 77 ? -22.972 16.825 -34.253 1.0 63.3 77 A 7 -ATOM 1183 N NH2 . ARG A1 1 77 ? -25.079 17.69 -33.974 1.0 70.54 77 A 7 -ATOM 1184 H H . ARG A1 1 77 ? -23.737 12.462 -30.65 1.0 2.41 77 A 7 -ATOM 1185 H HA . ARG A1 1 77 ? -25.845 14.283 -31.432 1.0 53.23 77 A 7 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.456 12.428 -33.333 1.0 41.04 77 A 7 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.064 14.054 -33.613 1.0 23.23 77 A 7 -ATOM 1188 H HG2 . ARG A1 1 77 ? -22.594 13.265 -32.089 1.0 3.21 77 A 7 -ATOM 1189 H HG3 . ARG A1 1 77 ? -22.684 14.133 -33.623 1.0 45.32 77 A 7 -ATOM 1190 H HD2 . ARG A1 1 77 ? -23.429 15.094 -30.877 1.0 24.22 77 A 7 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.255 15.78 -31.999 1.0 55.12 77 A 7 -ATOM 1192 H HE . ARG A1 1 77 ? -25.084 16.259 -31.946 1.0 41.44 77 A 7 -ATOM 1193 H HH11 . ARG A1 1 77 ? -22.232 16.23 -33.941 1.0 31.24 77 A 7 -ATOM 1194 H HH12 . ARG A1 1 77 ? -22.865 17.361 -35.091 1.0 72.5 77 A 7 -ATOM 1195 H HH21 . ARG A1 1 77 ? -25.929 17.749 -33.452 1.0 71.34 77 A 7 -ATOM 1196 H HH22 . ARG A1 1 77 ? -24.968 18.225 -34.811 1.0 1.44 77 A 7 -ATOM 1197 N N . LEU A1 1 78 ? -27.299 12.07 -30.778 1.0 31.03 78 A 7 -ATOM 1198 C CA . LEU A1 1 78 ? -28.402 11.118 -30.834 1.0 51.32 78 A 7 -ATOM 1199 C C . LEU A1 1 78 ? -29.675 11.787 -31.342 1.0 14.11 78 A 7 -ATOM 1200 O O . LEU A1 1 78 ? -30.289 11.325 -32.304 1.0 12.31 78 A 7 -ATOM 1201 C CB . LEU A1 1 78 ? -28.649 10.512 -29.451 1.0 42.51 78 A 7 -ATOM 1202 C CG . LEU A1 1 78 ? -27.889 9.222 -29.138 1.0 51.45 78 A 7 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.397 9.414 -29.359 1.0 14.44 78 A 7 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.165 8.774 -27.71 1.0 25.32 78 A 7 -ATOM 1205 H H . LEU A1 1 78 ? -27.129 12.555 -29.944 1.0 75.31 78 A 7 -ATOM 1206 H HA . LEU A1 1 78 ? -28.125 10.33 -31.518 1.0 64.2 78 A 7 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.368 11.248 -28.713 1.0 61.14 78 A 7 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.706 10.304 -29.365 1.0 62.32 78 A 7 -ATOM 1209 H HG . LEU A1 1 78 ? -28.228 8.442 -29.806 1.0 53.42 78 A 7 -ATOM 1210 H HD11 . LEU A1 1 78 ? -25.848 8.811 -28.652 1.0 3.24 78 A 7 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.143 10.454 -29.219 1.0 74.14 78 A 7 -ATOM 1212 H HD13 . LEU A1 1 78 ? -26.141 9.114 -30.365 1.0 11.41 78 A 7 -ATOM 1213 H HD21 . LEU A1 1 78 ? -28.539 9.609 -27.136 1.0 65.32 78 A 7 -ATOM 1214 H HD22 . LEU A1 1 78 ? -27.251 8.41 -27.264 1.0 65.43 78 A 7 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.901 7.983 -27.717 1.0 34.04 78 A 7 -ATOM 1216 N N . ARG A1 1 79 ? -30.064 12.879 -30.692 1.0 44.5 79 A 7 -ATOM 1217 C CA . ARG A1 1 79 ? -31.263 13.612 -31.079 1.0 54.44 79 A 7 -ATOM 1218 C C . ARG A1 1 79 ? -32.505 12.739 -30.932 1.0 43.43 79 A 7 -ATOM 1219 O O . ARG A1 1 79 ? -33.389 12.75 -31.788 1.0 24.23 79 A 7 -ATOM 1220 C CB . ARG A1 1 79 ? -31.141 14.106 -32.522 1.0 53.1 79 A 7 -ATOM 1221 C CG . ARG A1 1 79 ? -32.179 15.15 -32.899 1.0 62.42 79 A 7 -ATOM 1222 C CD . ARG A1 1 79 ? -31.555 16.528 -33.047 1.0 15.2 79 A 7 -ATOM 1223 N NE . ARG A1 1 79 ? -31.466 16.942 -34.445 1.0 22.21 79 A 7 -ATOM 1224 C CZ . ARG A1 1 79 ? -31.287 18.201 -34.829 1.0 43.33 79 A 7 -ATOM 1225 N NH1 . ARG A1 1 79 ? -31.177 19.164 -33.924 1.0 51.34 79 A 7 -ATOM 1226 N NH2 . ARG A1 1 79 ? -31.216 18.498 -36.12 1.0 24.34 79 A 7 -ATOM 1227 H H . ARG A1 1 79 ? -29.532 13.198 -29.933 1.0 30.43 79 A 7 -ATOM 1228 H HA . ARG A1 1 79 ? -31.356 14.465 -30.423 1.0 75.12 79 A 7 -ATOM 1229 H HB2 . ARG A1 1 79 ? -30.161 14.538 -32.661 1.0 72.51 79 A 7 -ATOM 1230 H HB3 . ARG A1 1 79 ? -31.251 13.263 -33.188 1.0 62.3 79 A 7 -ATOM 1231 H HG2 . ARG A1 1 79 ? -32.633 14.87 -33.838 1.0 34.21 79 A 7 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.934 15.187 -32.128 1.0 51.44 79 A 7 -ATOM 1233 H HD2 . ARG A1 1 79 ? -32.159 17.242 -32.508 1.0 21.42 79 A 7 -ATOM 1234 H HD3 . ARG A1 1 79 ? -30.561 16.506 -32.624 1.0 24.22 79 A 7 -ATOM 1235 H HE . ARG A1 1 79 ? -31.544 16.246 -35.13 1.0 63.2 79 A 7 -ATOM 1236 H HH11 . ARG A1 1 79 ? -31.229 18.943 -32.951 1.0 0.03 79 A 7 -ATOM 1237 H HH12 . ARG A1 1 79 ? -31.041 20.111 -34.216 1.0 54.33 79 A 7 -ATOM 1238 H HH21 . ARG A1 1 79 ? -31.298 17.774 -36.805 1.0 72.3 79 A 7 -ATOM 1239 H HH22 . ARG A1 1 79 ? -31.082 19.446 -36.408 1.0 2.44 79 A 7 -ATOM 1240 N N . GLY A1 1 80 ? -32.566 11.983 -29.84 1.0 11.03 80 A 7 -ATOM 1241 C CA . GLY A1 1 80 ? -33.703 11.115 -29.601 1.0 3.12 80 A 7 -ATOM 1242 C C . GLY A1 1 80 ? -33.571 10.328 -28.312 1.0 52.34 80 A 7 -ATOM 1243 O O . GLY A1 1 80 ? -34.547 10.143 -27.586 1.0 43.44 80 A 7 -ATOM 1244 H H . GLY A1 1 80 ? -31.832 12.016 -29.191 1.0 0.24 80 A 7 -ATOM 1245 H HA2 . GLY A1 1 80 ? -34.598 11.717 -29.553 1.0 71.24 80 A 7 -ATOM 1246 H HA3 . GLY A1 1 80 ? -33.792 10.422 -30.424 1.0 43.14 80 A 7 -ATOM 1247 N N . GLY A1 1 81 ? -32.359 9.861 -28.027 1.0 43.34 81 A 7 -ATOM 1248 C CA . GLY A1 1 81 ? -32.126 9.093 -26.818 1.0 20.2 81 A 7 -ATOM 1249 C C . GLY A1 1 81 ? -31.794 7.642 -27.107 1.0 63.23 81 A 7 -ATOM 1250 O O . GLY A1 1 81 ? -31.766 7.223 -28.264 1.0 30.24 81 A 7 -ATOM 1251 H H . GLY A1 1 81 ? -31.618 10.039 -28.643 1.0 11.33 81 A 7 -ATOM 1252 H HA2 . GLY A1 1 81 ? -31.305 9.537 -26.275 1.0 30.51 81 A 7 -ATOM 1253 H HA3 . GLY A1 1 81 ? -33.014 9.131 -26.204 1.0 55.14 81 A 7 -ATOM 1254 N N . VAL A1 1 82 ? -31.541 6.873 -26.053 1.0 30.52 82 A 7 -ATOM 1255 C CA . VAL A1 1 82 ? -31.209 5.461 -26.199 1.0 4.45 82 A 7 -ATOM 1256 C C . VAL A1 1 82 ? -32.332 4.702 -26.899 1.0 63.52 82 A 7 -ATOM 1257 O O . VAL A1 1 82 ? -33.308 5.298 -27.353 1.0 12.52 82 A 7 -ATOM 1258 C CB . VAL A1 1 82 ? -30.935 4.804 -24.833 1.0 53.54 82 A 7 -ATOM 1259 C CG1 . VAL A1 1 82 ? -29.684 5.395 -24.199 1.0 33.31 82 A 7 -ATOM 1260 C CG2 . VAL A1 1 82 ? -32.136 4.966 -23.914 1.0 1.13 82 A 7 -ATOM 1261 H H . VAL A1 1 82 ? -31.58 7.264 -25.156 1.0 42.11 82 A 7 -ATOM 1262 H HA . VAL A1 1 82 ? -30.312 5.389 -26.797 1.0 65.12 82 A 7 -ATOM 1263 H HB . VAL A1 1 82 ? -30.768 3.749 -24.991 1.0 3.02 82 A 7 -ATOM 1264 H HG11 . VAL A1 1 82 ? -29.66 6.46 -24.376 1.0 71.54 82 A 7 -ATOM 1265 H HG12 . VAL A1 1 82 ? -29.696 5.205 -23.136 1.0 43.52 82 A 7 -ATOM 1266 H HG13 . VAL A1 1 82 ? -28.809 4.938 -24.637 1.0 60.31 82 A 7 -ATOM 1267 H HG21 . VAL A1 1 82 ? -31.939 4.472 -22.974 1.0 51.1 82 A 7 -ATOM 1268 H HG22 . VAL A1 1 82 ? -32.316 6.016 -23.739 1.0 43.42 82 A 7 -ATOM 1269 H HG23 . VAL A1 1 82 ? -33.006 4.524 -24.377 1.0 61.21 82 A 7 -ATOM 1 N N . GLY A1 1 1 ? -14.994 2.906 -5.788 1.0 13.0 1 A 8 -ATOM 2 C CA . GLY A1 1 1 ? -13.766 2.647 -6.517 1.0 45.03 1 A 8 -ATOM 3 C C . GLY A1 1 1 ? -12.638 2.195 -5.61 1.0 65.21 1 A 8 -ATOM 4 O O . GLY A1 1 1 ? -11.701 2.943 -5.33 1.0 33.34 1 A 8 -ATOM 5 H H1 . GLY A1 1 1 ? -15.137 3.779 -5.367 1.0 52.4 1 A 8 -ATOM 6 H HA2 . GLY A1 1 1 ? -13.952 1.879 -7.253 1.0 14.15 1 A 8 -ATOM 7 H HA3 . GLY A1 1 1 ? -13.464 3.552 -7.023 1.0 34.23 1 A 8 -ATOM 8 N N . PRO A1 1 2 ? -12.721 0.945 -5.133 1.0 55.32 2 A 8 -ATOM 9 C CA . PRO A1 1 2 ? -11.708 0.367 -4.245 1.0 21.43 2 A 8 -ATOM 10 C C . PRO A1 1 2 ? -10.387 0.11 -4.961 1.0 41.45 2 A 8 -ATOM 11 O O . PRO A1 1 2 ? -9.331 0.037 -4.331 1.0 62.42 2 A 8 -ATOM 12 C CB . PRO A1 1 2 ? -12.34 -0.954 -3.799 1.0 51.45 2 A 8 -ATOM 13 C CG . PRO A1 1 2 ? -13.29 -1.308 -4.89 1.0 43.11 2 A 8 -ATOM 14 C CD . PRO A1 1 2 ? -13.81 -0.002 -5.425 1.0 64.14 2 A 8 -ATOM 15 H HA . PRO A1 1 2 ? -11.533 0.993 -3.383 1.0 31.54 2 A 8 -ATOM 16 H HB2 . PRO A1 1 2 ? -11.57 -1.704 -3.686 1.0 42.4 2 A 8 -ATOM 17 H HB3 . PRO A1 1 2 ? -12.853 -0.813 -2.859 1.0 62.54 2 A 8 -ATOM 18 H HG2 . PRO A1 1 2 ? -12.772 -1.851 -5.666 1.0 3.22 2 A 8 -ATOM 19 H HG3 . PRO A1 1 2 ? -14.101 -1.9 -4.493 1.0 51.14 2 A 8 -ATOM 20 H HD2 . PRO A1 1 2 ? -13.985 -0.073 -6.489 1.0 11.0 2 A 8 -ATOM 21 H HD3 . PRO A1 1 2 ? -14.716 0.282 -4.91 1.0 24.12 2 A 8 -ATOM 22 N N . LEU A1 1 3 ? -10.452 -0.026 -6.281 1.0 34.12 3 A 8 -ATOM 23 C CA . LEU A1 1 3 ? -9.26 -0.274 -7.084 1.0 54.03 3 A 8 -ATOM 24 C C . LEU A1 1 3 ? -9.241 0.619 -8.321 1.0 63.21 3 A 8 -ATOM 25 O O . LEU A1 1 3 ? -10.205 0.659 -9.085 1.0 11.24 3 A 8 -ATOM 26 C CB . LEU A1 1 3 ? -9.199 -1.744 -7.501 1.0 60.12 3 A 8 -ATOM 27 C CG . LEU A1 1 3 ? -7.97 -2.162 -8.311 1.0 64.13 3 A 8 -ATOM 28 C CD1 . LEU A1 1 3 ? -6.911 -2.765 -7.402 1.0 62.25 3 A 8 -ATOM 29 C CD2 . LEU A1 1 3 ? -8.361 -3.146 -9.404 1.0 0.12 3 A 8 -ATOM 30 H H . LEU A1 1 3 ? -11.322 0.042 -6.727 1.0 52.35 3 A 8 -ATOM 31 H HA . LEU A1 1 3 ? -8.397 -0.044 -6.477 1.0 43.13 3 A 8 -ATOM 32 H HB2 . LEU A1 1 3 ? -9.222 -2.343 -6.604 1.0 74.24 3 A 8 -ATOM 33 H HB3 . LEU A1 1 3 ? -10.076 -1.955 -8.096 1.0 72.41 3 A 8 -ATOM 34 H HG . LEU A1 1 3 ? -7.545 -1.287 -8.784 1.0 43.5 3 A 8 -ATOM 35 H HD11 . LEU A1 1 3 ? -6.884 -3.835 -7.541 1.0 50.45 3 A 8 -ATOM 36 H HD12 . LEU A1 1 3 ? -7.151 -2.541 -6.373 1.0 4.34 3 A 8 -ATOM 37 H HD13 . LEU A1 1 3 ? -5.946 -2.345 -7.646 1.0 54.42 3 A 8 -ATOM 38 H HD21 . LEU A1 1 3 ? -7.497 -3.375 -10.008 1.0 23.33 3 A 8 -ATOM 39 H HD22 . LEU A1 1 3 ? -9.13 -2.709 -10.024 1.0 1.01 3 A 8 -ATOM 40 H HD23 . LEU A1 1 3 ? -8.737 -4.054 -8.953 1.0 75.24 3 A 8 -ATOM 41 N N . GLY A1 1 4 ? -8.135 1.332 -8.514 1.0 4.21 4 A 8 -ATOM 42 C CA . GLY A1 1 4 ? -8.011 2.212 -9.661 1.0 43.34 4 A 8 -ATOM 43 C C . GLY A1 1 4 ? -7.108 3.398 -9.386 1.0 32.24 4 A 8 -ATOM 44 O O . GLY A1 1 4 ? -6.836 3.725 -8.231 1.0 73.31 4 A 8 -ATOM 45 H H . GLY A1 1 4 ? -7.398 1.259 -7.872 1.0 2.13 4 A 8 -ATOM 46 H HA2 . GLY A1 1 4 ? -7.607 1.65 -10.49 1.0 53.5 4 A 8 -ATOM 47 H HA3 . GLY A1 1 4 ? -8.992 2.576 -9.929 1.0 61.41 4 A 8 -ATOM 48 N N . SER A1 1 5 ? -6.642 4.044 -10.45 1.0 14.33 5 A 8 -ATOM 49 C CA . SER A1 1 5 ? -5.76 5.198 -10.318 1.0 12.42 5 A 8 -ATOM 50 C C . SER A1 1 5 ? -6.545 6.437 -9.898 1.0 43.22 5 A 8 -ATOM 51 O O . SER A1 1 5 ? -6.487 6.86 -8.744 1.0 33.52 5 A 8 -ATOM 52 C CB . SER A1 1 5 ? -5.032 5.464 -11.637 1.0 72.02 5 A 8 -ATOM 53 O OG . SER A1 1 5 ? -4.703 6.836 -11.77 1.0 21.35 5 A 8 -ATOM 54 H H . SER A1 1 5 ? -6.895 3.735 -11.345 1.0 31.12 5 A 8 -ATOM 55 H HA . SER A1 1 5 ? -5.031 4.972 -9.554 1.0 12.32 5 A 8 -ATOM 56 H HB2 . SER A1 1 5 ? -4.123 4.884 -11.667 1.0 41.01 5 A 8 -ATOM 57 H HB3 . SER A1 1 5 ? -5.67 5.177 -12.461 1.0 74.13 5 A 8 -ATOM 58 H HG . SER A1 1 5 ? -3.91 7.026 -11.264 1.0 33.45 5 A 8 -ATOM 59 N N . MET A1 1 6 ? -7.279 7.013 -10.844 1.0 14.01 6 A 8 -ATOM 60 C CA . MET A1 1 6 ? -8.077 8.203 -10.573 1.0 54.33 6 A 8 -ATOM 61 C C . MET A1 1 6 ? -9.509 8.021 -11.066 1.0 31.44 6 A 8 -ATOM 62 O O . MET A1 1 6 ? -9.881 6.945 -11.534 1.0 1.11 6 A 8 -ATOM 63 C CB . MET A1 1 6 ? -7.448 9.428 -11.24 1.0 70.21 6 A 8 -ATOM 64 C CG . MET A1 1 6 ? -7.524 9.4 -12.758 1.0 25.05 6 A 8 -ATOM 65 S SD . MET A1 1 6 ? -5.927 9.071 -13.527 1.0 3.44 6 A 8 -ATOM 66 C CE . MET A1 1 6 ? -4.948 10.416 -12.864 1.0 13.21 6 A 8 -ATOM 67 H H . MET A1 1 6 ? -7.284 6.63 -11.746 1.0 2.32 6 A 8 -ATOM 68 H HA . MET A1 1 6 ? -8.093 8.355 -9.504 1.0 5.22 6 A 8 -ATOM 69 H HB2 . MET A1 1 6 ? -7.958 10.314 -10.892 1.0 62.43 6 A 8 -ATOM 70 H HB3 . MET A1 1 6 ? -6.408 9.485 -10.954 1.0 63.34 6 A 8 -ATOM 71 H HG2 . MET A1 1 6 ? -8.217 8.628 -13.057 1.0 33.13 6 A 8 -ATOM 72 H HG3 . MET A1 1 6 ? -7.884 10.357 -13.104 1.0 12.41 6 A 8 -ATOM 73 H HE1 . MET A1 1 6 ? -4.068 10.556 -13.476 1.0 12.23 6 A 8 -ATOM 74 H HE2 . MET A1 1 6 ? -5.534 11.322 -12.863 1.0 52.54 6 A 8 -ATOM 75 H HE3 . MET A1 1 6 ? -4.649 10.179 -11.853 1.0 2.41 6 A 8 -ATOM 76 N N . GLN A1 1 7 ? -10.307 9.078 -10.956 1.0 13.12 7 A 8 -ATOM 77 C CA . GLN A1 1 7 ? -11.698 9.033 -11.39 1.0 13.2 7 A 8 -ATOM 78 C C . GLN A1 1 7 ? -12.086 10.319 -12.111 1.0 42.42 7 A 8 -ATOM 79 O O . GLN A1 1 7 ? -11.481 11.37 -11.895 1.0 71.33 7 A 8 -ATOM 80 C CB . GLN A1 1 7 ? -12.621 8.808 -10.191 1.0 42.01 7 A 8 -ATOM 81 C CG . GLN A1 1 7 ? -14.015 8.338 -10.576 1.0 12.34 7 A 8 -ATOM 82 C CD . GLN A1 1 7 ? -14.338 6.961 -10.029 1.0 44.31 7 A 8 -ATOM 83 O OE1 . GLN A1 1 7 ? -14.814 6.088 -10.756 1.0 33.44 7 A 8 -ATOM 84 N NE2 . GLN A1 1 7 ? -14.081 6.76 -8.742 1.0 73.32 7 A 8 -ATOM 85 H H . GLN A1 1 7 ? -9.952 9.907 -10.575 1.0 71.21 7 A 8 -ATOM 86 H HA . GLN A1 1 7 ? -11.805 8.205 -12.075 1.0 62.03 7 A 8 -ATOM 87 H HB2 . GLN A1 1 7 ? -12.179 8.063 -9.546 1.0 13.25 7 A 8 -ATOM 88 H HB3 . GLN A1 1 7 ? -12.716 9.735 -9.646 1.0 41.42 7 A 8 -ATOM 89 H HG2 . GLN A1 1 7 ? -14.738 9.041 -10.189 1.0 43.33 7 A 8 -ATOM 90 H HG3 . GLN A1 1 7 ? -14.086 8.307 -11.653 1.0 33.21 7 A 8 -ATOM 91 H HE21 . GLN A1 1 7 ? -13.703 7.502 -8.225 1.0 52.01 7 A 8 -ATOM 92 H HE22 . GLN A1 1 7 ? -14.281 5.88 -8.362 1.0 55.43 7 A 8 -ATOM 93 N N . ILE A1 1 8 ? -13.098 10.23 -12.968 1.0 12.12 8 A 8 -ATOM 94 C CA . ILE A1 1 8 ? -13.566 11.387 -13.72 1.0 64.2 8 A 8 -ATOM 95 C C . ILE A1 1 8 ? -15.09 11.435 -13.762 1.0 0.33 8 A 8 -ATOM 96 O O . ILE A1 1 8 ? -15.757 10.404 -13.682 1.0 11.35 8 A 8 -ATOM 97 C CB . ILE A1 1 8 ? -13.024 11.38 -15.161 1.0 65.34 8 A 8 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.068 10.202 -15.363 1.0 72.33 8 A 8 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.325 12.695 -15.471 1.0 55.24 8 A 8 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.617 10.029 -16.796 1.0 11.02 8 A 8 -ATOM 101 H H . ILE A1 1 8 ? -13.54 9.365 -13.096 1.0 43.45 8 A 8 -ATOM 102 H HA . ILE A1 1 8 ? -13.203 12.276 -13.224 1.0 41.41 8 A 8 -ATOM 103 H HB . ILE A1 1 8 ? -13.859 11.276 -15.836 1.0 13.24 8 A 8 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.189 10.352 -14.755 1.0 4.11 8 A 8 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.561 9.291 -15.057 1.0 33.41 8 A 8 -ATOM 106 H HG21 . ILE A1 1 8 ? -13.064 13.453 -15.686 1.0 12.11 8 A 8 -ATOM 107 H HG22 . ILE A1 1 8 ? -11.737 13.0 -14.618 1.0 14.43 8 A 8 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.68 12.568 -16.326 1.0 53.13 8 A 8 -ATOM 109 H HD11 . ILE A1 1 8 ? -11.908 10.896 -17.372 1.0 4.51 8 A 8 -ATOM 110 H HD12 . ILE A1 1 8 ? -10.542 9.924 -16.826 1.0 22.53 8 A 8 -ATOM 111 H HD13 . ILE A1 1 8 ? -12.078 9.148 -17.215 1.0 32.23 8 A 8 -ATOM 112 N N . PHE A1 1 9 ? -15.635 12.64 -13.892 1.0 44.42 9 A 8 -ATOM 113 C CA . PHE A1 1 9 ? -17.081 12.824 -13.946 1.0 45.42 9 A 8 -ATOM 114 C C . PHE A1 1 9 ? -17.524 13.234 -15.348 1.0 62.05 9 A 8 -ATOM 115 O O . PHE A1 1 9 ? -17.014 14.2 -15.915 1.0 33.13 9 A 8 -ATOM 116 C CB . PHE A1 1 9 ? -17.521 13.88 -12.931 1.0 42.3 9 A 8 -ATOM 117 C CG . PHE A1 1 9 ? -18.317 13.317 -11.788 1.0 44.44 9 A 8 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.464 12.575 -12.024 1.0 24.21 9 A 8 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.92 13.53 -10.478 1.0 24.11 9 A 8 -ATOM 120 C CE1 . PHE A1 1 9 ? -20.199 12.056 -10.975 1.0 54.33 9 A 8 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.65 13.013 -9.425 1.0 62.43 9 A 8 -ATOM 122 C CZ . PHE A1 1 9 ? -19.792 12.276 -9.674 1.0 72.21 9 A 8 -ATOM 123 H H . PHE A1 1 9 ? -15.051 13.426 -13.951 1.0 15.35 9 A 8 -ATOM 124 H HA . PHE A1 1 9 ? -17.543 11.881 -13.697 1.0 72.15 9 A 8 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.646 14.36 -12.52 1.0 13.22 9 A 8 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.131 14.617 -13.43 1.0 20.44 9 A 8 -ATOM 127 H HD1 . PHE A1 1 9 ? -19.783 12.403 -13.042 1.0 63.23 9 A 8 -ATOM 128 H HD2 . PHE A1 1 9 ? -17.028 14.107 -10.282 1.0 43.5 9 A 8 -ATOM 129 H HE1 . PHE A1 1 9 ? -21.09 11.48 -11.173 1.0 53.21 9 A 8 -ATOM 130 H HE2 . PHE A1 1 9 ? -18.33 13.187 -8.408 1.0 61.25 9 A 8 -ATOM 131 H HZ . PHE A1 1 9 ? -20.364 11.87 -8.853 1.0 11.33 9 A 8 -ATOM 132 N N . VAL A1 1 10 ? -18.478 12.491 -15.901 1.0 35.51 10 A 8 -ATOM 133 C CA . VAL A1 1 10 ? -18.992 12.776 -17.235 1.0 51.35 10 A 8 -ATOM 134 C C . VAL A1 1 10 ? -20.446 13.232 -17.179 1.0 20.3 10 A 8 -ATOM 135 O O . VAL A1 1 10 ? -21.29 12.578 -16.566 1.0 33.54 10 A 8 -ATOM 136 C CB . VAL A1 1 10 ? -18.887 11.543 -18.152 1.0 1.24 10 A 8 -ATOM 137 C CG1 . VAL A1 1 10 ? -18.92 11.961 -19.615 1.0 43.55 10 A 8 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.623 10.755 -17.843 1.0 70.41 10 A 8 -ATOM 139 H H . VAL A1 1 10 ? -18.846 11.734 -15.399 1.0 13.11 10 A 8 -ATOM 140 H HA . VAL A1 1 10 ? -18.393 13.568 -17.662 1.0 52.2 10 A 8 -ATOM 141 H HB . VAL A1 1 10 ? -19.739 10.906 -17.964 1.0 21.21 10 A 8 -ATOM 142 H HG11 . VAL A1 1 10 ? -18.491 11.177 -20.222 1.0 75.22 10 A 8 -ATOM 143 H HG12 . VAL A1 1 10 ? -19.942 12.135 -19.917 1.0 54.41 10 A 8 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.347 12.868 -19.743 1.0 61.31 10 A 8 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.239 10.318 -18.752 1.0 13.24 10 A 8 -ATOM 146 H HG22 . VAL A1 1 10 ? -16.882 11.417 -17.42 1.0 62.44 10 A 8 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.852 9.972 -17.135 1.0 2.35 10 A 8 -ATOM 148 N N . LYS A1 1 11 ? -20.732 14.359 -17.822 1.0 23.3 11 A 8 -ATOM 149 C CA . LYS A1 1 11 ? -22.085 14.903 -17.848 1.0 10.31 11 A 8 -ATOM 150 C C . LYS A1 1 11 ? -22.72 14.717 -19.222 1.0 22.12 11 A 8 -ATOM 151 O O . LYS A1 1 11 ? -22.291 15.324 -20.204 1.0 63.21 11 A 8 -ATOM 152 C CB . LYS A1 1 11 ? -22.066 16.388 -17.48 1.0 34.41 11 A 8 -ATOM 153 C CG . LYS A1 1 11 ? -23.377 17.102 -17.763 1.0 63.11 11 A 8 -ATOM 154 C CD . LYS A1 1 11 ? -23.3 18.575 -17.399 1.0 3.15 11 A 8 -ATOM 155 C CE . LYS A1 1 11 ? -22.963 19.432 -18.609 1.0 2.52 11 A 8 -ATOM 156 N NZ . LYS A1 1 11 ? -23.086 20.885 -18.311 1.0 51.12 11 A 8 -ATOM 157 H H . LYS A1 1 11 ? -20.016 14.836 -18.293 1.0 4.15 11 A 8 -ATOM 158 H HA . LYS A1 1 11 ? -22.672 14.367 -17.118 1.0 44.21 11 A 8 -ATOM 159 H HB2 . LYS A1 1 11 ? -21.849 16.483 -16.426 1.0 75.01 11 A 8 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.285 16.877 -18.045 1.0 15.43 11 A 8 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.604 17.014 -18.815 1.0 73.24 11 A 8 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.161 16.637 -17.183 1.0 30.03 11 A 8 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.254 18.889 -17.004 1.0 63.51 11 A 8 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.535 18.711 -16.647 1.0 61.22 11 A 8 -ATOM 165 H HE2 . LYS A1 1 11 ? -21.949 19.22 -18.913 1.0 70.24 11 A 8 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.64 19.179 -19.412 1.0 3.13 11 A 8 -ATOM 167 H HZ1 . LYS A1 1 11 ? -23.942 21.064 -17.748 1.0 1.34 11 A 8 -ATOM 168 H HZ2 . LYS A1 1 11 ? -23.146 21.428 -19.197 1.0 61.44 11 A 8 -ATOM 169 H HZ3 . LYS A1 1 11 ? -22.256 21.211 -17.775 1.0 12.11 11 A 8 -ATOM 170 N N . THR A1 1 12 ? -23.746 13.874 -19.285 1.0 60.33 12 A 8 -ATOM 171 C CA . THR A1 1 12 ? -24.441 13.608 -20.539 1.0 63.11 12 A 8 -ATOM 172 C C . THR A1 1 12 ? -25.332 14.78 -20.933 1.0 63.2 12 A 8 -ATOM 173 O O . THR A1 1 12 ? -25.657 15.632 -20.104 1.0 23.14 12 A 8 -ATOM 174 C CB . THR A1 1 12 ? -25.3 12.333 -20.445 1.0 13.53 12 A 8 -ATOM 175 O OG1 . THR A1 1 12 ? -26.385 12.539 -19.534 1.0 44.22 12 A 8 -ATOM 176 C CG2 . THR A1 1 12 ? -24.464 11.149 -19.986 1.0 44.25 12 A 8 -ATOM 177 H H . THR A1 1 12 ? -24.041 13.42 -18.469 1.0 50.31 12 A 8 -ATOM 178 H HA . THR A1 1 12 ? -23.696 13.46 -21.308 1.0 15.31 12 A 8 -ATOM 179 H HB . THR A1 1 12 ? -25.7 12.114 -21.425 1.0 3.11 12 A 8 -ATOM 180 H HG1 . THR A1 1 12 ? -26.977 11.784 -19.564 1.0 54.01 12 A 8 -ATOM 181 H HG21 . THR A1 1 12 ? -23.417 11.372 -20.126 1.0 54.24 12 A 8 -ATOM 182 H HG22 . THR A1 1 12 ? -24.726 10.276 -20.565 1.0 51.32 12 A 8 -ATOM 183 H HG23 . THR A1 1 12 ? -24.654 10.958 -18.94 1.0 74.05 12 A 8 -ATOM 184 N N . LEU A1 1 13 ? -25.725 14.819 -22.201 1.0 74.21 13 A 8 -ATOM 185 C CA . LEU A1 1 13 ? -26.58 15.887 -22.705 1.0 74.52 13 A 8 -ATOM 186 C C . LEU A1 1 13 ? -27.897 15.939 -21.937 1.0 25.21 13 A 8 -ATOM 187 O O . LEU A1 1 13 ? -28.598 16.951 -21.951 1.0 11.35 13 A 8 -ATOM 188 C CB . LEU A1 1 13 ? -26.854 15.687 -24.197 1.0 31.51 13 A 8 -ATOM 189 C CG . LEU A1 1 13 ? -27.511 16.862 -24.922 1.0 30.32 13 A 8 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.677 17.283 -26.122 1.0 44.31 13 A 8 -ATOM 191 C CD2 . LEU A1 1 13 ? -28.925 16.499 -25.354 1.0 64.01 13 A 8 -ATOM 192 H H . LEU A1 1 13 ? -25.433 14.112 -22.814 1.0 42.02 13 A 8 -ATOM 193 H HA . LEU A1 1 13 ? -26.059 16.823 -22.566 1.0 34.1 13 A 8 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.911 15.485 -24.682 1.0 62.11 13 A 8 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.502 14.828 -24.301 1.0 43.21 13 A 8 -ATOM 196 H HG . LEU A1 1 13 ? -27.573 17.705 -24.247 1.0 45.4 13 A 8 -ATOM 197 H HD11 . LEU A1 1 13 ? -26.822 18.336 -26.309 1.0 62.23 13 A 8 -ATOM 198 H HD12 . LEU A1 1 13 ? -26.983 16.717 -26.989 1.0 23.44 13 A 8 -ATOM 199 H HD13 . LEU A1 1 13 ? -25.633 17.093 -25.919 1.0 25.55 13 A 8 -ATOM 200 H HD21 . LEU A1 1 13 ? -29.312 15.727 -24.706 1.0 62.14 13 A 8 -ATOM 201 H HD22 . LEU A1 1 13 ? -28.908 16.14 -26.373 1.0 41.34 13 A 8 -ATOM 202 H HD23 . LEU A1 1 13 ? -29.556 17.373 -25.291 1.0 51.42 13 A 8 -ATOM 203 N N . THR A1 1 14 ? -28.227 14.841 -21.265 1.0 31.41 14 A 8 -ATOM 204 C CA . THR A1 1 14 ? -29.459 14.761 -20.49 1.0 30.33 14 A 8 -ATOM 205 C C . THR A1 1 14 ? -29.217 15.136 -19.032 1.0 22.13 14 A 8 -ATOM 206 O O . THR A1 1 14 ? -30.064 14.902 -18.171 1.0 5.31 14 A 8 -ATOM 207 C CB . THR A1 1 14 ? -30.069 13.348 -20.549 1.0 34.54 14 A 8 -ATOM 208 O OG1 . THR A1 1 14 ? -29.196 12.41 -19.91 1.0 3.22 14 A 8 -ATOM 209 C CG2 . THR A1 1 14 ? -30.312 12.923 -21.99 1.0 34.11 14 A 8 -ATOM 210 H H . THR A1 1 14 ? -27.627 14.066 -21.292 1.0 2.31 14 A 8 -ATOM 211 H HA . THR A1 1 14 ? -30.168 15.455 -20.917 1.0 25.44 14 A 8 -ATOM 212 H HB . THR A1 1 14 ? -31.016 13.359 -20.028 1.0 55.24 14 A 8 -ATOM 213 H HG1 . THR A1 1 14 ? -29.603 11.54 -19.914 1.0 24.42 14 A 8 -ATOM 214 H HG21 . THR A1 1 14 ? -29.537 12.238 -22.298 1.0 1.02 14 A 8 -ATOM 215 H HG22 . THR A1 1 14 ? -30.297 13.793 -22.629 1.0 12.23 14 A 8 -ATOM 216 H HG23 . THR A1 1 14 ? -31.273 12.437 -22.065 1.0 12.42 14 A 8 -ATOM 217 N N . GLY A1 1 15 ? -28.054 15.722 -18.762 1.0 61.2 15 A 8 -ATOM 218 C CA . GLY A1 1 15 ? -27.722 16.121 -17.407 1.0 25.44 15 A 8 -ATOM 219 C C . GLY A1 1 15 ? -27.572 14.936 -16.473 1.0 2.34 15 A 8 -ATOM 220 O O . GLY A1 1 15 ? -28.265 14.842 -15.46 1.0 24.03 15 A 8 -ATOM 221 H H . GLY A1 1 15 ? -27.416 15.884 -19.489 1.0 73.22 15 A 8 -ATOM 222 H HA2 . GLY A1 1 15 ? -26.794 16.673 -17.423 1.0 10.15 15 A 8 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.504 16.764 -17.031 1.0 23.53 15 A 8 -ATOM 224 N N . LYS A1 1 16 ? -26.665 14.027 -16.815 1.0 11.21 16 A 8 -ATOM 225 C CA . LYS A1 1 16 ? -26.425 12.841 -16.001 1.0 34.13 16 A 8 -ATOM 226 C C . LYS A1 1 16 ? -24.968 12.772 -15.556 1.0 15.24 16 A 8 -ATOM 227 O O . LYS A1 1 16 ? -24.057 12.71 -16.383 1.0 50.04 16 A 8 -ATOM 228 C CB . LYS A1 1 16 ? -26.791 11.578 -16.784 1.0 31.42 16 A 8 -ATOM 229 C CG . LYS A1 1 16 ? -27.351 10.465 -15.915 1.0 73.35 16 A 8 -ATOM 230 C CD . LYS A1 1 16 ? -26.252 9.544 -15.412 1.0 50.3 16 A 8 -ATOM 231 C CE . LYS A1 1 16 ? -25.633 8.743 -16.547 1.0 52.44 16 A 8 -ATOM 232 N NZ . LYS A1 1 16 ? -25.993 7.301 -16.47 1.0 2.53 16 A 8 -ATOM 233 H H . LYS A1 1 16 ? -26.143 14.158 -17.635 1.0 52.54 16 A 8 -ATOM 234 H HA . LYS A1 1 16 ? -27.054 12.907 -15.126 1.0 34.34 16 A 8 -ATOM 235 H HB2 . LYS A1 1 16 ? -27.531 11.832 -17.528 1.0 44.24 16 A 8 -ATOM 236 H HB3 . LYS A1 1 16 ? -25.906 11.208 -17.28 1.0 12.13 16 A 8 -ATOM 237 H HG2 . LYS A1 1 16 ? -27.855 10.902 -15.066 1.0 3.41 16 A 8 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.055 9.887 -16.496 1.0 74.14 16 A 8 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.481 10.139 -14.944 1.0 63.23 16 A 8 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.671 8.86 -14.687 1.0 14.51 16 A 8 -ATOM 241 H HE2 . LYS A1 1 16 ? -25.985 9.143 -17.486 1.0 44.12 16 A 8 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.558 8.841 -16.495 1.0 75.31 16 A 8 -ATOM 243 H HZ1 . LYS A1 1 16 ? -25.461 6.84 -15.704 1.0 61.55 16 A 8 -ATOM 244 H HZ2 . LYS A1 1 16 ? -25.768 6.827 -17.368 1.0 23.15 16 A 8 -ATOM 245 H HZ3 . LYS A1 1 16 ? -27.01 7.196 -16.281 1.0 43.23 16 A 8 -ATOM 246 N N . THR A1 1 17 ? -24.753 12.781 -14.244 1.0 33.03 17 A 8 -ATOM 247 C CA . THR A1 1 17 ? -23.407 12.719 -13.689 1.0 61.21 17 A 8 -ATOM 248 C C . THR A1 1 17 ? -22.991 11.279 -13.416 1.0 13.11 17 A 8 -ATOM 249 O O . THR A1 1 17 ? -23.624 10.579 -12.625 1.0 32.24 17 A 8 -ATOM 250 C CB . THR A1 1 17 ? -23.3 13.529 -12.383 1.0 22.54 17 A 8 -ATOM 251 O OG1 . THR A1 1 17 ? -24.603 13.737 -11.827 1.0 24.32 17 A 8 -ATOM 252 C CG2 . THR A1 1 17 ? -22.629 14.871 -12.632 1.0 72.42 17 A 8 -ATOM 253 H H . THR A1 1 17 ? -25.52 12.832 -13.636 1.0 63.53 17 A 8 -ATOM 254 H HA . THR A1 1 17 ? -22.729 13.15 -14.411 1.0 15.15 17 A 8 -ATOM 255 H HB . THR A1 1 17 ? -22.702 12.969 -11.678 1.0 61.22 17 A 8 -ATOM 256 H HG1 . THR A1 1 17 ? -25.04 14.453 -12.295 1.0 54.0 17 A 8 -ATOM 257 H HG21 . THR A1 1 17 ? -22.925 15.569 -11.863 1.0 31.34 17 A 8 -ATOM 258 H HG22 . THR A1 1 17 ? -22.93 15.251 -13.597 1.0 12.24 17 A 8 -ATOM 259 H HG23 . THR A1 1 17 ? -21.557 14.746 -12.612 1.0 74.01 17 A 8 -ATOM 260 N N . ILE A1 1 18 ? -21.923 10.841 -14.076 1.0 21.15 18 A 8 -ATOM 261 C CA . ILE A1 1 18 ? -21.422 9.484 -13.902 1.0 42.23 18 A 8 -ATOM 262 C C . ILE A1 1 18 ? -19.938 9.486 -13.551 1.0 2.02 18 A 8 -ATOM 263 O O . ILE A1 1 18 ? -19.17 10.305 -14.057 1.0 34.24 18 A 8 -ATOM 264 C CB . ILE A1 1 18 ? -21.636 8.638 -15.171 1.0 20.13 18 A 8 -ATOM 265 C CG1 . ILE A1 1 18 ? -20.911 7.296 -15.045 1.0 0.43 18 A 8 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.153 9.394 -16.4 1.0 34.34 18 A 8 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.195 6.346 -16.187 1.0 41.12 18 A 8 -ATOM 268 H H . ILE A1 1 18 ? -21.462 11.446 -14.693 1.0 72.35 18 A 8 -ATOM 269 H HA . ILE A1 1 18 ? -21.972 9.027 -13.092 1.0 33.1 18 A 8 -ATOM 270 H HB . ILE A1 1 18 ? -22.695 8.458 -15.283 1.0 55.23 18 A 8 -ATOM 271 H HG12 . ILE A1 1 18 ? -19.847 7.471 -15.017 1.0 35.45 18 A 8 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.218 6.815 -14.128 1.0 15.51 18 A 8 -ATOM 273 H HG21 . ILE A1 1 18 ? -21.323 8.794 -17.282 1.0 31.24 18 A 8 -ATOM 274 H HG22 . ILE A1 1 18 ? -21.696 10.323 -16.487 1.0 60.32 18 A 8 -ATOM 275 H HG23 . ILE A1 1 18 ? -20.098 9.601 -16.303 1.0 71.44 18 A 8 -ATOM 276 H HD11 . ILE A1 1 18 ? -20.266 6.065 -16.661 1.0 32.31 18 A 8 -ATOM 277 H HD12 . ILE A1 1 18 ? -21.685 5.462 -15.807 1.0 60.24 18 A 8 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.835 6.831 -16.909 1.0 25.35 18 A 8 -ATOM 279 N N . THR A1 1 19 ? -19.54 8.563 -12.682 1.0 42.32 19 A 8 -ATOM 280 C CA . THR A1 1 19 ? -18.148 8.457 -12.263 1.0 41.24 19 A 8 -ATOM 281 C C . THR A1 1 19 ? -17.492 7.209 -12.842 1.0 70.21 19 A 8 -ATOM 282 O O . THR A1 1 19 ? -18.113 6.148 -12.916 1.0 44.42 19 A 8 -ATOM 283 C CB . THR A1 1 19 ? -18.024 8.423 -10.728 1.0 2.4 19 A 8 -ATOM 284 O OG1 . THR A1 1 19 ? -19.325 8.445 -10.131 1.0 22.32 19 A 8 -ATOM 285 C CG2 . THR A1 1 19 ? -17.209 9.604 -10.224 1.0 13.14 19 A 8 -ATOM 286 H H . THR A1 1 19 ? -20.199 7.938 -12.314 1.0 1.15 19 A 8 -ATOM 287 H HA . THR A1 1 19 ? -17.623 9.329 -12.626 1.0 65.43 19 A 8 -ATOM 288 H HB . THR A1 1 19 ? -17.521 7.51 -10.443 1.0 44.24 19 A 8 -ATOM 289 H HG1 . THR A1 1 19 ? -19.717 7.569 -10.184 1.0 60.25 19 A 8 -ATOM 290 H HG21 . THR A1 1 19 ? -17.851 10.466 -10.123 1.0 73.33 19 A 8 -ATOM 291 H HG22 . THR A1 1 19 ? -16.42 9.824 -10.928 1.0 23.45 19 A 8 -ATOM 292 H HG23 . THR A1 1 19 ? -16.779 9.361 -9.264 1.0 51.03 19 A 8 -ATOM 293 N N . ILE A1 1 20 ? -16.235 7.342 -13.252 1.0 2.13 20 A 8 -ATOM 294 C CA . ILE A1 1 20 ? -15.496 6.224 -13.824 1.0 23.24 20 A 8 -ATOM 295 C C . ILE A1 1 20 ? -14.024 6.279 -13.428 1.0 21.51 20 A 8 -ATOM 296 O O . ILE A1 1 20 ? -13.38 7.323 -13.536 1.0 3.54 20 A 8 -ATOM 297 C CB . ILE A1 1 20 ? -15.603 6.204 -15.36 1.0 55.55 20 A 8 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.662 7.632 -15.907 1.0 1.5 20 A 8 -ATOM 299 C CG2 . ILE A1 1 20 ? -16.827 5.413 -15.796 1.0 1.32 20 A 8 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.011 7.787 -17.264 1.0 2.4 20 A 8 -ATOM 301 H H . ILE A1 1 20 ? -15.795 8.213 -13.168 1.0 32.52 20 A 8 -ATOM 302 H HA . ILE A1 1 20 ? -15.927 5.31 -13.441 1.0 40.32 20 A 8 -ATOM 303 H HB . ILE A1 1 20 ? -14.727 5.712 -15.753 1.0 75.22 20 A 8 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.693 7.934 -15.998 1.0 4.24 20 A 8 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.157 8.294 -15.219 1.0 20.02 20 A 8 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.631 6.095 -16.03 1.0 41.11 20 A 8 -ATOM 307 H HG22 . ILE A1 1 20 ? -16.585 4.829 -16.671 1.0 51.34 20 A 8 -ATOM 308 H HG23 . ILE A1 1 20 ? -17.134 4.755 -14.997 1.0 74.34 20 A 8 -ATOM 309 H HD11 . ILE A1 1 20 ? -15.516 8.566 -17.818 1.0 44.23 20 A 8 -ATOM 310 H HD12 . ILE A1 1 20 ? -13.972 8.052 -17.137 1.0 43.31 20 A 8 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.083 6.856 -17.806 1.0 23.14 20 A 8 -ATOM 312 N N . ASP A1 1 21 ? -13.497 5.148 -12.972 1.0 44.41 21 A 8 -ATOM 313 C CA . ASP A1 1 21 ? -12.1 5.066 -12.563 1.0 13.43 21 A 8 -ATOM 314 C C . ASP A1 1 21 ? -11.193 4.839 -13.768 1.0 74.52 21 A 8 -ATOM 315 O O . ASP A1 1 21 ? -11.41 3.918 -14.557 1.0 3.25 21 A 8 -ATOM 316 C CB . ASP A1 1 21 ? -11.909 3.939 -11.546 1.0 40.32 21 A 8 -ATOM 317 C CG . ASP A1 1 21 ? -12.341 2.59 -12.089 1.0 70.32 21 A 8 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.563 2.339 -12.147 1.0 34.41 21 A 8 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.458 1.787 -12.455 1.0 4.34 21 A 8 -ATOM 320 H H . ASP A1 1 21 ? -14.062 4.349 -12.909 1.0 61.24 21 A 8 -ATOM 321 H HA . ASP A1 1 21 ? -11.834 6.004 -12.1 1.0 0.1 21 A 8 -ATOM 322 H HB2 . ASP A1 1 21 ? -10.865 3.879 -11.276 1.0 73.15 21 A 8 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.493 4.156 -10.664 1.0 61.23 21 A 8 -ATOM 324 N N . VAL A1 1 22 ? -10.177 5.685 -13.906 1.0 30.34 22 A 8 -ATOM 325 C CA . VAL A1 1 22 ? -9.238 5.577 -15.015 1.0 1.34 22 A 8 -ATOM 326 C C . VAL A1 1 22 ? -7.818 5.908 -14.568 1.0 61.2 22 A 8 -ATOM 327 O O . VAL A1 1 22 ? -7.613 6.491 -13.503 1.0 34.03 22 A 8 -ATOM 328 C CB . VAL A1 1 22 ? -9.629 6.511 -16.176 1.0 60.13 22 A 8 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.109 6.855 -16.108 1.0 14.0 22 A 8 -ATOM 330 C CG2 . VAL A1 1 22 ? -8.779 7.772 -16.155 1.0 61.12 22 A 8 -ATOM 331 H H . VAL A1 1 22 ? -10.057 6.398 -13.245 1.0 71.0 22 A 8 -ATOM 332 H HA . VAL A1 1 22 ? -9.262 4.559 -15.376 1.0 41.13 22 A 8 -ATOM 333 H HB . VAL A1 1 22 ? -9.446 5.993 -17.106 1.0 23.42 22 A 8 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.28 7.552 -15.301 1.0 3.13 22 A 8 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.419 7.301 -17.042 1.0 11.12 22 A 8 -ATOM 336 H HG13 . VAL A1 1 22 ? -11.68 5.955 -15.931 1.0 2.3 22 A 8 -ATOM 337 H HG21 . VAL A1 1 22 ? -9.189 8.494 -16.844 1.0 43.3 22 A 8 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.775 8.186 -15.158 1.0 71.52 22 A 8 -ATOM 339 H HG23 . VAL A1 1 22 ? -7.767 7.529 -16.448 1.0 24.41 22 A 8 -ATOM 340 N N . ASP A1 1 23 ? -6.843 5.533 -15.388 1.0 73.14 23 A 8 -ATOM 341 C CA . ASP A1 1 23 ? -5.442 5.792 -15.077 1.0 0.33 23 A 8 -ATOM 342 C C . ASP A1 1 23 ? -4.826 6.744 -16.098 1.0 62.12 23 A 8 -ATOM 343 O O . ASP A1 1 23 ? -5.266 6.81 -17.246 1.0 35.34 23 A 8 -ATOM 344 C CB . ASP A1 1 23 ? -4.654 4.482 -15.044 1.0 24.44 23 A 8 -ATOM 345 C CG . ASP A1 1 23 ? -5.463 3.335 -14.47 1.0 11.25 23 A 8 -ATOM 346 O OD1 . ASP A1 1 23 ? -6.329 2.8 -15.193 1.0 71.52 23 A 8 -ATOM 347 O OD2 . ASP A1 1 23 ? -5.228 2.972 -13.299 1.0 54.12 23 A 8 -ATOM 348 H H . ASP A1 1 23 ? -7.07 5.072 -16.222 1.0 71.31 23 A 8 -ATOM 349 H HA . ASP A1 1 23 ? -5.398 6.253 -14.102 1.0 62.03 23 A 8 -ATOM 350 H HB2 . ASP A1 1 23 ? -4.358 4.221 -16.05 1.0 75.32 23 A 8 -ATOM 351 H HB3 . ASP A1 1 23 ? -3.771 4.615 -14.437 1.0 32.1 23 A 8 -ATOM 352 N N . HIS A1 1 24 ? -3.805 7.482 -15.672 1.0 3.42 24 A 8 -ATOM 353 C CA . HIS A1 1 24 ? -3.129 8.431 -16.549 1.0 64.1 24 A 8 -ATOM 354 C C . HIS A1 1 24 ? -2.514 7.719 -17.749 1.0 13.22 24 A 8 -ATOM 355 O O . HIS A1 1 24 ? -2.157 8.351 -18.742 1.0 40.32 24 A 8 -ATOM 356 C CB . HIS A1 1 24 ? -2.046 9.187 -15.778 1.0 43.52 24 A 8 -ATOM 357 C CG . HIS A1 1 24 ? -0.902 8.321 -15.349 1.0 63.23 24 A 8 -ATOM 358 N ND1 . HIS A1 1 24 ? -0.802 7.777 -14.086 1.0 33.23 24 A 8 -ATOM 359 C CD2 . HIS A1 1 24 ? 0.195 7.903 -16.024 1.0 70.35 24 A 8 -ATOM 360 C CE1 . HIS A1 1 24 ? 0.307 7.064 -14.002 1.0 52.22 24 A 8 -ATOM 361 N NE2 . HIS A1 1 24 ? 0.93 7.124 -15.165 1.0 51.1 24 A 8 -ATOM 362 H H . HIS A1 1 24 ? -3.5 7.385 -14.746 1.0 35.01 24 A 8 -ATOM 363 H HA . HIS A1 1 24 ? -3.865 9.137 -16.903 1.0 52.33 24 A 8 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.65 9.972 -16.405 1.0 74.33 24 A 8 -ATOM 365 H HB3 . HIS A1 1 24 ? -2.482 9.625 -14.892 1.0 2.24 24 A 8 -ATOM 366 H HD1 . HIS A1 1 24 ? -1.448 7.897 -13.359 1.0 61.24 24 A 8 -ATOM 367 H HD2 . HIS A1 1 24 ? 0.446 8.14 -17.049 1.0 14.35 24 A 8 -ATOM 368 H HE1 . HIS A1 1 24 ? 0.647 6.523 -13.131 1.0 73.24 24 A 8 -ATOM 369 N N . ALA A1 1 25 ? -2.392 6.399 -17.649 1.0 63.43 25 A 8 -ATOM 370 C CA . ALA A1 1 25 ? -1.821 5.601 -18.727 1.0 43.32 25 A 8 -ATOM 371 C C . ALA A1 1 25 ? -2.886 5.212 -19.746 1.0 33.54 25 A 8 -ATOM 372 O O . ALA A1 1 25 ? -2.627 4.431 -20.662 1.0 12.23 25 A 8 -ATOM 373 C CB . ALA A1 1 25 ? -1.148 4.358 -18.164 1.0 51.34 25 A 8 -ATOM 374 H H . ALA A1 1 25 ? -2.695 5.952 -16.832 1.0 55.41 25 A 8 -ATOM 375 H HA . ALA A1 1 25 ? -1.066 6.197 -19.22 1.0 23.12 25 A 8 -ATOM 376 H HB1 . ALA A1 1 25 ? -1.843 3.832 -17.525 1.0 42.21 25 A 8 -ATOM 377 H HB2 . ALA A1 1 25 ? -0.846 3.713 -18.975 1.0 3.14 25 A 8 -ATOM 378 H HB3 . ALA A1 1 25 ? -0.28 4.647 -17.591 1.0 44.44 25 A 8 -ATOM 379 N N . ASP A1 1 26 ? -4.085 5.761 -19.581 1.0 53.31 26 A 8 -ATOM 380 C CA . ASP A1 1 26 ? -5.19 5.472 -20.488 1.0 71.32 26 A 8 -ATOM 381 C C . ASP A1 1 26 ? -5.366 6.595 -21.505 1.0 31.24 26 A 8 -ATOM 382 O O . ASP A1 1 26 ? -4.5 7.459 -21.65 1.0 53.43 26 A 8 -ATOM 383 C CB . ASP A1 1 26 ? -6.485 5.274 -19.699 1.0 21.1 26 A 8 -ATOM 384 C CG . ASP A1 1 26 ? -6.343 4.238 -18.602 1.0 73.54 26 A 8 -ATOM 385 O OD1 . ASP A1 1 26 ? -5.321 3.52 -18.592 1.0 73.22 26 A 8 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.252 4.146 -17.751 1.0 2.02 26 A 8 -ATOM 387 H H . ASP A1 1 26 ? -4.229 6.377 -18.832 1.0 73.33 26 A 8 -ATOM 388 H HA . ASP A1 1 26 ? -4.957 4.56 -21.014 1.0 35.3 26 A 8 -ATOM 389 H HB2 . ASP A1 1 26 ? -6.772 6.213 -19.248 1.0 71.15 26 A 8 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.264 4.952 -20.375 1.0 51.4 26 A 8 -ATOM 391 N N . THR A1 1 27 ? -6.493 6.577 -22.211 1.0 11.22 27 A 8 -ATOM 392 C CA . THR A1 1 27 ? -6.781 7.591 -23.216 1.0 12.11 27 A 8 -ATOM 393 C C . THR A1 1 27 ? -8.276 7.879 -23.293 1.0 24.55 27 A 8 -ATOM 394 O O . THR A1 1 27 ? -9.092 7.126 -22.762 1.0 14.34 27 A 8 -ATOM 395 C CB . THR A1 1 27 ? -6.281 7.161 -24.608 1.0 24.42 27 A 8 -ATOM 396 O OG1 . THR A1 1 27 ? -6.262 5.732 -24.702 1.0 51.41 27 A 8 -ATOM 397 C CG2 . THR A1 1 27 ? -4.888 7.71 -24.876 1.0 72.22 27 A 8 -ATOM 398 H H . THR A1 1 27 ? -7.144 5.863 -22.05 1.0 1.33 27 A 8 -ATOM 399 H HA . THR A1 1 27 ? -6.264 8.497 -22.935 1.0 54.42 27 A 8 -ATOM 400 H HB . THR A1 1 27 ? -6.957 7.554 -25.354 1.0 51.23 27 A 8 -ATOM 401 H HG1 . THR A1 1 27 ? -6.388 5.469 -25.617 1.0 23.44 27 A 8 -ATOM 402 H HG21 . THR A1 1 27 ? -4.214 7.373 -24.104 1.0 20.21 27 A 8 -ATOM 403 H HG22 . THR A1 1 27 ? -4.921 8.79 -24.878 1.0 40.31 27 A 8 -ATOM 404 H HG23 . THR A1 1 27 ? -4.541 7.359 -25.836 1.0 53.14 27 A 8 -ATOM 405 N N . VAL A1 1 28 ? -8.63 8.974 -23.959 1.0 70.04 28 A 8 -ATOM 406 C CA . VAL A1 1 28 ? -10.028 9.361 -24.107 1.0 40.12 28 A 8 -ATOM 407 C C . VAL A1 1 28 ? -10.843 8.241 -24.743 1.0 43.3 28 A 8 -ATOM 408 O O . VAL A1 1 28 ? -11.907 7.874 -24.246 1.0 51.44 28 A 8 -ATOM 409 C CB . VAL A1 1 28 ? -10.17 10.635 -24.961 1.0 70.14 28 A 8 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.591 11.172 -24.886 1.0 13.41 28 A 8 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.168 11.689 -24.516 1.0 73.55 28 A 8 -ATOM 412 H H . VAL A1 1 28 ? -7.934 9.535 -24.36 1.0 50.23 28 A 8 -ATOM 413 H HA . VAL A1 1 28 ? -10.423 9.567 -23.123 1.0 62.42 28 A 8 -ATOM 414 H HB . VAL A1 1 28 ? -9.96 10.38 -25.989 1.0 52.41 28 A 8 -ATOM 415 H HG11 . VAL A1 1 28 ? -12.291 10.355 -24.986 1.0 72.32 28 A 8 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.742 11.661 -23.935 1.0 75.12 28 A 8 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.75 11.881 -25.685 1.0 43.12 28 A 8 -ATOM 418 H HG21 . VAL A1 1 28 ? -8.563 11.989 -25.358 1.0 22.23 28 A 8 -ATOM 419 H HG22 . VAL A1 1 28 ? -9.698 12.547 -24.129 1.0 21.24 28 A 8 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.533 11.28 -23.744 1.0 51.43 28 A 8 -ATOM 421 N N . GLY A1 1 29 ? -10.336 7.701 -25.848 1.0 51.02 29 A 8 -ATOM 422 C CA . GLY A1 1 29 ? -11.03 6.628 -26.535 1.0 24.21 29 A 8 -ATOM 423 C C . GLY A1 1 29 ? -11.441 5.51 -25.598 1.0 62.32 29 A 8 -ATOM 424 O O . GLY A1 1 29 ? -12.595 5.082 -25.599 1.0 1.41 29 A 8 -ATOM 425 H H . GLY A1 1 29 ? -9.484 8.035 -26.199 1.0 25.44 29 A 8 -ATOM 426 H HA2 . GLY A1 1 29 ? -11.914 7.03 -27.008 1.0 33.14 29 A 8 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.38 6.223 -27.296 1.0 61.11 29 A 8 -ATOM 428 N N . ALA A1 1 30 ? -10.494 5.034 -24.796 1.0 0.3 30 A 8 -ATOM 429 C CA . ALA A1 1 30 ? -10.764 3.958 -23.85 1.0 24.42 30 A 8 -ATOM 430 C C . ALA A1 1 30 ? -11.844 4.363 -22.853 1.0 23.15 30 A 8 -ATOM 431 O O . ALA A1 1 30 ? -12.723 3.568 -22.517 1.0 23.32 30 A 8 -ATOM 432 C CB . ALA A1 1 30 ? -9.488 3.567 -23.119 1.0 4.23 30 A 8 -ATOM 433 H H . ALA A1 1 30 ? -9.593 5.415 -24.842 1.0 13.0 30 A 8 -ATOM 434 H HA . ALA A1 1 30 ? -11.107 3.1 -24.409 1.0 42.35 30 A 8 -ATOM 435 H HB1 . ALA A1 1 30 ? -9.658 2.656 -22.563 1.0 24.3 30 A 8 -ATOM 436 H HB2 . ALA A1 1 30 ? -8.696 3.409 -23.836 1.0 15.25 30 A 8 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.206 4.357 -22.438 1.0 54.13 30 A 8 -ATOM 438 N N . VAL A1 1 31 ? -11.773 5.604 -22.381 1.0 44.02 31 A 8 -ATOM 439 C CA . VAL A1 1 31 ? -12.746 6.114 -21.422 1.0 44.43 31 A 8 -ATOM 440 C C . VAL A1 1 31 ? -14.153 6.103 -22.008 1.0 22.33 31 A 8 -ATOM 441 O O . VAL A1 1 31 ? -15.113 5.719 -21.34 1.0 41.34 31 A 8 -ATOM 442 C CB . VAL A1 1 31 ? -12.398 7.547 -20.978 1.0 42.01 31 A 8 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.459 8.085 -20.03 1.0 61.22 31 A 8 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.023 7.584 -20.329 1.0 34.2 31 A 8 -ATOM 445 H H . VAL A1 1 31 ? -11.05 6.19 -22.686 1.0 33.11 31 A 8 -ATOM 446 H HA . VAL A1 1 31 ? -12.724 5.475 -20.551 1.0 53.53 31 A 8 -ATOM 447 H HB . VAL A1 1 31 ? -12.376 8.178 -21.854 1.0 34.14 31 A 8 -ATOM 448 H HG11 . VAL A1 1 31 ? -12.984 8.659 -19.248 1.0 24.43 31 A 8 -ATOM 449 H HG12 . VAL A1 1 31 ? -14.144 8.717 -20.577 1.0 62.24 31 A 8 -ATOM 450 H HG13 . VAL A1 1 31 ? -14.001 7.26 -19.592 1.0 4.44 31 A 8 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.63 6.581 -20.258 1.0 32.4 31 A 8 -ATOM 452 H HG22 . VAL A1 1 31 ? -10.359 8.189 -20.928 1.0 31.51 31 A 8 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.103 8.01 -19.339 1.0 2.41 31 A 8 -ATOM 454 N N . LYS A1 1 32 ? -14.269 6.526 -23.262 1.0 44.33 32 A 8 -ATOM 455 C CA . LYS A1 1 32 ? -15.559 6.564 -23.941 1.0 33.41 32 A 8 -ATOM 456 C C . LYS A1 1 32 ? -16.227 5.192 -23.918 1.0 33.52 32 A 8 -ATOM 457 O O . LYS A1 1 32 ? -17.427 5.08 -23.669 1.0 55.22 32 A 8 -ATOM 458 C CB . LYS A1 1 32 ? -15.384 7.032 -25.387 1.0 21.43 32 A 8 -ATOM 459 C CG . LYS A1 1 32 ? -16.056 8.362 -25.682 1.0 62.04 32 A 8 -ATOM 460 C CD . LYS A1 1 32 ? -15.045 9.494 -25.758 1.0 13.3 32 A 8 -ATOM 461 C CE . LYS A1 1 32 ? -14.614 9.76 -27.192 1.0 61.02 32 A 8 -ATOM 462 N NZ . LYS A1 1 32 ? -14.191 8.512 -27.885 1.0 10.13 32 A 8 -ATOM 463 H H . LYS A1 1 32 ? -13.467 6.82 -23.744 1.0 0.43 32 A 8 -ATOM 464 H HA . LYS A1 1 32 ? -16.189 7.267 -23.418 1.0 20.21 32 A 8 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.329 7.132 -25.595 1.0 31.13 32 A 8 -ATOM 466 H HB3 . LYS A1 1 32 ? -15.803 6.287 -26.048 1.0 51.43 32 A 8 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.574 8.292 -26.627 1.0 34.55 32 A 8 -ATOM 468 H HG3 . LYS A1 1 32 ? -16.766 8.578 -24.895 1.0 75.31 32 A 8 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.49 10.391 -25.355 1.0 62.53 32 A 8 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.175 9.228 -25.173 1.0 34.24 32 A 8 -ATOM 471 H HE2 . LYS A1 1 32 ? -15.443 10.196 -27.728 1.0 32.35 32 A 8 -ATOM 472 H HE3 . LYS A1 1 32 ? -13.787 10.455 -27.182 1.0 31.14 32 A 8 -ATOM 473 H HZ1 . LYS A1 1 32 ? -13.636 7.915 -27.24 1.0 3.34 32 A 8 -ATOM 474 H HZ2 . LYS A1 1 32 ? -13.608 8.745 -28.714 1.0 11.13 32 A 8 -ATOM 475 H HZ3 . LYS A1 1 32 ? -15.026 7.979 -28.202 1.0 13.55 32 A 8 -ATOM 476 N N . ALA A1 1 33 ? -15.441 4.152 -24.176 1.0 34.21 33 A 8 -ATOM 477 C CA . ALA A1 1 33 ? -15.955 2.788 -24.181 1.0 60.31 33 A 8 -ATOM 478 C C . ALA A1 1 33 ? -16.452 2.384 -22.797 1.0 31.03 33 A 8 -ATOM 479 O O . ALA A1 1 33 ? -17.466 1.698 -22.665 1.0 31.32 33 A 8 -ATOM 480 C CB . ALA A1 1 33 ? -14.884 1.822 -24.662 1.0 54.24 33 A 8 -ATOM 481 H H . ALA A1 1 33 ? -14.492 4.306 -24.367 1.0 43.1 33 A 8 -ATOM 482 H HA . ALA A1 1 33 ? -16.782 2.746 -24.875 1.0 53.01 33 A 8 -ATOM 483 H HB1 . ALA A1 1 33 ? -13.991 1.95 -24.068 1.0 2.33 33 A 8 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.242 0.808 -24.561 1.0 61.23 33 A 8 -ATOM 485 H HB3 . ALA A1 1 33 ? -14.658 2.022 -25.699 1.0 53.23 33 A 8 -ATOM 486 N N . LYS A1 1 34 ? -15.731 2.813 -21.766 1.0 30.14 34 A 8 -ATOM 487 C CA . LYS A1 1 34 ? -16.098 2.497 -20.391 1.0 3.41 34 A 8 -ATOM 488 C C . LYS A1 1 34 ? -17.487 3.034 -20.061 1.0 51.04 34 A 8 -ATOM 489 O O . LYS A1 1 34 ? -18.295 2.349 -19.433 1.0 30.3 34 A 8 -ATOM 490 C CB . LYS A1 1 34 ? -15.069 3.081 -19.42 1.0 63.02 34 A 8 -ATOM 491 C CG . LYS A1 1 34 ? -15.328 2.716 -17.968 1.0 24.43 34 A 8 -ATOM 492 C CD . LYS A1 1 34 ? -15.131 1.229 -17.724 1.0 44.42 34 A 8 -ATOM 493 C CE . LYS A1 1 34 ? -13.677 0.822 -17.906 1.0 34.12 34 A 8 -ATOM 494 N NZ . LYS A1 1 34 ? -13.306 -0.319 -17.023 1.0 13.0 34 A 8 -ATOM 495 H H . LYS A1 1 34 ? -14.933 3.357 -21.935 1.0 65.25 34 A 8 -ATOM 496 H HA . LYS A1 1 34 ? -16.108 1.422 -20.289 1.0 3.22 34 A 8 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.089 2.718 -19.692 1.0 71.03 34 A 8 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.082 4.158 -19.506 1.0 71.12 34 A 8 -ATOM 499 H HG2 . LYS A1 1 34 ? -14.643 3.266 -17.34 1.0 24.23 34 A 8 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.344 2.981 -17.715 1.0 22.21 34 A 8 -ATOM 501 H HD2 . LYS A1 1 34 ? -15.434 0.995 -16.714 1.0 63.43 34 A 8 -ATOM 502 H HD3 . LYS A1 1 34 ? -15.741 0.674 -18.422 1.0 75.33 34 A 8 -ATOM 503 H HE2 . LYS A1 1 34 ? -13.523 0.534 -18.935 1.0 34.14 34 A 8 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.048 1.668 -17.671 1.0 0.12 34 A 8 -ATOM 505 H HZ1 . LYS A1 1 34 ? -13.038 0.031 -16.081 1.0 62.42 34 A 8 -ATOM 506 H HZ2 . LYS A1 1 34 ? -12.502 -0.838 -17.43 1.0 14.2 34 A 8 -ATOM 507 H HZ3 . LYS A1 1 34 ? -14.11 -0.97 -16.924 1.0 65.2 34 A 8 -ATOM 508 N N . ILE A1 1 35 ? -17.758 4.263 -20.488 1.0 14.42 35 A 8 -ATOM 509 C CA . ILE A1 1 35 ? -19.05 4.89 -20.24 1.0 22.32 35 A 8 -ATOM 510 C C . ILE A1 1 35 ? -20.162 4.179 -21.003 1.0 74.31 35 A 8 -ATOM 511 O O . ILE A1 1 35 ? -21.288 4.066 -20.518 1.0 33.23 35 A 8 -ATOM 512 C CB . ILE A1 1 35 ? -19.039 6.378 -20.638 1.0 42.5 35 A 8 -ATOM 513 C CG1 . ILE A1 1 35 ? -17.865 7.099 -19.972 1.0 22.04 35 A 8 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.357 7.037 -20.259 1.0 45.14 35 A 8 -ATOM 515 C CD1 . ILE A1 1 35 ? -17.852 6.967 -18.465 1.0 11.1 35 A 8 -ATOM 516 H H . ILE A1 1 35 ? -17.073 4.759 -20.983 1.0 54.44 35 A 8 -ATOM 517 H HA . ILE A1 1 35 ? -19.254 4.823 -19.181 1.0 30.01 35 A 8 -ATOM 518 H HB . ILE A1 1 35 ? -18.929 6.44 -21.71 1.0 2.44 35 A 8 -ATOM 519 H HG12 . ILE A1 1 35 ? -16.94 6.691 -20.348 1.0 3.24 35 A 8 -ATOM 520 H HG13 . ILE A1 1 35 ? -17.914 8.151 -20.214 1.0 0.11 35 A 8 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.429 8.001 -20.741 1.0 65.32 35 A 8 -ATOM 522 H HG22 . ILE A1 1 35 ? -21.177 6.413 -20.58 1.0 43.1 35 A 8 -ATOM 523 H HG23 . ILE A1 1 35 ? -20.399 7.167 -19.188 1.0 75.41 35 A 8 -ATOM 524 H HD11 . ILE A1 1 35 ? -16.997 6.379 -18.163 1.0 43.52 35 A 8 -ATOM 525 H HD12 . ILE A1 1 35 ? -17.788 7.948 -18.018 1.0 71.15 35 A 8 -ATOM 526 H HD13 . ILE A1 1 35 ? -18.757 6.479 -18.138 1.0 74.3 35 A 8 -ATOM 527 N N . TYR A1 1 36 ? -19.838 3.699 -22.199 1.0 62.53 36 A 8 -ATOM 528 C CA . TYR A1 1 36 ? -20.81 2.999 -23.03 1.0 64.44 36 A 8 -ATOM 529 C C . TYR A1 1 36 ? -21.408 1.81 -22.284 1.0 53.42 36 A 8 -ATOM 530 O O . TYR A1 1 36 ? -22.622 1.607 -22.29 1.0 34.33 36 A 8 -ATOM 531 C CB . TYR A1 1 36 ? -20.154 2.523 -24.327 1.0 74.42 36 A 8 -ATOM 532 C CG . TYR A1 1 36 ? -20.667 1.186 -24.811 1.0 43.51 36 A 8 -ATOM 533 C CD1 . TYR A1 1 36 ? -21.999 1.019 -25.169 1.0 62.31 36 A 8 -ATOM 534 C CD2 . TYR A1 1 36 ? -19.82 0.089 -24.91 1.0 22.21 36 A 8 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.472 -0.201 -25.611 1.0 25.24 36 A 8 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.284 -1.135 -25.352 1.0 24.41 36 A 8 -ATOM 537 C CZ . TYR A1 1 36 ? -21.611 -1.275 -25.7 1.0 51.0 36 A 8 -ATOM 538 O OH . TYR A1 1 36 ? -22.079 -2.492 -26.141 1.0 31.41 36 A 8 -ATOM 539 H H . TYR A1 1 36 ? -18.924 3.82 -22.531 1.0 42.53 36 A 8 -ATOM 540 H HA . TYR A1 1 36 ? -21.601 3.693 -23.272 1.0 45.34 36 A 8 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.339 3.249 -25.104 1.0 32.41 36 A 8 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.088 2.434 -24.172 1.0 73.31 36 A 8 -ATOM 543 H HD1 . TYR A1 1 36 ? -22.671 1.863 -25.098 1.0 14.41 36 A 8 -ATOM 544 H HD2 . TYR A1 1 36 ? -18.781 0.202 -24.636 1.0 73.43 36 A 8 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.511 -0.311 -25.884 1.0 30.0 36 A 8 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.61 -1.976 -25.422 1.0 11.1 36 A 8 -ATOM 547 H HH . TYR A1 1 36 ? -21.414 -3.166 -25.982 1.0 20.21 36 A 8 -ATOM 548 N N . ASP A1 1 37 ? -20.547 1.029 -21.642 1.0 31.31 37 A 8 -ATOM 549 C CA . ASP A1 1 37 ? -20.989 -0.139 -20.889 1.0 4.3 37 A 8 -ATOM 550 C C . ASP A1 1 37 ? -21.646 0.277 -19.577 1.0 30.32 37 A 8 -ATOM 551 O O . ASP A1 1 37 ? -22.561 -0.388 -19.09 1.0 62.0 37 A 8 -ATOM 552 C CB . ASP A1 1 37 ? -19.807 -1.069 -20.61 1.0 35.43 37 A 8 -ATOM 553 C CG . ASP A1 1 37 ? -20.213 -2.53 -20.588 1.0 34.32 37 A 8 -ATOM 554 O OD1 . ASP A1 1 37 ? -20.874 -2.977 -21.548 1.0 31.12 37 A 8 -ATOM 555 O OD2 . ASP A1 1 37 ? -19.87 -3.227 -19.609 1.0 3.2 37 A 8 -ATOM 556 H H . ASP A1 1 37 ? -19.591 1.243 -21.675 1.0 51.42 37 A 8 -ATOM 557 H HA . ASP A1 1 37 ? -21.715 -0.666 -21.49 1.0 32.24 37 A 8 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.061 -0.934 -21.379 1.0 43.14 37 A 8 -ATOM 559 H HB3 . ASP A1 1 37 ? -19.379 -0.818 -19.651 1.0 34.23 37 A 8 -ATOM 560 N N . LYS A1 1 38 ? -21.174 1.38 -19.008 1.0 33.03 38 A 8 -ATOM 561 C CA . LYS A1 1 38 ? -21.715 1.887 -17.753 1.0 33.5 38 A 8 -ATOM 562 C C . LYS A1 1 38 ? -23.223 2.092 -17.853 1.0 62.1 38 A 8 -ATOM 563 O O . LYS A1 1 38 ? -23.973 1.689 -16.966 1.0 13.24 38 A 8 -ATOM 564 C CB . LYS A1 1 38 ? -21.034 3.204 -17.374 1.0 32.13 38 A 8 -ATOM 565 C CG . LYS A1 1 38 ? -20.164 3.104 -16.133 1.0 11.13 38 A 8 -ATOM 566 C CD . LYS A1 1 38 ? -18.715 2.813 -16.489 1.0 55.11 38 A 8 -ATOM 567 C CE . LYS A1 1 38 ? -18.485 1.328 -16.721 1.0 12.13 38 A 8 -ATOM 568 N NZ . LYS A1 1 38 ? -18.058 0.632 -15.476 1.0 62.42 38 A 8 -ATOM 569 H H . LYS A1 1 38 ? -20.443 1.868 -19.445 1.0 40.1 38 A 8 -ATOM 570 H HA . LYS A1 1 38 ? -21.514 1.154 -16.986 1.0 13.43 38 A 8 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.413 3.524 -18.198 1.0 53.44 38 A 8 -ATOM 572 H HB3 . LYS A1 1 38 ? -21.794 3.95 -17.196 1.0 74.35 38 A 8 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.21 4.039 -15.595 1.0 72.35 38 A 8 -ATOM 574 H HG3 . LYS A1 1 38 ? -20.537 2.307 -15.506 1.0 65.33 38 A 8 -ATOM 575 H HD2 . LYS A1 1 38 ? -18.46 3.351 -17.391 1.0 31.44 38 A 8 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.081 3.145 -15.679 1.0 51.13 38 A 8 -ATOM 577 H HE2 . LYS A1 1 38 ? -19.405 0.885 -17.073 1.0 72.24 38 A 8 -ATOM 578 H HE3 . LYS A1 1 38 ? -17.718 1.209 -17.472 1.0 52.14 38 A 8 -ATOM 579 H HZ1 . LYS A1 1 38 ? -17.358 1.208 -14.967 1.0 12.21 38 A 8 -ATOM 580 H HZ2 . LYS A1 1 38 ? -17.63 -0.287 -15.71 1.0 31.3 38 A 8 -ATOM 581 H HZ3 . LYS A1 1 38 ? -18.877 0.472 -14.857 1.0 72.13 38 A 8 -ATOM 582 N N . GLU A1 1 39 ? -23.658 2.721 -18.941 1.0 74.33 39 A 8 -ATOM 583 C CA . GLU A1 1 39 ? -25.077 2.979 -19.156 1.0 31.43 39 A 8 -ATOM 584 C C . GLU A1 1 39 ? -25.602 2.175 -20.342 1.0 55.55 39 A 8 -ATOM 585 O O . GLU A1 1 39 ? -26.528 1.377 -20.203 1.0 44.25 39 A 8 -ATOM 586 C CB . GLU A1 1 39 ? -25.317 4.472 -19.392 1.0 31.12 39 A 8 -ATOM 587 C CG . GLU A1 1 39 ? -24.052 5.247 -19.722 1.0 22.34 39 A 8 -ATOM 588 C CD . GLU A1 1 39 ? -24.311 6.727 -19.927 1.0 34.02 39 A 8 -ATOM 589 O OE1 . GLU A1 1 39 ? -25.329 7.068 -20.565 1.0 60.52 39 A 8 -ATOM 590 O OE2 . GLU A1 1 39 ? -23.497 7.544 -19.449 1.0 24.54 39 A 8 -ATOM 591 H H . GLU A1 1 39 ? -23.01 3.019 -19.613 1.0 53.12 39 A 8 -ATOM 592 H HA . GLU A1 1 39 ? -25.608 2.676 -18.267 1.0 24.23 39 A 8 -ATOM 593 H HB2 . GLU A1 1 39 ? -26.01 4.588 -20.213 1.0 13.32 39 A 8 -ATOM 594 H HB3 . GLU A1 1 39 ? -25.753 4.899 -18.502 1.0 53.15 39 A 8 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.351 5.129 -18.909 1.0 73.51 39 A 8 -ATOM 596 H HG3 . GLU A1 1 39 ? -23.623 4.843 -20.627 1.0 55.55 39 A 8 -ATOM 597 N N . GLY A1 1 40 ? -25.004 2.392 -21.509 1.0 41.31 40 A 8 -ATOM 598 C CA . GLY A1 1 40 ? -25.424 1.681 -22.702 1.0 23.2 40 A 8 -ATOM 599 C C . GLY A1 1 40 ? -25.699 2.613 -23.865 1.0 54.31 40 A 8 -ATOM 600 O O . GLY A1 1 40 ? -26.769 2.558 -24.473 1.0 62.35 40 A 8 -ATOM 601 H H . GLY A1 1 40 ? -24.27 3.04 -21.56 1.0 1.31 40 A 8 -ATOM 602 H HA2 . GLY A1 1 40 ? -24.648 0.986 -22.986 1.0 42.33 40 A 8 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.325 1.128 -22.479 1.0 42.25 40 A 8 -ATOM 604 N N . ILE A1 1 41 ? -24.733 3.471 -24.175 1.0 11.45 41 A 8 -ATOM 605 C CA . ILE A1 1 41 ? -24.878 4.419 -25.273 1.0 13.21 41 A 8 -ATOM 606 C C . ILE A1 1 41 ? -23.673 4.366 -26.207 1.0 73.14 41 A 8 -ATOM 607 O O . ILE A1 1 41 ? -22.565 4.003 -25.811 1.0 54.03 41 A 8 -ATOM 608 C CB . ILE A1 1 41 ? -25.048 5.859 -24.754 1.0 13.54 41 A 8 -ATOM 609 C CG1 . ILE A1 1 41 ? -23.704 6.415 -24.278 1.0 35.25 41 A 8 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.072 5.9 -23.63 1.0 15.54 41 A 8 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.271 5.878 -22.933 1.0 51.21 41 A 8 -ATOM 612 H H . ILE A1 1 41 ? -23.904 3.466 -23.653 1.0 10.31 41 A 8 -ATOM 613 H HA . ILE A1 1 41 ? -25.764 4.151 -25.83 1.0 22.4 41 A 8 -ATOM 614 H HB . ILE A1 1 41 ? -25.415 6.469 -25.566 1.0 2.22 41 A 8 -ATOM 615 H HG12 . ILE A1 1 41 ? -22.942 6.162 -24.997 1.0 53.25 41 A 8 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.776 7.491 -24.199 1.0 73.21 41 A 8 -ATOM 617 H HG21 . ILE A1 1 41 ? -27.058 5.721 -24.035 1.0 41.34 41 A 8 -ATOM 618 H HG22 . ILE A1 1 41 ? -25.839 5.137 -22.903 1.0 35.01 41 A 8 -ATOM 619 H HG23 . ILE A1 1 41 ? -26.049 6.869 -23.156 1.0 24.24 41 A 8 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.919 5.063 -22.645 1.0 13.35 41 A 8 -ATOM 621 H HD12 . ILE A1 1 41 ? -22.253 5.521 -22.998 1.0 5.02 41 A 8 -ATOM 622 H HD13 . ILE A1 1 41 ? -23.331 6.663 -22.194 1.0 73.01 41 A 8 -ATOM 623 N N . PRO A1 1 42 ? -23.892 4.738 -27.477 1.0 42.01 42 A 8 -ATOM 624 C CA . PRO A1 1 42 ? -22.836 4.744 -28.493 1.0 63.34 42 A 8 -ATOM 625 C C . PRO A1 1 42 ? -21.802 5.837 -28.248 1.0 4.23 42 A 8 -ATOM 626 O O . PRO A1 1 42 ? -22.103 7.03 -28.29 1.0 21.54 42 A 8 -ATOM 627 C CB . PRO A1 1 42 ? -23.598 5.009 -29.794 1.0 63.45 42 A 8 -ATOM 628 C CG . PRO A1 1 42 ? -24.83 5.731 -29.371 1.0 31.23 42 A 8 -ATOM 629 C CD . PRO A1 1 42 ? -25.188 5.182 -28.018 1.0 52.22 42 A 8 -ATOM 630 H HA . PRO A1 1 42 ? -22.339 3.787 -28.554 1.0 60.32 42 A 8 -ATOM 631 H HB2 . PRO A1 1 42 ? -22.99 5.615 -30.452 1.0 50.23 42 A 8 -ATOM 632 H HB3 . PRO A1 1 42 ? -23.835 4.072 -30.275 1.0 64.01 42 A 8 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.631 6.79 -29.305 1.0 0.11 42 A 8 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.627 5.54 -30.075 1.0 1.1 42 A 8 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.62 5.954 -27.399 1.0 11.32 42 A 8 -ATOM 636 H HD3 . PRO A1 1 42 ? -25.869 4.35 -28.116 1.0 34.03 42 A 8 -ATOM 637 N N . PRO A1 1 43 ? -20.553 5.424 -27.988 1.0 1.41 43 A 8 -ATOM 638 C CA . PRO A1 1 43 ? -19.448 6.353 -27.732 1.0 62.53 43 A 8 -ATOM 639 C C . PRO A1 1 43 ? -19.037 7.123 -28.983 1.0 21.35 43 A 8 -ATOM 640 O O . PRO A1 1 43 ? -18.574 8.26 -28.899 1.0 73.42 43 A 8 -ATOM 641 C CB . PRO A1 1 43 ? -18.313 5.436 -27.271 1.0 74.43 43 A 8 -ATOM 642 C CG . PRO A1 1 43 ? -18.622 4.113 -27.881 1.0 42.11 43 A 8 -ATOM 643 C CD . PRO A1 1 43 ? -20.122 4.017 -27.922 1.0 32.53 43 A 8 -ATOM 644 H HA . PRO A1 1 43 ? -19.692 7.052 -26.945 1.0 3.1 43 A 8 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.368 5.824 -27.624 1.0 1.2 43 A 8 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.305 5.381 -26.193 1.0 52.2 43 A 8 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.216 4.065 -28.88 1.0 21.5 43 A 8 -ATOM 648 H HG3 . PRO A1 1 43 ? -18.213 3.322 -27.27 1.0 41.32 43 A 8 -ATOM 649 H HD2 . PRO A1 1 43 ? -20.442 3.475 -28.8 1.0 55.24 43 A 8 -ATOM 650 H HD3 . PRO A1 1 43 ? -20.495 3.542 -27.027 1.0 31.14 43 A 8 -ATOM 651 N N . ASP A1 1 44 ? -19.21 6.495 -30.141 1.0 54.12 44 A 8 -ATOM 652 C CA . ASP A1 1 44 ? -18.858 7.122 -31.41 1.0 51.34 44 A 8 -ATOM 653 C C . ASP A1 1 44 ? -19.87 8.202 -31.781 1.0 65.34 44 A 8 -ATOM 654 O O . ASP A1 1 44 ? -19.605 9.044 -32.638 1.0 41.23 44 A 8 -ATOM 655 C CB . ASP A1 1 44 ? -18.784 6.072 -32.519 1.0 23.35 44 A 8 -ATOM 656 C CG . ASP A1 1 44 ? -17.975 6.545 -33.711 1.0 52.14 44 A 8 -ATOM 657 O OD1 . ASP A1 1 44 ? -16.794 6.903 -33.521 1.0 70.43 44 A 8 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.523 6.557 -34.833 1.0 15.14 44 A 8 -ATOM 659 H H . ASP A1 1 44 ? -19.583 5.589 -30.143 1.0 64.31 44 A 8 -ATOM 660 H HA . ASP A1 1 44 ? -17.887 7.581 -31.295 1.0 72.42 44 A 8 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.323 5.176 -32.127 1.0 64.21 44 A 8 -ATOM 662 H HB3 . ASP A1 1 44 ? -19.784 5.84 -32.854 1.0 74.33 44 A 8 -ATOM 663 N N . GLN A1 1 45 ? -21.028 8.169 -31.131 1.0 24.51 45 A 8 -ATOM 664 C CA . GLN A1 1 45 ? -22.08 9.143 -31.396 1.0 55.1 45 A 8 -ATOM 665 C C . GLN A1 1 45 ? -22.002 10.308 -30.414 1.0 65.33 45 A 8 -ATOM 666 O O . GLN A1 1 45 ? -22.652 11.336 -30.604 1.0 0.12 45 A 8 -ATOM 667 C CB . GLN A1 1 45 ? -23.455 8.478 -31.307 1.0 3.33 45 A 8 -ATOM 668 C CG . GLN A1 1 45 ? -23.931 7.889 -32.625 1.0 71.05 45 A 8 -ATOM 669 C CD . GLN A1 1 45 ? -25.032 6.863 -32.442 1.0 50.21 45 A 8 -ATOM 670 O OE1 . GLN A1 1 45 ? -24.809 5.662 -32.593 1.0 30.33 45 A 8 -ATOM 671 N NE2 . GLN A1 1 45 ? -26.23 7.332 -32.113 1.0 54.11 45 A 8 -ATOM 672 H H . GLN A1 1 45 ? -21.18 7.473 -30.459 1.0 33.14 45 A 8 -ATOM 673 H HA . GLN A1 1 45 ? -21.937 9.522 -32.396 1.0 54.13 45 A 8 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.411 7.685 -30.577 1.0 72.22 45 A 8 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.177 9.214 -30.986 1.0 51.24 45 A 8 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.305 8.688 -33.248 1.0 11.31 45 A 8 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.094 7.414 -33.115 1.0 33.23 45 A 8 -ATOM 678 H HE21 . GLN A1 1 45 ? -26.334 8.302 -32.01 1.0 35.4 45 A 8 -ATOM 679 H HE22 . GLN A1 1 45 ? -26.96 6.692 -31.988 1.0 53.4 45 A 8 -ATOM 680 N N . GLN A1 1 46 ? -21.203 10.139 -29.366 1.0 5.34 46 A 8 -ATOM 681 C CA . GLN A1 1 46 ? -21.041 11.177 -28.354 1.0 54.21 46 A 8 -ATOM 682 C C . GLN A1 1 46 ? -19.619 11.727 -28.361 1.0 23.33 46 A 8 -ATOM 683 O O . GLN A1 1 46 ? -18.679 11.04 -28.762 1.0 42.0 46 A 8 -ATOM 684 C CB . GLN A1 1 46 ? -21.38 10.626 -26.968 1.0 54.1 46 A 8 -ATOM 685 C CG . GLN A1 1 46 ? -20.57 9.397 -26.587 1.0 63.33 46 A 8 -ATOM 686 C CD . GLN A1 1 46 ? -20.561 9.144 -25.093 1.0 73.34 46 A 8 -ATOM 687 O OE1 . GLN A1 1 46 ? -19.533 9.292 -24.432 1.0 62.34 46 A 8 -ATOM 688 N NE2 . GLN A1 1 46 ? -21.711 8.76 -24.551 1.0 52.51 46 A 8 -ATOM 689 H H . GLN A1 1 46 ? -20.711 9.298 -29.27 1.0 61.13 46 A 8 -ATOM 690 H HA . GLN A1 1 46 ? -21.725 11.979 -28.59 1.0 1.54 46 A 8 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.196 11.394 -26.233 1.0 70.34 46 A 8 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.427 10.36 -26.946 1.0 24.41 46 A 8 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.993 8.535 -27.08 1.0 71.34 46 A 8 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.552 9.537 -26.92 1.0 12.44 46 A 8 -ATOM 695 H HE21 . GLN A1 1 46 ? -22.489 8.662 -25.139 1.0 61.21 46 A 8 -ATOM 696 H HE22 . GLN A1 1 46 ? -21.734 8.589 -23.587 1.0 54.41 46 A 8 -ATOM 697 N N . ARG A1 1 47 ? -19.468 12.971 -27.916 1.0 11.31 47 A 8 -ATOM 698 C CA . ARG A1 1 47 ? -18.16 13.613 -27.873 1.0 74.42 47 A 8 -ATOM 699 C C . ARG A1 1 47 ? -17.949 14.327 -26.541 1.0 0.05 47 A 8 -ATOM 700 O O . ARG A1 1 47 ? -18.901 14.575 -25.799 1.0 62.43 47 A 8 -ATOM 701 C CB . ARG A1 1 47 ? -18.02 14.61 -29.025 1.0 53.24 47 A 8 -ATOM 702 C CG . ARG A1 1 47 ? -17.111 14.125 -30.143 1.0 25.13 47 A 8 -ATOM 703 C CD . ARG A1 1 47 ? -17.857 13.228 -31.118 1.0 74.31 47 A 8 -ATOM 704 N NE . ARG A1 1 47 ? -17.25 11.903 -31.217 1.0 72.02 47 A 8 -ATOM 705 C CZ . ARG A1 1 47 ? -16.113 11.662 -31.859 1.0 4.33 47 A 8 -ATOM 706 N NH1 . ARG A1 1 47 ? -15.461 12.651 -32.455 1.0 22.33 47 A 8 -ATOM 707 N NH2 . ARG A1 1 47 ? -15.624 10.429 -31.905 1.0 24.44 47 A 8 -ATOM 708 H H . ARG A1 1 47 ? -20.255 13.468 -27.61 1.0 14.32 47 A 8 -ATOM 709 H HA . ARG A1 1 47 ? -17.409 12.845 -27.98 1.0 52.1 47 A 8 -ATOM 710 H HB2 . ARG A1 1 47 ? -18.998 14.799 -29.443 1.0 12.43 47 A 8 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.617 15.534 -28.639 1.0 31.22 47 A 8 -ATOM 712 H HG2 . ARG A1 1 47 ? -16.727 14.98 -30.679 1.0 2.15 47 A 8 -ATOM 713 H HG3 . ARG A1 1 47 ? -16.291 13.57 -29.711 1.0 3.22 47 A 8 -ATOM 714 H HD2 . ARG A1 1 47 ? -18.877 13.122 -30.781 1.0 62.34 47 A 8 -ATOM 715 H HD3 . ARG A1 1 47 ? -17.847 13.693 -32.093 1.0 4.32 47 A 8 -ATOM 716 H HE . ARG A1 1 47 ? -17.715 11.158 -30.784 1.0 51.12 47 A 8 -ATOM 717 H HH11 . ARG A1 1 47 ? -15.826 13.581 -32.421 1.0 35.02 47 A 8 -ATOM 718 H HH12 . ARG A1 1 47 ? -14.604 12.467 -32.936 1.0 42.25 47 A 8 -ATOM 719 H HH21 . ARG A1 1 47 ? -16.112 9.681 -31.457 1.0 32.54 47 A 8 -ATOM 720 H HH22 . ARG A1 1 47 ? -14.768 10.249 -32.388 1.0 51.04 47 A 8 -ATOM 721 N N . LEU A1 1 48 ? -16.696 14.654 -26.243 1.0 13.42 48 A 8 -ATOM 722 C CA . LEU A1 1 48 ? -16.359 15.338 -25.0 1.0 63.04 48 A 8 -ATOM 723 C C . LEU A1 1 48 ? -16.074 16.816 -25.251 1.0 70.54 48 A 8 -ATOM 724 O O . LEU A1 1 48 ? -15.571 17.189 -26.311 1.0 13.22 48 A 8 -ATOM 725 C CB . LEU A1 1 48 ? -15.145 14.678 -24.344 1.0 73.22 48 A 8 -ATOM 726 C CG . LEU A1 1 48 ? -15.069 13.155 -24.454 1.0 23.01 48 A 8 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.443 12.535 -24.255 1.0 2.23 48 A 8 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.488 12.746 -25.799 1.0 62.5 48 A 8 -ATOM 729 H H . LEU A1 1 48 ? -15.981 14.43 -26.873 1.0 13.1 48 A 8 -ATOM 730 H HA . LEU A1 1 48 ? -17.207 15.256 -24.336 1.0 5.14 48 A 8 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.258 15.087 -24.802 1.0 14.35 48 A 8 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.157 14.935 -23.294 1.0 62.22 48 A 8 -ATOM 733 H HG . LEU A1 1 48 ? -14.417 12.776 -23.678 1.0 74.12 48 A 8 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.056 13.201 -23.666 1.0 72.12 48 A 8 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.342 11.591 -23.741 1.0 51.52 48 A 8 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.908 12.374 -25.216 1.0 50.13 48 A 8 -ATOM 737 H HD21 . LEU A1 1 48 ? -15.288 12.619 -26.513 1.0 32.51 48 A 8 -ATOM 738 H HD22 . LEU A1 1 48 ? -13.95 11.815 -25.691 1.0 4.35 48 A 8 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.811 13.513 -26.148 1.0 44.23 48 A 8 -ATOM 740 N N . ILE A1 1 49 ? -16.398 17.651 -24.27 1.0 13.31 49 A 8 -ATOM 741 C CA . ILE A1 1 49 ? -16.174 19.087 -24.384 1.0 13.25 49 A 8 -ATOM 742 C C . ILE A1 1 49 ? -15.663 19.669 -23.071 1.0 73.24 49 A 8 -ATOM 743 O O . ILE A1 1 49 ? -16.302 19.533 -22.028 1.0 20.41 49 A 8 -ATOM 744 C CB . ILE A1 1 49 ? -17.461 19.826 -24.795 1.0 42.12 49 A 8 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.497 20.03 -26.311 1.0 21.4 49 A 8 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.557 21.162 -24.073 1.0 44.11 49 A 8 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.76 19.508 -26.96 1.0 30.32 49 A 8 -ATOM 748 H H . ILE A1 1 49 ? -16.797 17.293 -23.45 1.0 11.12 49 A 8 -ATOM 749 H HA . ILE A1 1 49 ? -15.43 19.247 -25.151 1.0 31.54 49 A 8 -ATOM 750 H HB . ILE A1 1 49 ? -18.306 19.224 -24.499 1.0 10.22 49 A 8 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.424 21.083 -26.528 1.0 52.53 49 A 8 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.658 19.515 -26.755 1.0 23.14 49 A 8 -ATOM 753 H HG21 . ILE A1 1 49 ? -17.771 20.993 -23.028 1.0 54.41 49 A 8 -ATOM 754 H HG22 . ILE A1 1 49 ? -16.619 21.689 -24.166 1.0 2.4 49 A 8 -ATOM 755 H HG23 . ILE A1 1 49 ? -18.347 21.753 -24.511 1.0 53.42 49 A 8 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.365 19.006 -26.219 1.0 43.14 49 A 8 -ATOM 757 H HD12 . ILE A1 1 49 ? -19.317 20.333 -27.379 1.0 61.33 49 A 8 -ATOM 758 H HD13 . ILE A1 1 49 ? -18.501 18.813 -27.744 1.0 3.14 49 A 8 -ATOM 759 N N . PHE A1 1 50 ? -14.506 20.321 -23.13 1.0 0.44 50 A 8 -ATOM 760 C CA . PHE A1 1 50 ? -13.909 20.927 -21.946 1.0 63.4 50 A 8 -ATOM 761 C C . PHE A1 1 50 ? -13.563 22.391 -22.199 1.0 34.31 50 A 8 -ATOM 762 O O . PHE A1 1 50 ? -12.823 22.714 -23.127 1.0 24.03 50 A 8 -ATOM 763 C CB . PHE A1 1 50 ? -12.652 20.158 -21.533 1.0 1.31 50 A 8 -ATOM 764 C CG . PHE A1 1 50 ? -12.142 20.529 -20.17 1.0 63.44 50 A 8 -ATOM 765 C CD1 . PHE A1 1 50 ? -11.456 21.717 -19.972 1.0 63.22 50 A 8 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.349 19.691 -19.087 1.0 31.12 50 A 8 -ATOM 767 C CE1 . PHE A1 1 50 ? -10.986 22.06 -18.719 1.0 44.05 50 A 8 -ATOM 768 C CE2 . PHE A1 1 50 ? -11.881 20.03 -17.831 1.0 53.14 50 A 8 -ATOM 769 C CZ . PHE A1 1 50 ? -11.2 21.217 -17.647 1.0 64.24 50 A 8 -ATOM 770 H H . PHE A1 1 50 ? -14.044 20.397 -23.991 1.0 32.43 50 A 8 -ATOM 771 H HA . PHE A1 1 50 ? -14.632 20.873 -21.147 1.0 55.42 50 A 8 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.87 19.101 -21.529 1.0 72.21 50 A 8 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.867 20.356 -22.248 1.0 52.42 50 A 8 -ATOM 774 H HD1 . PHE A1 1 50 ? -11.289 22.378 -20.81 1.0 64.41 50 A 8 -ATOM 775 H HD2 . PHE A1 1 50 ? -12.883 18.762 -19.23 1.0 25.0 50 A 8 -ATOM 776 H HE1 . PHE A1 1 50 ? -10.453 22.989 -18.578 1.0 33.34 50 A 8 -ATOM 777 H HE2 . PHE A1 1 50 ? -12.051 19.367 -16.995 1.0 34.14 50 A 8 -ATOM 778 H HZ . PHE A1 1 50 ? -10.833 21.483 -16.667 1.0 42.2 50 A 8 -ATOM 779 N N . GLY A1 1 51 ? -14.105 23.274 -21.365 1.0 53.44 51 A 8 -ATOM 780 C CA . GLY A1 1 51 ? -13.843 24.693 -21.515 1.0 33.5 51 A 8 -ATOM 781 C C . GLY A1 1 51 ? -14.419 25.257 -22.8 1.0 34.32 51 A 8 -ATOM 782 O O . GLY A1 1 51 ? -14.127 26.392 -23.173 1.0 0.02 51 A 8 -ATOM 783 H H . GLY A1 1 51 ? -14.687 22.958 -20.643 1.0 14.34 51 A 8 -ATOM 784 H HA2 . GLY A1 1 51 ? -14.277 25.219 -20.678 1.0 71.3 51 A 8 -ATOM 785 H HA3 . GLY A1 1 51 ? -12.775 24.853 -21.513 1.0 2.33 51 A 8 -ATOM 786 N N . GLY A1 1 52 ? -15.239 24.46 -23.478 1.0 51.33 52 A 8 -ATOM 787 C CA . GLY A1 1 52 ? -15.842 24.902 -24.722 1.0 70.11 52 A 8 -ATOM 788 C C . GLY A1 1 52 ? -15.308 24.15 -25.925 1.0 64.35 52 A 8 -ATOM 789 O O . GLY A1 1 52 ? -16.016 23.964 -26.915 1.0 21.12 52 A 8 -ATOM 790 H H . GLY A1 1 52 ? -15.436 23.564 -23.132 1.0 52.33 52 A 8 -ATOM 791 H HA2 . GLY A1 1 52 ? -16.91 24.755 -24.663 1.0 34.31 52 A 8 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.641 25.955 -24.852 1.0 33.12 52 A 8 -ATOM 793 N N . LYS A1 1 53 ? -14.055 23.718 -25.842 1.0 4.12 53 A 8 -ATOM 794 C CA . LYS A1 1 53 ? -13.425 22.982 -26.932 1.0 20.15 53 A 8 -ATOM 795 C C . LYS A1 1 53 ? -13.564 21.478 -26.725 1.0 12.34 53 A 8 -ATOM 796 O O . LYS A1 1 53 ? -13.563 20.996 -25.593 1.0 53.3 53 A 8 -ATOM 797 C CB . LYS A1 1 53 ? -11.945 23.358 -27.04 1.0 12.13 53 A 8 -ATOM 798 C CG . LYS A1 1 53 ? -11.185 23.22 -25.732 1.0 34.42 53 A 8 -ATOM 799 C CD . LYS A1 1 53 ? -10.567 21.84 -25.59 1.0 44.0 53 A 8 -ATOM 800 C CE . LYS A1 1 53 ? -9.478 21.607 -26.626 1.0 75.53 53 A 8 -ATOM 801 N NZ . LYS A1 1 53 ? -8.118 21.644 -26.02 1.0 61.53 53 A 8 -ATOM 802 H H . LYS A1 1 53 ? -13.541 23.897 -25.026 1.0 32.12 53 A 8 -ATOM 803 H HA . LYS A1 1 53 ? -13.925 23.255 -27.849 1.0 74.23 53 A 8 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.476 22.719 -27.774 1.0 34.02 53 A 8 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.87 24.385 -27.369 1.0 32.22 53 A 8 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.399 23.96 -25.703 1.0 24.24 53 A 8 -ATOM 807 H HG3 . LYS A1 1 53 ? -11.868 23.386 -24.911 1.0 53.0 53 A 8 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.135 21.748 -24.604 1.0 22.42 53 A 8 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.339 21.094 -25.717 1.0 0.05 53 A 8 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.634 20.642 -27.082 1.0 25.2 53 A 8 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.548 22.377 -27.381 1.0 75.24 53 A 8 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.683 22.576 -26.175 1.0 1.33 53 A 8 -ATOM 813 H HZ2 . LYS A1 1 53 ? -7.515 20.915 -26.452 1.0 14.14 53 A 8 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.178 21.467 -24.997 1.0 31.25 53 A 8 -ATOM 815 N N . GLN A1 1 54 ? -13.682 20.742 -27.826 1.0 32.1 54 A 8 -ATOM 816 C CA . GLN A1 1 54 ? -13.821 19.292 -27.763 1.0 3.14 54 A 8 -ATOM 817 C C . GLN A1 1 54 ? -12.519 18.639 -27.311 1.0 14.5 54 A 8 -ATOM 818 O O . GLN A1 1 54 ? -11.467 19.279 -27.289 1.0 22.04 54 A 8 -ATOM 819 C CB . GLN A1 1 54 ? -14.236 18.739 -29.128 1.0 14.03 54 A 8 -ATOM 820 C CG . GLN A1 1 54 ? -15.551 17.976 -29.101 1.0 52.41 54 A 8 -ATOM 821 C CD . GLN A1 1 54 ? -16.378 18.194 -30.352 1.0 44.23 54 A 8 -ATOM 822 O OE1 . GLN A1 1 54 ? -17.494 18.71 -30.291 1.0 25.33 54 A 8 -ATOM 823 N NE2 . GLN A1 1 54 ? -15.833 17.801 -31.498 1.0 63.1 54 A 8 -ATOM 824 H H . GLN A1 1 54 ? -13.676 21.184 -28.699 1.0 52.11 54 A 8 -ATOM 825 H HA . GLN A1 1 54 ? -14.592 19.064 -27.043 1.0 62.04 54 A 8 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.336 19.561 -29.821 1.0 31.24 54 A 8 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.465 18.071 -29.482 1.0 25.42 54 A 8 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.339 16.921 -29.007 1.0 52.11 54 A 8 -ATOM 829 H HG3 . GLN A1 1 54 ? -16.124 18.304 -28.246 1.0 53.52 54 A 8 -ATOM 830 H HE21 . GLN A1 1 54 ? -14.94 17.396 -31.47 1.0 45.55 54 A 8 -ATOM 831 H HE22 . GLN A1 1 54 ? -16.346 17.929 -32.322 1.0 62.42 54 A 8 -ATOM 832 N N . LEU A1 1 55 ? -12.597 17.363 -26.952 1.0 51.34 55 A 8 -ATOM 833 C CA . LEU A1 1 55 ? -11.424 16.622 -26.5 1.0 40.45 55 A 8 -ATOM 834 C C . LEU A1 1 55 ? -11.089 15.49 -27.466 1.0 63.5 55 A 8 -ATOM 835 O O . LEU A1 1 55 ? -11.945 14.672 -27.798 1.0 52.11 55 A 8 -ATOM 836 C CB . LEU A1 1 55 ? -11.661 16.058 -25.098 1.0 25.03 55 A 8 -ATOM 837 C CG . LEU A1 1 55 ? -12.266 17.025 -24.079 1.0 41.33 55 A 8 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.309 16.388 -22.699 1.0 33.24 55 A 8 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.476 18.325 -24.044 1.0 52.23 55 A 8 -ATOM 840 H H . LEU A1 1 55 ? -13.462 16.906 -26.991 1.0 12.34 55 A 8 -ATOM 841 H HA . LEU A1 1 55 ? -10.591 17.309 -26.467 1.0 22.21 55 A 8 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.328 15.215 -25.19 1.0 55.1 55 A 8 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.709 15.722 -24.712 1.0 51.11 55 A 8 -ATOM 844 H HG . LEU A1 1 55 ? -13.281 17.257 -24.371 1.0 72.12 55 A 8 -ATOM 845 H HD11 . LEU A1 1 55 ? -12.173 17.149 -21.947 1.0 32.04 55 A 8 -ATOM 846 H HD12 . LEU A1 1 55 ? -11.52 15.655 -22.616 1.0 44.35 55 A 8 -ATOM 847 H HD13 . LEU A1 1 55 ? -13.264 15.905 -22.555 1.0 32.21 55 A 8 -ATOM 848 H HD21 . LEU A1 1 55 ? -12.079 19.123 -24.451 1.0 33.14 55 A 8 -ATOM 849 H HD22 . LEU A1 1 55 ? -10.578 18.216 -24.633 1.0 72.01 55 A 8 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.211 18.558 -23.023 1.0 74.33 55 A 8 -ATOM 851 N N . GLU A1 1 56 ? -9.837 15.45 -27.912 1.0 12.02 56 A 8 -ATOM 852 C CA . GLU A1 1 56 ? -9.389 14.417 -28.838 1.0 31.33 56 A 8 -ATOM 853 C C . GLU A1 1 56 ? -9.393 13.046 -28.168 1.0 62.51 56 A 8 -ATOM 854 O O . GLU A1 1 56 ? -9.828 12.903 -27.025 1.0 51.02 56 A 8 -ATOM 855 C CB . GLU A1 1 56 ? -7.986 14.739 -29.357 1.0 62.01 56 A 8 -ATOM 856 C CG . GLU A1 1 56 ? -7.895 14.792 -30.873 1.0 21.02 56 A 8 -ATOM 857 C CD . GLU A1 1 56 ? -6.521 15.207 -31.361 1.0 1.0 56 A 8 -ATOM 858 O OE1 . GLU A1 1 56 ? -6.161 16.39 -31.184 1.0 61.34 56 A 8 -ATOM 859 O OE2 . GLU A1 1 56 ? -5.805 14.35 -31.918 1.0 22.01 56 A 8 -ATOM 860 H H . GLU A1 1 56 ? -9.2 16.131 -27.61 1.0 72.43 56 A 8 -ATOM 861 H HA . GLU A1 1 56 ? -10.075 14.399 -29.671 1.0 4.21 56 A 8 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.682 15.698 -28.965 1.0 41.11 56 A 8 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.302 13.982 -29.003 1.0 51.02 56 A 8 -ATOM 864 H HG2 . GLU A1 1 56 ? -8.12 13.814 -31.269 1.0 71.31 56 A 8 -ATOM 865 H HG3 . GLU A1 1 56 ? -8.621 15.503 -31.24 1.0 60.44 56 A 8 -ATOM 866 N N . ASP A1 1 57 ? -8.907 12.041 -28.888 1.0 71.03 57 A 8 -ATOM 867 C CA . ASP A1 1 57 ? -8.853 10.681 -28.364 1.0 63.41 57 A 8 -ATOM 868 C C . ASP A1 1 57 ? -7.76 10.548 -27.309 1.0 21.4 57 A 8 -ATOM 869 O O . ASP A1 1 57 ? -7.824 9.678 -26.44 1.0 43.31 57 A 8 -ATOM 870 C CB . ASP A1 1 57 ? -8.61 9.684 -29.498 1.0 45.31 57 A 8 -ATOM 871 C CG . ASP A1 1 57 ? -9.717 9.702 -30.533 1.0 55.43 57 A 8 -ATOM 872 O OD1 . ASP A1 1 57 ? -10.895 9.552 -30.144 1.0 72.35 57 A 8 -ATOM 873 O OD2 . ASP A1 1 57 ? -9.407 9.867 -31.731 1.0 15.11 57 A 8 -ATOM 874 H H . ASP A1 1 57 ? -8.575 12.218 -29.793 1.0 23.12 57 A 8 -ATOM 875 H HA . ASP A1 1 57 ? -9.806 10.465 -27.906 1.0 62.14 57 A 8 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.679 9.929 -29.99 1.0 24.44 57 A 8 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.543 8.689 -29.085 1.0 64.03 57 A 8 -ATOM 878 N N . SER A1 1 58 ? -6.756 11.415 -27.392 1.0 32.51 58 A 8 -ATOM 879 C CA . SER A1 1 58 ? -5.645 11.391 -26.448 1.0 62.24 58 A 8 -ATOM 880 C C . SER A1 1 58 ? -5.684 12.61 -25.532 1.0 2.12 58 A 8 -ATOM 881 O O . SER A1 1 58 ? -4.791 12.813 -24.711 1.0 12.21 58 A 8 -ATOM 882 C CB . SER A1 1 58 ? -4.312 11.345 -27.197 1.0 65.11 58 A 8 -ATOM 883 O OG . SER A1 1 58 ? -3.226 11.201 -26.297 1.0 34.21 58 A 8 -ATOM 884 H H . SER A1 1 58 ? -6.761 12.085 -28.108 1.0 21.03 58 A 8 -ATOM 885 H HA . SER A1 1 58 ? -5.741 10.5 -25.846 1.0 33.55 58 A 8 -ATOM 886 H HB2 . SER A1 1 58 ? -4.313 10.507 -27.877 1.0 31.42 58 A 8 -ATOM 887 H HB3 . SER A1 1 58 ? -4.183 12.261 -27.754 1.0 40.4 58 A 8 -ATOM 888 H HG . SER A1 1 58 ? -2.462 10.862 -26.769 1.0 10.23 58 A 8 -ATOM 889 N N . ASN A1 1 59 ? -6.728 13.42 -25.679 1.0 35.41 59 A 8 -ATOM 890 C CA . ASN A1 1 59 ? -6.885 14.62 -24.866 1.0 52.34 59 A 8 -ATOM 891 C C . ASN A1 1 59 ? -7.578 14.296 -23.546 1.0 4.01 59 A 8 -ATOM 892 O O . ASN A1 1 59 ? -8.779 14.517 -23.393 1.0 42.21 59 A 8 -ATOM 893 C CB . ASN A1 1 59 ? -7.686 15.677 -25.629 1.0 21.1 59 A 8 -ATOM 894 C CG . ASN A1 1 59 ? -7.604 17.045 -24.98 1.0 14.54 59 A 8 -ATOM 895 O OD1 . ASN A1 1 59 ? -7.754 17.178 -23.765 1.0 24.42 59 A 8 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.366 18.071 -25.789 1.0 14.44 59 A 8 -ATOM 897 H H . ASN A1 1 59 ? -7.409 13.205 -26.351 1.0 5.51 59 A 8 -ATOM 898 H HA . ASN A1 1 59 ? -5.901 15.01 -24.657 1.0 74.51 59 A 8 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.301 15.754 -26.636 1.0 43.43 59 A 8 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.723 15.378 -25.667 1.0 11.21 59 A 8 -ATOM 901 H HD21 . ASN A1 1 59 ? -7.258 17.89 -26.747 1.0 21.33 59 A 8 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.308 18.966 -25.396 1.0 12.0 59 A 8 -ATOM 903 N N . ALA A1 1 60 ? -6.812 13.773 -22.595 1.0 13.11 60 A 8 -ATOM 904 C CA . ALA A1 1 60 ? -7.35 13.421 -21.287 1.0 35.51 60 A 8 -ATOM 905 C C . ALA A1 1 60 ? -6.24 12.995 -20.332 1.0 74.01 60 A 8 -ATOM 906 O O . ALA A1 1 60 ? -5.789 13.782 -19.5 1.0 74.24 60 A 8 -ATOM 907 C CB . ALA A1 1 60 ? -8.385 12.314 -21.423 1.0 64.13 60 A 8 -ATOM 908 H H . ALA A1 1 60 ? -5.861 13.621 -22.777 1.0 31.12 60 A 8 -ATOM 909 H HA . ALA A1 1 60 ? -7.844 14.294 -20.883 1.0 20.01 60 A 8 -ATOM 910 H HB1 . ALA A1 1 60 ? -7.928 11.449 -21.881 1.0 72.33 60 A 8 -ATOM 911 H HB2 . ALA A1 1 60 ? -8.759 12.049 -20.445 1.0 25.02 60 A 8 -ATOM 912 H HB3 . ALA A1 1 60 ? -9.202 12.659 -22.04 1.0 51.02 60 A 8 -ATOM 913 N N . MET A1 1 61 ? -5.804 11.746 -20.458 1.0 21.52 61 A 8 -ATOM 914 C CA . MET A1 1 61 ? -4.746 11.217 -19.606 1.0 32.03 61 A 8 -ATOM 915 C C . MET A1 1 61 ? -3.389 11.784 -20.009 1.0 55.14 61 A 8 -ATOM 916 O O . MET A1 1 61 ? -2.715 12.434 -19.21 1.0 73.23 61 A 8 -ATOM 917 C CB . MET A1 1 61 ? -4.716 9.689 -19.682 1.0 33.12 61 A 8 -ATOM 918 C CG . MET A1 1 61 ? -6.098 9.056 -19.714 1.0 10.31 61 A 8 -ATOM 919 S SD . MET A1 1 61 ? -7.178 9.679 -18.411 1.0 3.45 61 A 8 -ATOM 920 C CE . MET A1 1 61 ? -8.764 9.646 -19.243 1.0 11.34 61 A 8 -ATOM 921 H H . MET A1 1 61 ? -6.203 11.166 -21.141 1.0 44.35 61 A 8 -ATOM 922 H HA . MET A1 1 61 ? -4.96 11.514 -18.59 1.0 14.21 61 A 8 -ATOM 923 H HB2 . MET A1 1 61 ? -4.189 9.395 -20.577 1.0 14.23 61 A 8 -ATOM 924 H HB3 . MET A1 1 61 ? -4.189 9.307 -18.821 1.0 0.24 61 A 8 -ATOM 925 H HG2 . MET A1 1 61 ? -6.554 9.264 -20.67 1.0 62.14 61 A 8 -ATOM 926 H HG3 . MET A1 1 61 ? -5.991 7.988 -19.594 1.0 32.0 61 A 8 -ATOM 927 H HE1 . MET A1 1 61 ? -9.24 10.611 -19.147 1.0 54.23 61 A 8 -ATOM 928 H HE2 . MET A1 1 61 ? -8.618 9.419 -20.288 1.0 64.31 61 A 8 -ATOM 929 H HE3 . MET A1 1 61 ? -9.39 8.889 -18.794 1.0 24.11 61 A 8 -ATOM 930 N N . SER A1 1 62 ? -2.993 11.533 -21.253 1.0 73.15 62 A 8 -ATOM 931 C CA . SER A1 1 62 ? -1.714 12.015 -21.761 1.0 12.22 62 A 8 -ATOM 932 C C . SER A1 1 62 ? -1.625 13.535 -21.654 1.0 13.52 62 A 8 -ATOM 933 O O . SER A1 1 62 ? -0.552 14.09 -21.417 1.0 42.51 62 A 8 -ATOM 934 C CB . SER A1 1 62 ? -1.523 11.583 -23.216 1.0 62.33 62 A 8 -ATOM 935 O OG . SER A1 1 62 ? -0.885 12.599 -23.97 1.0 14.13 62 A 8 -ATOM 936 H H . SER A1 1 62 ? -3.575 11.009 -21.843 1.0 74.25 62 A 8 -ATOM 937 H HA . SER A1 1 62 ? -0.932 11.578 -21.158 1.0 74.15 62 A 8 -ATOM 938 H HB2 . SER A1 1 62 ? -0.914 10.692 -23.247 1.0 54.41 62 A 8 -ATOM 939 H HB3 . SER A1 1 62 ? -2.487 11.375 -23.656 1.0 23.45 62 A 8 -ATOM 940 H HG . SER A1 1 62 ? -1.545 13.095 -24.46 1.0 1.23 62 A 8 -ATOM 941 N N . ASP A1 1 63 ? -2.761 14.201 -21.83 1.0 34.33 63 A 8 -ATOM 942 C CA . ASP A1 1 63 ? -2.814 15.656 -21.753 1.0 10.21 63 A 8 -ATOM 943 C C . ASP A1 1 63 ? -2.322 16.147 -20.395 1.0 63.54 63 A 8 -ATOM 944 O O . ASP A1 1 63 ? -1.86 17.281 -20.263 1.0 31.33 63 A 8 -ATOM 945 C CB . ASP A1 1 63 ? -4.24 16.15 -22.002 1.0 21.1 63 A 8 -ATOM 946 C CG . ASP A1 1 63 ? -4.283 17.605 -22.425 1.0 12.2 63 A 8 -ATOM 947 O OD1 . ASP A1 1 63 ? -4.236 18.483 -21.538 1.0 53.24 63 A 8 -ATOM 948 O OD2 . ASP A1 1 63 ? -4.362 17.866 -23.643 1.0 3.13 63 A 8 -ATOM 949 H H . ASP A1 1 63 ? -3.584 13.702 -22.016 1.0 14.4 63 A 8 -ATOM 950 H HA . ASP A1 1 63 ? -2.166 16.053 -22.521 1.0 72.42 63 A 8 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.689 15.554 -22.783 1.0 63.34 63 A 8 -ATOM 952 H HB3 . ASP A1 1 63 ? -4.815 16.04 -21.095 1.0 44.51 63 A 8 -ATOM 953 N N . TYR A1 1 64 ? -2.424 15.286 -19.389 1.0 43.15 64 A 8 -ATOM 954 C CA . TYR A1 1 64 ? -1.993 15.633 -18.04 1.0 74.44 64 A 8 -ATOM 955 C C . TYR A1 1 64 ? -3.036 16.5 -17.341 1.0 35.31 64 A 8 -ATOM 956 O O . TYR A1 1 64 ? -2.725 17.222 -16.394 1.0 63.11 64 A 8 -ATOM 957 C CB . TYR A1 1 64 ? -0.651 16.365 -18.083 1.0 41.31 64 A 8 -ATOM 958 C CG . TYR A1 1 64 ? 0.176 16.187 -16.83 1.0 35.31 64 A 8 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.744 14.959 -16.517 1.0 10.21 64 A 8 -ATOM 960 C CD2 . TYR A1 1 64 ? 0.389 17.248 -15.958 1.0 61.0 64 A 8 -ATOM 961 C CE1 . TYR A1 1 64 ? 1.5 14.792 -15.372 1.0 31.32 64 A 8 -ATOM 962 C CE2 . TYR A1 1 64 ? 1.144 17.091 -14.812 1.0 3.01 64 A 8 -ATOM 963 C CZ . TYR A1 1 64 ? 1.697 15.861 -14.524 1.0 35.43 64 A 8 -ATOM 964 O OH . TYR A1 1 64 ? 2.449 15.7 -13.383 1.0 23.32 64 A 8 -ATOM 965 H H . TYR A1 1 64 ? -2.801 14.397 -19.556 1.0 10.22 64 A 8 -ATOM 966 H HA . TYR A1 1 64 ? -1.874 14.715 -17.483 1.0 40.51 64 A 8 -ATOM 967 H HB2 . TYR A1 1 64 ? -0.073 15.994 -18.916 1.0 75.32 64 A 8 -ATOM 968 H HB3 . TYR A1 1 64 ? -0.829 17.422 -18.217 1.0 32.34 64 A 8 -ATOM 969 H HD1 . TYR A1 1 64 ? 0.588 14.123 -17.183 1.0 1.35 64 A 8 -ATOM 970 H HD2 . TYR A1 1 64 ? -0.046 18.21 -16.187 1.0 32.41 64 A 8 -ATOM 971 H HE1 . TYR A1 1 64 ? 1.934 13.829 -15.146 1.0 52.21 64 A 8 -ATOM 972 H HE2 . TYR A1 1 64 ? 1.299 17.928 -14.147 1.0 43.14 64 A 8 -ATOM 973 H HH . TYR A1 1 64 ? 3.372 15.586 -13.621 1.0 23.33 64 A 8 -ATOM 974 N N . ASN A1 1 65 ? -4.275 16.423 -17.815 1.0 61.21 65 A 8 -ATOM 975 C CA . ASN A1 1 65 ? -5.365 17.2 -17.237 1.0 70.22 65 A 8 -ATOM 976 C C . ASN A1 1 65 ? -6.359 16.292 -16.52 1.0 21.44 65 A 8 -ATOM 977 O O . ASN A1 1 65 ? -7.449 16.723 -16.142 1.0 22.24 65 A 8 -ATOM 978 C CB . ASN A1 1 65 ? -6.082 18.001 -18.326 1.0 30.31 65 A 8 -ATOM 979 C CG . ASN A1 1 65 ? -7.105 17.17 -19.076 1.0 75.23 65 A 8 -ATOM 980 O OD1 . ASN A1 1 65 ? -6.757 16.208 -19.761 1.0 74.2 65 A 8 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.374 17.539 -18.95 1.0 12.4 65 A 8 -ATOM 982 H H . ASN A1 1 65 ? -4.461 15.829 -18.573 1.0 72.01 65 A 8 -ATOM 983 H HA . ASN A1 1 65 ? -4.939 17.886 -16.52 1.0 43.44 65 A 8 -ATOM 984 H HB2 . ASN A1 1 65 ? -6.59 18.839 -17.872 1.0 12.24 65 A 8 -ATOM 985 H HB3 . ASN A1 1 65 ? -5.353 18.368 -19.033 1.0 73.02 65 A 8 -ATOM 986 H HD21 . ASN A1 1 65 ? -8.577 18.316 -18.388 1.0 23.44 65 A 8 -ATOM 987 H HD22 . ASN A1 1 65 ? -9.056 17.019 -19.424 1.0 32.24 65 A 8 -ATOM 988 N N . VAL A1 1 66 ? -5.976 15.033 -16.334 1.0 11.4 66 A 8 -ATOM 989 C CA . VAL A1 1 66 ? -6.832 14.064 -15.661 1.0 70.45 66 A 8 -ATOM 990 C C . VAL A1 1 66 ? -6.594 14.073 -14.155 1.0 73.11 66 A 8 -ATOM 991 O O . VAL A1 1 66 ? -5.469 13.884 -13.694 1.0 33.12 66 A 8 -ATOM 992 C CB . VAL A1 1 66 ? -6.599 12.64 -16.198 1.0 40.11 66 A 8 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.161 12.207 -15.957 1.0 32.21 66 A 8 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.573 11.663 -15.557 1.0 25.13 66 A 8 -ATOM 995 H H . VAL A1 1 66 ? -5.095 14.749 -16.657 1.0 25.31 66 A 8 -ATOM 996 H HA . VAL A1 1 66 ? -7.86 14.336 -15.855 1.0 44.24 66 A 8 -ATOM 997 H HB . VAL A1 1 66 ? -6.776 12.645 -17.263 1.0 65.05 66 A 8 -ATOM 998 H HG11 . VAL A1 1 66 ? -4.952 11.316 -16.531 1.0 62.5 66 A 8 -ATOM 999 H HG12 . VAL A1 1 66 ? -4.491 12.998 -16.261 1.0 4.5 66 A 8 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.019 11.999 -14.906 1.0 12.32 66 A 8 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.568 11.846 -15.934 1.0 23.4 66 A 8 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.277 10.652 -15.795 1.0 64.2 66 A 8 -ATOM 1003 H HG23 . VAL A1 1 66 ? -7.565 11.797 -14.484 1.0 74.31 66 A 8 -ATOM 1004 N N . GLN A1 1 67 ? -7.661 14.295 -13.394 1.0 5.43 67 A 8 -ATOM 1005 C CA . GLN A1 1 67 ? -7.567 14.329 -11.939 1.0 15.5 67 A 8 -ATOM 1006 C C . GLN A1 1 67 ? -8.503 13.303 -11.309 1.0 62.54 67 A 8 -ATOM 1007 O O . GLN A1 1 67 ? -9.222 12.59 -12.01 1.0 44.01 67 A 8 -ATOM 1008 C CB . GLN A1 1 67 ? -7.9 15.728 -11.418 1.0 35.11 67 A 8 -ATOM 1009 C CG . GLN A1 1 67 ? -9.322 16.169 -11.725 1.0 11.21 67 A 8 -ATOM 1010 C CD . GLN A1 1 67 ? -9.394 17.595 -12.235 1.0 34.44 67 A 8 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.131 18.422 -11.698 1.0 41.54 67 A 8 -ATOM 1012 N NE2 . GLN A1 1 67 ? -8.626 17.89 -13.277 1.0 50.51 67 A 8 -ATOM 1013 H H . GLN A1 1 67 ? -8.531 14.439 -13.82 1.0 54.23 67 A 8 -ATOM 1014 H HA . GLN A1 1 67 ? -6.551 14.085 -11.667 1.0 21.13 67 A 8 -ATOM 1015 H HB2 . GLN A1 1 67 ? -7.765 15.742 -10.347 1.0 61.05 67 A 8 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.221 16.437 -11.868 1.0 21.05 67 A 8 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.735 15.513 -12.477 1.0 63.24 67 A 8 -ATOM 1018 H HG3 . GLN A1 1 67 ? -9.911 16.095 -10.822 1.0 63.02 67 A 8 -ATOM 1019 H HE21 . GLN A1 1 67 ? -8.064 17.18 -13.654 1.0 0.12 67 A 8 -ATOM 1020 H HE22 . GLN A1 1 67 ? -8.653 18.804 -13.628 1.0 72.41 67 A 8 -ATOM 1021 N N . LYS A1 1 68 ? -8.49 13.232 -9.983 1.0 63.33 68 A 8 -ATOM 1022 C CA . LYS A1 1 68 ? -9.338 12.294 -9.257 1.0 34.0 68 A 8 -ATOM 1023 C C . LYS A1 1 68 ? -10.813 12.627 -9.457 1.0 33.21 68 A 8 -ATOM 1024 O O . LYS A1 1 68 ? -11.668 11.743 -9.416 1.0 33.01 68 A 8 -ATOM 1025 C CB . LYS A1 1 68 ? -8.997 12.317 -7.765 1.0 41.41 68 A 8 -ATOM 1026 C CG . LYS A1 1 68 ? -9.835 11.359 -6.935 1.0 61.44 68 A 8 -ATOM 1027 C CD . LYS A1 1 68 ? -9.584 9.913 -7.329 1.0 43.41 68 A 8 -ATOM 1028 C CE . LYS A1 1 68 ? -8.613 9.237 -6.373 1.0 23.43 68 A 8 -ATOM 1029 N NZ . LYS A1 1 68 ? -9.154 9.169 -4.988 1.0 52.05 68 A 8 -ATOM 1030 H H . LYS A1 1 68 ? -7.894 13.827 -9.479 1.0 75.53 68 A 8 -ATOM 1031 H HA . LYS A1 1 68 ? -9.148 11.306 -9.646 1.0 31.4 68 A 8 -ATOM 1032 H HB2 . LYS A1 1 68 ? -7.957 12.052 -7.641 1.0 51.5 68 A 8 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.152 13.317 -7.387 1.0 62.4 68 A 8 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.585 11.486 -5.893 1.0 22.33 68 A 8 -ATOM 1035 H HG3 . LYS A1 1 68 ? -10.881 11.587 -7.087 1.0 45.02 68 A 8 -ATOM 1036 H HD2 . LYS A1 1 68 ? -10.52 9.376 -7.312 1.0 14.2 68 A 8 -ATOM 1037 H HD3 . LYS A1 1 68 ? -9.17 9.888 -8.327 1.0 13.53 68 A 8 -ATOM 1038 H HE2 . LYS A1 1 68 ? -8.421 8.235 -6.725 1.0 43.13 68 A 8 -ATOM 1039 H HE3 . LYS A1 1 68 ? -7.689 9.797 -6.363 1.0 63.42 68 A 8 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -10.044 9.703 -4.925 1.0 1.54 68 A 8 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -8.471 9.576 -4.317 1.0 73.32 68 A 8 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.335 8.181 -4.722 1.0 23.44 68 A 8 -ATOM 1043 N N . GLU A1 1 69 ? -11.102 13.906 -9.676 1.0 51.1 69 A 8 -ATOM 1044 C CA . GLU A1 1 69 ? -12.474 14.353 -9.884 1.0 15.41 69 A 8 -ATOM 1045 C C . GLU A1 1 69 ? -12.534 15.451 -10.942 1.0 20.25 69 A 8 -ATOM 1046 O O . GLU A1 1 69 ? -12.669 16.632 -10.62 1.0 55.15 69 A 8 -ATOM 1047 C CB . GLU A1 1 69 ? -13.073 14.862 -8.571 1.0 42.14 69 A 8 -ATOM 1048 C CG . GLU A1 1 69 ? -12.162 15.816 -7.816 1.0 32.44 69 A 8 -ATOM 1049 C CD . GLU A1 1 69 ? -12.931 16.803 -6.96 1.0 60.3 69 A 8 -ATOM 1050 O OE1 . GLU A1 1 69 ? -13.66 16.358 -6.05 1.0 52.11 69 A 8 -ATOM 1051 O OE2 . GLU A1 1 69 ? -12.803 18.022 -7.202 1.0 33.22 69 A 8 -ATOM 1052 H H . GLU A1 1 69 ? -10.376 14.564 -9.698 1.0 51.55 69 A 8 -ATOM 1053 H HA . GLU A1 1 69 ? -13.05 13.507 -10.227 1.0 21.13 69 A 8 -ATOM 1054 H HB2 . GLU A1 1 69 ? -13.998 15.375 -8.786 1.0 70.35 69 A 8 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.281 14.016 -7.933 1.0 25.14 69 A 8 -ATOM 1056 H HG2 . GLU A1 1 69 ? -11.51 15.24 -7.175 1.0 60.54 69 A 8 -ATOM 1057 H HG3 . GLU A1 1 69 ? -11.567 16.366 -8.53 1.0 2.43 69 A 8 -ATOM 1058 N N . SER A1 1 70 ? -12.433 15.053 -12.206 1.0 51.41 70 A 8 -ATOM 1059 C CA . SER A1 1 70 ? -12.471 16.002 -13.312 1.0 50.24 70 A 8 -ATOM 1060 C C . SER A1 1 70 ? -13.877 16.098 -13.897 1.0 72.1 70 A 8 -ATOM 1061 O O . SER A1 1 70 ? -14.464 15.094 -14.302 1.0 13.02 70 A 8 -ATOM 1062 C CB . SER A1 1 70 ? -11.48 15.588 -14.402 1.0 75.43 70 A 8 -ATOM 1063 O OG . SER A1 1 70 ? -10.619 16.661 -14.742 1.0 45.33 70 A 8 -ATOM 1064 H H . SER A1 1 70 ? -12.327 14.097 -12.399 1.0 42.55 70 A 8 -ATOM 1065 H HA . SER A1 1 70 ? -12.187 16.97 -12.928 1.0 61.25 70 A 8 -ATOM 1066 H HB2 . SER A1 1 70 ? -10.883 14.762 -14.047 1.0 1.23 70 A 8 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.025 15.285 -15.284 1.0 50.33 70 A 8 -ATOM 1068 H HG . SER A1 1 70 ? -11.121 17.344 -15.194 1.0 14.24 70 A 8 -ATOM 1069 N N . THR A1 1 71 ? -14.412 17.314 -13.939 1.0 52.55 71 A 8 -ATOM 1070 C CA . THR A1 1 71 ? -15.748 17.544 -14.473 1.0 43.33 71 A 8 -ATOM 1071 C C . THR A1 1 71 ? -15.693 17.937 -15.945 1.0 63.44 71 A 8 -ATOM 1072 O O . THR A1 1 71 ? -15.169 18.996 -16.295 1.0 13.52 71 A 8 -ATOM 1073 C CB . THR A1 1 71 ? -16.486 18.643 -13.687 1.0 4.41 71 A 8 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.55 19.613 -13.204 1.0 4.41 71 A 8 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.256 18.049 -12.517 1.0 4.35 71 A 8 -ATOM 1076 H H . THR A1 1 71 ? -13.894 18.075 -13.602 1.0 14.04 71 A 8 -ATOM 1077 H HA . THR A1 1 71 ? -16.308 16.624 -14.377 1.0 24.13 71 A 8 -ATOM 1078 H HB . THR A1 1 71 ? -17.188 19.13 -14.35 1.0 70.41 71 A 8 -ATOM 1079 H HG1 . THR A1 1 71 ? -15.951 20.121 -12.495 1.0 53.11 71 A 8 -ATOM 1080 H HG21 . THR A1 1 71 ? -16.706 17.212 -12.113 1.0 12.42 71 A 8 -ATOM 1081 H HG22 . THR A1 1 71 ? -18.224 17.712 -12.857 1.0 75.2 71 A 8 -ATOM 1082 H HG23 . THR A1 1 71 ? -17.384 18.799 -11.751 1.0 31.12 71 A 8 -ATOM 1083 N N . LEU A1 1 72 ? -16.235 17.08 -16.802 1.0 74.32 72 A 8 -ATOM 1084 C CA . LEU A1 1 72 ? -16.248 17.339 -18.238 1.0 62.12 72 A 8 -ATOM 1085 C C . LEU A1 1 72 ? -17.667 17.26 -18.793 1.0 14.1 72 A 8 -ATOM 1086 O O . LEU A1 1 72 ? -18.521 16.564 -18.244 1.0 22.33 72 A 8 -ATOM 1087 C CB . LEU A1 1 72 ? -15.348 16.338 -18.965 1.0 54.24 72 A 8 -ATOM 1088 C CG . LEU A1 1 72 ? -16.04 15.094 -19.522 1.0 12.34 72 A 8 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.411 15.299 -20.983 1.0 71.53 72 A 8 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.149 13.871 -19.362 1.0 45.31 72 A 8 -ATOM 1091 H H . LEU A1 1 72 ? -16.637 16.253 -16.463 1.0 40.44 72 A 8 -ATOM 1092 H HA . LEU A1 1 72 ? -15.866 18.336 -18.398 1.0 22.23 72 A 8 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.879 16.853 -19.789 1.0 24.33 72 A 8 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.588 16.011 -18.268 1.0 64.44 72 A 8 -ATOM 1095 H HG . LEU A1 1 72 ? -16.953 14.919 -18.969 1.0 60.22 72 A 8 -ATOM 1096 H HD11 . LEU A1 1 72 ? -16.052 14.464 -21.566 1.0 22.12 72 A 8 -ATOM 1097 H HD12 . LEU A1 1 72 ? -15.959 16.211 -21.344 1.0 11.12 72 A 8 -ATOM 1098 H HD13 . LEU A1 1 72 ? -17.485 15.369 -21.075 1.0 74.11 72 A 8 -ATOM 1099 H HD21 . LEU A1 1 72 ? -15.481 13.093 -20.034 1.0 45.11 72 A 8 -ATOM 1100 H HD22 . LEU A1 1 72 ? -15.206 13.515 -18.344 1.0 64.51 72 A 8 -ATOM 1101 H HD23 . LEU A1 1 72 ? -14.128 14.137 -19.595 1.0 15.53 72 A 8 -ATOM 1102 N N . HIS A1 1 73 ? -17.91 17.977 -19.885 1.0 22.1 73 A 8 -ATOM 1103 C CA . HIS A1 1 73 ? -19.225 17.987 -20.517 1.0 43.22 73 A 8 -ATOM 1104 C C . HIS A1 1 73 ? -19.276 16.999 -21.679 1.0 1.12 73 A 8 -ATOM 1105 O O . HIS A1 1 73 ? -18.515 17.116 -22.64 1.0 41.41 73 A 8 -ATOM 1106 C CB . HIS A1 1 73 ? -19.566 19.393 -21.011 1.0 34.11 73 A 8 -ATOM 1107 C CG . HIS A1 1 73 ? -19.401 20.452 -19.966 1.0 25.31 73 A 8 -ATOM 1108 N ND1 . HIS A1 1 73 ? -19.119 21.768 -20.266 1.0 22.31 73 A 8 -ATOM 1109 C CD2 . HIS A1 1 73 ? -19.48 20.384 -18.616 1.0 30.12 73 A 8 -ATOM 1110 C CE1 . HIS A1 1 73 ? -19.031 22.464 -19.146 1.0 74.03 73 A 8 -ATOM 1111 N NE2 . HIS A1 1 73 ? -19.246 21.647 -18.13 1.0 22.32 73 A 8 -ATOM 1112 H H . HIS A1 1 73 ? -17.188 18.513 -20.276 1.0 41.1 73 A 8 -ATOM 1113 H HA . HIS A1 1 73 ? -19.951 17.689 -19.775 1.0 23.25 73 A 8 -ATOM 1114 H HB2 . HIS A1 1 73 ? -18.921 19.642 -21.841 1.0 51.13 73 A 8 -ATOM 1115 H HB3 . HIS A1 1 73 ? -20.594 19.411 -21.343 1.0 64.13 73 A 8 -ATOM 1116 H HD1 . HIS A1 1 73 ? -19.0 22.137 -21.165 1.0 63.31 73 A 8 -ATOM 1117 H HD2 . HIS A1 1 73 ? -19.689 19.501 -18.029 1.0 71.43 73 A 8 -ATOM 1118 H HE1 . HIS A1 1 73 ? -18.819 23.52 -19.073 1.0 3.34 73 A 8 -ATOM 1119 N N . LEU A1 1 74 ? -20.178 16.028 -21.584 1.0 31.4 74 A 8 -ATOM 1120 C CA . LEU A1 1 74 ? -20.328 15.019 -22.627 1.0 41.22 74 A 8 -ATOM 1121 C C . LEU A1 1 74 ? -21.638 15.211 -23.384 1.0 21.0 74 A 8 -ATOM 1122 O O . LEU A1 1 74 ? -22.721 15.108 -22.809 1.0 70.53 74 A 8 -ATOM 1123 C CB . LEU A1 1 74 ? -20.278 13.617 -22.018 1.0 42.32 74 A 8 -ATOM 1124 C CG . LEU A1 1 74 ? -20.749 12.476 -22.922 1.0 13.02 74 A 8 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.015 12.513 -24.253 1.0 50.12 74 A 8 -ATOM 1126 C CD2 . LEU A1 1 74 ? -20.545 11.134 -22.235 1.0 22.4 74 A 8 -ATOM 1127 H H . LEU A1 1 74 ? -20.756 15.987 -20.794 1.0 53.04 74 A 8 -ATOM 1128 H HA . LEU A1 1 74 ? -19.506 15.133 -23.318 1.0 65.43 74 A 8 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.257 13.415 -21.736 1.0 22.02 74 A 8 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.901 13.618 -21.134 1.0 20.31 74 A 8 -ATOM 1131 H HG . LEU A1 1 74 ? -21.805 12.595 -23.12 1.0 34.12 74 A 8 -ATOM 1132 H HD11 . LEU A1 1 74 ? -19.014 12.887 -24.102 1.0 33.01 74 A 8 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.543 13.161 -24.937 1.0 1.34 74 A 8 -ATOM 1134 H HD13 . LEU A1 1 74 ? -19.969 11.516 -24.666 1.0 63.14 74 A 8 -ATOM 1135 H HD21 . LEU A1 1 74 ? -21.057 11.134 -21.284 1.0 12.32 74 A 8 -ATOM 1136 H HD22 . LEU A1 1 74 ? -19.49 10.968 -22.076 1.0 54.43 74 A 8 -ATOM 1137 H HD23 . LEU A1 1 74 ? -20.943 10.346 -22.859 1.0 14.02 74 A 8 -ATOM 1138 N N . VAL A1 1 75 ? -21.531 15.489 -24.68 1.0 43.5 75 A 8 -ATOM 1139 C CA . VAL A1 1 75 ? -22.707 15.691 -25.518 1.0 52.32 75 A 8 -ATOM 1140 C C . VAL A1 1 75 ? -22.857 14.566 -26.535 1.0 61.15 75 A 8 -ATOM 1141 O O . VAL A1 1 75 ? -21.882 14.138 -27.153 1.0 54.31 75 A 8 -ATOM 1142 C CB . VAL A1 1 75 ? -22.639 17.037 -26.264 1.0 24.5 75 A 8 -ATOM 1143 C CG1 . VAL A1 1 75 ? -22.725 18.197 -25.284 1.0 55.3 75 A 8 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.366 17.123 -27.093 1.0 64.14 75 A 8 -ATOM 1145 H H . VAL A1 1 75 ? -20.64 15.558 -25.082 1.0 70.11 75 A 8 -ATOM 1146 H HA . VAL A1 1 75 ? -23.576 15.703 -24.877 1.0 60.52 75 A 8 -ATOM 1147 H HB . VAL A1 1 75 ? -23.484 17.098 -26.934 1.0 44.41 75 A 8 -ATOM 1148 H HG11 . VAL A1 1 75 ? -21.939 18.105 -24.548 1.0 31.54 75 A 8 -ATOM 1149 H HG12 . VAL A1 1 75 ? -22.614 19.129 -25.817 1.0 61.34 75 A 8 -ATOM 1150 H HG13 . VAL A1 1 75 ? -23.684 18.178 -24.788 1.0 54.52 75 A 8 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.304 18.095 -27.558 1.0 5.24 75 A 8 -ATOM 1152 H HG22 . VAL A1 1 75 ? -20.51 16.973 -26.453 1.0 61.35 75 A 8 -ATOM 1153 H HG23 . VAL A1 1 75 ? -21.382 16.359 -27.857 1.0 24.43 75 A 8 -ATOM 1154 N N . LEU A1 1 76 ? -24.086 14.09 -26.705 1.0 35.1 76 A 8 -ATOM 1155 C CA . LEU A1 1 76 ? -24.366 13.013 -27.649 1.0 22.53 76 A 8 -ATOM 1156 C C . LEU A1 1 76 ? -25.433 13.434 -28.654 1.0 2.14 76 A 8 -ATOM 1157 O O . LEU A1 1 76 ? -26.432 14.056 -28.291 1.0 21.5 76 A 8 -ATOM 1158 C CB . LEU A1 1 76 ? -24.82 11.758 -26.901 1.0 73.12 76 A 8 -ATOM 1159 C CG . LEU A1 1 76 ? -24.572 11.75 -25.392 1.0 64.45 76 A 8 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.713 12.441 -24.66 1.0 24.13 76 A 8 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.399 10.325 -24.888 1.0 22.03 76 A 8 -ATOM 1162 H H . LEU A1 1 76 ? -24.823 14.471 -26.184 1.0 44.32 76 A 8 -ATOM 1163 H HA . LEU A1 1 76 ? -23.453 12.794 -28.182 1.0 53.04 76 A 8 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.881 11.643 -27.062 1.0 71.31 76 A 8 -ATOM 1165 H HB3 . LEU A1 1 76 ? -24.298 10.913 -27.328 1.0 62.14 76 A 8 -ATOM 1166 H HG . LEU A1 1 76 ? -23.662 12.294 -25.18 1.0 42.11 76 A 8 -ATOM 1167 H HD11 . LEU A1 1 76 ? -26.645 12.224 -25.16 1.0 12.14 76 A 8 -ATOM 1168 H HD12 . LEU A1 1 76 ? -25.545 13.507 -24.658 1.0 23.21 76 A 8 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.757 12.081 -23.642 1.0 40.2 76 A 8 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.644 10.305 -24.116 1.0 53.24 76 A 8 -ATOM 1171 H HD22 . LEU A1 1 76 ? -24.093 9.689 -25.706 1.0 72.02 76 A 8 -ATOM 1172 H HD23 . LEU A1 1 76 ? -25.336 9.968 -24.486 1.0 63.4 76 A 8 -ATOM 1173 N N . ARG A1 1 77 ? -25.216 13.089 -29.919 1.0 50.44 77 A 8 -ATOM 1174 C CA . ARG A1 1 77 ? -26.159 13.43 -30.977 1.0 12.4 77 A 8 -ATOM 1175 C C . ARG A1 1 77 ? -26.994 12.216 -31.373 1.0 10.32 77 A 8 -ATOM 1176 O O . ARG A1 1 77 ? -27.248 11.982 -32.555 1.0 12.43 77 A 8 -ATOM 1177 C CB . ARG A1 1 77 ? -25.415 13.971 -32.199 1.0 55.35 77 A 8 -ATOM 1178 C CG . ARG A1 1 77 ? -24.853 15.369 -32.0 1.0 12.22 77 A 8 -ATOM 1179 C CD . ARG A1 1 77 ? -23.388 15.329 -31.594 1.0 60.22 77 A 8 -ATOM 1180 N NE . ARG A1 1 77 ? -22.694 16.569 -31.929 1.0 64.33 77 A 8 -ATOM 1181 C CZ . ARG A1 1 77 ? -21.376 16.719 -31.847 1.0 13.31 77 A 8 -ATOM 1182 N NH1 . ARG A1 1 77 ? -20.615 15.711 -31.444 1.0 63.3 77 A 8 -ATOM 1183 N NH2 . ARG A1 1 77 ? -20.818 17.879 -32.169 1.0 70.54 77 A 8 -ATOM 1184 H H . ARG A1 1 77 ? -24.401 12.594 -30.147 1.0 2.41 77 A 8 -ATOM 1185 H HA . ARG A1 1 77 ? -26.818 14.197 -30.599 1.0 53.23 77 A 8 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.594 13.307 -32.429 1.0 41.04 77 A 8 -ATOM 1187 H HB3 . ARG A1 1 77 ? -26.094 13.994 -33.038 1.0 23.23 77 A 8 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.944 15.918 -32.926 1.0 3.21 77 A 8 -ATOM 1189 H HG3 . ARG A1 1 77 ? -25.419 15.867 -31.227 1.0 45.32 77 A 8 -ATOM 1190 H HD2 . ARG A1 1 77 ? -23.328 15.171 -30.528 1.0 24.22 77 A 8 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.909 14.509 -32.107 1.0 55.12 77 A 8 -ATOM 1192 H HE . ARG A1 1 77 ? -23.237 17.327 -32.229 1.0 41.44 77 A 8 -ATOM 1193 H HH11 . ARG A1 1 77 ? -21.033 14.836 -31.202 1.0 31.24 77 A 8 -ATOM 1194 H HH12 . ARG A1 1 77 ? -19.623 15.826 -31.384 1.0 72.5 77 A 8 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.388 18.641 -32.474 1.0 71.34 77 A 8 -ATOM 1196 H HH22 . ARG A1 1 77 ? -19.826 17.99 -32.107 1.0 1.44 77 A 8 -ATOM 1197 N N . LEU A1 1 78 ? -27.418 11.445 -30.377 1.0 31.03 78 A 8 -ATOM 1198 C CA . LEU A1 1 78 ? -28.224 10.254 -30.62 1.0 51.32 78 A 8 -ATOM 1199 C C . LEU A1 1 78 ? -29.516 10.611 -31.348 1.0 14.11 78 A 8 -ATOM 1200 O O . LEU A1 1 78 ? -29.887 9.964 -32.328 1.0 12.31 78 A 8 -ATOM 1201 C CB . LEU A1 1 78 ? -28.546 9.553 -29.299 1.0 42.51 78 A 8 -ATOM 1202 C CG . LEU A1 1 78 ? -27.626 8.394 -28.913 1.0 51.45 78 A 8 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.376 8.913 -28.219 1.0 14.44 78 A 8 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.362 7.405 -28.02 1.0 25.32 78 A 8 -ATOM 1205 H H . LEU A1 1 78 ? -27.183 11.682 -29.456 1.0 75.31 78 A 8 -ATOM 1206 H HA . LEU A1 1 78 ? -27.647 9.585 -31.242 1.0 64.2 78 A 8 -ATOM 1207 H HB2 . LEU A1 1 78 ? -28.496 10.291 -28.513 1.0 61.14 78 A 8 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.554 9.169 -29.367 1.0 62.32 78 A 8 -ATOM 1209 H HG . LEU A1 1 78 ? -27.318 7.873 -29.809 1.0 53.42 78 A 8 -ATOM 1210 H HD11 . LEU A1 1 78 ? -26.032 8.182 -27.504 1.0 3.24 78 A 8 -ATOM 1211 H HD12 . LEU A1 1 78 ? -26.605 9.837 -27.708 1.0 74.14 78 A 8 -ATOM 1212 H HD13 . LEU A1 1 78 ? -25.605 9.091 -28.954 1.0 11.41 78 A 8 -ATOM 1213 H HD21 . LEU A1 1 78 ? -27.689 7.037 -27.26 1.0 65.32 78 A 8 -ATOM 1214 H HD22 . LEU A1 1 78 ? -28.717 6.578 -28.617 1.0 65.43 78 A 8 -ATOM 1215 H HD23 . LEU A1 1 78 ? -29.201 7.898 -27.552 1.0 34.04 78 A 8 -ATOM 1216 N N . ARG A1 1 79 ? -30.196 11.645 -30.864 1.0 44.5 79 A 8 -ATOM 1217 C CA . ARG A1 1 79 ? -31.446 12.088 -31.469 1.0 54.44 79 A 8 -ATOM 1218 C C . ARG A1 1 79 ? -32.553 11.062 -31.245 1.0 43.43 79 A 8 -ATOM 1219 O O . ARG A1 1 79 ? -33.433 11.258 -30.408 1.0 24.23 79 A 8 -ATOM 1220 C CB . ARG A1 1 79 ? -31.255 12.328 -32.968 1.0 53.1 79 A 8 -ATOM 1221 C CG . ARG A1 1 79 ? -31.417 13.783 -33.378 1.0 62.42 79 A 8 -ATOM 1222 C CD . ARG A1 1 79 ? -32.87 14.119 -33.676 1.0 15.2 79 A 8 -ATOM 1223 N NE . ARG A1 1 79 ? -33.02 15.466 -34.219 1.0 22.21 79 A 8 -ATOM 1224 C CZ . ARG A1 1 79 ? -34.084 15.868 -34.904 1.0 43.33 79 A 8 -ATOM 1225 N NH1 . ARG A1 1 79 ? -35.087 15.03 -35.128 1.0 51.34 79 A 8 -ATOM 1226 N NH2 . ARG A1 1 79 ? -34.147 17.11 -35.366 1.0 24.34 79 A 8 -ATOM 1227 H H . ARG A1 1 79 ? -29.849 12.121 -30.081 1.0 30.43 79 A 8 -ATOM 1228 H HA . ARG A1 1 79 ? -31.731 13.017 -30.999 1.0 75.12 79 A 8 -ATOM 1229 H HB2 . ARG A1 1 79 ? -30.262 12.007 -33.249 1.0 72.51 79 A 8 -ATOM 1230 H HB3 . ARG A1 1 79 ? -31.981 11.741 -33.51 1.0 62.3 79 A 8 -ATOM 1231 H HG2 . ARG A1 1 79 ? -31.071 14.414 -32.574 1.0 34.21 79 A 8 -ATOM 1232 H HG3 . ARG A1 1 79 ? -30.825 13.966 -34.263 1.0 51.44 79 A 8 -ATOM 1233 H HD2 . ARG A1 1 79 ? -33.25 13.407 -34.393 1.0 21.42 79 A 8 -ATOM 1234 H HD3 . ARG A1 1 79 ? -33.437 14.044 -32.76 1.0 24.22 79 A 8 -ATOM 1235 H HE . ARG A1 1 79 ? -32.29 16.101 -34.065 1.0 63.2 79 A 8 -ATOM 1236 H HH11 . ARG A1 1 79 ? -35.043 14.094 -34.78 1.0 0.03 79 A 8 -ATOM 1237 H HH12 . ARG A1 1 79 ? -35.889 15.336 -35.643 1.0 54.33 79 A 8 -ATOM 1238 H HH21 . ARG A1 1 79 ? -33.393 17.745 -35.199 1.0 72.3 79 A 8 -ATOM 1239 H HH22 . ARG A1 1 79 ? -34.949 17.412 -35.882 1.0 2.44 79 A 8 -ATOM 1240 N N . GLY A1 1 80 ? -32.5 9.968 -31.998 1.0 11.03 80 A 8 -ATOM 1241 C CA . GLY A1 1 80 ? -33.504 8.928 -31.866 1.0 3.12 80 A 8 -ATOM 1242 C C . GLY A1 1 80 ? -33.158 7.684 -32.66 1.0 52.34 80 A 8 -ATOM 1243 O O . GLY A1 1 80 ? -33.717 7.446 -33.73 1.0 43.44 80 A 8 -ATOM 1244 H H . GLY A1 1 80 ? -31.775 9.866 -32.649 1.0 0.24 80 A 8 -ATOM 1245 H HA2 . GLY A1 1 80 ? -33.597 8.663 -30.824 1.0 71.24 80 A 8 -ATOM 1246 H HA3 . GLY A1 1 80 ? -34.451 9.312 -32.216 1.0 43.14 80 A 8 -ATOM 1247 N N . GLY A1 1 81 ? -32.23 6.889 -32.136 1.0 43.34 81 A 8 -ATOM 1248 C CA . GLY A1 1 81 ? -31.824 5.673 -32.817 1.0 20.2 81 A 8 -ATOM 1249 C C . GLY A1 1 81 ? -30.48 5.814 -33.504 1.0 63.23 81 A 8 -ATOM 1250 O O . GLY A1 1 81 ? -29.743 6.767 -33.251 1.0 30.24 81 A 8 -ATOM 1251 H H . GLY A1 1 81 ? -31.818 7.129 -31.28 1.0 11.33 81 A 8 -ATOM 1252 H HA2 . GLY A1 1 81 ? -31.766 4.872 -32.096 1.0 30.51 81 A 8 -ATOM 1253 H HA3 . GLY A1 1 81 ? -32.569 5.424 -33.558 1.0 55.14 81 A 8 -ATOM 1254 N N . VAL A1 1 82 ? -30.159 4.863 -34.375 1.0 30.52 82 A 8 -ATOM 1255 C CA . VAL A1 1 82 ? -28.894 4.885 -35.099 1.0 4.45 82 A 8 -ATOM 1256 C C . VAL A1 1 82 ? -29.119 4.746 -36.601 1.0 63.52 82 A 8 -ATOM 1257 O O . VAL A1 1 82 ? -28.817 5.657 -37.371 1.0 12.52 82 A 8 -ATOM 1258 C CB . VAL A1 1 82 ? -27.956 3.759 -34.626 1.0 53.54 82 A 8 -ATOM 1259 C CG1 . VAL A1 1 82 ? -28.554 2.397 -34.943 1.0 33.31 82 A 8 -ATOM 1260 C CG2 . VAL A1 1 82 ? -26.582 3.909 -35.26 1.0 1.13 82 A 8 -ATOM 1261 H H . VAL A1 1 82 ? -30.789 4.129 -34.534 1.0 42.11 82 A 8 -ATOM 1262 H HA . VAL A1 1 82 ? -28.413 5.832 -34.903 1.0 65.12 82 A 8 -ATOM 1263 H HB . VAL A1 1 82 ? -27.845 3.837 -33.554 1.0 3.02 82 A 8 -ATOM 1264 H HG11 . VAL A1 1 82 ? -28.322 2.132 -35.965 1.0 71.54 82 A 8 -ATOM 1265 H HG12 . VAL A1 1 82 ? -28.139 1.656 -34.275 1.0 43.52 82 A 8 -ATOM 1266 H HG13 . VAL A1 1 82 ? -29.626 2.436 -34.817 1.0 60.31 82 A 8 -ATOM 1267 H HG21 . VAL A1 1 82 ? -26.663 4.499 -36.16 1.0 51.1 82 A 8 -ATOM 1268 H HG22 . VAL A1 1 82 ? -25.917 4.4 -34.565 1.0 43.42 82 A 8 -ATOM 1269 H HG23 . VAL A1 1 82 ? -26.189 2.932 -35.505 1.0 61.21 82 A 8 -ATOM 1 N N . GLY A1 1 1 ? 1.791 -0.636 -0.883 1.0 13.0 1 A 9 -ATOM 2 C CA . GLY A1 1 1 ? 0.525 0.057 -1.032 1.0 45.03 1 A 9 -ATOM 3 C C . GLY A1 1 1 ? 0.514 0.995 -2.223 1.0 65.21 1 A 9 -ATOM 4 O O . GLY A1 1 1 ? 0.457 2.216 -2.078 1.0 33.34 1 A 9 -ATOM 5 H H1 . GLY A1 1 1 ? 2.271 -0.598 -0.029 1.0 52.4 1 A 9 -ATOM 6 H HA2 . GLY A1 1 1 ? -0.26 -0.674 -1.155 1.0 14.15 1 A 9 -ATOM 7 H HA3 . GLY A1 1 1 ? 0.333 0.629 -0.136 1.0 34.23 1 A 9 -ATOM 8 N N . PRO A1 1 2 ? 0.571 0.42 -3.434 1.0 55.32 2 A 9 -ATOM 9 C CA . PRO A1 1 2 ? 0.57 1.195 -4.678 1.0 21.43 2 A 9 -ATOM 10 C C . PRO A1 1 2 ? -0.777 1.858 -4.947 1.0 41.45 2 A 9 -ATOM 11 O O . PRO A1 1 2 ? -1.824 1.343 -4.552 1.0 62.42 2 A 9 -ATOM 12 C CB . PRO A1 1 2 ? 0.873 0.145 -5.75 1.0 51.45 2 A 9 -ATOM 13 C CG . PRO A1 1 2 ? 0.406 -1.142 -5.163 1.0 43.11 2 A 9 -ATOM 14 C CD . PRO A1 1 2 ? 0.64 -1.03 -3.681 1.0 64.14 2 A 9 -ATOM 15 H HA . PRO A1 1 2 ? 1.345 1.947 -4.678 1.0 31.54 2 A 9 -ATOM 16 H HB2 . PRO A1 1 2 ? 0.334 0.386 -6.656 1.0 42.4 2 A 9 -ATOM 17 H HB3 . PRO A1 1 2 ? 1.934 0.126 -5.95 1.0 62.54 2 A 9 -ATOM 18 H HG2 . PRO A1 1 2 ? -0.645 -1.279 -5.367 1.0 3.22 2 A 9 -ATOM 19 H HG3 . PRO A1 1 2 ? 0.98 -1.961 -5.571 1.0 51.14 2 A 9 -ATOM 20 H HD2 . PRO A1 1 2 ? -0.133 -1.551 -3.137 1.0 11.0 2 A 9 -ATOM 21 H HD3 . PRO A1 1 2 ? 1.614 -1.418 -3.423 1.0 24.12 2 A 9 -ATOM 22 N N . LEU A1 1 3 ? -0.744 3.001 -5.622 1.0 34.12 3 A 9 -ATOM 23 C CA . LEU A1 1 3 ? -1.964 3.734 -5.945 1.0 54.03 3 A 9 -ATOM 24 C C . LEU A1 1 3 ? -1.856 4.392 -7.317 1.0 63.21 3 A 9 -ATOM 25 O O . LEU A1 1 3 ? -0.824 4.304 -7.98 1.0 11.24 3 A 9 -ATOM 26 C CB . LEU A1 1 3 ? -2.242 4.795 -4.879 1.0 60.12 3 A 9 -ATOM 27 C CG . LEU A1 1 3 ? -1.111 5.789 -4.61 1.0 64.13 3 A 9 -ATOM 28 C CD1 . LEU A1 1 3 ? -1.589 7.215 -4.834 1.0 62.25 3 A 9 -ATOM 29 C CD2 . LEU A1 1 3 ? -0.578 5.619 -3.195 1.0 0.12 3 A 9 -ATOM 30 H H . LEU A1 1 3 ? 0.119 3.362 -5.911 1.0 52.35 3 A 9 -ATOM 31 H HA . LEU A1 1 3 ? -2.78 3.028 -5.961 1.0 43.13 3 A 9 -ATOM 32 H HB2 . LEU A1 1 3 ? -3.109 5.358 -5.19 1.0 74.24 3 A 9 -ATOM 33 H HB3 . LEU A1 1 3 ? -2.461 4.283 -3.953 1.0 72.41 3 A 9 -ATOM 34 H HG . LEU A1 1 3 ? -0.3 5.597 -5.299 1.0 43.5 3 A 9 -ATOM 35 H HD11 . LEU A1 1 3 ? -0.746 7.888 -4.794 1.0 50.45 3 A 9 -ATOM 36 H HD12 . LEU A1 1 3 ? -2.299 7.482 -4.065 1.0 4.34 3 A 9 -ATOM 37 H HD13 . LEU A1 1 3 ? -2.064 7.288 -5.801 1.0 54.42 3 A 9 -ATOM 38 H HD21 . LEU A1 1 3 ? 0.022 6.478 -2.931 1.0 23.33 3 A 9 -ATOM 39 H HD22 . LEU A1 1 3 ? 0.028 4.727 -3.143 1.0 1.01 3 A 9 -ATOM 40 H HD23 . LEU A1 1 3 ? -1.406 5.532 -2.506 1.0 75.24 3 A 9 -ATOM 41 N N . GLY A1 1 4 ? -2.93 5.054 -7.736 1.0 4.21 4 A 9 -ATOM 42 C CA . GLY A1 1 4 ? -2.936 5.719 -9.026 1.0 43.34 4 A 9 -ATOM 43 C C . GLY A1 1 4 ? -4.322 5.792 -9.636 1.0 32.24 4 A 9 -ATOM 44 O O . GLY A1 1 4 ? -4.716 6.825 -10.176 1.0 73.31 4 A 9 -ATOM 45 H H . GLY A1 1 4 ? -3.726 5.091 -7.165 1.0 2.13 4 A 9 -ATOM 46 H HA2 . GLY A1 1 4 ? -2.555 6.722 -8.904 1.0 53.5 4 A 9 -ATOM 47 H HA3 . GLY A1 1 4 ? -2.287 5.178 -9.7 1.0 61.41 4 A 9 -ATOM 48 N N . SER A1 1 5 ? -5.062 4.691 -9.552 1.0 14.33 5 A 9 -ATOM 49 C CA . SER A1 1 5 ? -6.41 4.632 -10.104 1.0 12.42 5 A 9 -ATOM 50 C C . SER A1 1 5 ? -7.245 5.816 -9.627 1.0 43.22 5 A 9 -ATOM 51 O O . SER A1 1 5 ? -6.952 6.42 -8.595 1.0 33.52 5 A 9 -ATOM 52 C CB . SER A1 1 5 ? -7.09 3.32 -9.707 1.0 72.02 5 A 9 -ATOM 53 O OG . SER A1 1 5 ? -6.341 2.202 -10.151 1.0 21.35 5 A 9 -ATOM 54 H H . SER A1 1 5 ? -4.691 3.898 -9.109 1.0 31.12 5 A 9 -ATOM 55 H HA . SER A1 1 5 ? -6.329 4.674 -11.18 1.0 12.32 5 A 9 -ATOM 56 H HB2 . SER A1 1 5 ? -7.178 3.275 -8.632 1.0 41.01 5 A 9 -ATOM 57 H HB3 . SER A1 1 5 ? -8.074 3.279 -10.151 1.0 74.13 5 A 9 -ATOM 58 H HG . SER A1 1 5 ? -6.341 1.526 -9.47 1.0 33.45 5 A 9 -ATOM 59 N N . MET A1 1 6 ? -8.286 6.142 -10.386 1.0 14.01 6 A 9 -ATOM 60 C CA . MET A1 1 6 ? -9.165 7.253 -10.04 1.0 54.33 6 A 9 -ATOM 61 C C . MET A1 1 6 ? -10.487 7.156 -10.796 1.0 31.44 6 A 9 -ATOM 62 O O . MET A1 1 6 ? -10.782 6.136 -11.418 1.0 1.11 6 A 9 -ATOM 63 C CB . MET A1 1 6 ? -8.483 8.587 -10.352 1.0 70.21 6 A 9 -ATOM 64 C CG . MET A1 1 6 ? -8.089 8.741 -11.812 1.0 25.05 6 A 9 -ATOM 65 S SD . MET A1 1 6 ? -6.463 9.493 -12.016 1.0 3.44 6 A 9 -ATOM 66 C CE . MET A1 1 6 ? -5.55 8.133 -12.741 1.0 13.21 6 A 9 -ATOM 67 H H . MET A1 1 6 ? -8.469 5.623 -11.197 1.0 2.32 6 A 9 -ATOM 68 H HA . MET A1 1 6 ? -9.365 7.2 -8.981 1.0 5.22 6 A 9 -ATOM 69 H HB2 . MET A1 1 6 ? -9.157 9.39 -10.096 1.0 62.43 6 A 9 -ATOM 70 H HB3 . MET A1 1 6 ? -7.591 8.671 -9.75 1.0 63.34 6 A 9 -ATOM 71 H HG2 . MET A1 1 6 ? -8.079 7.765 -12.274 1.0 33.13 6 A 9 -ATOM 72 H HG3 . MET A1 1 6 ? -8.822 9.363 -12.304 1.0 12.41 6 A 9 -ATOM 73 H HE1 . MET A1 1 6 ? -4.648 7.961 -12.173 1.0 12.23 6 A 9 -ATOM 74 H HE2 . MET A1 1 6 ? -6.16 7.241 -12.726 1.0 52.54 6 A 9 -ATOM 75 H HE3 . MET A1 1 6 ? -5.293 8.376 -13.761 1.0 2.41 6 A 9 -ATOM 76 N N . GLN A1 1 7 ? -11.278 8.222 -10.735 1.0 13.12 7 A 9 -ATOM 77 C CA . GLN A1 1 7 ? -12.568 8.255 -11.413 1.0 13.2 7 A 9 -ATOM 78 C C . GLN A1 1 7 ? -12.823 9.625 -12.032 1.0 42.42 7 A 9 -ATOM 79 O O . GLN A1 1 7 ? -12.23 10.623 -11.62 1.0 71.33 7 A 9 -ATOM 80 C CB . GLN A1 1 7 ? -13.691 7.907 -10.434 1.0 42.01 7 A 9 -ATOM 81 C CG . GLN A1 1 7 ? -13.365 6.732 -9.527 1.0 12.34 7 A 9 -ATOM 82 C CD . GLN A1 1 7 ? -12.835 7.168 -8.175 1.0 44.31 7 A 9 -ATOM 83 O OE1 . GLN A1 1 7 ? -12.662 8.359 -7.918 1.0 33.44 7 A 9 -ATOM 84 N NE2 . GLN A1 1 7 ? -12.573 6.202 -7.302 1.0 73.32 7 A 9 -ATOM 85 H H . GLN A1 1 7 ? -10.987 9.005 -10.223 1.0 71.21 7 A 9 -ATOM 86 H HA . GLN A1 1 7 ? -12.548 7.517 -12.2 1.0 62.03 7 A 9 -ATOM 87 H HB2 . GLN A1 1 7 ? -13.892 8.768 -9.814 1.0 13.25 7 A 9 -ATOM 88 H HB3 . GLN A1 1 7 ? -14.58 7.664 -10.997 1.0 41.42 7 A 9 -ATOM 89 H HG2 . GLN A1 1 7 ? -14.263 6.152 -9.374 1.0 43.33 7 A 9 -ATOM 90 H HG3 . GLN A1 1 7 ? -12.619 6.118 -10.01 1.0 33.21 7 A 9 -ATOM 91 H HE21 . GLN A1 1 7 ? -12.734 5.274 -7.577 1.0 52.01 7 A 9 -ATOM 92 H HE22 . GLN A1 1 7 ? -12.229 6.455 -6.422 1.0 55.43 7 A 9 -ATOM 93 N N . ILE A1 1 8 ? -13.708 9.666 -13.022 1.0 12.12 8 A 9 -ATOM 94 C CA . ILE A1 1 8 ? -14.042 10.915 -13.697 1.0 64.2 8 A 9 -ATOM 95 C C . ILE A1 1 8 ? -15.552 11.119 -13.761 1.0 0.33 8 A 9 -ATOM 96 O O . ILE A1 1 8 ? -16.324 10.177 -13.581 1.0 11.35 8 A 9 -ATOM 97 C CB . ILE A1 1 8 ? -13.469 10.953 -15.126 1.0 65.34 8 A 9 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.683 9.673 -15.418 1.0 72.33 8 A 9 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.585 12.177 -15.31 1.0 55.24 8 A 9 -ATOM 100 C CD1 . ILE A1 1 8 ? -12.249 9.546 -16.862 1.0 11.02 8 A 9 -ATOM 101 H H . ILE A1 1 8 ? -14.148 8.838 -13.305 1.0 43.45 8 A 9 -ATOM 102 H HA . ILE A1 1 8 ? -13.603 11.725 -13.133 1.0 41.41 8 A 9 -ATOM 103 H HB . ILE A1 1 8 ? -14.293 11.027 -15.819 1.0 13.24 8 A 9 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.798 9.653 -14.803 1.0 4.11 8 A 9 -ATOM 105 H HG13 . ILE A1 1 8 ? -13.301 8.818 -15.181 1.0 33.41 8 A 9 -ATOM 106 H HG21 . ILE A1 1 8 ? -13.202 13.04 -15.51 1.0 12.11 8 A 9 -ATOM 107 H HG22 . ILE A1 1 8 ? -12.013 12.346 -14.41 1.0 14.43 8 A 9 -ATOM 108 H HG23 . ILE A1 1 8 ? -11.912 12.015 -16.139 1.0 53.13 8 A 9 -ATOM 109 H HD11 . ILE A1 1 8 ? -11.186 9.355 -16.902 1.0 4.51 8 A 9 -ATOM 110 H HD12 . ILE A1 1 8 ? -12.779 8.728 -17.327 1.0 22.53 8 A 9 -ATOM 111 H HD13 . ILE A1 1 8 ? -12.469 10.464 -17.386 1.0 32.23 8 A 9 -ATOM 112 N N . PHE A1 1 9 ? -15.966 12.354 -14.021 1.0 44.42 9 A 9 -ATOM 113 C CA . PHE A1 1 9 ? -17.384 12.683 -14.11 1.0 45.42 9 A 9 -ATOM 114 C C . PHE A1 1 9 ? -17.747 13.145 -15.517 1.0 62.05 9 A 9 -ATOM 115 O O . PHE A1 1 9 ? -17.135 14.066 -16.058 1.0 33.13 9 A 9 -ATOM 116 C CB . PHE A1 1 9 ? -17.742 13.77 -13.095 1.0 42.3 9 A 9 -ATOM 117 C CG . PHE A1 1 9 ? -18.493 13.253 -11.901 1.0 44.44 9 A 9 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.757 12.705 -12.046 1.0 24.21 9 A 9 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.934 13.313 -10.635 1.0 24.11 9 A 9 -ATOM 120 C CE1 . PHE A1 1 9 ? -20.451 12.229 -10.949 1.0 54.33 9 A 9 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.622 12.838 -9.534 1.0 62.43 9 A 9 -ATOM 122 C CZ . PHE A1 1 9 ? -19.882 12.294 -9.692 1.0 72.21 9 A 9 -ATOM 123 H H . PHE A1 1 9 ? -15.301 13.063 -14.155 1.0 15.35 9 A 9 -ATOM 124 H HA . PHE A1 1 9 ? -17.945 11.79 -13.881 1.0 72.15 9 A 9 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.834 14.234 -12.739 1.0 13.22 9 A 9 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.356 14.515 -13.578 1.0 20.44 9 A 9 -ATOM 127 H HD1 . PHE A1 1 9 ? -20.203 12.652 -13.029 1.0 63.23 9 A 9 -ATOM 128 H HD2 . PHE A1 1 9 ? -16.948 13.738 -10.51 1.0 43.5 9 A 9 -ATOM 129 H HE1 . PHE A1 1 9 ? -21.435 11.804 -11.075 1.0 53.21 9 A 9 -ATOM 130 H HE2 . PHE A1 1 9 ? -18.175 12.891 -8.553 1.0 61.25 9 A 9 -ATOM 131 H HZ . PHE A1 1 9 ? -20.422 11.923 -8.834 1.0 11.33 9 A 9 -ATOM 132 N N . VAL A1 1 10 ? -18.749 12.499 -16.106 1.0 35.51 10 A 9 -ATOM 133 C CA . VAL A1 1 10 ? -19.196 12.843 -17.45 1.0 51.35 10 A 9 -ATOM 134 C C . VAL A1 1 10 ? -20.636 13.343 -17.44 1.0 20.3 10 A 9 -ATOM 135 O O . VAL A1 1 10 ? -21.52 12.713 -16.858 1.0 33.54 10 A 9 -ATOM 136 C CB . VAL A1 1 10 ? -19.089 11.638 -18.403 1.0 1.24 10 A 9 -ATOM 137 C CG1 . VAL A1 1 10 ? -19.041 12.103 -19.85 1.0 43.55 10 A 9 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.868 10.797 -18.063 1.0 70.41 10 A 9 -ATOM 139 H H . VAL A1 1 10 ? -19.199 11.774 -15.624 1.0 13.11 10 A 9 -ATOM 140 H HA . VAL A1 1 10 ? -18.555 13.629 -17.824 1.0 52.2 10 A 9 -ATOM 141 H HB . VAL A1 1 10 ? -19.969 11.025 -18.275 1.0 21.21 10 A 9 -ATOM 142 H HG11 . VAL A1 1 10 ? -18.478 13.023 -19.913 1.0 75.22 10 A 9 -ATOM 143 H HG12 . VAL A1 1 10 ? -18.565 11.346 -20.457 1.0 54.41 10 A 9 -ATOM 144 H HG13 . VAL A1 1 10 ? -20.046 12.272 -20.208 1.0 61.31 10 A 9 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.026 11.445 -17.872 1.0 13.24 10 A 9 -ATOM 146 H HG22 . VAL A1 1 10 ? -18.074 10.203 -17.185 1.0 62.44 10 A 9 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.638 10.144 -18.893 1.0 2.35 10 A 9 -ATOM 148 N N . LYS A1 1 11 ? -20.867 14.48 -18.087 1.0 23.3 11 A 9 -ATOM 149 C CA . LYS A1 1 11 ? -22.2 15.066 -18.155 1.0 10.31 11 A 9 -ATOM 150 C C . LYS A1 1 11 ? -22.787 14.921 -19.555 1.0 22.12 11 A 9 -ATOM 151 O O . LYS A1 1 11 ? -22.294 15.52 -20.512 1.0 63.21 11 A 9 -ATOM 152 C CB . LYS A1 1 11 ? -22.151 16.544 -17.761 1.0 34.41 11 A 9 -ATOM 153 C CG . LYS A1 1 11 ? -23.425 17.304 -18.09 1.0 63.11 11 A 9 -ATOM 154 C CD . LYS A1 1 11 ? -23.327 18.762 -17.675 1.0 3.15 11 A 9 -ATOM 155 C CE . LYS A1 1 11 ? -22.891 19.643 -18.836 1.0 2.52 11 A 9 -ATOM 156 N NZ . LYS A1 1 11 ? -22.898 21.087 -18.469 1.0 51.12 11 A 9 -ATOM 157 H H . LYS A1 1 11 ? -20.121 14.937 -18.531 1.0 4.15 11 A 9 -ATOM 158 H HA . LYS A1 1 11 ? -22.831 14.537 -17.456 1.0 44.21 11 A 9 -ATOM 159 H HB2 . LYS A1 1 11 ? -21.979 16.615 -16.697 1.0 75.01 11 A 9 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.331 17.016 -18.282 1.0 15.43 11 A 9 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.598 17.254 -19.154 1.0 73.24 11 A 9 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.252 16.845 -17.567 1.0 30.03 11 A 9 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.294 19.095 -17.329 1.0 63.51 11 A 9 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.606 18.852 -16.875 1.0 61.22 11 A 9 -ATOM 165 H HE2 . LYS A1 1 11 ? -21.892 19.36 -19.13 1.0 70.24 11 A 9 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.567 19.487 -19.663 1.0 3.13 11 A 9 -ATOM 167 H HZ1 . LYS A1 1 11 ? -22.82 21.194 -17.438 1.0 1.34 11 A 9 -ATOM 168 H HZ2 . LYS A1 1 11 ? -23.783 21.531 -18.788 1.0 61.44 11 A 9 -ATOM 169 H HZ3 . LYS A1 1 11 ? -22.097 21.574 -18.92 1.0 12.11 11 A 9 -ATOM 170 N N . THR A1 1 12 ? -23.845 14.124 -19.669 1.0 60.33 12 A 9 -ATOM 171 C CA . THR A1 1 12 ? -24.5 13.901 -20.952 1.0 63.11 12 A 9 -ATOM 172 C C . THR A1 1 12 ? -25.306 15.123 -21.377 1.0 63.2 12 A 9 -ATOM 173 O O . THR A1 1 12 ? -25.643 15.975 -20.554 1.0 23.14 12 A 9 -ATOM 174 C CB . THR A1 1 12 ? -25.433 12.677 -20.901 1.0 13.53 12 A 9 -ATOM 175 O OG1 . THR A1 1 12 ? -26.579 12.967 -20.094 1.0 44.22 12 A 9 -ATOM 176 C CG2 . THR A1 1 12 ? -24.705 11.464 -20.34 1.0 44.25 12 A 9 -ATOM 177 H H . THR A1 1 12 ? -24.192 13.674 -18.87 1.0 50.31 12 A 9 -ATOM 178 H HA . THR A1 1 12 ? -23.733 13.713 -21.689 1.0 15.31 12 A 9 -ATOM 179 H HB . THR A1 1 12 ? -25.758 12.449 -21.907 1.0 3.11 12 A 9 -ATOM 180 H HG1 . THR A1 1 12 ? -27.314 12.416 -20.371 1.0 54.01 12 A 9 -ATOM 181 H HG21 . THR A1 1 12 ? -24.326 11.696 -19.357 1.0 54.24 12 A 9 -ATOM 182 H HG22 . THR A1 1 12 ? -23.883 11.205 -20.991 1.0 51.32 12 A 9 -ATOM 183 H HG23 . THR A1 1 12 ? -25.39 10.632 -20.275 1.0 74.05 12 A 9 -ATOM 184 N N . LEU A1 1 13 ? -25.613 15.203 -22.667 1.0 74.21 13 A 9 -ATOM 185 C CA . LEU A1 1 13 ? -26.381 16.322 -23.203 1.0 74.52 13 A 9 -ATOM 186 C C . LEU A1 1 13 ? -27.742 16.423 -22.522 1.0 25.21 13 A 9 -ATOM 187 O O . LEU A1 1 13 ? -28.393 17.468 -22.561 1.0 11.35 13 A 9 -ATOM 188 C CB . LEU A1 1 13 ? -26.564 16.165 -24.713 1.0 31.51 13 A 9 -ATOM 189 C CG . LEU A1 1 13 ? -27.106 17.387 -25.455 1.0 30.32 13 A 9 -ATOM 190 C CD1 . LEU A1 1 13 ? -25.996 18.397 -25.702 1.0 44.31 13 A 9 -ATOM 191 C CD2 . LEU A1 1 13 ? -27.753 16.97 -26.768 1.0 64.01 13 A 9 -ATOM 192 H H . LEU A1 1 13 ? -25.316 14.495 -23.275 1.0 42.02 13 A 9 -ATOM 193 H HA . LEU A1 1 13 ? -25.827 17.228 -23.008 1.0 34.1 13 A 9 -ATOM 194 H HB2 . LEU A1 1 13 ? -25.603 15.919 -25.138 1.0 62.11 13 A 9 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.248 15.345 -24.879 1.0 43.21 13 A 9 -ATOM 196 H HG . LEU A1 1 13 ? -27.861 17.864 -24.845 1.0 45.4 13 A 9 -ATOM 197 H HD11 . LEU A1 1 13 ? -25.894 18.567 -26.763 1.0 62.23 13 A 9 -ATOM 198 H HD12 . LEU A1 1 13 ? -25.066 18.014 -25.308 1.0 23.44 13 A 9 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.239 19.327 -25.209 1.0 25.55 13 A 9 -ATOM 200 H HD21 . LEU A1 1 13 ? -28.784 16.703 -26.592 1.0 62.14 13 A 9 -ATOM 201 H HD22 . LEU A1 1 13 ? -27.224 16.121 -27.175 1.0 41.34 13 A 9 -ATOM 202 H HD23 . LEU A1 1 13 ? -27.708 17.792 -27.468 1.0 51.42 13 A 9 -ATOM 203 N N . THR A1 1 14 ? -28.168 15.33 -21.896 1.0 31.41 14 A 9 -ATOM 204 C CA . THR A1 1 14 ? -29.451 15.295 -21.206 1.0 30.33 14 A 9 -ATOM 205 C C . THR A1 1 14 ? -29.312 15.768 -19.763 1.0 22.13 14 A 9 -ATOM 206 O O . THR A1 1 14 ? -30.262 15.702 -18.984 1.0 5.31 14 A 9 -ATOM 207 C CB . THR A1 1 14 ? -30.055 13.878 -21.214 1.0 34.54 14 A 9 -ATOM 208 O OG1 . THR A1 1 14 ? -29.013 12.901 -21.111 1.0 3.22 14 A 9 -ATOM 209 C CG2 . THR A1 1 14 ? -30.857 13.639 -22.484 1.0 34.11 14 A 9 -ATOM 210 H H . THR A1 1 14 ? -27.604 14.528 -21.901 1.0 2.31 14 A 9 -ATOM 211 H HA . THR A1 1 14 ? -30.128 15.955 -21.728 1.0 25.44 14 A 9 -ATOM 212 H HB . THR A1 1 14 ? -30.715 13.78 -20.364 1.0 55.24 14 A 9 -ATOM 213 H HG1 . THR A1 1 14 ? -28.678 12.696 -21.987 1.0 24.42 14 A 9 -ATOM 214 H HG21 . THR A1 1 14 ? -31.545 12.822 -22.326 1.0 1.02 14 A 9 -ATOM 215 H HG22 . THR A1 1 14 ? -30.186 13.392 -23.293 1.0 12.23 14 A 9 -ATOM 216 H HG23 . THR A1 1 14 ? -31.41 14.532 -22.733 1.0 12.42 14 A 9 -ATOM 217 N N . GLY A1 1 15 ? -28.121 16.245 -19.414 1.0 61.2 15 A 9 -ATOM 218 C CA . GLY A1 1 15 ? -27.881 16.723 -18.065 1.0 25.44 15 A 9 -ATOM 219 C C . GLY A1 1 15 ? -27.848 15.598 -17.049 1.0 2.34 15 A 9 -ATOM 220 O O . GLY A1 1 15 ? -28.591 15.616 -16.067 1.0 24.03 15 A 9 -ATOM 221 H H . GLY A1 1 15 ? -27.4 16.273 -20.077 1.0 73.22 15 A 9 -ATOM 222 H HA2 . GLY A1 1 15 ? -26.934 17.242 -18.042 1.0 10.15 15 A 9 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.666 17.413 -17.794 1.0 23.53 15 A 9 -ATOM 224 N N . LYS A1 1 16 ? -26.985 14.616 -17.284 1.0 11.21 16 A 9 -ATOM 225 C CA . LYS A1 1 16 ? -26.858 13.477 -16.383 1.0 34.13 16 A 9 -ATOM 226 C C . LYS A1 1 16 ? -25.413 13.304 -15.925 1.0 15.24 16 A 9 -ATOM 227 O O . LYS A1 1 16 ? -24.503 13.169 -16.743 1.0 50.04 16 A 9 -ATOM 228 C CB . LYS A1 1 16 ? -27.342 12.198 -17.071 1.0 31.42 16 A 9 -ATOM 229 C CG . LYS A1 1 16 ? -27.943 11.183 -16.115 1.0 73.35 16 A 9 -ATOM 230 C CD . LYS A1 1 16 ? -26.898 10.195 -15.622 1.0 50.3 16 A 9 -ATOM 231 C CE . LYS A1 1 16 ? -26.419 9.285 -16.742 1.0 52.44 16 A 9 -ATOM 232 N NZ . LYS A1 1 16 ? -26.906 7.888 -16.568 1.0 2.53 16 A 9 -ATOM 233 H H . LYS A1 1 16 ? -26.419 14.658 -18.084 1.0 52.54 16 A 9 -ATOM 234 H HA . LYS A1 1 16 ? -27.476 13.666 -15.519 1.0 34.34 16 A 9 -ATOM 235 H HB2 . LYS A1 1 16 ? -28.091 12.46 -17.803 1.0 44.24 16 A 9 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.505 11.736 -17.575 1.0 12.13 16 A 9 -ATOM 237 H HG2 . LYS A1 1 16 ? -28.359 11.704 -15.265 1.0 3.41 16 A 9 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.725 10.64 -16.626 1.0 74.14 16 A 9 -ATOM 239 H HD2 . LYS A1 1 16 ? -26.053 10.743 -15.232 1.0 63.23 16 A 9 -ATOM 240 H HD3 . LYS A1 1 16 ? -27.33 9.59 -14.837 1.0 14.51 16 A 9 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.784 9.669 -17.682 1.0 44.12 16 A 9 -ATOM 242 H HE3 . LYS A1 1 16 ? -25.339 9.283 -16.749 1.0 75.31 16 A 9 -ATOM 243 H HZ1 . LYS A1 1 16 ? -27.943 7.86 -16.634 1.0 61.55 16 A 9 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.618 7.523 -15.638 1.0 23.15 16 A 9 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.505 7.276 -17.307 1.0 43.23 16 A 9 -ATOM 246 N N . THR A1 1 17 ? -25.208 13.308 -14.611 1.0 33.03 17 A 9 -ATOM 247 C CA . THR A1 1 17 ? -23.875 13.152 -14.045 1.0 61.21 17 A 9 -ATOM 248 C C . THR A1 1 17 ? -23.551 11.683 -13.798 1.0 13.11 17 A 9 -ATOM 249 O O . THR A1 1 17 ? -24.229 11.01 -13.021 1.0 32.24 17 A 9 -ATOM 250 C CB . THR A1 1 17 ? -23.732 13.927 -12.721 1.0 22.54 17 A 9 -ATOM 251 O OG1 . THR A1 1 17 ? -24.999 13.997 -12.056 1.0 24.32 17 A 9 -ATOM 252 C CG2 . THR A1 1 17 ? -23.205 15.332 -12.97 1.0 72.42 17 A 9 -ATOM 253 H H . THR A1 1 17 ? -25.974 13.42 -14.01 1.0 63.53 17 A 9 -ATOM 254 H HA . THR A1 1 17 ? -23.163 13.554 -14.751 1.0 15.15 17 A 9 -ATOM 255 H HB . THR A1 1 17 ? -23.031 13.402 -12.088 1.0 61.22 17 A 9 -ATOM 256 H HG1 . THR A1 1 17 ? -25.26 13.119 -11.77 1.0 54.0 17 A 9 -ATOM 257 H HG21 . THR A1 1 17 ? -23.993 16.048 -12.792 1.0 31.34 17 A 9 -ATOM 258 H HG22 . THR A1 1 17 ? -22.869 15.414 -13.993 1.0 12.24 17 A 9 -ATOM 259 H HG23 . THR A1 1 17 ? -22.381 15.53 -12.302 1.0 74.01 17 A 9 -ATOM 260 N N . ILE A1 1 18 ? -22.511 11.192 -14.463 1.0 21.15 18 A 9 -ATOM 261 C CA . ILE A1 1 18 ? -22.097 9.802 -14.314 1.0 42.23 18 A 9 -ATOM 262 C C . ILE A1 1 18 ? -20.642 9.707 -13.866 1.0 2.02 18 A 9 -ATOM 263 O O . ILE A1 1 18 ? -19.798 10.499 -14.286 1.0 34.24 18 A 9 -ATOM 264 C CB . ILE A1 1 18 ? -22.269 9.019 -15.629 1.0 20.13 18 A 9 -ATOM 265 C CG1 . ILE A1 1 18 ? -21.58 7.656 -15.53 1.0 0.43 18 A 9 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.711 9.817 -16.798 1.0 34.34 18 A 9 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.881 6.741 -16.697 1.0 41.12 18 A 9 -ATOM 268 H H . ILE A1 1 18 ? -22.01 11.777 -15.068 1.0 72.35 18 A 9 -ATOM 269 H HA . ILE A1 1 18 ? -22.724 9.346 -13.562 1.0 33.1 18 A 9 -ATOM 270 H HB . ILE A1 1 18 ? -23.324 8.87 -15.797 1.0 55.23 18 A 9 -ATOM 271 H HG12 . ILE A1 1 18 ? -20.512 7.801 -15.49 1.0 35.45 18 A 9 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.906 7.161 -14.627 1.0 15.51 18 A 9 -ATOM 273 H HG21 . ILE A1 1 18 ? -20.76 10.247 -16.519 1.0 31.24 18 A 9 -ATOM 274 H HG22 . ILE A1 1 18 ? -21.575 9.164 -17.646 1.0 60.32 18 A 9 -ATOM 275 H HG23 . ILE A1 1 18 ? -22.4 10.606 -17.057 1.0 71.44 18 A 9 -ATOM 276 H HD11 . ILE A1 1 18 ? -22.314 7.317 -17.503 1.0 32.31 18 A 9 -ATOM 277 H HD12 . ILE A1 1 18 ? -20.966 6.279 -17.037 1.0 60.24 18 A 9 -ATOM 278 H HD13 . ILE A1 1 18 ? -22.577 5.978 -16.386 1.0 25.35 18 A 9 -ATOM 279 N N . THR A1 1 19 ? -20.355 8.731 -13.009 1.0 42.32 19 A 9 -ATOM 280 C CA . THR A1 1 19 ? -19.003 8.532 -12.504 1.0 41.24 19 A 9 -ATOM 281 C C . THR A1 1 19 ? -18.421 7.211 -12.997 1.0 70.21 19 A 9 -ATOM 282 O O . THR A1 1 19 ? -19.111 6.192 -13.029 1.0 44.42 19 A 9 -ATOM 283 C CB . THR A1 1 19 ? -18.97 8.551 -10.964 1.0 2.4 19 A 9 -ATOM 284 O OG1 . THR A1 1 19 ? -20.155 9.174 -10.457 1.0 22.32 19 A 9 -ATOM 285 C CG2 . THR A1 1 19 ? -17.744 9.296 -10.459 1.0 13.14 19 A 9 -ATOM 286 H H . THR A1 1 19 ? -21.071 8.133 -12.711 1.0 1.15 19 A 9 -ATOM 287 H HA . THR A1 1 19 ? -18.388 9.343 -12.867 1.0 65.43 19 A 9 -ATOM 288 H HB . THR A1 1 19 ? -18.926 7.532 -10.607 1.0 44.24 19 A 9 -ATOM 289 H HG1 . THR A1 1 19 ? -20.63 8.552 -9.899 1.0 60.25 19 A 9 -ATOM 290 H HG21 . THR A1 1 19 ? -18.054 10.104 -9.813 1.0 73.33 19 A 9 -ATOM 291 H HG22 . THR A1 1 19 ? -17.195 9.697 -11.298 1.0 23.45 19 A 9 -ATOM 292 H HG23 . THR A1 1 19 ? -17.112 8.616 -9.906 1.0 51.03 19 A 9 -ATOM 293 N N . ILE A1 1 20 ? -17.149 7.237 -13.379 1.0 2.13 20 A 9 -ATOM 294 C CA . ILE A1 1 20 ? -16.475 6.041 -13.868 1.0 23.24 20 A 9 -ATOM 295 C C . ILE A1 1 20 ? -15.025 5.995 -13.396 1.0 21.51 20 A 9 -ATOM 296 O O . ILE A1 1 20 ? -14.295 6.98 -13.504 1.0 3.54 20 A 9 -ATOM 297 C CB . ILE A1 1 20 ? -16.505 5.967 -15.406 1.0 55.55 20 A 9 -ATOM 298 C CG1 . ILE A1 1 20 ? -16.397 7.369 -16.008 1.0 1.5 20 A 9 -ATOM 299 C CG2 . ILE A1 1 20 ? -17.776 5.277 -15.878 1.0 1.32 20 A 9 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.649 7.407 -17.322 1.0 2.4 20 A 9 -ATOM 301 H H . ILE A1 1 20 ? -16.651 8.079 -13.33 1.0 32.52 20 A 9 -ATOM 302 H HA . ILE A1 1 20 ? -16.997 5.18 -13.476 1.0 40.32 20 A 9 -ATOM 303 H HB . ILE A1 1 20 ? -15.662 5.377 -15.732 1.0 75.22 20 A 9 -ATOM 304 H HG12 . ILE A1 1 20 ? -17.389 7.757 -16.181 1.0 4.24 20 A 9 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.88 8.013 -15.311 1.0 20.02 20 A 9 -ATOM 306 H HG21 . ILE A1 1 20 ? -18.088 4.553 -15.141 1.0 41.11 20 A 9 -ATOM 307 H HG22 . ILE A1 1 20 ? -18.555 6.012 -16.012 1.0 51.34 20 A 9 -ATOM 308 H HG23 . ILE A1 1 20 ? -17.588 4.778 -16.817 1.0 74.34 20 A 9 -ATOM 309 H HD11 . ILE A1 1 20 ? -16.002 8.24 -17.913 1.0 44.23 20 A 9 -ATOM 310 H HD12 . ILE A1 1 20 ? -14.592 7.525 -17.131 1.0 43.31 20 A 9 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.818 6.487 -17.86 1.0 23.14 20 A 9 -ATOM 312 N N . ASP A1 1 21 ? -14.615 4.844 -12.875 1.0 44.41 21 A 9 -ATOM 313 C CA . ASP A1 1 21 ? -13.251 4.667 -12.389 1.0 13.43 21 A 9 -ATOM 314 C C . ASP A1 1 21 ? -12.304 4.337 -13.538 1.0 74.52 21 A 9 -ATOM 315 O O . ASP A1 1 21 ? -12.501 3.358 -14.258 1.0 3.25 21 A 9 -ATOM 316 C CB . ASP A1 1 21 ? -13.202 3.559 -11.336 1.0 40.32 21 A 9 -ATOM 317 C CG . ASP A1 1 21 ? -13.876 2.285 -11.804 1.0 70.32 21 A 9 -ATOM 318 O OD1 . ASP A1 1 21 ? -15.124 2.251 -11.836 1.0 34.41 21 A 9 -ATOM 319 O OD2 . ASP A1 1 21 ? -13.156 1.32 -12.138 1.0 4.34 21 A 9 -ATOM 320 H H . ASP A1 1 21 ? -15.244 4.094 -12.816 1.0 61.24 21 A 9 -ATOM 321 H HA . ASP A1 1 21 ? -12.938 5.596 -11.936 1.0 0.1 21 A 9 -ATOM 322 H HB2 . ASP A1 1 21 ? -12.17 3.335 -11.106 1.0 73.15 21 A 9 -ATOM 323 H HB3 . ASP A1 1 21 ? -13.699 3.901 -10.44 1.0 61.23 21 A 9 -ATOM 324 N N . VAL A1 1 22 ? -11.274 5.161 -13.704 1.0 30.34 22 A 9 -ATOM 325 C CA . VAL A1 1 22 ? -10.295 4.956 -14.765 1.0 1.34 22 A 9 -ATOM 326 C C . VAL A1 1 22 ? -8.875 5.172 -14.253 1.0 61.2 22 A 9 -ATOM 327 O O . VAL A1 1 22 ? -8.671 5.76 -13.19 1.0 34.03 22 A 9 -ATOM 328 C CB . VAL A1 1 22 ? -10.549 5.903 -15.953 1.0 60.13 22 A 9 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.998 6.367 -15.966 1.0 14.0 22 A 9 -ATOM 330 C CG2 . VAL A1 1 22 ? -9.601 7.091 -15.9 1.0 61.12 22 A 9 -ATOM 331 H H . VAL A1 1 22 ? -11.169 5.924 -13.098 1.0 71.0 22 A 9 -ATOM 332 H HA . VAL A1 1 22 ? -10.39 3.939 -15.116 1.0 41.13 22 A 9 -ATOM 333 H HB . VAL A1 1 22 ? -10.36 5.36 -16.867 1.0 23.42 22 A 9 -ATOM 334 H HG11 . VAL A1 1 22 ? -12.2 6.888 -16.89 1.0 3.13 22 A 9 -ATOM 335 H HG12 . VAL A1 1 22 ? -12.651 5.51 -15.884 1.0 11.12 22 A 9 -ATOM 336 H HG13 . VAL A1 1 22 ? -12.17 7.032 -15.133 1.0 2.3 22 A 9 -ATOM 337 H HG21 . VAL A1 1 22 ? -9.569 7.482 -14.893 1.0 43.3 22 A 9 -ATOM 338 H HG22 . VAL A1 1 22 ? -8.612 6.775 -16.196 1.0 71.52 22 A 9 -ATOM 339 H HG23 . VAL A1 1 22 ? -9.949 7.861 -16.573 1.0 24.41 22 A 9 -ATOM 340 N N . ASP A1 1 23 ? -7.898 4.693 -15.015 1.0 73.14 23 A 9 -ATOM 341 C CA . ASP A1 1 23 ? -6.496 4.835 -14.639 1.0 0.33 23 A 9 -ATOM 342 C C . ASP A1 1 23 ? -5.765 5.759 -15.607 1.0 62.12 23 A 9 -ATOM 343 O O . ASP A1 1 23 ? -6.136 5.87 -16.776 1.0 35.34 23 A 9 -ATOM 344 C CB . ASP A1 1 23 ? -5.814 3.466 -14.606 1.0 24.44 23 A 9 -ATOM 345 C CG . ASP A1 1 23 ? -4.96 3.274 -13.369 1.0 11.25 23 A 9 -ATOM 346 O OD1 . ASP A1 1 23 ? -4.352 4.263 -12.908 1.0 71.52 23 A 9 -ATOM 347 O OD2 . ASP A1 1 23 ? -4.899 2.135 -12.861 1.0 54.12 23 A 9 -ATOM 348 H H . ASP A1 1 23 ? -8.125 4.234 -15.85 1.0 71.31 23 A 9 -ATOM 349 H HA . ASP A1 1 23 ? -6.46 5.268 -13.651 1.0 62.03 23 A 9 -ATOM 350 H HB2 . ASP A1 1 23 ? -6.57 2.694 -14.623 1.0 75.32 23 A 9 -ATOM 351 H HB3 . ASP A1 1 23 ? -5.183 3.365 -15.477 1.0 32.1 23 A 9 -ATOM 352 N N . HIS A1 1 24 ? -4.724 6.422 -15.112 1.0 3.42 24 A 9 -ATOM 353 C CA . HIS A1 1 24 ? -3.94 7.338 -15.934 1.0 64.1 24 A 9 -ATOM 354 C C . HIS A1 1 24 ? -3.298 6.602 -17.106 1.0 13.22 24 A 9 -ATOM 355 O O . HIS A1 1 24 ? -2.84 7.222 -18.065 1.0 40.32 24 A 9 -ATOM 356 C CB . HIS A1 1 24 ? -2.861 8.017 -15.09 1.0 43.52 24 A 9 -ATOM 357 C CG . HIS A1 1 24 ? -1.968 7.053 -14.371 1.0 63.23 24 A 9 -ATOM 358 N ND1 . HIS A1 1 24 ? -1.013 6.291 -15.01 1.0 33.23 24 A 9 -ATOM 359 C CD2 . HIS A1 1 24 ? -1.888 6.73 -13.059 1.0 70.35 24 A 9 -ATOM 360 C CE1 . HIS A1 1 24 ? -0.385 5.541 -14.123 1.0 52.22 24 A 9 -ATOM 361 N NE2 . HIS A1 1 24 ? -0.897 5.788 -12.931 1.0 51.1 24 A 9 -ATOM 362 H H . HIS A1 1 24 ? -4.477 6.292 -14.173 1.0 35.01 24 A 9 -ATOM 363 H HA . HIS A1 1 24 ? -4.609 8.091 -16.321 1.0 52.33 24 A 9 -ATOM 364 H HB2 . HIS A1 1 24 ? -2.242 8.626 -15.732 1.0 74.33 24 A 9 -ATOM 365 H HB3 . HIS A1 1 24 ? -3.334 8.647 -14.351 1.0 2.24 24 A 9 -ATOM 366 H HD1 . HIS A1 1 24 ? -0.824 6.299 -15.972 1.0 61.24 24 A 9 -ATOM 367 H HD2 . HIS A1 1 24 ? -2.492 7.137 -12.26 1.0 14.35 24 A 9 -ATOM 368 H HE1 . HIS A1 1 24 ? 0.411 4.843 -14.335 1.0 73.24 24 A 9 -ATOM 369 N N . ALA A1 1 25 ? -3.269 5.276 -17.022 1.0 63.43 25 A 9 -ATOM 370 C CA . ALA A1 1 25 ? -2.685 4.456 -18.076 1.0 43.32 25 A 9 -ATOM 371 C C . ALA A1 1 25 ? -3.71 4.144 -19.16 1.0 33.54 25 A 9 -ATOM 372 O O . ALA A1 1 25 ? -3.447 3.354 -20.068 1.0 12.23 25 A 9 -ATOM 373 C CB . ALA A1 1 25 ? -2.122 3.168 -17.492 1.0 51.34 25 A 9 -ATOM 374 H H . ALA A1 1 25 ? -3.651 4.839 -16.232 1.0 55.41 25 A 9 -ATOM 375 H HA . ALA A1 1 25 ? -1.868 5.01 -18.515 1.0 23.12 25 A 9 -ATOM 376 H HB1 . ALA A1 1 25 ? -2.882 2.681 -16.899 1.0 42.21 25 A 9 -ATOM 377 H HB2 . ALA A1 1 25 ? -1.815 2.514 -18.294 1.0 3.14 25 A 9 -ATOM 378 H HB3 . ALA A1 1 25 ? -1.271 3.398 -16.868 1.0 44.44 25 A 9 -ATOM 379 N N . ASP A1 1 26 ? -4.878 4.768 -19.061 1.0 53.31 26 A 9 -ATOM 380 C CA . ASP A1 1 26 ? -5.944 4.556 -20.034 1.0 71.32 26 A 9 -ATOM 381 C C . ASP A1 1 26 ? -6.008 5.711 -21.028 1.0 31.24 26 A 9 -ATOM 382 O O . ASP A1 1 26 ? -5.091 6.53 -21.107 1.0 53.43 26 A 9 -ATOM 383 C CB . ASP A1 1 26 ? -7.29 4.403 -19.324 1.0 21.1 26 A 9 -ATOM 384 C CG . ASP A1 1 26 ? -7.249 3.359 -18.225 1.0 73.54 26 A 9 -ATOM 385 O OD1 . ASP A1 1 26 ? -6.278 2.575 -18.189 1.0 73.22 26 A 9 -ATOM 386 O OD2 . ASP A1 1 26 ? -8.188 3.326 -17.403 1.0 2.02 26 A 9 -ATOM 387 H H . ASP A1 1 26 ? -5.028 5.386 -18.315 1.0 73.33 26 A 9 -ATOM 388 H HA . ASP A1 1 26 ? -5.725 3.646 -20.572 1.0 35.3 26 A 9 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.567 5.35 -18.884 1.0 71.15 26 A 9 -ATOM 390 H HB3 . ASP A1 1 26 ? -8.039 4.112 -20.045 1.0 51.4 26 A 9 -ATOM 391 N N . THR A1 1 27 ? -7.097 5.772 -21.788 1.0 11.22 27 A 9 -ATOM 392 C CA . THR A1 1 27 ? -7.28 6.824 -22.779 1.0 12.11 27 A 9 -ATOM 393 C C . THR A1 1 27 ? -8.753 7.187 -22.93 1.0 24.55 27 A 9 -ATOM 394 O O . THR A1 1 27 ? -9.63 6.494 -22.414 1.0 14.34 27 A 9 -ATOM 395 C CB . THR A1 1 27 ? -6.723 6.406 -24.153 1.0 24.42 27 A 9 -ATOM 396 O OG1 . THR A1 1 27 ? -6.719 4.978 -24.266 1.0 51.41 27 A 9 -ATOM 397 C CG2 . THR A1 1 27 ? -5.312 6.939 -24.35 1.0 72.22 27 A 9 -ATOM 398 H H . THR A1 1 27 ? -7.793 5.091 -21.679 1.0 1.33 27 A 9 -ATOM 399 H HA . THR A1 1 27 ? -6.737 7.696 -22.444 1.0 54.42 27 A 9 -ATOM 400 H HB . THR A1 1 27 ? -7.359 6.818 -24.923 1.0 51.23 27 A 9 -ATOM 401 H HG1 . THR A1 1 27 ? -5.901 4.631 -23.902 1.0 23.44 27 A 9 -ATOM 402 H HG21 . THR A1 1 27 ? -4.926 6.594 -25.297 1.0 20.21 27 A 9 -ATOM 403 H HG22 . THR A1 1 27 ? -4.678 6.583 -23.551 1.0 40.31 27 A 9 -ATOM 404 H HG23 . THR A1 1 27 ? -5.331 8.019 -24.341 1.0 53.14 27 A 9 -ATOM 405 N N . VAL A1 1 28 ? -9.019 8.278 -23.641 1.0 70.04 28 A 9 -ATOM 406 C CA . VAL A1 1 28 ? -10.387 8.732 -23.862 1.0 40.12 28 A 9 -ATOM 407 C C . VAL A1 1 28 ? -11.216 7.661 -24.562 1.0 43.3 28 A 9 -ATOM 408 O O . VAL A1 1 28 ? -12.326 7.343 -24.137 1.0 51.44 28 A 9 -ATOM 409 C CB . VAL A1 1 28 ? -10.422 10.022 -24.702 1.0 70.14 28 A 9 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.809 10.645 -24.669 1.0 13.41 28 A 9 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.374 11.008 -24.208 1.0 73.55 28 A 9 -ATOM 412 H H . VAL A1 1 28 ? -8.278 8.79 -24.028 1.0 50.23 28 A 9 -ATOM 413 H HA . VAL A1 1 28 ? -10.829 8.943 -22.899 1.0 62.42 28 A 9 -ATOM 414 H HB . VAL A1 1 28 ? -10.191 9.768 -25.726 1.0 52.41 28 A 9 -ATOM 415 H HG11 . VAL A1 1 28 ? -11.879 11.408 -25.43 1.0 72.32 28 A 9 -ATOM 416 H HG12 . VAL A1 1 28 ? -12.551 9.882 -24.853 1.0 75.12 28 A 9 -ATOM 417 H HG13 . VAL A1 1 28 ? -11.982 11.088 -23.699 1.0 43.12 28 A 9 -ATOM 418 H HG21 . VAL A1 1 28 ? -9.862 11.9 -23.844 1.0 22.23 28 A 9 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.805 10.557 -23.409 1.0 21.24 28 A 9 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.711 11.267 -25.02 1.0 51.43 28 A 9 -ATOM 421 N N . GLY A1 1 29 ? -10.667 7.105 -25.638 1.0 51.02 29 A 9 -ATOM 422 C CA . GLY A1 1 29 ? -11.369 6.074 -26.38 1.0 24.21 29 A 9 -ATOM 423 C C . GLY A1 1 29 ? -11.912 4.981 -25.482 1.0 62.32 29 A 9 -ATOM 424 O O . GLY A1 1 29 ? -13.092 4.639 -25.552 1.0 1.41 29 A 9 -ATOM 425 H H . GLY A1 1 29 ? -9.779 7.398 -25.931 1.0 25.44 29 A 9 -ATOM 426 H HA2 . GLY A1 1 29 ? -12.191 6.527 -26.915 1.0 33.14 29 A 9 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.688 5.633 -27.093 1.0 61.11 29 A 9 -ATOM 428 N N . ALA A1 1 30 ? -11.048 4.429 -24.636 1.0 0.3 30 A 9 -ATOM 429 C CA . ALA A1 1 30 ? -11.447 3.368 -23.72 1.0 24.42 30 A 9 -ATOM 430 C C . ALA A1 1 30 ? -12.554 3.839 -22.783 1.0 23.15 30 A 9 -ATOM 431 O O . ALA A1 1 30 ? -13.501 3.104 -22.505 1.0 23.32 30 A 9 -ATOM 432 C CB . ALA A1 1 30 ? -10.247 2.882 -22.92 1.0 4.23 30 A 9 -ATOM 433 H H . ALA A1 1 30 ? -10.12 4.744 -24.627 1.0 13.0 30 A 9 -ATOM 434 H HA . ALA A1 1 30 ? -11.816 2.54 -24.308 1.0 42.35 30 A 9 -ATOM 435 H HB1 . ALA A1 1 30 ? -10.209 1.803 -22.95 1.0 24.3 30 A 9 -ATOM 436 H HB2 . ALA A1 1 30 ? -9.342 3.287 -23.347 1.0 15.25 30 A 9 -ATOM 437 H HB3 . ALA A1 1 30 ? -10.341 3.211 -21.895 1.0 54.13 30 A 9 -ATOM 438 N N . VAL A1 1 31 ? -12.429 5.071 -22.298 1.0 44.02 31 A 9 -ATOM 439 C CA . VAL A1 1 31 ? -13.419 5.64 -21.392 1.0 44.43 31 A 9 -ATOM 440 C C . VAL A1 1 31 ? -14.786 5.735 -22.062 1.0 22.33 31 A 9 -ATOM 441 O O . VAL A1 1 31 ? -15.81 5.427 -21.453 1.0 41.34 31 A 9 -ATOM 442 C CB . VAL A1 1 31 ? -12.998 7.041 -20.909 1.0 42.01 31 A 9 -ATOM 443 C CG1 . VAL A1 1 31 ? -14.101 7.671 -20.072 1.0 61.22 31 A 9 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.698 6.964 -20.123 1.0 34.2 31 A 9 -ATOM 445 H H . VAL A1 1 31 ? -11.652 5.609 -22.556 1.0 33.11 31 A 9 -ATOM 446 H HA . VAL A1 1 31 ? -13.495 4.993 -20.531 1.0 53.53 31 A 9 -ATOM 447 H HB . VAL A1 1 31 ? -12.834 7.664 -21.776 1.0 34.14 31 A 9 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.662 8.365 -20.681 1.0 24.43 31 A 9 -ATOM 449 H HG12 . VAL A1 1 31 ? -14.759 6.899 -19.703 1.0 62.24 31 A 9 -ATOM 450 H HG13 . VAL A1 1 31 ? -13.662 8.199 -19.238 1.0 4.44 31 A 9 -ATOM 451 H HG21 . VAL A1 1 31 ? -10.895 7.381 -20.713 1.0 32.4 31 A 9 -ATOM 452 H HG22 . VAL A1 1 31 ? -11.799 7.525 -19.206 1.0 31.51 31 A 9 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.477 5.932 -19.892 1.0 2.41 31 A 9 -ATOM 454 N N . LYS A1 1 32 ? -14.794 6.163 -23.319 1.0 44.33 32 A 9 -ATOM 455 C CA . LYS A1 1 32 ? -16.034 6.298 -24.074 1.0 33.41 32 A 9 -ATOM 456 C C . LYS A1 1 32 ? -16.802 4.98 -24.098 1.0 33.52 32 A 9 -ATOM 457 O O . LYS A1 1 32 ? -18.023 4.96 -23.946 1.0 55.22 32 A 9 -ATOM 458 C CB . LYS A1 1 32 ? -15.737 6.753 -25.505 1.0 21.43 32 A 9 -ATOM 459 C CG . LYS A1 1 32 ? -16.306 8.121 -25.839 1.0 62.04 32 A 9 -ATOM 460 C CD . LYS A1 1 32 ? -15.228 9.192 -25.826 1.0 13.3 32 A 9 -ATOM 461 C CE . LYS A1 1 32 ? -14.681 9.449 -27.221 1.0 61.02 32 A 9 -ATOM 462 N NZ . LYS A1 1 32 ? -14.291 8.185 -27.906 1.0 10.13 32 A 9 -ATOM 463 H H . LYS A1 1 32 ? -13.944 6.394 -23.751 1.0 0.43 32 A 9 -ATOM 464 H HA . LYS A1 1 32 ? -16.64 7.046 -23.586 1.0 20.21 32 A 9 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.667 6.787 -25.644 1.0 31.13 32 A 9 -ATOM 466 H HB3 . LYS A1 1 32 ? -16.158 6.033 -26.193 1.0 51.43 32 A 9 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.751 8.085 -26.822 1.0 34.55 32 A 9 -ATOM 468 H HG3 . LYS A1 1 32 ? -17.062 8.374 -25.109 1.0 75.31 32 A 9 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.649 10.109 -25.442 1.0 62.53 32 A 9 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.42 8.868 -25.185 1.0 34.24 32 A 9 -ATOM 471 H HE2 . LYS A1 1 32 ? -15.441 9.944 -27.806 1.0 32.35 32 A 9 -ATOM 472 H HE3 . LYS A1 1 32 ? -13.814 10.088 -27.142 1.0 31.14 32 A 9 -ATOM 473 H HZ1 . LYS A1 1 32 ? -15.132 7.713 -28.293 1.0 3.34 32 A 9 -ATOM 474 H HZ2 . LYS A1 1 32 ? -13.825 7.544 -27.232 1.0 11.13 32 A 9 -ATOM 475 H HZ3 . LYS A1 1 32 ? -13.632 8.389 -28.684 1.0 13.55 32 A 9 -ATOM 476 N N . ALA A1 1 33 ? -16.078 3.882 -24.287 1.0 34.21 33 A 9 -ATOM 477 C CA . ALA A1 1 33 ? -16.692 2.56 -24.326 1.0 60.31 33 A 9 -ATOM 478 C C . ALA A1 1 33 ? -17.324 2.208 -22.984 1.0 31.03 33 A 9 -ATOM 479 O O . ALA A1 1 33 ? -18.411 1.634 -22.929 1.0 31.32 33 A 9 -ATOM 480 C CB . ALA A1 1 33 ? -15.662 1.511 -24.718 1.0 54.24 33 A 9 -ATOM 481 H H . ALA A1 1 33 ? -15.109 3.962 -24.402 1.0 43.1 33 A 9 -ATOM 482 H HA . ALA A1 1 33 ? -17.463 2.573 -25.083 1.0 53.01 33 A 9 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.745 1.688 -24.176 1.0 2.33 33 A 9 -ATOM 484 H HB2 . ALA A1 1 33 ? -16.039 0.529 -24.478 1.0 61.23 33 A 9 -ATOM 485 H HB3 . ALA A1 1 33 ? -15.471 1.574 -25.779 1.0 53.23 33 A 9 -ATOM 486 N N . LYS A1 1 34 ? -16.635 2.555 -21.902 1.0 30.14 34 A 9 -ATOM 487 C CA . LYS A1 1 34 ? -17.128 2.277 -20.558 1.0 3.41 34 A 9 -ATOM 488 C C . LYS A1 1 34 ? -18.467 2.966 -20.316 1.0 51.04 34 A 9 -ATOM 489 O O . LYS A1 1 34 ? -19.396 2.366 -19.776 1.0 30.3 34 A 9 -ATOM 490 C CB . LYS A1 1 34 ? -16.109 2.737 -19.513 1.0 63.02 34 A 9 -ATOM 491 C CG . LYS A1 1 34 ? -16.517 2.422 -18.085 1.0 24.43 34 A 9 -ATOM 492 C CD . LYS A1 1 34 ? -16.54 0.924 -17.829 1.0 44.42 34 A 9 -ATOM 493 C CE . LYS A1 1 34 ? -15.146 0.322 -17.918 1.0 34.12 34 A 9 -ATOM 494 N NZ . LYS A1 1 34 ? -14.183 1.02 -17.022 1.0 13.0 34 A 9 -ATOM 495 H H . LYS A1 1 34 ? -15.773 3.011 -22.01 1.0 65.25 34 A 9 -ATOM 496 H HA . LYS A1 1 34 ? -17.265 1.21 -20.47 1.0 3.22 34 A 9 -ATOM 497 H HB2 . LYS A1 1 34 ? -15.164 2.252 -19.711 1.0 71.03 34 A 9 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.979 3.806 -19.601 1.0 71.12 34 A 9 -ATOM 499 H HG2 . LYS A1 1 34 ? -15.812 2.881 -17.408 1.0 24.23 34 A 9 -ATOM 500 H HG3 . LYS A1 1 34 ? -17.505 2.823 -17.906 1.0 22.21 34 A 9 -ATOM 501 H HD2 . LYS A1 1 34 ? -16.936 0.742 -16.841 1.0 63.43 34 A 9 -ATOM 502 H HD3 . LYS A1 1 34 ? -17.174 0.451 -18.566 1.0 75.33 34 A 9 -ATOM 503 H HE2 . LYS A1 1 34 ? -15.198 -0.718 -17.635 1.0 34.14 34 A 9 -ATOM 504 H HE3 . LYS A1 1 34 ? -14.798 0.401 -18.937 1.0 0.12 34 A 9 -ATOM 505 H HZ1 . LYS A1 1 34 ? -13.835 1.888 -17.477 1.0 62.42 34 A 9 -ATOM 506 H HZ2 . LYS A1 1 34 ? -13.373 0.401 -16.817 1.0 14.2 34 A 9 -ATOM 507 H HZ3 . LYS A1 1 34 ? -14.646 1.273 -16.126 1.0 65.2 34 A 9 -ATOM 508 N N . ILE A1 1 35 ? -18.558 4.229 -20.72 1.0 14.42 35 A 9 -ATOM 509 C CA . ILE A1 1 35 ? -19.785 4.998 -20.549 1.0 22.32 35 A 9 -ATOM 510 C C . ILE A1 1 35 ? -20.916 4.425 -21.396 1.0 74.31 35 A 9 -ATOM 511 O O . ILE A1 1 35 ? -22.075 4.419 -20.981 1.0 33.23 35 A 9 -ATOM 512 C CB . ILE A1 1 35 ? -19.578 6.478 -20.922 1.0 42.5 35 A 9 -ATOM 513 C CG1 . ILE A1 1 35 ? -18.407 7.067 -20.133 1.0 22.04 35 A 9 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.85 7.272 -20.665 1.0 45.14 35 A 9 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.563 6.937 -18.634 1.0 11.1 35 A 9 -ATOM 516 H H . ILE A1 1 35 ? -17.783 4.653 -21.144 1.0 54.44 35 A 9 -ATOM 517 H HA . ILE A1 1 35 ? -20.068 4.946 -19.508 1.0 30.01 35 A 9 -ATOM 518 H HB . ILE A1 1 35 ? -19.355 6.532 -21.977 1.0 2.44 35 A 9 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.498 6.56 -20.417 1.0 3.24 35 A 9 -ATOM 520 H HG13 . ILE A1 1 35 ? -18.316 8.117 -20.368 1.0 0.11 35 A 9 -ATOM 521 H HG21 . ILE A1 1 35 ? -21.644 6.597 -20.382 1.0 65.32 35 A 9 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.678 7.978 -19.867 1.0 43.1 35 A 9 -ATOM 523 H HG23 . ILE A1 1 35 ? -21.131 7.803 -21.562 1.0 75.41 35 A 9 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.795 6.281 -18.248 1.0 43.52 35 A 9 -ATOM 525 H HD12 . ILE A1 1 35 ? -18.466 7.91 -18.176 1.0 71.15 35 A 9 -ATOM 526 H HD13 . ILE A1 1 35 ? -19.534 6.525 -18.407 1.0 74.3 35 A 9 -ATOM 527 N N . TYR A1 1 36 ? -20.571 3.942 -22.585 1.0 62.53 36 A 9 -ATOM 528 C CA . TYR A1 1 36 ? -21.557 3.366 -23.491 1.0 64.44 36 A 9 -ATOM 529 C C . TYR A1 1 36 ? -22.313 2.223 -22.82 1.0 53.42 36 A 9 -ATOM 530 O O . TYR A1 1 36 ? -23.538 2.137 -22.91 1.0 34.33 36 A 9 -ATOM 531 C CB . TYR A1 1 36 ? -20.877 2.863 -24.766 1.0 74.42 36 A 9 -ATOM 532 C CG . TYR A1 1 36 ? -21.317 1.478 -25.181 1.0 43.51 36 A 9 -ATOM 533 C CD1 . TYR A1 1 36 ? -22.583 1.259 -25.709 1.0 62.31 36 A 9 -ATOM 534 C CD2 . TYR A1 1 36 ? -20.467 0.387 -25.043 1.0 22.21 36 A 9 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.99 -0.006 -26.089 1.0 25.24 36 A 9 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.865 -0.881 -25.421 1.0 24.41 36 A 9 -ATOM 537 C CZ . TYR A1 1 36 ? -22.127 -1.072 -25.944 1.0 51.0 36 A 9 -ATOM 538 O OH . TYR A1 1 36 ? -22.528 -2.333 -26.32 1.0 31.41 36 A 9 -ATOM 539 H H . TYR A1 1 36 ? -19.631 3.974 -22.86 1.0 42.53 36 A 9 -ATOM 540 H HA . TYR A1 1 36 ? -22.26 4.143 -23.753 1.0 45.34 36 A 9 -ATOM 541 H HB2 . TYR A1 1 36 ? -21.103 3.539 -25.576 1.0 32.41 36 A 9 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.808 2.84 -24.61 1.0 73.31 36 A 9 -ATOM 543 H HD1 . TYR A1 1 36 ? -23.257 2.096 -25.822 1.0 14.41 36 A 9 -ATOM 544 H HD2 . TYR A1 1 36 ? -19.48 0.54 -24.633 1.0 73.43 36 A 9 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.978 -0.156 -26.498 1.0 30.0 36 A 9 -ATOM 546 H HE2 . TYR A1 1 36 ? -20.19 -1.716 -25.307 1.0 11.1 36 A 9 -ATOM 547 H HH . TYR A1 1 36 ? -22.202 -2.975 -25.685 1.0 20.21 36 A 9 -ATOM 548 N N . ASP A1 1 37 ? -21.573 1.349 -22.147 1.0 31.31 37 A 9 -ATOM 549 C CA . ASP A1 1 37 ? -22.172 0.212 -21.458 1.0 4.3 37 A 9 -ATOM 550 C C . ASP A1 1 37 ? -22.862 0.657 -20.172 1.0 30.32 37 A 9 -ATOM 551 O O . ASP A1 1 37 ? -23.851 0.059 -19.747 1.0 62.0 37 A 9 -ATOM 552 C CB . ASP A1 1 37 ? -21.106 -0.839 -21.142 1.0 35.43 37 A 9 -ATOM 553 C CG . ASP A1 1 37 ? -21.689 -2.232 -21.008 1.0 34.32 37 A 9 -ATOM 554 O OD1 . ASP A1 1 37 ? -22.923 -2.347 -20.857 1.0 31.12 37 A 9 -ATOM 555 O OD2 . ASP A1 1 37 ? -20.91 -3.208 -21.052 1.0 3.2 37 A 9 -ATOM 556 H H . ASP A1 1 37 ? -20.601 1.472 -22.112 1.0 51.42 37 A 9 -ATOM 557 H HA . ASP A1 1 37 ? -22.909 -0.224 -22.115 1.0 32.24 37 A 9 -ATOM 558 H HB2 . ASP A1 1 37 ? -20.374 -0.85 -21.936 1.0 43.14 37 A 9 -ATOM 559 H HB3 . ASP A1 1 37 ? -20.619 -0.58 -20.213 1.0 34.23 37 A 9 -ATOM 560 N N . LYS A1 1 38 ? -22.334 1.709 -19.557 1.0 33.03 38 A 9 -ATOM 561 C CA . LYS A1 1 38 ? -22.898 2.236 -18.32 1.0 33.5 38 A 9 -ATOM 562 C C . LYS A1 1 38 ? -24.382 2.544 -18.487 1.0 62.1 38 A 9 -ATOM 563 O O . LYS A1 1 38 ? -25.198 2.185 -17.638 1.0 13.24 38 A 9 -ATOM 564 C CB . LYS A1 1 38 ? -22.149 3.5 -17.891 1.0 32.13 38 A 9 -ATOM 565 C CG . LYS A1 1 38 ? -21.39 3.343 -16.585 1.0 11.13 38 A 9 -ATOM 566 C CD . LYS A1 1 38 ? -19.954 2.907 -16.824 1.0 55.11 38 A 9 -ATOM 567 C CE . LYS A1 1 38 ? -19.846 1.397 -16.963 1.0 12.13 38 A 9 -ATOM 568 N NZ . LYS A1 1 38 ? -19.274 0.767 -15.74 1.0 62.42 38 A 9 -ATOM 569 H H . LYS A1 1 38 ? -21.545 2.143 -19.946 1.0 40.1 38 A 9 -ATOM 570 H HA . LYS A1 1 38 ? -22.782 1.482 -17.556 1.0 13.43 38 A 9 -ATOM 571 H HB2 . LYS A1 1 38 ? -21.443 3.765 -18.665 1.0 53.44 38 A 9 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.862 4.304 -17.775 1.0 74.35 38 A 9 -ATOM 573 H HG2 . LYS A1 1 38 ? -21.385 4.29 -16.066 1.0 72.35 38 A 9 -ATOM 574 H HG3 . LYS A1 1 38 ? -21.886 2.6 -15.978 1.0 65.33 38 A 9 -ATOM 575 H HD2 . LYS A1 1 38 ? -19.593 3.367 -17.732 1.0 31.44 38 A 9 -ATOM 576 H HD3 . LYS A1 1 38 ? -19.346 3.228 -15.99 1.0 51.13 38 A 9 -ATOM 577 H HE2 . LYS A1 1 38 ? -20.831 0.993 -17.138 1.0 72.24 38 A 9 -ATOM 578 H HE3 . LYS A1 1 38 ? -19.209 1.17 -17.805 1.0 52.14 38 A 9 -ATOM 579 H HZ1 . LYS A1 1 38 ? -19.995 0.717 -14.993 1.0 12.21 38 A 9 -ATOM 580 H HZ2 . LYS A1 1 38 ? -18.468 1.327 -15.394 1.0 31.3 38 A 9 -ATOM 581 H HZ3 . LYS A1 1 38 ? -18.945 -0.196 -15.955 1.0 72.13 38 A 9 -ATOM 582 N N . GLU A1 1 39 ? -24.725 3.208 -19.586 1.0 74.33 39 A 9 -ATOM 583 C CA . GLU A1 1 39 ? -26.112 3.563 -19.863 1.0 31.43 39 A 9 -ATOM 584 C C . GLU A1 1 39 ? -26.625 2.828 -21.098 1.0 55.55 39 A 9 -ATOM 585 O O . GLU A1 1 39 ? -27.656 2.157 -21.05 1.0 44.25 39 A 9 -ATOM 586 C CB . GLU A1 1 39 ? -26.245 5.074 -20.063 1.0 31.12 39 A 9 -ATOM 587 C CG . GLU A1 1 39 ? -25.117 5.681 -20.88 1.0 22.34 39 A 9 -ATOM 588 C CD . GLU A1 1 39 ? -25.138 7.197 -20.867 1.0 34.02 39 A 9 -ATOM 589 O OE1 . GLU A1 1 39 ? -26.034 7.784 -21.509 1.0 60.52 39 A 9 -ATOM 590 O OE2 . GLU A1 1 39 ? -24.258 7.797 -20.214 1.0 24.54 39 A 9 -ATOM 591 H H . GLU A1 1 39 ? -24.028 3.466 -20.225 1.0 53.12 39 A 9 -ATOM 592 H HA . GLU A1 1 39 ? -26.706 3.269 -19.011 1.0 24.23 39 A 9 -ATOM 593 H HB2 . GLU A1 1 39 ? -27.178 5.277 -20.568 1.0 13.32 39 A 9 -ATOM 594 H HB3 . GLU A1 1 39 ? -26.258 5.553 -19.095 1.0 53.15 39 A 9 -ATOM 595 H HG2 . GLU A1 1 39 ? -24.174 5.346 -20.474 1.0 73.51 39 A 9 -ATOM 596 H HG3 . GLU A1 1 39 ? -25.208 5.344 -21.902 1.0 55.55 39 A 9 -ATOM 597 N N . GLY A1 1 40 ? -25.898 2.96 -22.203 1.0 41.31 40 A 9 -ATOM 598 C CA . GLY A1 1 40 ? -26.295 2.304 -23.435 1.0 23.2 40 A 9 -ATOM 599 C C . GLY A1 1 40 ? -26.41 3.271 -24.596 1.0 54.31 40 A 9 -ATOM 600 O O . GLY A1 1 40 ? -27.408 3.269 -25.318 1.0 62.35 40 A 9 -ATOM 601 H H . GLY A1 1 40 ? -25.085 3.507 -22.182 1.0 1.31 40 A 9 -ATOM 602 H HA2 . GLY A1 1 40 ? -25.564 1.548 -23.68 1.0 42.33 40 A 9 -ATOM 603 H HA3 . GLY A1 1 40 ? -27.253 1.827 -23.283 1.0 42.25 40 A 9 -ATOM 604 N N . ILE A1 1 41 ? -25.388 4.101 -24.776 1.0 11.45 41 A 9 -ATOM 605 C CA . ILE A1 1 41 ? -25.379 5.078 -25.857 1.0 13.21 41 A 9 -ATOM 606 C C . ILE A1 1 41 ? -24.204 4.844 -26.8 1.0 73.14 41 A 9 -ATOM 607 O O . ILE A1 1 41 ? -23.177 4.279 -26.424 1.0 54.03 41 A 9 -ATOM 608 C CB . ILE A1 1 41 ? -25.308 6.518 -25.314 1.0 13.54 41 A 9 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.214 6.632 -24.251 1.0 35.25 41 A 9 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.655 6.935 -24.743 1.0 15.54 41 A 9 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.269 7.791 -24.478 1.0 51.21 41 A 9 -ATOM 612 H H . ILE A1 1 41 ? -24.621 4.054 -24.167 1.0 10.31 41 A 9 -ATOM 613 H HA . ILE A1 1 41 ? -26.3 4.969 -26.412 1.0 22.4 41 A 9 -ATOM 614 H HB . ILE A1 1 41 ? -25.073 7.178 -26.135 1.0 2.22 41 A 9 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.673 6.764 -23.284 1.0 53.25 41 A 9 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.631 5.723 -24.247 1.0 73.21 41 A 9 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.529 7.814 -24.128 1.0 41.34 41 A 9 -ATOM 618 H HG22 . ILE A1 1 41 ? -27.335 7.158 -25.551 1.0 35.01 41 A 9 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.058 6.132 -24.144 1.0 24.24 41 A 9 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.426 8.194 -25.469 1.0 13.35 41 A 9 -ATOM 621 H HD12 . ILE A1 1 41 ? -23.458 8.56 -23.744 1.0 5.02 41 A 9 -ATOM 622 H HD13 . ILE A1 1 41 ? -22.25 7.448 -24.387 1.0 73.01 41 A 9 -ATOM 623 N N . PRO A1 1 42 ? -24.355 5.291 -28.056 1.0 42.01 42 A 9 -ATOM 624 C CA . PRO A1 1 42 ? -23.315 5.144 -29.079 1.0 63.34 42 A 9 -ATOM 625 C C . PRO A1 1 42 ? -22.104 6.029 -28.805 1.0 4.23 42 A 9 -ATOM 626 O O . PRO A1 1 42 ? -22.189 7.257 -28.806 1.0 21.54 42 A 9 -ATOM 627 C CB . PRO A1 1 42 ? -24.019 5.583 -30.365 1.0 63.45 42 A 9 -ATOM 628 C CG . PRO A1 1 42 ? -25.104 6.497 -29.911 1.0 31.23 42 A 9 -ATOM 629 C CD . PRO A1 1 42 ? -25.552 5.975 -28.574 1.0 52.22 42 A 9 -ATOM 630 H HA . PRO A1 1 42 ? -22.995 4.117 -29.174 1.0 60.32 42 A 9 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.315 6.094 -31.007 1.0 50.23 42 A 9 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.418 4.719 -30.875 1.0 64.01 42 A 9 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.721 7.501 -29.812 1.0 0.11 42 A 9 -ATOM 634 H HG3 . PRO A1 1 42 ? -25.922 6.474 -30.615 1.0 1.1 42 A 9 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.84 6.791 -27.927 1.0 11.32 42 A 9 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.37 5.28 -28.695 1.0 34.03 42 A 9 -ATOM 637 N N . PRO A1 1 43 ? -20.947 5.393 -28.566 1.0 1.41 43 A 9 -ATOM 638 C CA . PRO A1 1 43 ? -19.696 6.103 -28.287 1.0 62.53 43 A 9 -ATOM 639 C C . PRO A1 1 43 ? -19.156 6.829 -29.515 1.0 21.35 43 A 9 -ATOM 640 O O . PRO A1 1 43 ? -18.471 7.845 -29.396 1.0 73.42 43 A 9 -ATOM 641 C CB . PRO A1 1 43 ? -18.74 4.986 -27.863 1.0 74.43 43 A 9 -ATOM 642 C CG . PRO A1 1 43 ? -19.279 3.759 -28.514 1.0 42.11 43 A 9 -ATOM 643 C CD . PRO A1 1 43 ? -20.773 3.931 -28.549 1.0 32.53 43 A 9 -ATOM 644 H HA . PRO A1 1 43 ? -19.811 6.808 -27.477 1.0 3.1 43 A 9 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.741 5.212 -28.21 1.0 1.2 43 A 9 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.742 4.895 -26.787 1.0 52.2 43 A 9 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.888 3.673 -29.516 1.0 21.5 43 A 9 -ATOM 648 H HG3 . PRO A1 1 43 ? -19.016 2.889 -27.931 1.0 41.32 43 A 9 -ATOM 649 H HD2 . PRO A1 1 43 ? -21.183 3.483 -29.442 1.0 55.24 43 A 9 -ATOM 650 H HD3 . PRO A1 1 43 ? -21.223 3.499 -27.667 1.0 31.14 43 A 9 -ATOM 651 N N . ASP A1 1 44 ? -19.468 6.301 -30.693 1.0 54.12 44 A 9 -ATOM 652 C CA . ASP A1 1 44 ? -19.015 6.899 -31.944 1.0 51.34 44 A 9 -ATOM 653 C C . ASP A1 1 44 ? -19.864 8.115 -32.303 1.0 65.34 44 A 9 -ATOM 654 O O . ASP A1 1 44 ? -19.477 8.926 -33.144 1.0 41.23 44 A 9 -ATOM 655 C CB . ASP A1 1 44 ? -19.069 5.872 -33.075 1.0 23.35 44 A 9 -ATOM 656 C CG . ASP A1 1 44 ? -18.28 6.31 -34.293 1.0 52.14 44 A 9 -ATOM 657 O OD1 . ASP A1 1 44 ? -17.464 7.247 -34.167 1.0 70.43 44 A 9 -ATOM 658 O OD2 . ASP A1 1 44 ? -18.479 5.715 -35.373 1.0 15.14 44 A 9 -ATOM 659 H H . ASP A1 1 44 ? -20.017 5.489 -30.723 1.0 64.31 44 A 9 -ATOM 660 H HA . ASP A1 1 44 ? -17.993 7.218 -31.808 1.0 72.42 44 A 9 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.66 4.936 -32.722 1.0 64.21 44 A 9 -ATOM 662 H HB3 . ASP A1 1 44 ? -20.098 5.722 -33.368 1.0 74.33 44 A 9 -ATOM 663 N N . GLN A1 1 45 ? -21.022 8.232 -31.662 1.0 24.51 45 A 9 -ATOM 664 C CA . GLN A1 1 45 ? -21.926 9.348 -31.916 1.0 55.1 45 A 9 -ATOM 665 C C . GLN A1 1 45 ? -21.797 10.411 -30.831 1.0 65.33 45 A 9 -ATOM 666 O O . GLN A1 1 45 ? -22.301 11.524 -30.977 1.0 0.12 45 A 9 -ATOM 667 C CB . GLN A1 1 45 ? -23.372 8.853 -31.992 1.0 3.33 45 A 9 -ATOM 668 C CG . GLN A1 1 45 ? -23.775 8.364 -33.373 1.0 71.05 45 A 9 -ATOM 669 C CD . GLN A1 1 45 ? -24.746 7.2 -33.32 1.0 50.21 45 A 9 -ATOM 670 O OE1 . GLN A1 1 45 ? -25.895 7.354 -32.906 1.0 30.33 45 A 9 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.287 6.027 -33.739 1.0 54.11 45 A 9 -ATOM 672 H H . GLN A1 1 45 ? -21.275 7.553 -31.003 1.0 33.14 45 A 9 -ATOM 673 H HA . GLN A1 1 45 ? -21.655 9.784 -32.865 1.0 54.13 45 A 9 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.498 8.039 -31.294 1.0 72.22 45 A 9 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.031 9.662 -31.714 1.0 51.24 45 A 9 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.243 9.178 -33.907 1.0 11.31 45 A 9 -ATOM 677 H HG3 . GLN A1 1 45 ? -22.888 8.05 -33.903 1.0 33.23 45 A 9 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.359 5.979 -34.054 1.0 35.4 45 A 9 -ATOM 679 H HE22 . GLN A1 1 45 ? -24.892 5.257 -33.715 1.0 53.4 45 A 9 -ATOM 680 N N . GLN A1 1 46 ? -21.119 10.06 -29.743 1.0 5.34 46 A 9 -ATOM 681 C CA . GLN A1 1 46 ? -20.924 10.985 -28.633 1.0 54.21 46 A 9 -ATOM 682 C C . GLN A1 1 46 ? -19.504 11.541 -28.629 1.0 23.33 46 A 9 -ATOM 683 O O . GLN A1 1 46 ? -18.57 10.885 -29.091 1.0 42.0 46 A 9 -ATOM 684 C CB . GLN A1 1 46 ? -21.216 10.288 -27.303 1.0 54.1 46 A 9 -ATOM 685 C CG . GLN A1 1 46 ? -20.174 9.249 -26.92 1.0 63.33 46 A 9 -ATOM 686 C CD . GLN A1 1 46 ? -19.273 9.714 -25.793 1.0 73.34 46 A 9 -ATOM 687 O OE1 . GLN A1 1 46 ? -18.27 10.391 -26.023 1.0 62.34 46 A 9 -ATOM 688 N NE2 . GLN A1 1 46 ? -19.626 9.353 -24.565 1.0 52.51 46 A 9 -ATOM 689 H H . GLN A1 1 46 ? -20.741 9.159 -29.685 1.0 61.13 46 A 9 -ATOM 690 H HA . GLN A1 1 46 ? -21.617 11.804 -28.759 1.0 1.54 46 A 9 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.256 11.032 -26.521 1.0 70.34 46 A 9 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.175 9.796 -27.371 1.0 24.41 46 A 9 -ATOM 693 H HG2 . GLN A1 1 46 ? -20.681 8.348 -26.606 1.0 71.34 46 A 9 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.564 9.035 -27.785 1.0 12.44 46 A 9 -ATOM 695 H HE21 . GLN A1 1 46 ? -20.437 8.812 -24.457 1.0 61.21 46 A 9 -ATOM 696 H HE22 . GLN A1 1 46 ? -19.061 9.639 -23.818 1.0 54.41 46 A 9 -ATOM 697 N N . ARG A1 1 47 ? -19.349 12.752 -28.105 1.0 11.31 47 A 9 -ATOM 698 C CA . ARG A1 1 47 ? -18.042 13.396 -28.042 1.0 74.42 47 A 9 -ATOM 699 C C . ARG A1 1 47 ? -17.858 14.124 -26.714 1.0 0.05 47 A 9 -ATOM 700 O O . ARG A1 1 47 ? -18.829 14.433 -26.023 1.0 62.43 47 A 9 -ATOM 701 C CB . ARG A1 1 47 ? -17.878 14.379 -29.202 1.0 53.24 47 A 9 -ATOM 702 C CG . ARG A1 1 47 ? -18.814 15.575 -29.124 1.0 25.13 47 A 9 -ATOM 703 C CD . ARG A1 1 47 ? -19.812 15.578 -30.271 1.0 74.31 47 A 9 -ATOM 704 N NE . ARG A1 1 47 ? -20.696 16.739 -30.224 1.0 72.02 47 A 9 -ATOM 705 C CZ . ARG A1 1 47 ? -20.3 17.976 -30.499 1.0 4.33 47 A 9 -ATOM 706 N NH1 . ARG A1 1 47 ? -19.04 18.212 -30.84 1.0 22.33 47 A 9 -ATOM 707 N NH2 . ARG A1 1 47 ? -21.164 18.981 -30.435 1.0 24.44 47 A 9 -ATOM 708 H H . ARG A1 1 47 ? -20.131 13.224 -27.752 1.0 14.32 47 A 9 -ATOM 709 H HA . ARG A1 1 47 ? -17.289 12.627 -28.125 1.0 52.1 47 A 9 -ATOM 710 H HB2 . ARG A1 1 47 ? -16.862 14.745 -29.208 1.0 12.43 47 A 9 -ATOM 711 H HB3 . ARG A1 1 47 ? -18.071 13.859 -30.129 1.0 31.22 47 A 9 -ATOM 712 H HG2 . ARG A1 1 47 ? -19.356 15.535 -28.19 1.0 2.15 47 A 9 -ATOM 713 H HG3 . ARG A1 1 47 ? -18.228 16.481 -29.164 1.0 3.22 47 A 9 -ATOM 714 H HD2 . ARG A1 1 47 ? -19.268 15.59 -31.204 1.0 62.34 47 A 9 -ATOM 715 H HD3 . ARG A1 1 47 ? -20.408 14.68 -30.214 1.0 4.32 47 A 9 -ATOM 716 H HE . ARG A1 1 47 ? -21.631 16.587 -29.974 1.0 51.12 47 A 9 -ATOM 717 H HH11 . ARG A1 1 47 ? -18.387 17.457 -30.891 1.0 35.02 47 A 9 -ATOM 718 H HH12 . ARG A1 1 47 ? -18.745 19.145 -31.048 1.0 42.25 47 A 9 -ATOM 719 H HH21 . ARG A1 1 47 ? -22.115 18.807 -30.178 1.0 32.54 47 A 9 -ATOM 720 H HH22 . ARG A1 1 47 ? -20.865 19.912 -30.642 1.0 51.04 47 A 9 -ATOM 721 N N . LEU A1 1 48 ? -16.605 14.395 -26.363 1.0 13.42 48 A 9 -ATOM 722 C CA . LEU A1 1 48 ? -16.293 15.086 -25.117 1.0 63.04 48 A 9 -ATOM 723 C C . LEU A1 1 48 ? -15.887 16.532 -25.384 1.0 70.54 48 A 9 -ATOM 724 O O . LEU A1 1 48 ? -15.272 16.836 -26.406 1.0 13.22 48 A 9 -ATOM 725 C CB . LEU A1 1 48 ? -15.171 14.359 -24.374 1.0 73.22 48 A 9 -ATOM 726 C CG . LEU A1 1 48 ? -15.164 12.834 -24.496 1.0 23.01 48 A 9 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.578 12.285 -24.397 1.0 2.23 48 A 9 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.514 12.407 -25.803 1.0 62.5 48 A 9 -ATOM 729 H H . LEU A1 1 48 ? -15.873 14.124 -26.954 1.0 13.1 48 A 9 -ATOM 730 H HA . LEU A1 1 48 ? -17.182 15.082 -24.504 1.0 5.14 48 A 9 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.23 14.725 -24.756 1.0 14.35 48 A 9 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.254 14.608 -23.326 1.0 62.22 48 A 9 -ATOM 733 H HG . LEU A1 1 48 ? -14.587 12.417 -23.682 1.0 74.12 48 A 9 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.187 12.96 -23.815 1.0 72.12 48 A 9 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.556 11.317 -23.919 1.0 51.52 48 A 9 -ATOM 736 H HD13 . LEU A1 1 48 ? -16.996 12.186 -25.388 1.0 50.13 48 A 9 -ATOM 737 H HD21 . LEU A1 1 48 ? -15.269 12.319 -26.569 1.0 32.51 48 A 9 -ATOM 738 H HD22 . LEU A1 1 48 ? -14.026 11.453 -25.667 1.0 4.35 48 A 9 -ATOM 739 H HD23 . LEU A1 1 48 ? -13.783 13.145 -26.1 1.0 44.23 48 A 9 -ATOM 740 N N . ILE A1 1 49 ? -16.234 17.419 -24.457 1.0 13.31 49 A 9 -ATOM 741 C CA . ILE A1 1 49 ? -15.903 18.832 -24.592 1.0 13.25 49 A 9 -ATOM 742 C C . ILE A1 1 49 ? -15.481 19.428 -23.252 1.0 73.24 49 A 9 -ATOM 743 O O . ILE A1 1 49 ? -16.184 19.292 -22.251 1.0 20.41 49 A 9 -ATOM 744 C CB . ILE A1 1 49 ? -17.092 19.639 -25.147 1.0 42.12 49 A 9 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.199 19.453 -26.662 1.0 21.4 49 A 9 -ATOM 746 C CG2 . ILE A1 1 49 ? -16.941 21.112 -24.798 1.0 44.11 49 A 9 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.497 18.813 -27.102 1.0 30.32 49 A 9 -ATOM 748 H H . ILE A1 1 49 ? -16.724 17.116 -23.665 1.0 11.12 49 A 9 -ATOM 749 H HA . ILE A1 1 49 ? -15.08 18.917 -25.286 1.0 31.54 49 A 9 -ATOM 750 H HB . ILE A1 1 49 ? -17.994 19.274 -24.682 1.0 10.22 49 A 9 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.124 20.415 -27.143 1.0 52.53 49 A 9 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.387 18.823 -26.998 1.0 23.14 49 A 9 -ATOM 753 H HG21 . ILE A1 1 49 ? -15.893 21.374 -24.784 1.0 54.41 49 A 9 -ATOM 754 H HG22 . ILE A1 1 49 ? -17.451 21.711 -25.539 1.0 2.4 49 A 9 -ATOM 755 H HG23 . ILE A1 1 49 ? -17.372 21.298 -23.826 1.0 53.42 49 A 9 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.18 19.58 -27.439 1.0 43.14 49 A 9 -ATOM 757 H HD12 . ILE A1 1 49 ? -18.304 18.125 -27.911 1.0 61.33 49 A 9 -ATOM 758 H HD13 . ILE A1 1 49 ? -18.936 18.281 -26.272 1.0 3.14 49 A 9 -ATOM 759 N N . PHE A1 1 50 ? -14.329 20.089 -23.242 1.0 0.44 50 A 9 -ATOM 760 C CA . PHE A1 1 50 ? -13.812 20.707 -22.026 1.0 63.4 50 A 9 -ATOM 761 C C . PHE A1 1 50 ? -13.673 22.217 -22.2 1.0 34.31 50 A 9 -ATOM 762 O O . PHE A1 1 50 ? -12.801 22.691 -22.927 1.0 24.03 50 A 9 -ATOM 763 C CB . PHE A1 1 50 ? -12.459 20.098 -21.654 1.0 1.31 50 A 9 -ATOM 764 C CG . PHE A1 1 50 ? -12.022 20.418 -20.254 1.0 63.44 50 A 9 -ATOM 765 C CD1 . PHE A1 1 50 ? -12.494 19.68 -19.181 1.0 63.22 50 A 9 -ATOM 766 C CD2 . PHE A1 1 50 ? -11.139 21.458 -20.01 1.0 31.12 50 A 9 -ATOM 767 C CE1 . PHE A1 1 50 ? -12.094 19.973 -17.891 1.0 44.05 50 A 9 -ATOM 768 C CE2 . PHE A1 1 50 ? -10.735 21.755 -18.722 1.0 53.14 50 A 9 -ATOM 769 C CZ . PHE A1 1 50 ? -11.212 21.011 -17.661 1.0 64.24 50 A 9 -ATOM 770 H H . PHE A1 1 50 ? -13.813 20.164 -24.073 1.0 32.43 50 A 9 -ATOM 771 H HA . PHE A1 1 50 ? -14.516 20.512 -21.232 1.0 55.42 50 A 9 -ATOM 772 H HB2 . PHE A1 1 50 ? -12.519 19.024 -21.745 1.0 72.21 50 A 9 -ATOM 773 H HB3 . PHE A1 1 50 ? -11.706 20.471 -22.332 1.0 52.42 50 A 9 -ATOM 774 H HD1 . PHE A1 1 50 ? -13.183 18.867 -19.358 1.0 64.41 50 A 9 -ATOM 775 H HD2 . PHE A1 1 50 ? -10.764 22.04 -20.84 1.0 25.0 50 A 9 -ATOM 776 H HE1 . PHE A1 1 50 ? -12.469 19.39 -17.063 1.0 33.34 50 A 9 -ATOM 777 H HE2 . PHE A1 1 50 ? -10.045 22.568 -18.546 1.0 34.14 50 A 9 -ATOM 778 H HZ . PHE A1 1 50 ? -10.899 21.243 -16.654 1.0 42.2 50 A 9 -ATOM 779 N N . GLY A1 1 51 ? -14.54 22.967 -21.527 1.0 53.44 51 A 9 -ATOM 780 C CA . GLY A1 1 51 ? -14.498 24.414 -21.62 1.0 33.5 51 A 9 -ATOM 781 C C . GLY A1 1 51 ? -15.032 24.926 -22.943 1.0 34.32 51 A 9 -ATOM 782 O O . GLY A1 1 51 ? -15.13 26.134 -23.156 1.0 0.02 51 A 9 -ATOM 783 H H . GLY A1 1 51 ? -15.214 22.533 -20.962 1.0 14.34 51 A 9 -ATOM 784 H HA2 . GLY A1 1 51 ? -15.089 24.833 -20.819 1.0 71.3 51 A 9 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.475 24.741 -21.508 1.0 2.33 51 A 9 -ATOM 786 N N . GLY A1 1 52 ? -15.378 24.004 -23.837 1.0 51.33 52 A 9 -ATOM 787 C CA . GLY A1 1 52 ? -15.899 24.388 -25.136 1.0 70.11 52 A 9 -ATOM 788 C C . GLY A1 1 52 ? -15.202 23.67 -26.275 1.0 64.35 52 A 9 -ATOM 789 O O . GLY A1 1 52 ? -15.769 23.509 -27.356 1.0 21.12 52 A 9 -ATOM 790 H H . GLY A1 1 52 ? -15.278 23.055 -23.612 1.0 52.33 52 A 9 -ATOM 791 H HA2 . GLY A1 1 52 ? -16.953 24.159 -25.17 1.0 34.31 52 A 9 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.767 25.452 -25.263 1.0 33.12 52 A 9 -ATOM 793 N N . LYS A1 1 53 ? -13.969 23.237 -26.034 1.0 4.12 53 A 9 -ATOM 794 C CA . LYS A1 1 53 ? -13.194 22.533 -27.048 1.0 20.15 53 A 9 -ATOM 795 C C . LYS A1 1 53 ? -13.362 21.023 -26.909 1.0 12.34 53 A 9 -ATOM 796 O O . LYS A1 1 53 ? -13.503 20.505 -25.802 1.0 53.3 53 A 9 -ATOM 797 C CB . LYS A1 1 53 ? -11.713 22.904 -26.936 1.0 12.13 53 A 9 -ATOM 798 C CG . LYS A1 1 53 ? -11.112 22.602 -25.574 1.0 34.42 53 A 9 -ATOM 799 C CD . LYS A1 1 53 ? -10.483 21.219 -25.537 1.0 44.0 53 A 9 -ATOM 800 C CE . LYS A1 1 53 ? -9.31 21.114 -26.499 1.0 75.53 53 A 9 -ATOM 801 N NZ . LYS A1 1 53 ? -8.114 20.506 -25.851 1.0 61.53 53 A 9 -ATOM 802 H H . LYS A1 1 53 ? -13.572 23.395 -25.152 1.0 32.12 53 A 9 -ATOM 803 H HA . LYS A1 1 53 ? -13.56 22.836 -28.016 1.0 74.23 53 A 9 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.159 22.353 -27.681 1.0 34.02 53 A 9 -ATOM 805 H HB3 . LYS A1 1 53 ? -11.604 23.962 -27.127 1.0 32.22 53 A 9 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.351 23.337 -25.355 1.0 24.24 53 A 9 -ATOM 807 H HG3 . LYS A1 1 53 ? -11.891 22.654 -24.827 1.0 53.0 53 A 9 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.132 21.02 -24.535 1.0 22.42 53 A 9 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.229 20.487 -25.811 1.0 0.05 53 A 9 -ATOM 810 H HE2 . LYS A1 1 53 ? -9.603 20.503 -27.338 1.0 25.2 53 A 9 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.056 22.105 -26.846 1.0 75.24 53 A 9 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.288 20.589 -26.477 1.0 1.33 53 A 9 -ATOM 813 H HZ2 . LYS A1 1 53 ? -8.288 19.5 -25.654 1.0 14.14 53 A 9 -ATOM 814 H HZ3 . LYS A1 1 53 ? -7.908 20.992 -24.955 1.0 31.25 53 A 9 -ATOM 815 N N . GLN A1 1 54 ? -13.343 20.324 -28.04 1.0 32.1 54 A 9 -ATOM 816 C CA . GLN A1 1 54 ? -13.493 18.874 -28.043 1.0 3.14 54 A 9 -ATOM 817 C C . GLN A1 1 54 ? -12.248 18.197 -27.48 1.0 14.5 54 A 9 -ATOM 818 O O . GLN A1 1 54 ? -11.187 18.814 -27.373 1.0 22.04 54 A 9 -ATOM 819 C CB . GLN A1 1 54 ? -13.763 18.371 -29.463 1.0 14.03 54 A 9 -ATOM 820 C CG . GLN A1 1 54 ? -15.232 18.092 -29.74 1.0 52.41 54 A 9 -ATOM 821 C CD . GLN A1 1 54 ? -15.837 19.073 -30.724 1.0 44.23 54 A 9 -ATOM 822 O OE1 . GLN A1 1 54 ? -16.302 18.687 -31.797 1.0 25.33 54 A 9 -ATOM 823 N NE2 . GLN A1 1 54 ? -15.834 20.351 -30.364 1.0 63.1 54 A 9 -ATOM 824 H H . GLN A1 1 54 ? -13.227 20.795 -28.891 1.0 52.11 54 A 9 -ATOM 825 H HA . GLN A1 1 54 ? -14.337 18.626 -27.417 1.0 62.04 54 A 9 -ATOM 826 H HB2 . GLN A1 1 54 ? -13.421 19.115 -30.166 1.0 31.24 54 A 9 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.21 17.457 -29.619 1.0 25.42 54 A 9 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.326 17.096 -30.145 1.0 52.11 54 A 9 -ATOM 829 H HG3 . GLN A1 1 54 ? -15.778 18.154 -28.81 1.0 53.52 54 A 9 -ATOM 830 H HE21 . GLN A1 1 54 ? -15.445 20.586 -29.495 1.0 45.55 54 A 9 -ATOM 831 H HE22 . GLN A1 1 54 ? -16.218 21.007 -30.981 1.0 62.42 54 A 9 -ATOM 832 N N . LEU A1 1 55 ? -12.384 16.925 -27.121 1.0 51.34 55 A 9 -ATOM 833 C CA . LEU A1 1 55 ? -11.269 16.163 -26.567 1.0 40.45 55 A 9 -ATOM 834 C C . LEU A1 1 55 ? -10.938 14.965 -27.45 1.0 63.5 55 A 9 -ATOM 835 O O . LEU A1 1 55 ? -11.812 14.164 -27.781 1.0 52.11 55 A 9 -ATOM 836 C CB . LEU A1 1 55 ? -11.602 15.691 -25.151 1.0 25.03 55 A 9 -ATOM 837 C CG . LEU A1 1 55 ? -12.194 16.744 -24.214 1.0 41.33 55 A 9 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.34 16.186 -22.807 1.0 33.24 55 A 9 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.33 17.997 -24.206 1.0 52.23 55 A 9 -ATOM 840 H H . LEU A1 1 55 ? -13.253 16.487 -27.229 1.0 12.34 55 A 9 -ATOM 841 H HA . LEU A1 1 55 ? -10.409 16.815 -26.528 1.0 22.21 55 A 9 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.312 14.883 -25.23 1.0 55.1 55 A 9 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.689 15.324 -24.703 1.0 51.11 55 A 9 -ATOM 844 H HG . LEU A1 1 55 ? -13.179 17.019 -24.568 1.0 72.12 55 A 9 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.632 15.384 -22.663 1.0 32.04 55 A 9 -ATOM 846 H HD12 . LEU A1 1 55 ? -13.343 15.809 -22.672 1.0 44.35 55 A 9 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.15 16.969 -22.088 1.0 32.21 55 A 9 -ATOM 848 H HD21 . LEU A1 1 55 ? -10.351 17.762 -24.595 1.0 33.14 55 A 9 -ATOM 849 H HD22 . LEU A1 1 55 ? -11.238 18.363 -23.194 1.0 72.01 55 A 9 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.791 18.756 -24.822 1.0 74.33 55 A 9 -ATOM 851 N N . GLU A1 1 56 ? -9.668 14.847 -27.827 1.0 12.02 56 A 9 -ATOM 852 C CA . GLU A1 1 56 ? -9.221 13.744 -28.671 1.0 31.33 56 A 9 -ATOM 853 C C . GLU A1 1 56 ? -9.236 12.428 -27.899 1.0 62.51 56 A 9 -ATOM 854 O O . GLU A1 1 56 ? -9.697 12.37 -26.759 1.0 51.02 56 A 9 -ATOM 855 C CB . GLU A1 1 56 ? -7.814 14.02 -29.205 1.0 62.01 56 A 9 -ATOM 856 C CG . GLU A1 1 56 ? -6.805 14.35 -28.119 1.0 21.02 56 A 9 -ATOM 857 C CD . GLU A1 1 56 ? -5.451 13.713 -28.367 1.0 1.0 56 A 9 -ATOM 858 O OE1 . GLU A1 1 56 ? -5.416 12.571 -28.87 1.0 61.34 56 A 9 -ATOM 859 O OE2 . GLU A1 1 56 ? -4.427 14.358 -28.059 1.0 22.01 56 A 9 -ATOM 860 H H . GLU A1 1 56 ? -9.017 15.517 -27.532 1.0 72.43 56 A 9 -ATOM 861 H HA . GLU A1 1 56 ? -9.904 13.667 -29.504 1.0 4.21 56 A 9 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.467 13.146 -29.738 1.0 41.11 56 A 9 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.86 14.853 -29.891 1.0 51.02 56 A 9 -ATOM 864 H HG2 . GLU A1 1 56 ? -6.678 15.422 -28.077 1.0 71.31 56 A 9 -ATOM 865 H HG3 . GLU A1 1 56 ? -7.185 13.996 -27.172 1.0 60.44 56 A 9 -ATOM 866 N N . ASP A1 1 57 ? -8.728 11.374 -28.529 1.0 71.03 57 A 9 -ATOM 867 C CA . ASP A1 1 57 ? -8.682 10.058 -27.902 1.0 63.41 57 A 9 -ATOM 868 C C . ASP A1 1 57 ? -7.6 10.006 -26.828 1.0 21.4 57 A 9 -ATOM 869 O O . ASP A1 1 57 ? -7.6 9.118 -25.975 1.0 43.31 57 A 9 -ATOM 870 C CB . ASP A1 1 57 ? -8.427 8.978 -28.954 1.0 45.31 57 A 9 -ATOM 871 C CG . ASP A1 1 57 ? -7.329 9.364 -29.926 1.0 55.43 57 A 9 -ATOM 872 O OD1 . ASP A1 1 57 ? -6.201 9.641 -29.468 1.0 72.35 57 A 9 -ATOM 873 O OD2 . ASP A1 1 57 ? -7.599 9.39 -31.145 1.0 15.11 57 A 9 -ATOM 874 H H . ASP A1 1 57 ? -8.376 11.484 -29.437 1.0 23.12 57 A 9 -ATOM 875 H HA . ASP A1 1 57 ? -9.64 9.878 -27.439 1.0 62.14 57 A 9 -ATOM 876 H HB2 . ASP A1 1 57 ? -8.136 8.063 -28.458 1.0 24.44 57 A 9 -ATOM 877 H HB3 . ASP A1 1 57 ? -9.335 8.807 -29.513 1.0 64.03 57 A 9 -ATOM 878 N N . SER A1 1 58 ? -6.678 10.962 -26.877 1.0 32.51 58 A 9 -ATOM 879 C CA . SER A1 1 58 ? -5.587 11.022 -25.911 1.0 62.24 58 A 9 -ATOM 880 C C . SER A1 1 58 ? -5.769 12.2 -24.958 1.0 2.12 58 A 9 -ATOM 881 O O . SER A1 1 58 ? -4.897 12.492 -24.141 1.0 12.21 58 A 9 -ATOM 882 C CB . SER A1 1 58 ? -4.244 11.139 -26.634 1.0 65.11 58 A 9 -ATOM 883 O OG . SER A1 1 58 ? -3.174 10.759 -25.786 1.0 34.21 58 A 9 -ATOM 884 H H . SER A1 1 58 ? -6.731 11.642 -27.581 1.0 21.03 58 A 9 -ATOM 885 H HA . SER A1 1 58 ? -5.6 10.106 -25.339 1.0 33.55 58 A 9 -ATOM 886 H HB2 . SER A1 1 58 ? -4.247 10.496 -27.5 1.0 31.42 58 A 9 -ATOM 887 H HB3 . SER A1 1 58 ? -4.094 12.163 -26.946 1.0 40.4 58 A 9 -ATOM 888 H HG . SER A1 1 58 ? -2.813 9.92 -26.083 1.0 10.23 58 A 9 -ATOM 889 N N . ASN A1 1 59 ? -6.909 12.873 -25.071 1.0 35.41 59 A 9 -ATOM 890 C CA . ASN A1 1 59 ? -7.207 14.02 -24.22 1.0 52.34 59 A 9 -ATOM 891 C C . ASN A1 1 59 ? -7.942 13.584 -22.957 1.0 4.01 59 A 9 -ATOM 892 O O . ASN A1 1 59 ? -9.15 13.784 -22.829 1.0 42.21 59 A 9 -ATOM 893 C CB . ASN A1 1 59 ? -8.048 15.044 -24.986 1.0 21.1 59 A 9 -ATOM 894 C CG . ASN A1 1 59 ? -7.201 16.134 -25.613 1.0 14.54 59 A 9 -ATOM 895 O OD1 . ASN A1 1 59 ? -6.008 15.947 -25.856 1.0 24.42 59 A 9 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.815 17.282 -25.878 1.0 14.44 59 A 9 -ATOM 897 H H . ASN A1 1 59 ? -7.566 12.592 -25.742 1.0 5.51 59 A 9 -ATOM 898 H HA . ASN A1 1 59 ? -6.27 14.476 -23.939 1.0 74.51 59 A 9 -ATOM 899 H HB2 . ASN A1 1 59 ? -8.59 14.54 -25.772 1.0 43.43 59 A 9 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.75 15.504 -24.307 1.0 11.21 59 A 9 -ATOM 901 H HD21 . ASN A1 1 59 ? -8.766 17.36 -25.657 1.0 21.33 59 A 9 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.291 18.003 -26.284 1.0 12.0 59 A 9 -ATOM 903 N N . ALA A1 1 60 ? -7.205 12.988 -22.025 1.0 13.11 60 A 9 -ATOM 904 C CA . ALA A1 1 60 ? -7.786 12.527 -20.771 1.0 35.51 60 A 9 -ATOM 905 C C . ALA A1 1 60 ? -6.703 12.074 -19.798 1.0 74.01 60 A 9 -ATOM 906 O O . ALA A1 1 60 ? -6.297 12.826 -18.913 1.0 74.24 60 A 9 -ATOM 907 C CB . ALA A1 1 60 ? -8.771 11.396 -21.03 1.0 64.13 60 A 9 -ATOM 908 H H . ALA A1 1 60 ? -6.247 12.858 -22.185 1.0 31.12 60 A 9 -ATOM 909 H HA . ALA A1 1 60 ? -8.329 13.351 -20.331 1.0 20.01 60 A 9 -ATOM 910 H HB1 . ALA A1 1 60 ? -9.177 11.051 -20.09 1.0 72.33 60 A 9 -ATOM 911 H HB2 . ALA A1 1 60 ? -9.573 11.755 -21.658 1.0 25.02 60 A 9 -ATOM 912 H HB3 . ALA A1 1 60 ? -8.263 10.582 -21.524 1.0 51.02 60 A 9 -ATOM 913 N N . MET A1 1 61 ? -6.24 10.84 -19.968 1.0 21.52 61 A 9 -ATOM 914 C CA . MET A1 1 61 ? -5.203 10.288 -19.104 1.0 32.03 61 A 9 -ATOM 915 C C . MET A1 1 61 ? -3.826 10.805 -19.508 1.0 55.14 61 A 9 -ATOM 916 O O . MET A1 1 61 ? -3.1 11.37 -18.69 1.0 73.23 61 A 9 -ATOM 917 C CB . MET A1 1 61 ? -5.222 8.759 -19.16 1.0 33.12 61 A 9 -ATOM 918 C CG . MET A1 1 61 ? -6.621 8.172 -19.255 1.0 10.31 61 A 9 -ATOM 919 S SD . MET A1 1 61 ? -7.746 8.856 -18.022 1.0 3.45 61 A 9 -ATOM 920 C CE . MET A1 1 61 ? -9.306 8.761 -18.897 1.0 11.34 61 A 9 -ATOM 921 H H . MET A1 1 61 ? -6.603 10.287 -20.691 1.0 44.35 61 A 9 -ATOM 922 H HA . MET A1 1 61 ? -5.411 10.604 -18.093 1.0 14.21 61 A 9 -ATOM 923 H HB2 . MET A1 1 61 ? -4.66 8.435 -20.023 1.0 14.23 61 A 9 -ATOM 924 H HB3 . MET A1 1 61 ? -4.753 8.371 -18.269 1.0 0.24 61 A 9 -ATOM 925 H HG2 . MET A1 1 61 ? -7.019 8.379 -20.237 1.0 62.14 61 A 9 -ATOM 926 H HG3 . MET A1 1 61 ? -6.559 7.104 -19.112 1.0 32.0 61 A 9 -ATOM 927 H HE1 . MET A1 1 61 ? -9.85 7.887 -18.567 1.0 54.23 61 A 9 -ATOM 928 H HE2 . MET A1 1 61 ? -9.888 9.646 -18.692 1.0 64.31 61 A 9 -ATOM 929 H HE3 . MET A1 1 61 ? -9.119 8.69 -19.958 1.0 24.11 61 A 9 -ATOM 930 N N . SER A1 1 62 ? -3.473 10.609 -20.775 1.0 73.15 62 A 9 -ATOM 931 C CA . SER A1 1 62 ? -2.182 11.053 -21.286 1.0 12.22 62 A 9 -ATOM 932 C C . SER A1 1 62 ? -2.007 12.556 -21.09 1.0 13.52 62 A 9 -ATOM 933 O O . SER A1 1 62 ? -0.896 13.039 -20.867 1.0 42.51 62 A 9 -ATOM 934 C CB . SER A1 1 62 ? -2.049 10.702 -22.769 1.0 62.33 62 A 9 -ATOM 935 O OG . SER A1 1 62 ? -0.721 10.319 -23.085 1.0 14.13 62 A 9 -ATOM 936 H H . SER A1 1 62 ? -4.096 10.153 -21.379 1.0 74.25 62 A 9 -ATOM 937 H HA . SER A1 1 62 ? -1.411 10.537 -20.732 1.0 74.15 62 A 9 -ATOM 938 H HB2 . SER A1 1 62 ? -2.712 9.883 -23.003 1.0 54.41 62 A 9 -ATOM 939 H HB3 . SER A1 1 62 ? -2.315 11.563 -23.365 1.0 23.45 62 A 9 -ATOM 940 H HG . SER A1 1 62 ? -0.588 9.399 -22.848 1.0 1.23 62 A 9 -ATOM 941 N N . ASP A1 1 63 ? -3.111 13.289 -21.174 1.0 34.33 63 A 9 -ATOM 942 C CA . ASP A1 1 63 ? -3.082 14.737 -21.005 1.0 10.21 63 A 9 -ATOM 943 C C . ASP A1 1 63 ? -2.595 15.112 -19.608 1.0 63.54 63 A 9 -ATOM 944 O O . ASP A1 1 63 ? -2.068 16.204 -19.396 1.0 31.33 63 A 9 -ATOM 945 C CB . ASP A1 1 63 ? -4.471 15.329 -21.249 1.0 21.1 63 A 9 -ATOM 946 C CG . ASP A1 1 63 ? -4.418 16.799 -21.616 1.0 12.2 63 A 9 -ATOM 947 O OD1 . ASP A1 1 63 ? -4.04 17.614 -20.748 1.0 53.24 63 A 9 -ATOM 948 O OD2 . ASP A1 1 63 ? -4.753 17.134 -22.771 1.0 3.13 63 A 9 -ATOM 949 H H . ASP A1 1 63 ? -3.967 12.846 -21.353 1.0 14.4 63 A 9 -ATOM 950 H HA . ASP A1 1 63 ? -2.395 15.143 -21.732 1.0 72.42 63 A 9 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.946 14.793 -22.058 1.0 63.34 63 A 9 -ATOM 952 H HB3 . ASP A1 1 63 ? -5.064 15.221 -20.353 1.0 44.51 63 A 9 -ATOM 953 N N . TYR A1 1 64 ? -2.775 14.199 -18.66 1.0 43.15 64 A 9 -ATOM 954 C CA . TYR A1 1 64 ? -2.357 14.435 -17.283 1.0 74.44 64 A 9 -ATOM 955 C C . TYR A1 1 64 ? -3.354 15.332 -16.557 1.0 35.31 64 A 9 -ATOM 956 O O . TYR A1 1 64 ? -3.026 15.952 -15.546 1.0 63.11 64 A 9 -ATOM 957 C CB . TYR A1 1 64 ? -0.965 15.069 -17.252 1.0 41.31 64 A 9 -ATOM 958 C CG . TYR A1 1 64 ? -0.188 14.763 -15.992 1.0 35.31 64 A 9 -ATOM 959 C CD1 . TYR A1 1 64 ? 0.232 13.47 -15.708 1.0 10.21 64 A 9 -ATOM 960 C CD2 . TYR A1 1 64 ? 0.126 15.768 -15.085 1.0 61.0 64 A 9 -ATOM 961 C CE1 . TYR A1 1 64 ? 0.942 13.186 -14.557 1.0 31.32 64 A 9 -ATOM 962 C CE2 . TYR A1 1 64 ? 0.836 15.494 -13.932 1.0 3.01 64 A 9 -ATOM 963 C CZ . TYR A1 1 64 ? 1.241 14.201 -13.673 1.0 35.43 64 A 9 -ATOM 964 O OH . TYR A1 1 64 ? 1.949 13.922 -12.526 1.0 23.32 64 A 9 -ATOM 965 H H . TYR A1 1 64 ? -3.2 13.347 -18.891 1.0 10.22 64 A 9 -ATOM 966 H HA . TYR A1 1 64 ? -2.317 13.479 -16.781 1.0 40.51 64 A 9 -ATOM 967 H HB2 . TYR A1 1 64 ? -0.392 14.705 -18.091 1.0 75.32 64 A 9 -ATOM 968 H HB3 . TYR A1 1 64 ? -1.065 16.142 -17.329 1.0 32.34 64 A 9 -ATOM 969 H HD1 . TYR A1 1 64 ? -0.004 12.677 -16.403 1.0 1.35 64 A 9 -ATOM 970 H HD2 . TYR A1 1 64 ? -0.193 16.78 -15.291 1.0 32.41 64 A 9 -ATOM 971 H HE1 . TYR A1 1 64 ? 1.259 12.174 -14.354 1.0 52.21 64 A 9 -ATOM 972 H HE2 . TYR A1 1 64 ? 1.071 16.288 -13.239 1.0 43.14 64 A 9 -ATOM 973 H HH . TYR A1 1 64 ? 1.492 13.242 -12.025 1.0 23.33 64 A 9 -ATOM 974 N N . ASN A1 1 65 ? -4.573 15.397 -17.082 1.0 61.21 65 A 9 -ATOM 975 C CA . ASN A1 1 65 ? -5.62 16.218 -16.485 1.0 70.22 65 A 9 -ATOM 976 C C . ASN A1 1 65 ? -6.684 15.347 -15.824 1.0 21.44 65 A 9 -ATOM 977 O O . ASN A1 1 65 ? -7.76 15.827 -15.466 1.0 22.24 65 A 9 -ATOM 978 C CB . ASN A1 1 65 ? -6.264 17.112 -17.547 1.0 30.31 65 A 9 -ATOM 979 C CG . ASN A1 1 65 ? -7.143 18.189 -16.94 1.0 75.23 65 A 9 -ATOM 980 O OD1 . ASN A1 1 65 ? -6.845 18.718 -15.87 1.0 74.2 65 A 9 -ATOM 981 N ND2 . ASN A1 1 65 ? -8.233 18.517 -17.624 1.0 12.4 65 A 9 -ATOM 982 H H . ASN A1 1 65 ? -4.774 14.88 -17.89 1.0 72.01 65 A 9 -ATOM 983 H HA . ASN A1 1 65 ? -5.163 16.841 -15.731 1.0 43.44 65 A 9 -ATOM 984 H HB2 . ASN A1 1 65 ? -5.487 17.592 -18.124 1.0 12.24 65 A 9 -ATOM 985 H HB3 . ASN A1 1 65 ? -6.87 16.504 -18.201 1.0 73.02 65 A 9 -ATOM 986 H HD21 . ASN A1 1 65 ? -8.406 18.053 -18.47 1.0 23.44 65 A 9 -ATOM 987 H HD22 . ASN A1 1 65 ? -8.818 19.211 -17.256 1.0 32.24 65 A 9 -ATOM 988 N N . VAL A1 1 66 ? -6.376 14.064 -15.664 1.0 11.4 66 A 9 -ATOM 989 C CA . VAL A1 1 66 ? -7.304 13.126 -15.044 1.0 70.45 66 A 9 -ATOM 990 C C . VAL A1 1 66 ? -7.179 13.152 -13.525 1.0 73.11 66 A 9 -ATOM 991 O O . VAL A1 1 66 ? -6.103 12.915 -12.977 1.0 33.12 66 A 9 -ATOM 992 C CB . VAL A1 1 66 ? -7.066 11.689 -15.543 1.0 40.11 66 A 9 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.643 11.246 -15.236 1.0 32.21 66 A 9 -ATOM 994 C CG2 . VAL A1 1 66 ? -8.075 10.735 -14.921 1.0 25.13 66 A 9 -ATOM 995 H H . VAL A1 1 66 ? -5.502 13.741 -15.969 1.0 25.31 66 A 9 -ATOM 996 H HA . VAL A1 1 66 ? -8.307 13.419 -15.318 1.0 44.24 66 A 9 -ATOM 997 H HB . VAL A1 1 66 ? -7.201 11.674 -16.614 1.0 65.05 66 A 9 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.664 10.456 -14.499 1.0 62.5 66 A 9 -ATOM 999 H HG12 . VAL A1 1 66 ? -5.176 10.884 -16.14 1.0 4.5 66 A 9 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.081 12.083 -14.85 1.0 12.32 66 A 9 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.068 10.852 -13.848 1.0 23.4 66 A 9 -ATOM 1002 H HG22 . VAL A1 1 66 ? -9.061 10.959 -15.302 1.0 64.2 66 A 9 -ATOM 1003 H HG23 . VAL A1 1 66 ? -7.814 9.718 -15.175 1.0 74.31 66 A 9 -ATOM 1004 N N . GLN A1 1 67 ? -8.288 13.442 -12.851 1.0 5.43 67 A 9 -ATOM 1005 C CA . GLN A1 1 67 ? -8.302 13.499 -11.394 1.0 15.5 67 A 9 -ATOM 1006 C C . GLN A1 1 67 ? -9.326 12.525 -10.821 1.0 62.54 67 A 9 -ATOM 1007 O O . GLN A1 1 67 ? -9.976 11.784 -11.559 1.0 44.01 67 A 9 -ATOM 1008 C CB . GLN A1 1 67 ? -8.613 14.92 -10.921 1.0 35.11 67 A 9 -ATOM 1009 C CG . GLN A1 1 67 ? -10.002 15.4 -11.31 1.0 11.21 67 A 9 -ATOM 1010 C CD . GLN A1 1 67 ? -10.439 16.621 -10.524 1.0 34.44 67 A 9 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.642 17.697 -11.088 1.0 41.54 67 A 9 -ATOM 1012 N NE2 . GLN A1 1 67 ? -10.585 16.461 -9.214 1.0 50.51 67 A 9 -ATOM 1013 H H . GLN A1 1 67 ? -9.114 13.621 -13.344 1.0 54.23 67 A 9 -ATOM 1014 H HA . GLN A1 1 67 ? -7.321 13.219 -11.041 1.0 21.13 67 A 9 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.531 14.955 -9.845 1.0 61.05 67 A 9 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.889 15.596 -11.351 1.0 21.05 67 A 9 -ATOM 1017 H HG2 . GLN A1 1 67 ? -10.002 15.649 -12.361 1.0 63.24 67 A 9 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.708 14.603 -11.13 1.0 63.02 67 A 9 -ATOM 1019 H HE21 . GLN A1 1 67 ? -10.405 15.576 -8.833 1.0 0.12 67 A 9 -ATOM 1020 H HE22 . GLN A1 1 67 ? -10.866 17.234 -8.682 1.0 72.41 67 A 9 -ATOM 1021 N N . LYS A1 1 68 ? -9.465 12.529 -9.499 1.0 63.33 68 A 9 -ATOM 1022 C CA . LYS A1 1 68 ? -10.41 11.647 -8.826 1.0 34.0 68 A 9 -ATOM 1023 C C . LYS A1 1 68 ? -11.847 12.013 -9.184 1.0 33.21 68 A 9 -ATOM 1024 O O . LYS A1 1 68 ? -12.726 11.152 -9.217 1.0 33.01 68 A 9 -ATOM 1025 C CB . LYS A1 1 68 ? -10.217 11.721 -7.309 1.0 41.41 68 A 9 -ATOM 1026 C CG . LYS A1 1 68 ? -10.817 10.543 -6.561 1.0 61.44 68 A 9 -ATOM 1027 C CD . LYS A1 1 68 ? -10.066 9.255 -6.855 1.0 43.41 68 A 9 -ATOM 1028 C CE . LYS A1 1 68 ? -8.825 9.123 -5.987 1.0 23.43 68 A 9 -ATOM 1029 N NZ . LYS A1 1 68 ? -9.163 9.09 -4.537 1.0 52.05 68 A 9 -ATOM 1030 H H . LYS A1 1 68 ? -8.918 13.142 -8.964 1.0 75.53 68 A 9 -ATOM 1031 H HA . LYS A1 1 68 ? -10.215 10.638 -9.156 1.0 31.4 68 A 9 -ATOM 1032 H HB2 . LYS A1 1 68 ? -9.159 11.756 -7.094 1.0 51.5 68 A 9 -ATOM 1033 H HB3 . LYS A1 1 68 ? -10.68 12.626 -6.944 1.0 62.4 68 A 9 -ATOM 1034 H HG2 . LYS A1 1 68 ? -10.77 10.74 -5.501 1.0 22.33 68 A 9 -ATOM 1035 H HG3 . LYS A1 1 68 ? -11.848 10.425 -6.862 1.0 45.02 68 A 9 -ATOM 1036 H HD2 . LYS A1 1 68 ? -10.718 8.416 -6.661 1.0 14.2 68 A 9 -ATOM 1037 H HD3 . LYS A1 1 68 ? -9.77 9.251 -7.895 1.0 13.53 68 A 9 -ATOM 1038 H HE2 . LYS A1 1 68 ? -8.313 8.21 -6.249 1.0 43.13 68 A 9 -ATOM 1039 H HE3 . LYS A1 1 68 ? -8.177 9.966 -6.177 1.0 63.42 68 A 9 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.446 8.547 -4.015 1.0 1.54 68 A 9 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -10.091 8.642 -4.397 1.0 73.32 68 A 9 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.197 10.056 -4.155 1.0 23.44 68 A 9 -ATOM 1043 N N . GLU A1 1 69 ? -12.076 13.294 -9.455 1.0 51.1 69 A 9 -ATOM 1044 C CA . GLU A1 1 69 ? -13.407 13.772 -9.812 1.0 15.41 69 A 9 -ATOM 1045 C C . GLU A1 1 69 ? -13.322 14.921 -10.812 1.0 20.25 69 A 9 -ATOM 1046 O O . GLU A1 1 69 ? -13.444 16.089 -10.444 1.0 55.15 69 A 9 -ATOM 1047 C CB . GLU A1 1 69 ? -14.163 14.224 -8.561 1.0 42.14 69 A 9 -ATOM 1048 C CG . GLU A1 1 69 ? -13.333 15.088 -7.627 1.0 32.44 69 A 9 -ATOM 1049 C CD . GLU A1 1 69 ? -14.186 15.95 -6.717 1.0 60.3 69 A 9 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.659 15.434 -5.682 1.0 52.11 69 A 9 -ATOM 1051 O OE2 . GLU A1 1 69 ? -14.38 17.141 -7.039 1.0 33.22 69 A 9 -ATOM 1052 H H . GLU A1 1 69 ? -11.334 13.932 -9.412 1.0 51.55 69 A 9 -ATOM 1053 H HA . GLU A1 1 69 ? -13.942 12.953 -10.268 1.0 21.13 69 A 9 -ATOM 1054 H HB2 . GLU A1 1 69 ? -15.032 14.79 -8.865 1.0 70.35 69 A 9 -ATOM 1055 H HB3 . GLU A1 1 69 ? -14.488 13.35 -8.016 1.0 25.14 69 A 9 -ATOM 1056 H HG2 . GLU A1 1 69 ? -12.717 14.445 -7.015 1.0 60.54 69 A 9 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.7 15.732 -8.22 1.0 2.43 69 A 9 -ATOM 1058 N N . SER A1 1 70 ? -13.111 14.58 -12.08 1.0 51.41 70 A 9 -ATOM 1059 C CA . SER A1 1 70 ? -13.005 15.583 -13.133 1.0 50.24 70 A 9 -ATOM 1060 C C . SER A1 1 70 ? -14.359 15.82 -13.796 1.0 72.1 70 A 9 -ATOM 1061 O O . SER A1 1 70 ? -15.014 14.882 -14.251 1.0 13.02 70 A 9 -ATOM 1062 C CB . SER A1 1 70 ? -11.981 15.145 -14.182 1.0 75.43 70 A 9 -ATOM 1063 O OG . SER A1 1 70 ? -11.057 16.184 -14.458 1.0 45.33 70 A 9 -ATOM 1064 H H . SER A1 1 70 ? -13.023 13.632 -12.311 1.0 42.55 70 A 9 -ATOM 1065 H HA . SER A1 1 70 ? -12.672 16.505 -12.681 1.0 61.25 70 A 9 -ATOM 1066 H HB2 . SER A1 1 70 ? -11.44 14.286 -13.816 1.0 1.23 70 A 9 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.495 14.884 -15.096 1.0 50.33 70 A 9 -ATOM 1068 H HG . SER A1 1 70 ? -11.053 16.367 -15.4 1.0 14.24 70 A 9 -ATOM 1069 N N . THR A1 1 71 ? -14.773 17.083 -13.846 1.0 52.55 71 A 9 -ATOM 1070 C CA . THR A1 1 71 ? -16.048 17.445 -14.451 1.0 43.33 71 A 9 -ATOM 1071 C C . THR A1 1 71 ? -15.871 17.841 -15.912 1.0 63.44 71 A 9 -ATOM 1072 O O . THR A1 1 71 ? -15.23 18.847 -16.22 1.0 13.52 71 A 9 -ATOM 1073 C CB . THR A1 1 71 ? -16.719 18.607 -13.694 1.0 4.41 71 A 9 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.726 19.529 -13.233 1.0 4.41 71 A 9 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.525 18.088 -12.512 1.0 4.35 71 A 9 -ATOM 1076 H H . THR A1 1 71 ? -14.206 17.786 -13.466 1.0 14.04 71 A 9 -ATOM 1077 H HA . THR A1 1 71 ? -16.699 16.584 -14.398 1.0 24.13 71 A 9 -ATOM 1078 H HB . THR A1 1 71 ? -17.389 19.118 -14.37 1.0 70.41 71 A 9 -ATOM 1079 H HG1 . THR A1 1 71 ? -16.147 20.22 -12.715 1.0 53.11 71 A 9 -ATOM 1080 H HG21 . THR A1 1 71 ? -18.522 17.837 -12.839 1.0 12.42 71 A 9 -ATOM 1081 H HG22 . THR A1 1 71 ? -17.579 18.852 -11.75 1.0 75.2 71 A 9 -ATOM 1082 H HG23 . THR A1 1 71 ? -17.046 17.209 -12.108 1.0 31.12 71 A 9 -ATOM 1083 N N . LEU A1 1 72 ? -16.442 17.045 -16.81 1.0 74.32 72 A 9 -ATOM 1084 C CA . LEU A1 1 72 ? -16.348 17.314 -18.24 1.0 62.12 72 A 9 -ATOM 1085 C C . LEU A1 1 72 ? -17.729 17.308 -18.888 1.0 14.1 72 A 9 -ATOM 1086 O O . LEU A1 1 72 ? -18.652 16.655 -18.4 1.0 22.33 72 A 9 -ATOM 1087 C CB . LEU A1 1 72 ? -15.451 16.275 -18.916 1.0 54.24 72 A 9 -ATOM 1088 C CG . LEU A1 1 72 ? -16.164 15.065 -19.521 1.0 12.34 72 A 9 -ATOM 1089 C CD1 . LEU A1 1 72 ? -16.349 15.248 -21.019 1.0 71.53 72 A 9 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.387 13.789 -19.23 1.0 45.31 72 A 9 -ATOM 1091 H H . LEU A1 1 72 ? -16.939 16.259 -16.504 1.0 40.44 72 A 9 -ATOM 1092 H HA . LEU A1 1 72 ? -15.909 18.292 -18.365 1.0 22.23 72 A 9 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.91 16.77 -19.708 1.0 24.33 72 A 9 -ATOM 1094 H HB3 . LEU A1 1 72 ? -14.751 15.913 -18.177 1.0 64.44 72 A 9 -ATOM 1095 H HG . LEU A1 1 72 ? -17.143 14.971 -19.073 1.0 60.22 72 A 9 -ATOM 1096 H HD11 . LEU A1 1 72 ? -15.388 15.407 -21.484 1.0 22.12 72 A 9 -ATOM 1097 H HD12 . LEU A1 1 72 ? -16.983 16.104 -21.201 1.0 11.12 72 A 9 -ATOM 1098 H HD13 . LEU A1 1 72 ? -16.81 14.364 -21.435 1.0 74.11 72 A 9 -ATOM 1099 H HD21 . LEU A1 1 72 ? -14.53 13.732 -19.885 1.0 45.11 72 A 9 -ATOM 1100 H HD22 . LEU A1 1 72 ? -16.026 12.934 -19.397 1.0 64.51 72 A 9 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.056 13.795 -18.202 1.0 15.53 72 A 9 -ATOM 1102 N N . HIS A1 1 73 ? -17.863 18.038 -19.99 1.0 22.1 73 A 9 -ATOM 1103 C CA . HIS A1 1 73 ? -19.131 18.115 -20.707 1.0 43.22 73 A 9 -ATOM 1104 C C . HIS A1 1 73 ? -19.16 17.126 -21.868 1.0 1.12 73 A 9 -ATOM 1105 O O . HIS A1 1 73 ? -18.334 17.197 -22.779 1.0 41.41 73 A 9 -ATOM 1106 C CB . HIS A1 1 73 ? -19.363 19.535 -21.226 1.0 34.11 73 A 9 -ATOM 1107 C CG . HIS A1 1 73 ? -20.8 19.84 -21.515 1.0 25.31 73 A 9 -ATOM 1108 N ND1 . HIS A1 1 73 ? -21.35 21.094 -21.357 1.0 22.31 73 A 9 -ATOM 1109 C CD2 . HIS A1 1 73 ? -21.802 19.044 -21.957 1.0 30.12 73 A 9 -ATOM 1110 C CE1 . HIS A1 1 73 ? -22.629 21.057 -21.687 1.0 74.03 73 A 9 -ATOM 1111 N NE2 . HIS A1 1 73 ? -22.928 19.824 -22.056 1.0 22.32 73 A 9 -ATOM 1112 H H . HIS A1 1 73 ? -17.091 18.537 -20.33 1.0 41.1 73 A 9 -ATOM 1113 H HA . HIS A1 1 73 ? -19.919 17.862 -20.014 1.0 23.25 73 A 9 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.016 20.242 -20.486 1.0 51.13 73 A 9 -ATOM 1115 H HB3 . HIS A1 1 73 ? -18.803 19.673 -22.139 1.0 64.13 73 A 9 -ATOM 1116 H HD1 . HIS A1 1 73 ? -20.875 21.892 -21.046 1.0 63.31 73 A 9 -ATOM 1117 H HD2 . HIS A1 1 73 ? -21.731 17.991 -22.189 1.0 71.43 73 A 9 -ATOM 1118 H HE1 . HIS A1 1 73 ? -23.313 21.891 -21.661 1.0 3.34 73 A 9 -ATOM 1119 N N . LEU A1 1 74 ? -20.115 16.203 -21.829 1.0 31.4 74 A 9 -ATOM 1120 C CA . LEU A1 1 74 ? -20.252 15.198 -22.877 1.0 41.22 74 A 9 -ATOM 1121 C C . LEU A1 1 74 ? -21.463 15.49 -23.757 1.0 21.0 74 A 9 -ATOM 1122 O O . LEU A1 1 74 ? -22.601 15.484 -23.286 1.0 70.53 74 A 9 -ATOM 1123 C CB . LEU A1 1 74 ? -20.378 13.804 -22.261 1.0 42.32 74 A 9 -ATOM 1124 C CG . LEU A1 1 74 ? -21.085 12.753 -23.118 1.0 13.02 74 A 9 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.424 12.644 -24.483 1.0 50.12 74 A 9 -ATOM 1126 C CD2 . LEU A1 1 74 ? -21.086 11.404 -22.414 1.0 22.4 74 A 9 -ATOM 1127 H H . LEU A1 1 74 ? -20.744 16.197 -21.078 1.0 53.04 74 A 9 -ATOM 1128 H HA . LEU A1 1 74 ? -19.362 15.234 -23.488 1.0 65.43 74 A 9 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.382 13.444 -22.052 1.0 22.02 74 A 9 -ATOM 1130 H HB3 . LEU A1 1 74 ? -20.926 13.901 -21.335 1.0 20.31 74 A 9 -ATOM 1131 H HG . LEU A1 1 74 ? -22.113 13.053 -23.268 1.0 34.12 74 A 9 -ATOM 1132 H HD11 . LEU A1 1 74 ? -19.387 12.932 -24.405 1.0 33.01 74 A 9 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.928 13.298 -25.18 1.0 1.34 74 A 9 -ATOM 1134 H HD13 . LEU A1 1 74 ? -20.49 11.625 -24.834 1.0 63.14 74 A 9 -ATOM 1135 H HD21 . LEU A1 1 74 ? -20.074 11.138 -22.145 1.0 12.32 74 A 9 -ATOM 1136 H HD22 . LEU A1 1 74 ? -21.492 10.653 -23.076 1.0 54.43 74 A 9 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.693 11.463 -21.522 1.0 14.02 74 A 9 -ATOM 1138 N N . VAL A1 1 75 ? -21.212 15.742 -25.037 1.0 43.5 75 A 9 -ATOM 1139 C CA . VAL A1 1 75 ? -22.282 16.032 -25.984 1.0 52.32 75 A 9 -ATOM 1140 C C . VAL A1 1 75 ? -22.448 14.9 -26.991 1.0 61.15 75 A 9 -ATOM 1141 O O . VAL A1 1 75 ? -21.483 14.476 -27.629 1.0 54.31 75 A 9 -ATOM 1142 C CB . VAL A1 1 75 ? -22.019 17.346 -26.744 1.0 24.5 75 A 9 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.204 17.697 -27.63 1.0 55.3 75 A 9 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.719 18.474 -25.769 1.0 64.14 75 A 9 -ATOM 1145 H H . VAL A1 1 75 ? -20.284 15.732 -25.353 1.0 70.11 75 A 9 -ATOM 1146 H HA . VAL A1 1 75 ? -23.201 16.142 -25.426 1.0 60.52 75 A 9 -ATOM 1147 H HB . VAL A1 1 75 ? -21.154 17.205 -27.376 1.0 44.41 75 A 9 -ATOM 1148 H HG11 . VAL A1 1 75 ? -23.629 18.636 -27.307 1.0 31.54 75 A 9 -ATOM 1149 H HG12 . VAL A1 1 75 ? -22.874 17.784 -28.655 1.0 61.34 75 A 9 -ATOM 1150 H HG13 . VAL A1 1 75 ? -23.951 16.92 -27.557 1.0 54.52 75 A 9 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.787 19.422 -26.282 1.0 5.24 75 A 9 -ATOM 1152 H HG22 . VAL A1 1 75 ? -22.434 18.45 -24.96 1.0 61.35 75 A 9 -ATOM 1153 H HG23 . VAL A1 1 75 ? -20.722 18.351 -25.371 1.0 24.43 75 A 9 -ATOM 1154 N N . LEU A1 1 76 ? -23.676 14.414 -27.129 1.0 35.1 76 A 9 -ATOM 1155 C CA . LEU A1 1 76 ? -23.969 13.329 -28.06 1.0 22.53 76 A 9 -ATOM 1156 C C . LEU A1 1 76 ? -25.073 13.73 -29.034 1.0 2.14 76 A 9 -ATOM 1157 O O . LEU A1 1 76 ? -26.07 14.336 -28.641 1.0 21.5 76 A 9 -ATOM 1158 C CB . LEU A1 1 76 ? -24.381 12.071 -27.294 1.0 73.12 76 A 9 -ATOM 1159 C CG . LEU A1 1 76 ? -24.311 12.16 -25.769 1.0 64.45 76 A 9 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.526 12.891 -25.221 1.0 24.13 76 A 9 -ATOM 1161 C CD2 . LEU A1 1 76 ? -24.202 10.77 -25.159 1.0 22.03 76 A 9 -ATOM 1162 H H . LEU A1 1 76 ? -24.404 14.792 -26.594 1.0 44.32 76 A 9 -ATOM 1163 H HA . LEU A1 1 76 ? -23.07 13.121 -28.62 1.0 53.04 76 A 9 -ATOM 1164 H HB2 . LEU A1 1 76 ? -25.4 11.838 -27.565 1.0 71.31 76 A 9 -ATOM 1165 H HB3 . LEU A1 1 76 ? -23.734 11.265 -27.61 1.0 62.14 76 A 9 -ATOM 1166 H HG . LEU A1 1 76 ? -23.43 12.72 -25.488 1.0 42.11 76 A 9 -ATOM 1167 H HD11 . LEU A1 1 76 ? -25.784 12.486 -24.254 1.0 12.14 76 A 9 -ATOM 1168 H HD12 . LEU A1 1 76 ? -26.358 12.766 -25.898 1.0 23.21 76 A 9 -ATOM 1169 H HD13 . LEU A1 1 76 ? -25.299 13.943 -25.122 1.0 40.2 76 A 9 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.313 10.714 -24.548 1.0 53.24 76 A 9 -ATOM 1171 H HD22 . LEU A1 1 76 ? -24.144 10.035 -25.947 1.0 72.02 76 A 9 -ATOM 1172 H HD23 . LEU A1 1 76 ? -25.072 10.576 -24.548 1.0 63.4 76 A 9 -ATOM 1173 N N . ARG A1 1 77 ? -24.888 13.387 -30.304 1.0 50.44 77 A 9 -ATOM 1174 C CA . ARG A1 1 77 ? -25.868 13.71 -31.333 1.0 12.4 77 A 9 -ATOM 1175 C C . ARG A1 1 77 ? -26.539 12.446 -31.862 1.0 10.32 77 A 9 -ATOM 1176 O O . ARG A1 1 77 ? -26.292 12.024 -32.992 1.0 12.43 77 A 9 -ATOM 1177 C CB . ARG A1 1 77 ? -25.201 14.465 -32.484 1.0 55.35 77 A 9 -ATOM 1178 C CG . ARG A1 1 77 ? -24.389 15.669 -32.034 1.0 12.22 77 A 9 -ATOM 1179 C CD . ARG A1 1 77 ? -22.934 15.55 -32.458 1.0 60.22 77 A 9 -ATOM 1180 N NE . ARG A1 1 77 ? -22.372 16.839 -32.853 1.0 64.33 77 A 9 -ATOM 1181 C CZ . ARG A1 1 77 ? -21.288 16.967 -33.61 1.0 13.31 77 A 9 -ATOM 1182 N NH1 . ARG A1 1 77 ? -20.654 15.89 -34.053 1.0 63.3 77 A 9 -ATOM 1183 N NH2 . ARG A1 1 77 ? -20.837 18.174 -33.927 1.0 70.54 77 A 9 -ATOM 1184 H H . ARG A1 1 77 ? -24.072 12.905 -30.555 1.0 2.41 77 A 9 -ATOM 1185 H HA . ARG A1 1 77 ? -26.621 14.344 -30.888 1.0 53.23 77 A 9 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.54 13.789 -33.008 1.0 41.04 77 A 9 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.965 14.808 -33.165 1.0 23.23 77 A 9 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.809 16.56 -32.475 1.0 3.21 77 A 9 -ATOM 1189 H HG3 . ARG A1 1 77 ? -24.437 15.741 -30.958 1.0 45.32 77 A 9 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.362 15.157 -31.63 1.0 24.22 77 A 9 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.871 14.869 -33.294 1.0 55.12 77 A 9 -ATOM 1192 H HE . ARG A1 1 77 ? -22.825 17.647 -32.537 1.0 41.44 77 A 9 -ATOM 1193 H HH11 . ARG A1 1 77 ? -20.991 14.979 -33.817 1.0 31.24 77 A 9 -ATOM 1194 H HH12 . ARG A1 1 77 ? -19.839 15.989 -34.625 1.0 72.5 77 A 9 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.313 18.988 -33.595 1.0 71.34 77 A 9 -ATOM 1196 H HH22 . ARG A1 1 77 ? -20.022 18.269 -34.497 1.0 1.44 77 A 9 -ATOM 1197 N N . LEU A1 1 78 ? -27.389 11.845 -31.036 1.0 31.03 78 A 9 -ATOM 1198 C CA . LEU A1 1 78 ? -28.096 10.628 -31.42 1.0 51.32 78 A 9 -ATOM 1199 C C . LEU A1 1 78 ? -29.222 10.938 -32.401 1.0 14.11 78 A 9 -ATOM 1200 O O . LEU A1 1 78 ? -29.411 10.227 -33.389 1.0 12.31 78 A 9 -ATOM 1201 C CB . LEU A1 1 78 ? -28.662 9.931 -30.181 1.0 42.51 78 A 9 -ATOM 1202 C CG . LEU A1 1 78 ? -27.692 9.032 -29.414 1.0 51.45 78 A 9 -ATOM 1203 C CD1 . LEU A1 1 78 ? -26.573 9.856 -28.798 1.0 14.44 78 A 9 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.43 8.244 -28.342 1.0 25.32 78 A 9 -ATOM 1205 H H . LEU A1 1 78 ? -27.546 12.227 -30.148 1.0 75.31 78 A 9 -ATOM 1206 H HA . LEU A1 1 78 ? -27.387 9.97 -31.9 1.0 64.2 78 A 9 -ATOM 1207 H HB2 . LEU A1 1 78 ? -29.011 10.695 -29.503 1.0 61.14 78 A 9 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.499 9.325 -30.497 1.0 62.32 78 A 9 -ATOM 1209 H HG . LEU A1 1 78 ? -27.246 8.326 -30.102 1.0 53.42 78 A 9 -ATOM 1210 H HD11 . LEU A1 1 78 ? -26.997 10.637 -28.185 1.0 3.24 78 A 9 -ATOM 1211 H HD12 . LEU A1 1 78 ? -25.977 10.298 -29.582 1.0 74.14 78 A 9 -ATOM 1212 H HD13 . LEU A1 1 78 ? -25.95 9.218 -28.189 1.0 11.41 78 A 9 -ATOM 1213 H HD21 . LEU A1 1 78 ? -27.79 8.122 -27.481 1.0 65.32 78 A 9 -ATOM 1214 H HD22 . LEU A1 1 78 ? -28.7 7.273 -28.731 1.0 65.43 78 A 9 -ATOM 1215 H HD23 . LEU A1 1 78 ? -29.324 8.778 -28.054 1.0 34.04 78 A 9 -ATOM 1216 N N . ARG A1 1 79 ? -29.964 12.004 -32.124 1.0 44.5 79 A 9 -ATOM 1217 C CA . ARG A1 1 79 ? -31.07 12.41 -32.984 1.0 54.44 79 A 9 -ATOM 1218 C C . ARG A1 1 79 ? -30.556 13.113 -34.236 1.0 43.43 79 A 9 -ATOM 1219 O O . ARG A1 1 79 ? -30.309 14.318 -34.227 1.0 24.23 79 A 9 -ATOM 1220 C CB . ARG A1 1 79 ? -32.024 13.333 -32.223 1.0 53.1 79 A 9 -ATOM 1221 C CG . ARG A1 1 79 ? -33.264 12.628 -31.697 1.0 62.42 79 A 9 -ATOM 1222 C CD . ARG A1 1 79 ? -32.91 11.588 -30.646 1.0 15.2 79 A 9 -ATOM 1223 N NE . ARG A1 1 79 ? -33.266 10.237 -31.072 1.0 22.21 79 A 9 -ATOM 1224 C CZ . ARG A1 1 79 ? -34.518 9.801 -31.166 1.0 43.33 79 A 9 -ATOM 1225 N NH1 . ARG A1 1 79 ? -35.527 10.607 -30.866 1.0 51.34 79 A 9 -ATOM 1226 N NH2 . ARG A1 1 79 ? -34.761 8.558 -31.56 1.0 24.34 79 A 9 -ATOM 1227 H H . ARG A1 1 79 ? -29.765 12.531 -31.323 1.0 30.43 79 A 9 -ATOM 1228 H HA . ARG A1 1 79 ? -31.605 11.519 -33.279 1.0 75.12 79 A 9 -ATOM 1229 H HB2 . ARG A1 1 79 ? -31.498 13.761 -31.382 1.0 72.51 79 A 9 -ATOM 1230 H HB3 . ARG A1 1 79 ? -32.34 14.127 -32.882 1.0 62.3 79 A 9 -ATOM 1231 H HG2 . ARG A1 1 79 ? -33.923 13.36 -31.255 1.0 34.21 79 A 9 -ATOM 1232 H HG3 . ARG A1 1 79 ? -33.765 12.14 -32.52 1.0 51.44 79 A 9 -ATOM 1233 H HD2 . ARG A1 1 79 ? -31.847 11.628 -30.462 1.0 21.42 79 A 9 -ATOM 1234 H HD3 . ARG A1 1 79 ? -33.442 11.82 -29.736 1.0 24.22 79 A 9 -ATOM 1235 H HE . ARG A1 1 79 ? -32.535 9.625 -31.298 1.0 63.2 79 A 9 -ATOM 1236 H HH11 . ARG A1 1 79 ? -35.347 11.544 -30.57 1.0 0.03 79 A 9 -ATOM 1237 H HH12 . ARG A1 1 79 ? -36.469 10.277 -30.939 1.0 54.33 79 A 9 -ATOM 1238 H HH21 . ARG A1 1 79 ? -34.003 7.948 -31.787 1.0 72.3 79 A 9 -ATOM 1239 H HH22 . ARG A1 1 79 ? -35.703 8.232 -31.631 1.0 2.44 79 A 9 -ATOM 1240 N N . GLY A1 1 80 ? -30.396 12.35 -35.314 1.0 11.03 80 A 9 -ATOM 1241 C CA . GLY A1 1 80 ? -29.912 12.917 -36.559 1.0 3.12 80 A 9 -ATOM 1242 C C . GLY A1 1 80 ? -29.827 11.889 -37.67 1.0 52.34 80 A 9 -ATOM 1243 O O . GLY A1 1 80 ? -28.955 11.969 -38.533 1.0 43.44 80 A 9 -ATOM 1244 H H . GLY A1 1 80 ? -30.609 11.395 -35.263 1.0 0.24 80 A 9 -ATOM 1245 H HA2 . GLY A1 1 80 ? -30.579 13.709 -36.865 1.0 71.24 80 A 9 -ATOM 1246 H HA3 . GLY A1 1 80 ? -28.929 13.333 -36.393 1.0 43.14 80 A 9 -ATOM 1247 N N . GLY A1 1 81 ? -30.735 10.919 -37.647 1.0 43.34 81 A 9 -ATOM 1248 C CA . GLY A1 1 81 ? -30.741 9.884 -38.664 1.0 20.2 81 A 9 -ATOM 1249 C C . GLY A1 1 81 ? -30.906 8.496 -38.077 1.0 63.23 81 A 9 -ATOM 1250 O O . GLY A1 1 81 ? -31.912 8.202 -37.431 1.0 30.24 81 A 9 -ATOM 1251 H H . GLY A1 1 81 ? -31.407 10.906 -36.933 1.0 11.33 81 A 9 -ATOM 1252 H HA2 . GLY A1 1 81 ? -31.553 10.072 -39.35 1.0 30.51 81 A 9 -ATOM 1253 H HA3 . GLY A1 1 81 ? -29.807 9.923 -39.207 1.0 55.14 81 A 9 -ATOM 1254 N N . VAL A1 1 82 ? -29.916 7.637 -38.304 1.0 30.52 82 A 9 -ATOM 1255 C CA . VAL A1 1 82 ? -29.956 6.272 -37.794 1.0 4.45 82 A 9 -ATOM 1256 C C . VAL A1 1 82 ? -28.726 5.965 -36.947 1.0 63.52 82 A 9 -ATOM 1257 O O . VAL A1 1 82 ? -28.672 6.306 -35.766 1.0 12.52 82 A 9 -ATOM 1258 C CB . VAL A1 1 82 ? -30.046 5.247 -38.94 1.0 53.54 82 A 9 -ATOM 1259 C CG1 . VAL A1 1 82 ? -28.829 5.352 -39.847 1.0 33.31 82 A 9 -ATOM 1260 C CG2 . VAL A1 1 82 ? -30.187 3.838 -38.384 1.0 1.13 82 A 9 -ATOM 1261 H H . VAL A1 1 82 ? -29.14 7.93 -38.826 1.0 42.11 82 A 9 -ATOM 1262 H HA . VAL A1 1 82 ? -30.839 6.171 -37.179 1.0 65.12 82 A 9 -ATOM 1263 H HB . VAL A1 1 82 ? -30.925 5.47 -39.527 1.0 3.02 82 A 9 -ATOM 1264 H HG11 . VAL A1 1 82 ? -28.729 6.369 -40.197 1.0 71.54 82 A 9 -ATOM 1265 H HG12 . VAL A1 1 82 ? -27.944 5.071 -39.295 1.0 43.52 82 A 9 -ATOM 1266 H HG13 . VAL A1 1 82 ? -28.952 4.691 -40.692 1.0 60.31 82 A 9 -ATOM 1267 H HG21 . VAL A1 1 82 ? -31.144 3.43 -38.675 1.0 51.1 82 A 9 -ATOM 1268 H HG22 . VAL A1 1 82 ? -29.396 3.216 -38.776 1.0 43.42 82 A 9 -ATOM 1269 H HG23 . VAL A1 1 82 ? -30.121 3.867 -37.306 1.0 61.21 82 A 9 -ATOM 1 N N . GLY A1 1 1 ? -9.315 -3.394 -3.453 1.0 13.0 1 A 10 -ATOM 2 C CA . GLY A1 1 1 ? -8.883 -2.262 -2.652 1.0 45.03 1 A 10 -ATOM 3 C C . GLY A1 1 1 ? -7.565 -1.684 -3.129 1.0 65.21 1 A 10 -ATOM 4 O O . GLY A1 1 1 ? -6.539 -1.786 -2.456 1.0 33.34 1 A 10 -ATOM 5 H H1 . GLY A1 1 1 ? -9.316 -4.294 -3.065 1.0 52.4 1 A 10 -ATOM 6 H HA2 . GLY A1 1 1 ? -9.64 -1.493 -2.699 1.0 14.15 1 A 10 -ATOM 7 H HA3 . GLY A1 1 1 ? -8.773 -2.583 -1.627 1.0 34.23 1 A 10 -ATOM 8 N N . PRO A1 1 2 ? -7.582 -1.062 -4.317 1.0 55.32 2 A 10 -ATOM 9 C CA . PRO A1 1 2 ? -6.387 -0.454 -4.909 1.0 21.43 2 A 10 -ATOM 10 C C . PRO A1 1 2 ? -5.934 0.79 -4.154 1.0 41.45 2 A 10 -ATOM 11 O O . PRO A1 1 2 ? -6.508 1.147 -3.124 1.0 62.42 2 A 10 -ATOM 12 C CB . PRO A1 1 2 ? -6.841 -0.086 -6.324 1.0 51.45 2 A 10 -ATOM 13 C CG . PRO A1 1 2 ? -8.318 0.08 -6.217 1.0 43.11 2 A 10 -ATOM 14 C CD . PRO A1 1 2 ? -8.77 -0.903 -5.173 1.0 64.14 2 A 10 -ATOM 15 H HA . PRO A1 1 2 ? -5.57 -1.158 -4.964 1.0 31.54 2 A 10 -ATOM 16 H HB2 . PRO A1 1 2 ? -6.361 0.833 -6.631 1.0 42.4 2 A 10 -ATOM 17 H HB3 . PRO A1 1 2 ? -6.581 -0.88 -7.008 1.0 62.54 2 A 10 -ATOM 18 H HG2 . PRO A1 1 2 ? -8.553 1.088 -5.91 1.0 3.22 2 A 10 -ATOM 19 H HG3 . PRO A1 1 2 ? -8.781 -0.143 -7.167 1.0 51.14 2 A 10 -ATOM 20 H HD2 . PRO A1 1 2 ? -9.6 -0.501 -4.61 1.0 11.0 2 A 10 -ATOM 21 H HD3 . PRO A1 1 2 ? -9.042 -1.842 -5.631 1.0 24.12 2 A 10 -ATOM 22 N N . LEU A1 1 3 ? -4.902 1.448 -4.671 1.0 34.12 3 A 10 -ATOM 23 C CA . LEU A1 1 3 ? -4.372 2.654 -4.045 1.0 54.03 3 A 10 -ATOM 24 C C . LEU A1 1 3 ? -4.382 3.824 -5.023 1.0 63.21 3 A 10 -ATOM 25 O O . LEU A1 1 3 ? -5.097 4.806 -4.825 1.0 11.24 3 A 10 -ATOM 26 C CB . LEU A1 1 3 ? -2.949 2.408 -3.541 1.0 60.12 3 A 10 -ATOM 27 C CG . LEU A1 1 3 ? -2.813 2.049 -2.061 1.0 64.13 3 A 10 -ATOM 28 C CD1 . LEU A1 1 3 ? -1.495 1.336 -1.802 1.0 62.25 3 A 10 -ATOM 29 C CD2 . LEU A1 1 3 ? -2.925 3.298 -1.197 1.0 0.12 3 A 10 -ATOM 30 H H . LEU A1 1 3 ? -4.486 1.115 -5.493 1.0 52.35 3 A 10 -ATOM 31 H HA . LEU A1 1 3 ? -5.006 2.897 -3.205 1.0 43.13 3 A 10 -ATOM 32 H HB2 . LEU A1 1 3 ? -2.53 1.597 -4.117 1.0 74.24 3 A 10 -ATOM 33 H HB3 . LEU A1 1 3 ? -2.376 3.307 -3.719 1.0 72.41 3 A 10 -ATOM 34 H HG . LEU A1 1 3 ? -3.615 1.378 -1.784 1.0 43.5 3 A 10 -ATOM 35 H HD11 . LEU A1 1 3 ? -1.625 0.615 -1.01 1.0 50.45 3 A 10 -ATOM 36 H HD12 . LEU A1 1 3 ? -0.746 2.058 -1.513 1.0 4.34 3 A 10 -ATOM 37 H HD13 . LEU A1 1 3 ? -1.178 0.83 -2.702 1.0 54.42 3 A 10 -ATOM 38 H HD21 . LEU A1 1 3 ? -3.668 3.96 -1.616 1.0 23.33 3 A 10 -ATOM 39 H HD22 . LEU A1 1 3 ? -1.969 3.8 -1.168 1.0 1.01 3 A 10 -ATOM 40 H HD23 . LEU A1 1 3 ? -3.215 3.017 -0.195 1.0 75.24 3 A 10 -ATOM 41 N N . GLY A1 1 4 ? -3.584 3.712 -6.081 1.0 4.21 4 A 10 -ATOM 42 C CA . GLY A1 1 4 ? -3.518 4.767 -7.075 1.0 43.34 4 A 10 -ATOM 43 C C . GLY A1 1 4 ? -4.793 4.878 -7.888 1.0 32.24 4 A 10 -ATOM 44 O O . GLY A1 1 4 ? -5.893 4.755 -7.349 1.0 73.31 4 A 10 -ATOM 45 H H . GLY A1 1 4 ? -3.036 2.906 -6.187 1.0 2.13 4 A 10 -ATOM 46 H HA2 . GLY A1 1 4 ? -3.338 5.707 -6.576 1.0 53.5 4 A 10 -ATOM 47 H HA3 . GLY A1 1 4 ? -2.695 4.563 -7.745 1.0 61.41 4 A 10 -ATOM 48 N N . SER A1 1 5 ? -4.646 5.114 -9.188 1.0 14.33 5 A 10 -ATOM 49 C CA . SER A1 1 5 ? -5.795 5.248 -10.075 1.0 12.42 5 A 10 -ATOM 50 C C . SER A1 1 5 ? -6.66 6.437 -9.667 1.0 43.22 5 A 10 -ATOM 51 O O . SER A1 1 5 ? -6.508 6.984 -8.576 1.0 33.52 5 A 10 -ATOM 52 C CB . SER A1 1 5 ? -6.629 3.966 -10.061 1.0 72.02 5 A 10 -ATOM 53 O OG . SER A1 1 5 ? -5.802 2.82 -9.96 1.0 21.35 5 A 10 -ATOM 54 H H . SER A1 1 5 ? -3.742 5.203 -9.558 1.0 31.12 5 A 10 -ATOM 55 H HA . SER A1 1 5 ? -5.423 5.415 -11.075 1.0 12.32 5 A 10 -ATOM 56 H HB2 . SER A1 1 5 ? -7.301 3.986 -9.216 1.0 41.01 5 A 10 -ATOM 57 H HB3 . SER A1 1 5 ? -7.202 3.903 -10.975 1.0 74.13 5 A 10 -ATOM 58 H HG . SER A1 1 5 ? -5.546 2.531 -10.839 1.0 33.45 5 A 10 -ATOM 59 N N . MET A1 1 6 ? -7.569 6.83 -10.553 1.0 14.01 6 A 10 -ATOM 60 C CA . MET A1 1 6 ? -8.461 7.953 -10.286 1.0 54.33 6 A 10 -ATOM 61 C C . MET A1 1 6 ? -9.804 7.758 -10.981 1.0 31.44 6 A 10 -ATOM 62 O O . MET A1 1 6 ? -10.057 6.713 -11.58 1.0 1.11 6 A 10 -ATOM 63 C CB . MET A1 1 6 ? -7.819 9.263 -10.749 1.0 70.21 6 A 10 -ATOM 64 C CG . MET A1 1 6 ? -7.173 9.171 -12.121 1.0 25.05 6 A 10 -ATOM 65 S SD . MET A1 1 6 ? -5.423 8.742 -12.037 1.0 3.44 6 A 10 -ATOM 66 C CE . MET A1 1 6 ? -4.7 10.341 -11.675 1.0 13.21 6 A 10 -ATOM 67 H H . MET A1 1 6 ? -7.644 6.354 -11.407 1.0 2.32 6 A 10 -ATOM 68 H HA . MET A1 1 6 ? -8.624 7.999 -9.22 1.0 5.22 6 A 10 -ATOM 69 H HB2 . MET A1 1 6 ? -8.579 10.029 -10.783 1.0 62.43 6 A 10 -ATOM 70 H HB3 . MET A1 1 6 ? -7.061 9.55 -10.036 1.0 63.34 6 A 10 -ATOM 71 H HG2 . MET A1 1 6 ? -7.686 8.415 -12.697 1.0 33.13 6 A 10 -ATOM 72 H HG3 . MET A1 1 6 ? -7.272 10.126 -12.615 1.0 12.41 6 A 10 -ATOM 73 H HE1 . MET A1 1 6 ? -5.425 10.955 -11.161 1.0 12.23 6 A 10 -ATOM 74 H HE2 . MET A1 1 6 ? -3.831 10.209 -11.048 1.0 52.54 6 A 10 -ATOM 75 H HE3 . MET A1 1 6 ? -4.409 10.821 -12.598 1.0 2.41 6 A 10 -ATOM 76 N N . GLN A1 1 7 ? -10.662 8.77 -10.897 1.0 13.12 7 A 10 -ATOM 77 C CA . GLN A1 1 7 ? -11.979 8.708 -11.518 1.0 13.2 7 A 10 -ATOM 78 C C . GLN A1 1 7 ? -12.339 10.04 -12.168 1.0 42.42 7 A 10 -ATOM 79 O O . GLN A1 1 7 ? -11.798 11.085 -11.804 1.0 71.33 7 A 10 -ATOM 80 C CB . GLN A1 1 7 ? -13.038 8.331 -10.48 1.0 42.01 7 A 10 -ATOM 81 C CG . GLN A1 1 7 ? -12.595 7.229 -9.532 1.0 12.34 7 A 10 -ATOM 82 C CD . GLN A1 1 7 ? -12.064 7.768 -8.218 1.0 44.31 7 A 10 -ATOM 83 O OE1 . GLN A1 1 7 ? -11.95 8.98 -8.032 1.0 33.44 7 A 10 -ATOM 84 N NE2 . GLN A1 1 7 ? -11.737 6.868 -7.298 1.0 73.32 7 A 10 -ATOM 85 H H . GLN A1 1 7 ? -10.402 9.577 -10.407 1.0 71.21 7 A 10 -ATOM 86 H HA . GLN A1 1 7 ? -11.95 7.946 -12.282 1.0 62.03 7 A 10 -ATOM 87 H HB2 . GLN A1 1 7 ? -13.278 9.206 -9.895 1.0 13.25 7 A 10 -ATOM 88 H HB3 . GLN A1 1 7 ? -13.927 7.997 -10.995 1.0 41.42 7 A 10 -ATOM 89 H HG2 . GLN A1 1 7 ? -13.44 6.588 -9.325 1.0 43.33 7 A 10 -ATOM 90 H HG3 . GLN A1 1 7 ? -11.816 6.653 -10.009 1.0 33.21 7 A 10 -ATOM 91 H HE21 . GLN A1 1 7 ? -11.853 5.919 -7.517 1.0 52.01 7 A 10 -ATOM 92 H HE22 . GLN A1 1 7 ? -11.391 7.188 -6.44 1.0 55.43 7 A 10 -ATOM 93 N N . ILE A1 1 8 ? -13.253 9.996 -13.13 1.0 12.12 8 A 10 -ATOM 94 C CA . ILE A1 1 8 ? -13.685 11.2 -13.83 1.0 64.2 8 A 10 -ATOM 95 C C . ILE A1 1 8 ? -15.205 11.314 -13.841 1.0 0.33 8 A 10 -ATOM 96 O O . ILE A1 1 8 ? -15.915 10.316 -13.71 1.0 11.35 8 A 10 -ATOM 97 C CB . ILE A1 1 8 ? -13.169 11.224 -15.28 1.0 65.34 8 A 10 -ATOM 98 C CG1 . ILE A1 1 8 ? -12.348 9.966 -15.573 1.0 72.33 8 A 10 -ATOM 99 C CG2 . ILE A1 1 8 ? -12.338 12.474 -15.527 1.0 55.24 8 A 10 -ATOM 100 C CD1 . ILE A1 1 8 ? -11.971 9.817 -17.031 1.0 11.02 8 A 10 -ATOM 101 H H . ILE A1 1 8 ? -13.648 9.134 -13.375 1.0 43.45 8 A 10 -ATOM 102 H HA . ILE A1 1 8 ? -13.274 12.053 -13.308 1.0 41.41 8 A 10 -ATOM 103 H HB . ILE A1 1 8 ? -14.021 11.251 -15.942 1.0 13.24 8 A 10 -ATOM 104 H HG12 . ILE A1 1 8 ? -11.437 9.996 -14.997 1.0 4.11 8 A 10 -ATOM 105 H HG13 . ILE A1 1 8 ? -12.921 9.096 -15.287 1.0 33.41 8 A 10 -ATOM 106 H HG21 . ILE A1 1 8 ? -11.743 12.689 -14.651 1.0 12.11 8 A 10 -ATOM 107 H HG22 . ILE A1 1 8 ? -11.687 12.313 -16.373 1.0 14.43 8 A 10 -ATOM 108 H HG23 . ILE A1 1 8 ? -12.993 13.308 -15.73 1.0 53.13 8 A 10 -ATOM 109 H HD11 . ILE A1 1 8 ? -12.197 10.734 -17.557 1.0 4.51 8 A 10 -ATOM 110 H HD12 . ILE A1 1 8 ? -10.914 9.608 -17.11 1.0 22.53 8 A 10 -ATOM 111 H HD13 . ILE A1 1 8 ? -12.533 9.005 -17.467 1.0 32.23 8 A 10 -ATOM 112 N N . PHE A1 1 9 ? -15.7 12.537 -14.0 1.0 44.42 9 A 10 -ATOM 113 C CA . PHE A1 1 9 ? -17.137 12.783 -14.03 1.0 45.42 9 A 10 -ATOM 114 C C . PHE A1 1 9 ? -17.595 13.168 -15.433 1.0 62.05 9 A 10 -ATOM 115 O O . PHE A1 1 9 ? -17.069 14.105 -16.034 1.0 33.13 9 A 10 -ATOM 116 C CB . PHE A1 1 9 ? -17.508 13.888 -13.039 1.0 42.3 9 A 10 -ATOM 117 C CG . PHE A1 1 9 ? -18.202 13.382 -11.807 1.0 44.44 9 A 10 -ATOM 118 C CD1 . PHE A1 1 9 ? -19.457 12.8 -11.893 1.0 24.21 9 A 10 -ATOM 119 C CD2 . PHE A1 1 9 ? -17.601 13.488 -10.564 1.0 24.11 9 A 10 -ATOM 120 C CE1 . PHE A1 1 9 ? -20.099 12.332 -10.762 1.0 54.33 9 A 10 -ATOM 121 C CE2 . PHE A1 1 9 ? -18.237 13.021 -9.429 1.0 62.43 9 A 10 -ATOM 122 C CZ . PHE A1 1 9 ? -19.488 12.444 -9.528 1.0 72.21 9 A 10 -ATOM 123 H H . PHE A1 1 9 ? -15.084 13.293 -14.099 1.0 15.35 9 A 10 -ATOM 124 H HA . PHE A1 1 9 ? -17.635 11.87 -13.74 1.0 72.15 9 A 10 -ATOM 125 H HB2 . PHE A1 1 9 ? -16.609 14.398 -12.726 1.0 13.22 9 A 10 -ATOM 126 H HB3 . PHE A1 1 9 ? -18.165 14.593 -13.526 1.0 20.44 9 A 10 -ATOM 127 H HD1 . PHE A1 1 9 ? -19.936 12.712 -12.858 1.0 63.23 9 A 10 -ATOM 128 H HD2 . PHE A1 1 9 ? -16.623 13.94 -10.484 1.0 43.5 9 A 10 -ATOM 129 H HE1 . PHE A1 1 9 ? -21.077 11.881 -10.843 1.0 53.21 9 A 10 -ATOM 130 H HE2 . PHE A1 1 9 ? -17.758 13.11 -8.465 1.0 61.25 9 A 10 -ATOM 131 H HZ . PHE A1 1 9 ? -19.988 12.079 -8.643 1.0 11.33 9 A 10 -ATOM 132 N N . VAL A1 1 10 ? -18.577 12.437 -15.951 1.0 35.51 10 A 10 -ATOM 133 C CA . VAL A1 1 10 ? -19.106 12.701 -17.284 1.0 51.35 10 A 10 -ATOM 134 C C . VAL A1 1 10 ? -20.576 13.1 -17.222 1.0 20.3 10 A 10 -ATOM 135 O O . VAL A1 1 10 ? -21.378 12.457 -16.544 1.0 33.54 10 A 10 -ATOM 136 C CB . VAL A1 1 10 ? -18.957 11.473 -18.2 1.0 1.24 10 A 10 -ATOM 137 C CG1 . VAL A1 1 10 ? -19.085 11.878 -19.661 1.0 43.55 10 A 10 -ATOM 138 C CG2 . VAL A1 1 10 ? -17.629 10.776 -17.946 1.0 70.41 10 A 10 -ATOM 139 H H . VAL A1 1 10 ? -18.955 11.703 -15.423 1.0 13.11 10 A 10 -ATOM 140 H HA . VAL A1 1 10 ? -18.54 13.515 -17.712 1.0 52.2 10 A 10 -ATOM 141 H HB . VAL A1 1 10 ? -19.753 10.779 -17.971 1.0 21.21 10 A 10 -ATOM 142 H HG11 . VAL A1 1 10 ? -20.117 12.11 -19.881 1.0 75.22 10 A 10 -ATOM 143 H HG12 . VAL A1 1 10 ? -18.472 12.746 -19.849 1.0 54.41 10 A 10 -ATOM 144 H HG13 . VAL A1 1 10 ? -18.759 11.062 -20.29 1.0 61.31 10 A 10 -ATOM 145 H HG21 . VAL A1 1 10 ? -17.43 10.077 -18.744 1.0 13.24 10 A 10 -ATOM 146 H HG22 . VAL A1 1 10 ? -16.84 11.512 -17.906 1.0 62.44 10 A 10 -ATOM 147 H HG23 . VAL A1 1 10 ? -17.674 10.246 -17.006 1.0 2.35 10 A 10 -ATOM 148 N N . LYS A1 1 11 ? -20.924 14.166 -17.935 1.0 23.3 11 A 10 -ATOM 149 C CA . LYS A1 1 11 ? -22.299 14.652 -17.964 1.0 10.31 11 A 10 -ATOM 150 C C . LYS A1 1 11 ? -22.936 14.401 -19.327 1.0 22.12 11 A 10 -ATOM 151 O O . LYS A1 1 11 ? -22.538 14.996 -20.329 1.0 63.21 11 A 10 -ATOM 152 C CB . LYS A1 1 11 ? -22.34 16.147 -17.636 1.0 34.41 11 A 10 -ATOM 153 C CG . LYS A1 1 11 ? -23.686 16.793 -17.916 1.0 63.11 11 A 10 -ATOM 154 C CD . LYS A1 1 11 ? -23.636 18.298 -17.708 1.0 3.15 11 A 10 -ATOM 155 C CE . LYS A1 1 11 ? -23.242 19.024 -18.985 1.0 2.52 11 A 10 -ATOM 156 N NZ . LYS A1 1 11 ? -23.426 20.497 -18.865 1.0 51.12 11 A 10 -ATOM 157 H H . LYS A1 1 11 ? -20.24 14.638 -18.455 1.0 4.15 11 A 10 -ATOM 158 H HA . LYS A1 1 11 ? -22.857 14.113 -17.214 1.0 44.21 11 A 10 -ATOM 159 H HB2 . LYS A1 1 11 ? -22.11 16.28 -16.59 1.0 75.01 11 A 10 -ATOM 160 H HB3 . LYS A1 1 11 ? -21.591 16.653 -18.228 1.0 15.43 11 A 10 -ATOM 161 H HG2 . LYS A1 1 11 ? -23.967 16.591 -18.939 1.0 73.24 11 A 10 -ATOM 162 H HG3 . LYS A1 1 11 ? -24.423 16.371 -17.248 1.0 30.03 11 A 10 -ATOM 163 H HD2 . LYS A1 1 11 ? -24.61 18.643 -17.397 1.0 63.51 11 A 10 -ATOM 164 H HD3 . LYS A1 1 11 ? -22.91 18.522 -16.939 1.0 61.22 11 A 10 -ATOM 165 H HE2 . LYS A1 1 11 ? -22.205 18.816 -19.197 1.0 70.24 11 A 10 -ATOM 166 H HE3 . LYS A1 1 11 ? -23.855 18.658 -19.795 1.0 3.13 11 A 10 -ATOM 167 H HZ1 . LYS A1 1 11 ? -24.231 20.805 -19.447 1.0 1.34 11 A 10 -ATOM 168 H HZ2 . LYS A1 1 11 ? -22.57 20.991 -19.187 1.0 61.44 11 A 10 -ATOM 169 H HZ3 . LYS A1 1 11 ? -23.61 20.754 -17.875 1.0 12.11 11 A 10 -ATOM 170 N N . THR A1 1 12 ? -23.929 13.518 -19.357 1.0 60.33 12 A 10 -ATOM 171 C CA . THR A1 1 12 ? -24.622 13.19 -20.597 1.0 63.11 12 A 10 -ATOM 172 C C . THR A1 1 12 ? -25.542 14.325 -21.03 1.0 63.2 12 A 10 -ATOM 173 O O . THR A1 1 12 ? -25.902 15.187 -20.227 1.0 23.14 12 A 10 -ATOM 174 C CB . THR A1 1 12 ? -25.45 11.899 -20.452 1.0 13.53 12 A 10 -ATOM 175 O OG1 . THR A1 1 12 ? -26.491 12.09 -19.488 1.0 44.22 12 A 10 -ATOM 176 C CG2 . THR A1 1 12 ? -24.567 10.734 -20.03 1.0 44.25 12 A 10 -ATOM 177 H H . THR A1 1 12 ? -24.201 13.078 -18.525 1.0 50.31 12 A 10 -ATOM 178 H HA . THR A1 1 12 ? -23.877 13.031 -21.363 1.0 15.31 12 A 10 -ATOM 179 H HB . THR A1 1 12 ? -25.895 11.666 -21.409 1.0 3.11 12 A 10 -ATOM 180 H HG1 . THR A1 1 12 ? -26.891 11.243 -19.277 1.0 54.01 12 A 10 -ATOM 181 H HG21 . THR A1 1 12 ? -24.787 10.469 -19.007 1.0 54.24 12 A 10 -ATOM 182 H HG22 . THR A1 1 12 ? -23.529 11.021 -20.112 1.0 51.32 12 A 10 -ATOM 183 H HG23 . THR A1 1 12 ? -24.759 9.886 -20.671 1.0 74.05 12 A 10 -ATOM 184 N N . LEU A1 1 13 ? -25.922 14.319 -22.303 1.0 74.21 13 A 10 -ATOM 185 C CA . LEU A1 1 13 ? -26.803 15.349 -22.844 1.0 74.52 13 A 10 -ATOM 186 C C . LEU A1 1 13 ? -28.134 15.372 -22.099 1.0 25.21 13 A 10 -ATOM 187 O O . LEU A1 1 13 ? -28.872 16.357 -22.154 1.0 11.35 13 A 10 -ATOM 188 C CB . LEU A1 1 13 ? -27.043 15.111 -24.335 1.0 31.51 13 A 10 -ATOM 189 C CG . LEU A1 1 13 ? -27.715 16.253 -25.098 1.0 30.32 13 A 10 -ATOM 190 C CD1 . LEU A1 1 13 ? -26.675 17.24 -25.606 1.0 44.31 13 A 10 -ATOM 191 C CD2 . LEU A1 1 13 ? -28.545 15.709 -26.251 1.0 64.01 13 A 10 -ATOM 192 H H . LEU A1 1 13 ? -25.603 13.606 -22.894 1.0 42.02 13 A 10 -ATOM 193 H HA . LEU A1 1 13 ? -26.315 16.303 -22.714 1.0 34.1 13 A 10 -ATOM 194 H HB2 . LEU A1 1 13 ? -26.087 14.921 -24.798 1.0 62.11 13 A 10 -ATOM 195 H HB3 . LEU A1 1 13 ? -27.668 14.234 -24.432 1.0 43.21 13 A 10 -ATOM 196 H HG . LEU A1 1 13 ? -28.378 16.784 -24.428 1.0 45.4 13 A 10 -ATOM 197 H HD11 . LEU A1 1 13 ? -26.05 17.558 -24.785 1.0 62.23 13 A 10 -ATOM 198 H HD12 . LEU A1 1 13 ? -27.171 18.097 -26.035 1.0 23.44 13 A 10 -ATOM 199 H HD13 . LEU A1 1 13 ? -26.065 16.763 -26.359 1.0 25.55 13 A 10 -ATOM 200 H HD21 . LEU A1 1 13 ? -29.275 16.447 -26.549 1.0 62.14 13 A 10 -ATOM 201 H HD22 . LEU A1 1 13 ? -29.05 14.808 -25.937 1.0 41.34 13 A 10 -ATOM 202 H HD23 . LEU A1 1 13 ? -27.897 15.485 -27.087 1.0 51.42 13 A 10 -ATOM 203 N N . THR A1 1 14 ? -28.435 14.282 -21.401 1.0 31.41 14 A 10 -ATOM 204 C CA . THR A1 1 14 ? -29.676 14.177 -20.644 1.0 30.33 14 A 10 -ATOM 205 C C . THR A1 1 14 ? -29.525 14.782 -19.253 1.0 22.13 14 A 10 -ATOM 206 O O . THR A1 1 14 ? -30.444 14.725 -18.438 1.0 5.31 14 A 10 -ATOM 207 C CB . THR A1 1 14 ? -30.129 12.711 -20.508 1.0 34.54 14 A 10 -ATOM 208 O OG1 . THR A1 1 14 ? -29.123 11.949 -19.831 1.0 3.22 14 A 10 -ATOM 209 C CG2 . THR A1 1 14 ? -30.403 12.1 -21.874 1.0 34.11 14 A 10 -ATOM 210 H H . THR A1 1 14 ? -27.806 13.53 -21.396 1.0 2.31 14 A 10 -ATOM 211 H HA . THR A1 1 14 ? -30.441 14.72 -21.181 1.0 25.44 14 A 10 -ATOM 212 H HB . THR A1 1 14 ? -31.041 12.685 -19.928 1.0 55.24 14 A 10 -ATOM 213 H HG1 . THR A1 1 14 ? -29.446 11.058 -19.678 1.0 24.42 14 A 10 -ATOM 214 H HG21 . THR A1 1 14 ? -29.681 12.471 -22.585 1.0 1.02 14 A 10 -ATOM 215 H HG22 . THR A1 1 14 ? -31.398 12.371 -22.196 1.0 12.23 14 A 10 -ATOM 216 H HG23 . THR A1 1 14 ? -30.326 11.025 -21.809 1.0 12.42 14 A 10 -ATOM 217 N N . GLY A1 1 15 ? -28.359 15.364 -18.989 1.0 61.2 15 A 10 -ATOM 218 C CA . GLY A1 1 15 ? -28.109 15.972 -17.695 1.0 25.44 15 A 10 -ATOM 219 C C . GLY A1 1 15 ? -27.949 14.944 -16.593 1.0 2.34 15 A 10 -ATOM 220 O O . GLY A1 1 15 ? -28.644 14.998 -15.578 1.0 24.03 15 A 10 -ATOM 221 H H . GLY A1 1 15 ? -27.662 15.379 -19.679 1.0 73.22 15 A 10 -ATOM 222 H HA2 . GLY A1 1 15 ? -27.207 16.563 -17.756 1.0 10.15 15 A 10 -ATOM 223 H HA3 . GLY A1 1 15 ? -28.937 16.62 -17.45 1.0 23.53 15 A 10 -ATOM 224 N N . LYS A1 1 16 ? -27.032 14.003 -16.791 1.0 11.21 16 A 10 -ATOM 225 C CA . LYS A1 1 16 ? -26.783 12.957 -15.807 1.0 34.13 16 A 10 -ATOM 226 C C . LYS A1 1 16 ? -25.299 12.878 -15.461 1.0 15.24 16 A 10 -ATOM 227 O O . LYS A1 1 16 ? -24.451 12.745 -16.344 1.0 50.04 16 A 10 -ATOM 228 C CB . LYS A1 1 16 ? -27.268 11.605 -16.335 1.0 31.42 16 A 10 -ATOM 229 C CG . LYS A1 1 16 ? -27.696 10.643 -15.24 1.0 73.35 16 A 10 -ATOM 230 C CD . LYS A1 1 16 ? -26.505 9.911 -14.644 1.0 50.3 16 A 10 -ATOM 231 C CE . LYS A1 1 16 ? -25.919 8.908 -15.625 1.0 52.44 16 A 10 -ATOM 232 N NZ . LYS A1 1 16 ? -26.238 7.505 -15.241 1.0 2.53 16 A 10 -ATOM 233 H H . LYS A1 1 16 ? -26.51 14.013 -17.621 1.0 52.54 16 A 10 -ATOM 234 H HA . LYS A1 1 16 ? -27.336 13.204 -14.913 1.0 34.34 16 A 10 -ATOM 235 H HB2 . LYS A1 1 16 ? -28.11 11.769 -16.991 1.0 44.24 16 A 10 -ATOM 236 H HB3 . LYS A1 1 16 ? -26.468 11.144 -16.897 1.0 12.13 16 A 10 -ATOM 237 H HG2 . LYS A1 1 16 ? -28.192 11.198 -14.458 1.0 3.41 16 A 10 -ATOM 238 H HG3 . LYS A1 1 16 ? -28.38 9.918 -15.659 1.0 74.14 16 A 10 -ATOM 239 H HD2 . LYS A1 1 16 ? -25.744 10.631 -14.385 1.0 63.23 16 A 10 -ATOM 240 H HD3 . LYS A1 1 16 ? -26.825 9.387 -13.754 1.0 14.51 16 A 10 -ATOM 241 H HE2 . LYS A1 1 16 ? -26.324 9.104 -16.606 1.0 44.12 16 A 10 -ATOM 242 H HE3 . LYS A1 1 16 ? -24.846 9.031 -15.647 1.0 75.31 16 A 10 -ATOM 243 H HZ1 . LYS A1 1 16 ? -25.361 6.962 -15.109 1.0 61.55 16 A 10 -ATOM 244 H HZ2 . LYS A1 1 16 ? -26.806 7.051 -15.986 1.0 23.15 16 A 10 -ATOM 245 H HZ3 . LYS A1 1 16 ? -26.779 7.491 -14.353 1.0 43.23 16 A 10 -ATOM 246 N N . THR A1 1 17 ? -24.992 12.959 -14.17 1.0 33.03 17 A 10 -ATOM 247 C CA . THR A1 1 17 ? -23.611 12.896 -13.708 1.0 61.21 17 A 10 -ATOM 248 C C . THR A1 1 17 ? -23.194 11.459 -13.416 1.0 13.11 17 A 10 -ATOM 249 O O . THR A1 1 17 ? -23.771 10.799 -12.551 1.0 32.24 17 A 10 -ATOM 250 C CB . THR A1 1 17 ? -23.403 13.746 -12.441 1.0 22.54 17 A 10 -ATOM 251 O OG1 . THR A1 1 17 ? -24.573 13.69 -11.616 1.0 24.32 17 A 10 -ATOM 252 C CG2 . THR A1 1 17 ? -23.101 15.193 -12.803 1.0 72.42 17 A 10 -ATOM 253 H H . THR A1 1 17 ? -25.712 13.064 -13.514 1.0 63.53 17 A 10 -ATOM 254 H HA . THR A1 1 17 ? -22.979 13.292 -14.49 1.0 15.15 17 A 10 -ATOM 255 H HB . THR A1 1 17 ? -22.564 13.346 -11.89 1.0 61.22 17 A 10 -ATOM 256 H HG1 . THR A1 1 17 ? -24.447 14.248 -10.844 1.0 54.0 17 A 10 -ATOM 257 H HG21 . THR A1 1 17 ? -23.946 15.812 -12.542 1.0 31.34 17 A 10 -ATOM 258 H HG22 . THR A1 1 17 ? -22.915 15.266 -13.865 1.0 12.24 17 A 10 -ATOM 259 H HG23 . THR A1 1 17 ? -22.229 15.525 -12.261 1.0 74.01 17 A 10 -ATOM 260 N N . ILE A1 1 18 ? -22.189 10.981 -14.141 1.0 21.15 18 A 10 -ATOM 261 C CA . ILE A1 1 18 ? -21.694 9.622 -13.957 1.0 42.23 18 A 10 -ATOM 262 C C . ILE A1 1 18 ? -20.214 9.621 -13.587 1.0 2.02 18 A 10 -ATOM 263 O O . ILE A1 1 18 ? -19.438 10.438 -14.082 1.0 34.24 18 A 10 -ATOM 264 C CB . ILE A1 1 18 ? -21.894 8.773 -15.227 1.0 20.13 18 A 10 -ATOM 265 C CG1 . ILE A1 1 18 ? -21.082 7.479 -15.135 1.0 0.43 18 A 10 -ATOM 266 C CG2 . ILE A1 1 18 ? -21.497 9.567 -16.462 1.0 34.34 18 A 10 -ATOM 267 C CD1 . ILE A1 1 18 ? -21.46 6.454 -16.181 1.0 41.12 18 A 10 -ATOM 268 H H . ILE A1 1 18 ? -21.769 11.555 -14.815 1.0 72.35 18 A 10 -ATOM 269 H HA . ILE A1 1 18 ? -22.256 9.169 -13.153 1.0 33.1 18 A 10 -ATOM 270 H HB . ILE A1 1 18 ? -22.942 8.528 -15.307 1.0 55.23 18 A 10 -ATOM 271 H HG12 . ILE A1 1 18 ? -20.036 7.708 -15.258 1.0 35.45 18 A 10 -ATOM 272 H HG13 . ILE A1 1 18 ? -21.237 7.035 -14.162 1.0 15.51 18 A 10 -ATOM 273 H HG21 . ILE A1 1 18 ? -20.531 10.023 -16.302 1.0 31.24 18 A 10 -ATOM 274 H HG22 . ILE A1 1 18 ? -21.445 8.905 -17.314 1.0 60.32 18 A 10 -ATOM 275 H HG23 . ILE A1 1 18 ? -22.231 10.336 -16.648 1.0 71.44 18 A 10 -ATOM 276 H HD11 . ILE A1 1 18 ? -20.604 5.831 -16.4 1.0 32.31 18 A 10 -ATOM 277 H HD12 . ILE A1 1 18 ? -22.265 5.838 -15.808 1.0 60.24 18 A 10 -ATOM 278 H HD13 . ILE A1 1 18 ? -21.777 6.958 -17.082 1.0 25.35 18 A 10 -ATOM 279 N N . THR A1 1 19 ? -19.829 8.696 -12.713 1.0 42.32 19 A 10 -ATOM 280 C CA . THR A1 1 19 ? -18.443 8.587 -12.276 1.0 41.24 19 A 10 -ATOM 281 C C . THR A1 1 19 ? -17.816 7.284 -12.756 1.0 70.21 19 A 10 -ATOM 282 O O . THR A1 1 19 ? -18.448 6.228 -12.715 1.0 44.42 19 A 10 -ATOM 283 C CB . THR A1 1 19 ? -18.33 8.663 -10.741 1.0 2.4 19 A 10 -ATOM 284 O OG1 . THR A1 1 19 ? -19.615 8.929 -10.168 1.0 22.32 19 A 10 -ATOM 285 C CG2 . THR A1 1 19 ? -17.349 9.748 -10.324 1.0 13.14 19 A 10 -ATOM 286 H H . THR A1 1 19 ? -20.495 8.073 -12.354 1.0 1.15 19 A 10 -ATOM 287 H HA . THR A1 1 19 ? -17.895 9.417 -12.698 1.0 65.43 19 A 10 -ATOM 288 H HB . THR A1 1 19 ? -17.97 7.713 -10.375 1.0 44.24 19 A 10 -ATOM 289 H HG1 . THR A1 1 19 ? -19.505 9.251 -9.27 1.0 60.25 19 A 10 -ATOM 290 H HG21 . THR A1 1 19 ? -17.302 10.505 -11.092 1.0 73.33 19 A 10 -ATOM 291 H HG22 . THR A1 1 19 ? -16.37 9.315 -10.186 1.0 23.45 19 A 10 -ATOM 292 H HG23 . THR A1 1 19 ? -17.679 10.195 -9.398 1.0 51.03 19 A 10 -ATOM 293 N N . ILE A1 1 20 ? -16.57 7.364 -13.21 1.0 2.13 20 A 10 -ATOM 294 C CA . ILE A1 1 20 ? -15.857 6.19 -13.696 1.0 23.24 20 A 10 -ATOM 295 C C . ILE A1 1 20 ? -14.385 6.238 -13.303 1.0 21.51 20 A 10 -ATOM 296 O O . ILE A1 1 20 ? -13.715 7.254 -13.487 1.0 3.54 20 A 10 -ATOM 297 C CB . ILE A1 1 20 ? -15.963 6.06 -15.228 1.0 55.55 20 A 10 -ATOM 298 C CG1 . ILE A1 1 20 ? -15.95 7.444 -15.88 1.0 1.5 20 A 10 -ATOM 299 C CG2 . ILE A1 1 20 ? -17.225 5.301 -15.609 1.0 1.32 20 A 10 -ATOM 300 C CD1 . ILE A1 1 20 ? -15.262 7.47 -17.227 1.0 2.4 20 A 10 -ATOM 301 H H . ILE A1 1 20 ? -16.119 8.234 -13.217 1.0 32.52 20 A 10 -ATOM 302 H HA . ILE A1 1 20 ? -16.31 5.316 -13.249 1.0 40.32 20 A 10 -ATOM 303 H HB . ILE A1 1 20 ? -15.113 5.496 -15.579 1.0 75.22 20 A 10 -ATOM 304 H HG12 . ILE A1 1 20 ? -16.965 7.78 -16.02 1.0 4.24 20 A 10 -ATOM 305 H HG13 . ILE A1 1 20 ? -15.433 8.135 -15.23 1.0 20.02 20 A 10 -ATOM 306 H HG21 . ILE A1 1 20 ? -17.106 4.877 -16.595 1.0 41.11 20 A 10 -ATOM 307 H HG22 . ILE A1 1 20 ? -17.398 4.51 -14.895 1.0 51.34 20 A 10 -ATOM 308 H HG23 . ILE A1 1 20 ? -18.067 5.978 -15.607 1.0 74.34 20 A 10 -ATOM 309 H HD11 . ILE A1 1 20 ? -14.21 7.673 -17.09 1.0 44.23 20 A 10 -ATOM 310 H HD12 . ILE A1 1 20 ? -15.382 6.513 -17.712 1.0 43.31 20 A 10 -ATOM 311 H HD13 . ILE A1 1 20 ? -15.7 8.243 -17.841 1.0 23.14 20 A 10 -ATOM 312 N N . ASP A1 1 21 ? -13.887 5.132 -12.761 1.0 44.41 21 A 10 -ATOM 313 C CA . ASP A1 1 21 ? -12.492 5.046 -12.343 1.0 13.43 21 A 10 -ATOM 314 C C . ASP A1 1 21 ? -11.589 4.718 -13.528 1.0 74.52 21 A 10 -ATOM 315 O O . ASP A1 1 21 ? -11.759 3.691 -14.186 1.0 3.25 21 A 10 -ATOM 316 C CB . ASP A1 1 21 ? -12.328 3.986 -11.252 1.0 40.32 21 A 10 -ATOM 317 C CG . ASP A1 1 21 ? -12.688 2.596 -11.737 1.0 70.32 21 A 10 -ATOM 318 O OD1 . ASP A1 1 21 ? -13.891 2.259 -11.734 1.0 34.41 21 A 10 -ATOM 319 O OD2 . ASP A1 1 21 ? -11.767 1.845 -12.121 1.0 4.34 21 A 10 -ATOM 320 H H . ASP A1 1 21 ? -14.471 4.354 -12.639 1.0 61.24 21 A 10 -ATOM 321 H HA . ASP A1 1 21 ? -12.206 6.007 -11.944 1.0 0.1 21 A 10 -ATOM 322 H HB2 . ASP A1 1 21 ? -11.3 3.977 -10.92 1.0 73.15 21 A 10 -ATOM 323 H HB3 . ASP A1 1 21 ? -12.969 4.235 -10.419 1.0 61.23 21 A 10 -ATOM 324 N N . VAL A1 1 22 ? -10.629 5.598 -13.796 1.0 30.34 22 A 10 -ATOM 325 C CA . VAL A1 1 22 ? -9.699 5.402 -14.901 1.0 1.34 22 A 10 -ATOM 326 C C . VAL A1 1 22 ? -8.265 5.686 -14.47 1.0 61.2 22 A 10 -ATOM 327 O O . VAL A1 1 22 ? -8.029 6.307 -13.433 1.0 34.03 22 A 10 -ATOM 328 C CB . VAL A1 1 22 ? -10.052 6.305 -16.098 1.0 60.13 22 A 10 -ATOM 329 C CG1 . VAL A1 1 22 ? -11.507 6.741 -16.027 1.0 14.0 22 A 10 -ATOM 330 C CG2 . VAL A1 1 22 ? -9.126 7.511 -16.145 1.0 61.12 22 A 10 -ATOM 331 H H . VAL A1 1 22 ? -10.544 6.397 -13.235 1.0 71.0 22 A 10 -ATOM 332 H HA . VAL A1 1 22 ? -9.772 4.372 -15.22 1.0 41.13 22 A 10 -ATOM 333 H HB . VAL A1 1 22 ? -9.914 5.736 -17.006 1.0 23.42 22 A 10 -ATOM 334 H HG11 . VAL A1 1 22 ? -11.639 7.42 -15.197 1.0 3.13 22 A 10 -ATOM 335 H HG12 . VAL A1 1 22 ? -11.779 7.239 -16.946 1.0 11.12 22 A 10 -ATOM 336 H HG13 . VAL A1 1 22 ? -12.136 5.875 -15.886 1.0 2.3 22 A 10 -ATOM 337 H HG21 . VAL A1 1 22 ? -9.514 8.235 -16.846 1.0 43.3 22 A 10 -ATOM 338 H HG22 . VAL A1 1 22 ? -9.066 7.956 -15.164 1.0 71.52 22 A 10 -ATOM 339 H HG23 . VAL A1 1 22 ? -8.141 7.198 -16.459 1.0 24.41 22 A 10 -ATOM 340 N N . ASP A1 1 23 ? -7.31 5.227 -15.271 1.0 73.14 23 A 10 -ATOM 341 C CA . ASP A1 1 23 ? -5.897 5.433 -14.974 1.0 0.33 23 A 10 -ATOM 342 C C . ASP A1 1 23 ? -5.248 6.335 -16.018 1.0 62.12 23 A 10 -ATOM 343 O O . ASP A1 1 23 ? -5.693 6.395 -17.165 1.0 35.34 23 A 10 -ATOM 344 C CB . ASP A1 1 23 ? -5.166 4.091 -14.915 1.0 24.44 23 A 10 -ATOM 345 C CG . ASP A1 1 23 ? -4.4 3.905 -13.619 1.0 11.25 23 A 10 -ATOM 346 O OD1 . ASP A1 1 23 ? -3.838 4.899 -13.115 1.0 71.52 23 A 10 -ATOM 347 O OD2 . ASP A1 1 23 ? -4.362 2.765 -13.11 1.0 54.12 23 A 10 -ATOM 348 H H . ASP A1 1 23 ? -7.561 4.739 -16.084 1.0 71.31 23 A 10 -ATOM 349 H HA . ASP A1 1 23 ? -5.828 5.913 -14.009 1.0 62.03 23 A 10 -ATOM 350 H HB2 . ASP A1 1 23 ? -5.887 3.291 -15.003 1.0 75.32 23 A 10 -ATOM 351 H HB3 . ASP A1 1 23 ? -4.467 4.033 -15.737 1.0 32.1 23 A 10 -ATOM 352 N N . HIS A1 1 24 ? -4.193 7.035 -15.614 1.0 3.42 24 A 10 -ATOM 353 C CA . HIS A1 1 24 ? -3.482 7.935 -16.515 1.0 64.1 24 A 10 -ATOM 354 C C . HIS A1 1 24 ? -2.906 7.171 -17.704 1.0 13.22 24 A 10 -ATOM 355 O O . HIS A1 1 24 ? -2.526 7.766 -18.712 1.0 40.32 24 A 10 -ATOM 356 C CB . HIS A1 1 24 ? -2.361 8.659 -15.768 1.0 43.52 24 A 10 -ATOM 357 C CG . HIS A1 1 24 ? -1.216 7.767 -15.396 1.0 63.23 24 A 10 -ATOM 358 N ND1 . HIS A1 1 24 ? -1.292 6.825 -14.392 1.0 33.23 24 A 10 -ATOM 359 C CD2 . HIS A1 1 24 ? 0.036 7.677 -15.901 1.0 70.35 24 A 10 -ATOM 360 C CE1 . HIS A1 1 24 ? -0.135 6.195 -14.294 1.0 52.22 24 A 10 -ATOM 361 N NE2 . HIS A1 1 24 ? 0.688 6.693 -15.199 1.0 51.1 24 A 10 -ATOM 362 H H . HIS A1 1 24 ? -3.885 6.944 -14.688 1.0 35.01 24 A 10 -ATOM 363 H HA . HIS A1 1 24 ? -4.188 8.665 -16.881 1.0 52.33 24 A 10 -ATOM 364 H HB2 . HIS A1 1 24 ? -1.974 9.451 -16.392 1.0 74.33 24 A 10 -ATOM 365 H HB3 . HIS A1 1 24 ? -2.76 9.085 -14.859 1.0 2.24 24 A 10 -ATOM 366 H HD1 . HIS A1 1 24 ? -2.076 6.646 -13.833 1.0 61.24 24 A 10 -ATOM 367 H HD2 . HIS A1 1 24 ? 0.448 8.27 -16.706 1.0 14.35 24 A 10 -ATOM 368 H HE1 . HIS A1 1 24 ? 0.099 5.407 -13.595 1.0 73.24 24 A 10 -ATOM 369 N N . ALA A1 1 25 ? -2.844 5.849 -17.577 1.0 63.43 25 A 10 -ATOM 370 C CA . ALA A1 1 25 ? -2.316 5.004 -18.641 1.0 43.32 25 A 10 -ATOM 371 C C . ALA A1 1 25 ? -3.402 4.647 -19.649 1.0 33.54 25 A 10 -ATOM 372 O O . ALA A1 1 25 ? -3.185 3.835 -20.549 1.0 12.23 25 A 10 -ATOM 373 C CB . ALA A1 1 25 ? -1.701 3.741 -18.055 1.0 51.34 25 A 10 -ATOM 374 H H . ALA A1 1 25 ? -3.162 5.433 -16.749 1.0 55.41 25 A 10 -ATOM 375 H HA . ALA A1 1 25 ? -1.535 5.553 -19.147 1.0 23.12 25 A 10 -ATOM 376 H HB1 . ALA A1 1 25 ? -2.418 3.262 -17.404 1.0 42.21 25 A 10 -ATOM 377 H HB2 . ALA A1 1 25 ? -1.434 3.067 -18.855 1.0 3.14 25 A 10 -ATOM 378 H HB3 . ALA A1 1 25 ? -0.818 3.999 -17.491 1.0 44.44 25 A 10 -ATOM 379 N N . ASP A1 1 26 ? -4.571 5.258 -19.493 1.0 53.31 26 A 10 -ATOM 380 C CA . ASP A1 1 26 ? -5.693 5.005 -20.391 1.0 71.32 26 A 10 -ATOM 381 C C . ASP A1 1 26 ? -5.821 6.118 -21.427 1.0 31.24 26 A 10 -ATOM 382 O O . ASP A1 1 26 ? -4.925 6.95 -21.575 1.0 53.43 26 A 10 -ATOM 383 C CB . ASP A1 1 26 ? -6.993 4.88 -19.595 1.0 21.1 26 A 10 -ATOM 384 C CG . ASP A1 1 26 ? -6.927 3.785 -18.548 1.0 73.54 26 A 10 -ATOM 385 O OD1 . ASP A1 1 26 ? -6.059 3.87 -17.654 1.0 73.22 26 A 10 -ATOM 386 O OD2 . ASP A1 1 26 ? -7.744 2.843 -18.623 1.0 2.02 26 A 10 -ATOM 387 H H . ASP A1 1 26 ? -4.683 5.896 -18.757 1.0 73.33 26 A 10 -ATOM 388 H HA . ASP A1 1 26 ? -5.504 4.074 -20.903 1.0 35.3 26 A 10 -ATOM 389 H HB2 . ASP A1 1 26 ? -7.194 5.817 -19.096 1.0 71.15 26 A 10 -ATOM 390 H HB3 . ASP A1 1 26 ? -7.802 4.657 -20.273 1.0 51.4 26 A 10 -ATOM 391 N N . THR A1 1 27 ? -6.941 6.126 -22.142 1.0 11.22 27 A 10 -ATOM 392 C CA . THR A1 1 27 ? -7.187 7.135 -23.166 1.0 12.11 27 A 10 -ATOM 393 C C . THR A1 1 27 ? -8.671 7.468 -23.265 1.0 24.55 27 A 10 -ATOM 394 O O . THR A1 1 27 ? -9.518 6.732 -22.759 1.0 14.34 27 A 10 -ATOM 395 C CB . THR A1 1 27 ? -6.683 6.669 -24.545 1.0 24.42 27 A 10 -ATOM 396 O OG1 . THR A1 1 27 ? -6.678 5.238 -24.607 1.0 51.41 27 A 10 -ATOM 397 C CG2 . THR A1 1 27 ? -5.283 7.199 -24.818 1.0 72.22 27 A 10 -ATOM 398 H H . THR A1 1 27 ? -7.618 5.437 -21.978 1.0 1.33 27 A 10 -ATOM 399 H HA . THR A1 1 27 ? -6.645 8.028 -22.891 1.0 54.42 27 A 10 -ATOM 400 H HB . THR A1 1 27 ? -7.351 7.052 -25.304 1.0 51.23 27 A 10 -ATOM 401 H HG1 . THR A1 1 27 ? -5.902 4.901 -24.152 1.0 23.44 27 A 10 -ATOM 402 H HG21 . THR A1 1 27 ? -4.934 6.82 -25.766 1.0 20.21 27 A 10 -ATOM 403 H HG22 . THR A1 1 27 ? -4.616 6.874 -24.033 1.0 40.31 27 A 10 -ATOM 404 H HG23 . THR A1 1 27 ? -5.307 8.278 -24.847 1.0 53.14 27 A 10 -ATOM 405 N N . VAL A1 1 28 ? -8.98 8.581 -23.922 1.0 70.04 28 A 10 -ATOM 406 C CA . VAL A1 1 28 ? -10.363 9.011 -24.089 1.0 40.12 28 A 10 -ATOM 407 C C . VAL A1 1 28 ? -11.207 7.911 -24.723 1.0 43.3 28 A 10 -ATOM 408 O O . VAL A1 1 28 ? -12.286 7.581 -24.232 1.0 51.44 28 A 10 -ATOM 409 C CB . VAL A1 1 28 ? -10.456 10.28 -24.958 1.0 70.14 28 A 10 -ATOM 410 C CG1 . VAL A1 1 28 ? -11.86 10.861 -24.907 1.0 13.41 28 A 10 -ATOM 411 C CG2 . VAL A1 1 28 ? -9.428 11.307 -24.51 1.0 73.55 28 A 10 -ATOM 412 H H . VAL A1 1 28 ? -8.261 9.127 -24.303 1.0 50.23 28 A 10 -ATOM 413 H HA . VAL A1 1 28 ? -10.763 9.24 -23.112 1.0 62.42 28 A 10 -ATOM 414 H HB . VAL A1 1 28 ? -10.24 10.007 -25.981 1.0 52.41 28 A 10 -ATOM 415 H HG11 . VAL A1 1 28 ? -12.003 11.375 -23.967 1.0 72.32 28 A 10 -ATOM 416 H HG12 . VAL A1 1 28 ? -11.992 11.556 -25.723 1.0 75.12 28 A 10 -ATOM 417 H HG13 . VAL A1 1 28 ? -12.583 10.063 -24.993 1.0 43.12 28 A 10 -ATOM 418 H HG21 . VAL A1 1 28 ? -9.934 12.191 -24.152 1.0 22.23 28 A 10 -ATOM 419 H HG22 . VAL A1 1 28 ? -8.825 10.891 -23.717 1.0 21.24 28 A 10 -ATOM 420 H HG23 . VAL A1 1 28 ? -8.793 11.57 -25.345 1.0 51.43 28 A 10 -ATOM 421 N N . GLY A1 1 29 ? -10.708 7.347 -25.819 1.0 51.02 29 A 10 -ATOM 422 C CA . GLY A1 1 29 ? -11.429 6.29 -26.503 1.0 24.21 29 A 10 -ATOM 423 C C . GLY A1 1 29 ? -11.869 5.185 -25.563 1.0 62.32 29 A 10 -ATOM 424 O O . GLY A1 1 29 ? -13.036 4.794 -25.557 1.0 1.41 29 A 10 -ATOM 425 H H . GLY A1 1 29 ? -9.844 7.651 -26.166 1.0 25.44 29 A 10 -ATOM 426 H HA2 . GLY A1 1 29 ? -12.302 6.713 -26.978 1.0 33.14 29 A 10 -ATOM 427 H HA3 . GLY A1 1 29 ? -10.789 5.866 -27.262 1.0 61.11 29 A 10 -ATOM 428 N N . ALA A1 1 30 ? -10.933 4.681 -24.766 1.0 0.3 30 A 10 -ATOM 429 C CA . ALA A1 1 30 ? -11.23 3.615 -23.817 1.0 24.42 30 A 10 -ATOM 430 C C . ALA A1 1 30 ? -12.301 4.05 -22.821 1.0 23.15 30 A 10 -ATOM 431 O O . ALA A1 1 30 ? -13.182 3.269 -22.461 1.0 23.32 30 A 10 -ATOM 432 C CB . ALA A1 1 30 ? -9.965 3.194 -23.084 1.0 4.23 30 A 10 -ATOM 433 H H . ALA A1 1 30 ? -10.021 5.035 -24.817 1.0 13.0 30 A 10 -ATOM 434 H HA . ALA A1 1 30 ? -11.595 2.764 -24.374 1.0 42.35 30 A 10 -ATOM 435 H HB1 . ALA A1 1 30 ? -10.09 2.191 -22.701 1.0 24.3 30 A 10 -ATOM 436 H HB2 . ALA A1 1 30 ? -9.129 3.218 -23.766 1.0 15.25 30 A 10 -ATOM 437 H HB3 . ALA A1 1 30 ? -9.782 3.872 -22.264 1.0 54.13 30 A 10 -ATOM 438 N N . VAL A1 1 31 ? -12.219 5.301 -22.379 1.0 44.02 31 A 10 -ATOM 439 C CA . VAL A1 1 31 ? -13.181 5.839 -21.426 1.0 44.43 31 A 10 -ATOM 440 C C . VAL A1 1 31 ? -14.586 5.864 -22.017 1.0 22.33 31 A 10 -ATOM 441 O O . VAL A1 1 31 ? -15.56 5.516 -21.348 1.0 41.34 31 A 10 -ATOM 442 C CB . VAL A1 1 31 ? -12.797 7.264 -20.984 1.0 42.01 31 A 10 -ATOM 443 C CG1 . VAL A1 1 31 ? -13.863 7.845 -20.068 1.0 61.22 31 A 10 -ATOM 444 C CG2 . VAL A1 1 31 ? -11.438 7.261 -20.3 1.0 34.2 31 A 10 -ATOM 445 H H . VAL A1 1 31 ? -11.494 5.875 -22.703 1.0 33.11 31 A 10 -ATOM 446 H HA . VAL A1 1 31 ? -13.179 5.202 -20.553 1.0 53.53 31 A 10 -ATOM 447 H HB . VAL A1 1 31 ? -12.733 7.886 -21.864 1.0 34.14 31 A 10 -ATOM 448 H HG11 . VAL A1 1 31 ? -14.495 8.516 -20.631 1.0 24.43 31 A 10 -ATOM 449 H HG12 . VAL A1 1 31 ? -14.461 7.044 -19.658 1.0 62.24 31 A 10 -ATOM 450 H HG13 . VAL A1 1 31 ? -13.389 8.388 -19.264 1.0 4.44 31 A 10 -ATOM 451 H HG21 . VAL A1 1 31 ? -11.185 6.254 -20.005 1.0 32.4 31 A 10 -ATOM 452 H HG22 . VAL A1 1 31 ? -10.691 7.634 -20.985 1.0 31.51 31 A 10 -ATOM 453 H HG23 . VAL A1 1 31 ? -11.473 7.894 -19.426 1.0 2.41 31 A 10 -ATOM 454 N N . LYS A1 1 32 ? -14.685 6.276 -23.276 1.0 44.33 32 A 10 -ATOM 455 C CA . LYS A1 1 32 ? -15.971 6.345 -23.961 1.0 33.41 32 A 10 -ATOM 456 C C . LYS A1 1 32 ? -16.682 4.996 -23.92 1.0 33.52 32 A 10 -ATOM 457 O O . LYS A1 1 32 ? -17.89 4.928 -23.698 1.0 55.22 32 A 10 -ATOM 458 C CB . LYS A1 1 32 ? -15.775 6.786 -25.413 1.0 21.43 32 A 10 -ATOM 459 C CG . LYS A1 1 32 ? -16.397 8.136 -25.727 1.0 62.04 32 A 10 -ATOM 460 C CD . LYS A1 1 32 ? -15.336 9.207 -25.921 1.0 13.3 32 A 10 -ATOM 461 C CE . LYS A1 1 32 ? -15.247 9.647 -27.375 1.0 61.02 32 A 10 -ATOM 462 N NZ . LYS A1 1 32 ? -16.522 10.252 -27.85 1.0 10.13 32 A 10 -ATOM 463 H H . LYS A1 1 32 ? -13.872 6.54 -23.758 1.0 0.43 32 A 10 -ATOM 464 H HA . LYS A1 1 32 ? -16.58 7.075 -23.45 1.0 20.21 32 A 10 -ATOM 465 H HB2 . LYS A1 1 32 ? -14.717 6.844 -25.62 1.0 31.13 32 A 10 -ATOM 466 H HB3 . LYS A1 1 32 ? -16.221 6.048 -26.064 1.0 51.43 32 A 10 -ATOM 467 H HG2 . LYS A1 1 32 ? -16.978 8.053 -26.633 1.0 34.55 32 A 10 -ATOM 468 H HG3 . LYS A1 1 32 ? -17.041 8.425 -24.909 1.0 75.31 32 A 10 -ATOM 469 H HD2 . LYS A1 1 32 ? -15.585 10.063 -25.312 1.0 62.53 32 A 10 -ATOM 470 H HD3 . LYS A1 1 32 ? -14.378 8.812 -25.615 1.0 34.24 32 A 10 -ATOM 471 H HE2 . LYS A1 1 32 ? -14.456 10.375 -27.469 1.0 32.35 32 A 10 -ATOM 472 H HE3 . LYS A1 1 32 ? -15.018 8.785 -27.984 1.0 31.14 32 A 10 -ATOM 473 H HZ1 . LYS A1 1 32 ? -16.366 10.758 -28.744 1.0 3.34 32 A 10 -ATOM 474 H HZ2 . LYS A1 1 32 ? -16.884 10.923 -27.142 1.0 11.13 32 A 10 -ATOM 475 H HZ3 . LYS A1 1 32 ? -17.234 9.51 -28.003 1.0 13.55 32 A 10 -ATOM 476 N N . ALA A1 1 33 ? -15.924 3.926 -24.133 1.0 34.21 33 A 10 -ATOM 477 C CA . ALA A1 1 33 ? -16.481 2.579 -24.117 1.0 60.31 33 A 10 -ATOM 478 C C . ALA A1 1 33 ? -17.027 2.228 -22.737 1.0 31.03 33 A 10 -ATOM 479 O O . ALA A1 1 33 ? -18.1 1.636 -22.615 1.0 31.32 33 A 10 -ATOM 480 C CB . ALA A1 1 33 ? -15.429 1.567 -24.543 1.0 54.24 33 A 10 -ATOM 481 H H . ALA A1 1 33 ? -14.966 4.045 -24.305 1.0 43.1 33 A 10 -ATOM 482 H HA . ALA A1 1 33 ? -17.29 2.544 -24.833 1.0 53.01 33 A 10 -ATOM 483 H HB1 . ALA A1 1 33 ? -14.512 1.753 -24.003 1.0 2.33 33 A 10 -ATOM 484 H HB2 . ALA A1 1 33 ? -15.78 0.569 -24.326 1.0 61.23 33 A 10 -ATOM 485 H HB3 . ALA A1 1 33 ? -15.247 1.662 -25.603 1.0 53.23 33 A 10 -ATOM 486 N N . LYS A1 1 34 ? -16.283 2.596 -21.7 1.0 30.14 34 A 10 -ATOM 487 C CA . LYS A1 1 34 ? -16.692 2.321 -20.328 1.0 3.41 34 A 10 -ATOM 488 C C . LYS A1 1 34 ? -18.027 2.989 -20.013 1.0 51.04 34 A 10 -ATOM 489 O O . LYS A1 1 34 ? -18.889 2.399 -19.363 1.0 30.3 34 A 10 -ATOM 490 C CB . LYS A1 1 34 ? -15.622 2.807 -19.348 1.0 63.02 34 A 10 -ATOM 491 C CG . LYS A1 1 34 ? -15.965 2.541 -17.892 1.0 24.43 34 A 10 -ATOM 492 C CD . LYS A1 1 34 ? -15.943 1.055 -17.577 1.0 44.42 34 A 10 -ATOM 493 C CE . LYS A1 1 34 ? -14.548 0.472 -17.737 1.0 34.12 34 A 10 -ATOM 494 N NZ . LYS A1 1 34 ? -14.444 -0.89 -17.143 1.0 13.0 34 A 10 -ATOM 495 H H . LYS A1 1 34 ? -15.437 3.066 -21.862 1.0 65.25 34 A 10 -ATOM 496 H HA . LYS A1 1 34 ? -16.805 1.252 -20.223 1.0 3.22 34 A 10 -ATOM 497 H HB2 . LYS A1 1 34 ? -14.691 2.309 -19.573 1.0 71.03 34 A 10 -ATOM 498 H HB3 . LYS A1 1 34 ? -15.491 3.872 -19.476 1.0 71.12 34 A 10 -ATOM 499 H HG2 . LYS A1 1 34 ? -15.243 3.042 -17.264 1.0 24.23 34 A 10 -ATOM 500 H HG3 . LYS A1 1 34 ? -16.953 2.929 -17.688 1.0 22.21 34 A 10 -ATOM 501 H HD2 . LYS A1 1 34 ? -16.267 0.907 -16.557 1.0 63.43 34 A 10 -ATOM 502 H HD3 . LYS A1 1 34 ? -16.617 0.543 -18.249 1.0 75.33 34 A 10 -ATOM 503 H HE2 . LYS A1 1 34 ? -14.315 0.415 -18.79 1.0 34.14 34 A 10 -ATOM 504 H HE3 . LYS A1 1 34 ? -13.84 1.124 -17.247 1.0 0.12 34 A 10 -ATOM 505 H HZ1 . LYS A1 1 34 ? -14.375 -0.824 -16.108 1.0 62.42 34 A 10 -ATOM 506 H HZ2 . LYS A1 1 34 ? -13.597 -1.374 -17.506 1.0 14.2 34 A 10 -ATOM 507 H HZ3 . LYS A1 1 34 ? -15.283 -1.452 -17.389 1.0 65.2 34 A 10 -ATOM 508 N N . ILE A1 1 35 ? -18.19 4.223 -20.48 1.0 14.42 35 A 10 -ATOM 509 C CA . ILE A1 1 35 ? -19.42 4.969 -20.251 1.0 22.32 35 A 10 -ATOM 510 C C . ILE A1 1 35 ? -20.579 4.377 -21.046 1.0 74.31 35 A 10 -ATOM 511 O O . ILE A1 1 35 ? -21.719 4.357 -20.58 1.0 33.23 35 A 10 -ATOM 512 C CB . ILE A1 1 35 ? -19.258 6.453 -20.629 1.0 42.5 35 A 10 -ATOM 513 C CG1 . ILE A1 1 35 ? -18.084 7.071 -19.866 1.0 22.04 35 A 10 -ATOM 514 C CG2 . ILE A1 1 35 ? -20.543 7.216 -20.345 1.0 45.14 35 A 10 -ATOM 515 C CD1 . ILE A1 1 35 ? -18.193 6.92 -18.365 1.0 11.1 35 A 10 -ATOM 516 H H . ILE A1 1 35 ? -17.466 4.64 -20.992 1.0 54.44 35 A 10 -ATOM 517 H HA . ILE A1 1 35 ? -19.654 4.911 -19.197 1.0 30.01 35 A 10 -ATOM 518 H HB . ILE A1 1 35 ? -19.06 6.512 -21.689 1.0 2.44 35 A 10 -ATOM 519 H HG12 . ILE A1 1 35 ? -17.168 6.597 -20.181 1.0 3.24 35 A 10 -ATOM 520 H HG13 . ILE A1 1 35 ? -18.035 8.127 -20.091 1.0 0.11 35 A 10 -ATOM 521 H HG21 . ILE A1 1 35 ? -20.354 7.972 -19.596 1.0 65.32 35 A 10 -ATOM 522 H HG22 . ILE A1 1 35 ? -20.889 7.689 -21.252 1.0 43.1 35 A 10 -ATOM 523 H HG23 . ILE A1 1 35 ? -21.296 6.532 -19.985 1.0 75.41 35 A 10 -ATOM 524 H HD11 . ILE A1 1 35 ? -17.422 6.249 -18.014 1.0 43.52 35 A 10 -ATOM 525 H HD12 . ILE A1 1 35 ? -18.07 7.884 -17.895 1.0 71.15 35 A 10 -ATOM 526 H HD13 . ILE A1 1 35 ? -19.162 6.516 -18.112 1.0 74.3 35 A 10 -ATOM 527 N N . TYR A1 1 36 ? -20.28 3.895 -22.247 1.0 62.53 36 A 10 -ATOM 528 C CA . TYR A1 1 36 ? -21.296 3.303 -23.108 1.0 64.44 36 A 10 -ATOM 529 C C . TYR A1 1 36 ? -22.014 2.16 -22.396 1.0 53.42 36 A 10 -ATOM 530 O O . TYR A1 1 36 ? -23.24 2.058 -22.442 1.0 34.33 36 A 10 -ATOM 531 C CB . TYR A1 1 36 ? -20.663 2.794 -24.404 1.0 74.42 36 A 10 -ATOM 532 C CG . TYR A1 1 36 ? -21.079 1.387 -24.769 1.0 43.51 36 A 10 -ATOM 533 C CD1 . TYR A1 1 36 ? -22.358 1.12 -25.24 1.0 62.31 36 A 10 -ATOM 534 C CD2 . TYR A1 1 36 ? -20.192 0.325 -24.642 1.0 22.21 36 A 10 -ATOM 535 C CE1 . TYR A1 1 36 ? -22.743 -0.165 -25.574 1.0 25.24 36 A 10 -ATOM 536 C CE2 . TYR A1 1 36 ? -20.568 -0.962 -24.975 1.0 24.41 36 A 10 -ATOM 537 C CZ . TYR A1 1 36 ? -21.844 -1.202 -25.441 1.0 51.0 36 A 10 -ATOM 538 O OH . TYR A1 1 36 ? -22.222 -2.483 -25.772 1.0 31.41 36 A 10 -ATOM 539 H H . TYR A1 1 36 ? -19.353 3.94 -22.563 1.0 42.53 36 A 10 -ATOM 540 H HA . TYR A1 1 36 ? -22.017 4.071 -23.348 1.0 45.34 36 A 10 -ATOM 541 H HB2 . TYR A1 1 36 ? -20.95 3.445 -25.216 1.0 32.41 36 A 10 -ATOM 542 H HB3 . TYR A1 1 36 ? -19.588 2.807 -24.301 1.0 73.31 36 A 10 -ATOM 543 H HD1 . TYR A1 1 36 ? -23.061 1.934 -25.344 1.0 14.41 36 A 10 -ATOM 544 H HD2 . TYR A1 1 36 ? -19.194 0.516 -24.277 1.0 73.43 36 A 10 -ATOM 545 H HE1 . TYR A1 1 36 ? -23.742 -0.353 -25.939 1.0 30.0 36 A 10 -ATOM 546 H HE2 . TYR A1 1 36 ? -19.864 -1.775 -24.87 1.0 11.1 36 A 10 -ATOM 547 H HH . TYR A1 1 36 ? -22.805 -2.457 -26.534 1.0 20.21 36 A 10 -ATOM 548 N N . ASP A1 1 37 ? -21.241 1.303 -21.739 1.0 31.31 37 A 10 -ATOM 549 C CA . ASP A1 1 37 ? -21.801 0.168 -21.015 1.0 4.3 37 A 10 -ATOM 550 C C . ASP A1 1 37 ? -22.444 0.62 -19.708 1.0 30.32 37 A 10 -ATOM 551 O O . ASP A1 1 37 ? -23.441 0.051 -19.264 1.0 62.0 37 A 10 -ATOM 552 C CB . ASP A1 1 37 ? -20.714 -0.87 -20.732 1.0 35.43 37 A 10 -ATOM 553 C CG . ASP A1 1 37 ? -20.961 -2.179 -21.455 1.0 34.32 37 A 10 -ATOM 554 O OD1 . ASP A1 1 37 ? -21.905 -2.901 -21.071 1.0 31.12 37 A 10 -ATOM 555 O OD2 . ASP A1 1 37 ? -20.209 -2.483 -22.406 1.0 3.2 37 A 10 -ATOM 556 H H . ASP A1 1 37 ? -20.27 1.438 -21.739 1.0 51.42 37 A 10 -ATOM 557 H HA . ASP A1 1 37 ? -22.56 -0.281 -21.638 1.0 32.24 37 A 10 -ATOM 558 H HB2 . ASP A1 1 37 ? -19.759 -0.479 -21.051 1.0 43.14 37 A 10 -ATOM 559 H HB3 . ASP A1 1 37 ? -20.681 -1.067 -19.67 1.0 34.23 37 A 10 -ATOM 560 N N . LYS A1 1 38 ? -21.865 1.646 -19.094 1.0 33.03 38 A 10 -ATOM 561 C CA . LYS A1 1 38 ? -22.379 2.176 -17.837 1.0 33.5 38 A 10 -ATOM 562 C C . LYS A1 1 38 ? -23.843 2.582 -17.976 1.0 62.1 38 A 10 -ATOM 563 O O . LYS A1 1 38 ? -24.678 2.22 -17.148 1.0 13.24 38 A 10 -ATOM 564 C CB . LYS A1 1 38 ? -21.546 3.379 -17.387 1.0 32.13 38 A 10 -ATOM 565 C CG . LYS A1 1 38 ? -20.791 3.144 -16.091 1.0 11.13 38 A 10 -ATOM 566 C CD . LYS A1 1 38 ? -19.332 2.807 -16.348 1.0 55.11 38 A 10 -ATOM 567 C CE . LYS A1 1 38 ? -19.123 1.307 -16.488 1.0 12.13 38 A 10 -ATOM 568 N NZ . LYS A1 1 38 ? -18.425 0.731 -15.306 1.0 62.42 38 A 10 -ATOM 569 H H . LYS A1 1 38 ? -21.071 2.059 -19.497 1.0 40.1 38 A 10 -ATOM 570 H HA . LYS A1 1 38 ? -22.304 1.398 -17.093 1.0 13.43 38 A 10 -ATOM 571 H HB2 . LYS A1 1 38 ? -20.829 3.614 -18.16 1.0 53.44 38 A 10 -ATOM 572 H HB3 . LYS A1 1 38 ? -22.204 4.225 -17.248 1.0 74.35 38 A 10 -ATOM 573 H HG2 . LYS A1 1 38 ? -20.841 4.039 -15.488 1.0 72.35 38 A 10 -ATOM 574 H HG3 . LYS A1 1 38 ? -21.252 2.324 -15.559 1.0 65.33 38 A 10 -ATOM 575 H HD2 . LYS A1 1 38 ? -19.015 3.289 -17.261 1.0 31.44 38 A 10 -ATOM 576 H HD3 . LYS A1 1 38 ? -18.736 3.169 -15.522 1.0 51.13 38 A 10 -ATOM 577 H HE2 . LYS A1 1 38 ? -20.086 0.831 -16.594 1.0 72.24 38 A 10 -ATOM 578 H HE3 . LYS A1 1 38 ? -18.53 1.12 -17.372 1.0 52.14 38 A 10 -ATOM 579 H HZ1 . LYS A1 1 38 ? -17.863 -0.096 -15.59 1.0 12.21 38 A 10 -ATOM 580 H HZ2 . LYS A1 1 38 ? -19.12 0.436 -14.59 1.0 31.3 38 A 10 -ATOM 581 H HZ3 . LYS A1 1 38 ? -17.791 1.44 -14.885 1.0 72.13 38 A 10 -ATOM 582 N N . GLU A1 1 39 ? -24.146 3.334 -19.03 1.0 74.33 39 A 10 -ATOM 583 C CA . GLU A1 1 39 ? -25.51 3.788 -19.277 1.0 31.43 39 A 10 -ATOM 584 C C . GLU A1 1 39 ? -26.159 2.977 -20.394 1.0 55.55 39 A 10 -ATOM 585 O O . GLU A1 1 39 ? -27.217 2.377 -20.206 1.0 44.25 39 A 10 -ATOM 586 C CB . GLU A1 1 39 ? -25.519 5.274 -19.64 1.0 31.12 39 A 10 -ATOM 587 C CG . GLU A1 1 39 ? -24.295 6.029 -19.146 1.0 22.34 39 A 10 -ATOM 588 C CD . GLU A1 1 39 ? -24.253 6.148 -17.635 1.0 34.02 39 A 10 -ATOM 589 O OE1 . GLU A1 1 39 ? -24.41 5.112 -16.955 1.0 60.52 39 A 10 -ATOM 590 O OE2 . GLU A1 1 39 ? -24.064 7.275 -17.133 1.0 24.54 39 A 10 -ATOM 591 H H . GLU A1 1 39 ? -23.436 3.59 -19.655 1.0 53.12 39 A 10 -ATOM 592 H HA . GLU A1 1 39 ? -26.076 3.645 -18.369 1.0 24.23 39 A 10 -ATOM 593 H HB2 . GLU A1 1 39 ? -25.566 5.37 -20.714 1.0 13.32 39 A 10 -ATOM 594 H HB3 . GLU A1 1 39 ? -26.396 5.732 -19.207 1.0 53.15 39 A 10 -ATOM 595 H HG2 . GLU A1 1 39 ? -23.409 5.507 -19.476 1.0 73.51 39 A 10 -ATOM 596 H HG3 . GLU A1 1 39 ? -24.305 7.022 -19.571 1.0 55.55 39 A 10 -ATOM 597 N N . GLY A1 1 40 ? -25.517 2.964 -21.558 1.0 41.31 40 A 10 -ATOM 598 C CA . GLY A1 1 40 ? -26.046 2.224 -22.689 1.0 23.2 40 A 10 -ATOM 599 C C . GLY A1 1 40 ? -26.269 3.103 -23.904 1.0 54.31 40 A 10 -ATOM 600 O O . GLY A1 1 40 ? -27.31 3.02 -24.556 1.0 62.35 40 A 10 -ATOM 601 H H . GLY A1 1 40 ? -24.677 3.46 -21.65 1.0 1.31 40 A 10 -ATOM 602 H HA2 . GLY A1 1 40 ? -25.352 1.439 -22.948 1.0 42.33 40 A 10 -ATOM 603 H HA3 . GLY A1 1 40 ? -26.988 1.779 -22.404 1.0 42.25 40 A 10 -ATOM 604 N N . ILE A1 1 41 ? -25.29 3.949 -24.208 1.0 11.45 41 A 10 -ATOM 605 C CA . ILE A1 1 41 ? -25.385 4.847 -25.352 1.0 13.21 41 A 10 -ATOM 606 C C . ILE A1 1 41 ? -24.237 4.617 -26.328 1.0 73.14 41 A 10 -ATOM 607 O O . ILE A1 1 41 ? -23.176 4.105 -25.968 1.0 54.03 41 A 10 -ATOM 608 C CB . ILE A1 1 41 ? -25.381 6.323 -24.91 1.0 13.54 41 A 10 -ATOM 609 C CG1 . ILE A1 1 41 ? -24.33 6.549 -23.821 1.0 35.25 41 A 10 -ATOM 610 C CG2 . ILE A1 1 41 ? -26.76 6.732 -24.416 1.0 15.54 41 A 10 -ATOM 611 C CD1 . ILE A1 1 41 ? -23.651 7.898 -23.908 1.0 51.21 41 A 10 -ATOM 612 H H . ILE A1 1 41 ? -24.485 3.969 -23.65 1.0 10.31 41 A 10 -ATOM 613 H HA . ILE A1 1 41 ? -26.319 4.646 -25.857 1.0 22.4 41 A 10 -ATOM 614 H HB . ILE A1 1 41 ? -25.137 6.931 -25.768 1.0 2.22 41 A 10 -ATOM 615 H HG12 . ILE A1 1 41 ? -24.802 6.477 -22.854 1.0 53.25 41 A 10 -ATOM 616 H HG13 . ILE A1 1 41 ? -23.568 5.787 -23.903 1.0 73.21 41 A 10 -ATOM 617 H HG21 . ILE A1 1 41 ? -26.78 6.7 -23.337 1.0 41.34 41 A 10 -ATOM 618 H HG22 . ILE A1 1 41 ? -26.979 7.735 -24.75 1.0 35.01 41 A 10 -ATOM 619 H HG23 . ILE A1 1 41 ? -27.501 6.052 -24.81 1.0 24.24 41 A 10 -ATOM 620 H HD11 . ILE A1 1 41 ? -23.533 8.176 -24.946 1.0 13.35 41 A 10 -ATOM 621 H HD12 . ILE A1 1 41 ? -24.256 8.639 -23.405 1.0 5.02 41 A 10 -ATOM 622 H HD13 . ILE A1 1 41 ? -22.681 7.844 -23.438 1.0 73.01 41 A 10 -ATOM 623 N N . PRO A1 1 42 ? -24.45 5.004 -27.594 1.0 42.01 42 A 10 -ATOM 624 C CA . PRO A1 1 42 ? -23.444 4.852 -28.649 1.0 63.34 42 A 10 -ATOM 625 C C . PRO A1 1 42 ? -22.258 5.792 -28.458 1.0 4.23 42 A 10 -ATOM 626 O O . PRO A1 1 42 ? -22.393 7.015 -28.484 1.0 21.54 42 A 10 -ATOM 627 C CB . PRO A1 1 42 ? -24.21 5.211 -29.925 1.0 63.45 42 A 10 -ATOM 628 C CG . PRO A1 1 42 ? -25.312 6.103 -29.467 1.0 31.23 42 A 10 -ATOM 629 C CD . PRO A1 1 42 ? -25.691 5.621 -28.094 1.0 52.22 42 A 10 -ATOM 630 H HA . PRO A1 1 42 ? -23.088 3.834 -28.714 1.0 60.32 42 A 10 -ATOM 631 H HB2 . PRO A1 1 42 ? -23.549 5.719 -30.613 1.0 50.23 42 A 10 -ATOM 632 H HB3 . PRO A1 1 42 ? -24.594 4.312 -30.383 1.0 64.01 42 A 10 -ATOM 633 H HG2 . PRO A1 1 42 ? -24.964 7.124 -29.424 1.0 0.11 42 A 10 -ATOM 634 H HG3 . PRO A1 1 42 ? -26.154 6.019 -30.138 1.0 1.1 42 A 10 -ATOM 635 H HD2 . PRO A1 1 42 ? -25.986 6.452 -27.471 1.0 11.32 42 A 10 -ATOM 636 H HD3 . PRO A1 1 42 ? -26.485 4.892 -28.155 1.0 34.03 42 A 10 -ATOM 637 N N . PRO A1 1 43 ? -21.066 5.209 -28.262 1.0 1.41 43 A 10 -ATOM 638 C CA . PRO A1 1 43 ? -19.832 5.976 -28.064 1.0 62.53 43 A 10 -ATOM 639 C C . PRO A1 1 43 ? -19.384 6.69 -29.334 1.0 21.35 43 A 10 -ATOM 640 O O . PRO A1 1 43 ? -18.741 7.739 -29.274 1.0 73.42 43 A 10 -ATOM 641 C CB . PRO A1 1 43 ? -18.811 4.909 -27.662 1.0 74.43 43 A 10 -ATOM 642 C CG . PRO A1 1 43 ? -19.331 3.645 -28.255 1.0 42.11 43 A 10 -ATOM 643 C CD . PRO A1 1 43 ? -20.83 3.756 -28.219 1.0 32.53 43 A 10 -ATOM 644 H HA . PRO A1 1 43 ? -19.937 6.696 -27.265 1.0 3.1 43 A 10 -ATOM 645 H HB2 . PRO A1 1 43 ? -17.841 5.165 -28.063 1.0 1.2 43 A 10 -ATOM 646 H HB3 . PRO A1 1 43 ? -18.756 4.845 -26.585 1.0 52.2 43 A 10 -ATOM 647 H HG2 . PRO A1 1 43 ? -18.986 3.549 -29.273 1.0 21.5 43 A 10 -ATOM 648 H HG3 . PRO A1 1 43 ? -19.004 2.801 -27.666 1.0 41.32 43 A 10 -ATOM 649 H HD2 . PRO A1 1 43 ? -21.265 3.269 -29.079 1.0 55.24 43 A 10 -ATOM 650 H HD3 . PRO A1 1 43 ? -21.218 3.33 -27.305 1.0 31.14 43 A 10 -ATOM 651 N N . ASP A1 1 44 ? -19.727 6.117 -30.482 1.0 54.12 44 A 10 -ATOM 652 C CA . ASP A1 1 44 ? -19.361 6.7 -31.768 1.0 51.34 44 A 10 -ATOM 653 C C . ASP A1 1 44 ? -20.286 7.86 -32.122 1.0 65.34 44 A 10 -ATOM 654 O O . ASP A1 1 44 ? -19.986 8.657 -33.01 1.0 41.23 44 A 10 -ATOM 655 C CB . ASP A1 1 44 ? -19.41 5.638 -32.867 1.0 23.35 44 A 10 -ATOM 656 C CG . ASP A1 1 44 ? -18.699 6.079 -34.131 1.0 52.14 44 A 10 -ATOM 657 O OD1 . ASP A1 1 44 ? -17.656 6.756 -34.019 1.0 70.43 44 A 10 -ATOM 658 O OD2 . ASP A1 1 44 ? -19.187 5.748 -35.232 1.0 15.14 44 A 10 -ATOM 659 H H . ASP A1 1 44 ? -20.24 5.282 -30.465 1.0 64.31 44 A 10 -ATOM 660 H HA . ASP A1 1 44 ? -18.351 7.074 -31.686 1.0 72.42 44 A 10 -ATOM 661 H HB2 . ASP A1 1 44 ? -18.938 4.735 -32.507 1.0 64.21 44 A 10 -ATOM 662 H HB3 . ASP A1 1 44 ? -20.441 5.428 -33.109 1.0 74.33 44 A 10 -ATOM 663 N N . GLN A1 1 45 ? -21.413 7.946 -31.422 1.0 24.51 45 A 10 -ATOM 664 C CA . GLN A1 1 45 ? -22.384 9.007 -31.665 1.0 55.1 45 A 10 -ATOM 665 C C . GLN A1 1 45 ? -22.256 10.11 -30.62 1.0 65.33 45 A 10 -ATOM 666 O O . GLN A1 1 45 ? -22.82 11.193 -30.776 1.0 0.12 45 A 10 -ATOM 667 C CB . GLN A1 1 45 ? -23.804 8.44 -31.654 1.0 3.33 45 A 10 -ATOM 668 C CG . GLN A1 1 45 ? -24.261 7.917 -33.007 1.0 71.05 45 A 10 -ATOM 669 C CD . GLN A1 1 45 ? -25.17 6.709 -32.889 1.0 50.21 45 A 10 -ATOM 670 O OE1 . GLN A1 1 45 ? -26.386 6.845 -32.747 1.0 30.33 45 A 10 -ATOM 671 N NE2 . GLN A1 1 45 ? -24.584 5.519 -32.947 1.0 54.11 45 A 10 -ATOM 672 H H . GLN A1 1 45 ? -21.597 7.28 -30.728 1.0 33.14 45 A 10 -ATOM 673 H HA . GLN A1 1 45 ? -22.18 9.425 -32.639 1.0 54.13 45 A 10 -ATOM 674 H HB2 . GLN A1 1 45 ? -23.85 7.628 -30.944 1.0 72.22 45 A 10 -ATOM 675 H HB3 . GLN A1 1 45 ? -24.487 9.217 -31.344 1.0 51.24 45 A 10 -ATOM 676 H HG2 . GLN A1 1 45 ? -24.796 8.702 -33.52 1.0 11.31 45 A 10 -ATOM 677 H HG3 . GLN A1 1 45 ? -23.39 7.639 -33.583 1.0 33.23 45 A 10 -ATOM 678 H HE21 . GLN A1 1 45 ? -23.611 5.488 -33.06 1.0 35.4 45 A 10 -ATOM 679 H HE22 . GLN A1 1 45 ? -25.148 4.722 -32.873 1.0 53.4 45 A 10 -ATOM 680 N N . GLN A1 1 46 ? -21.512 9.827 -29.555 1.0 5.34 46 A 10 -ATOM 681 C CA . GLN A1 1 46 ? -21.313 10.796 -28.484 1.0 54.21 46 A 10 -ATOM 682 C C . GLN A1 1 46 ? -19.903 11.378 -28.532 1.0 23.33 46 A 10 -ATOM 683 O O . GLN A1 1 46 ? -18.989 10.769 -29.089 1.0 42.0 46 A 10 -ATOM 684 C CB . GLN A1 1 46 ? -21.562 10.143 -27.124 1.0 54.1 46 A 10 -ATOM 685 C CG . GLN A1 1 46 ? -20.639 8.97 -26.834 1.0 63.33 46 A 10 -ATOM 686 C CD . GLN A1 1 46 ? -19.791 9.186 -25.597 1.0 73.34 46 A 10 -ATOM 687 O OE1 . GLN A1 1 46 ? -20.041 8.594 -24.547 1.0 62.34 46 A 10 -ATOM 688 N NE2 . GLN A1 1 46 ? -18.779 10.038 -25.714 1.0 52.51 46 A 10 -ATOM 689 H H . GLN A1 1 46 ? -21.089 8.947 -29.488 1.0 61.13 46 A 10 -ATOM 690 H HA . GLN A1 1 46 ? -22.023 11.597 -28.625 1.0 1.54 46 A 10 -ATOM 691 H HB2 . GLN A1 1 46 ? -21.421 10.884 -26.351 1.0 70.34 46 A 10 -ATOM 692 H HB3 . GLN A1 1 46 ? -22.581 9.788 -27.089 1.0 24.41 46 A 10 -ATOM 693 H HG2 . GLN A1 1 46 ? -21.24 8.084 -26.689 1.0 71.34 46 A 10 -ATOM 694 H HG3 . GLN A1 1 46 ? -19.985 8.826 -27.681 1.0 12.44 46 A 10 -ATOM 695 H HE21 . GLN A1 1 46 ? -18.64 10.475 -26.581 1.0 61.21 46 A 10 -ATOM 696 H HE22 . GLN A1 1 46 ? -18.215 10.198 -24.93 1.0 54.41 46 A 10 -ATOM 697 N N . ARG A1 1 47 ? -19.735 12.558 -27.946 1.0 11.31 47 A 10 -ATOM 698 C CA . ARG A1 1 47 ? -18.438 13.222 -27.923 1.0 74.42 47 A 10 -ATOM 699 C C . ARG A1 1 47 ? -18.226 13.957 -26.603 1.0 0.05 47 A 10 -ATOM 700 O O . ARG A1 1 47 ? -19.176 14.206 -25.859 1.0 62.43 47 A 10 -ATOM 701 C CB . ARG A1 1 47 ? -18.323 14.205 -29.09 1.0 53.24 47 A 10 -ATOM 702 C CG . ARG A1 1 47 ? -18.388 13.54 -30.455 1.0 25.13 47 A 10 -ATOM 703 C CD . ARG A1 1 47 ? -19.808 13.521 -30.998 1.0 74.31 47 A 10 -ATOM 704 N NE . ARG A1 1 47 ? -19.933 12.663 -32.173 1.0 72.02 47 A 10 -ATOM 705 C CZ . ARG A1 1 47 ? -19.569 13.033 -33.396 1.0 4.33 47 A 10 -ATOM 706 N NH1 . ARG A1 1 47 ? -19.06 14.239 -33.603 1.0 22.33 47 A 10 -ATOM 707 N NH2 . ARG A1 1 47 ? -19.714 12.195 -34.415 1.0 24.44 47 A 10 -ATOM 708 H H . ARG A1 1 47 ? -20.502 12.994 -27.519 1.0 14.32 47 A 10 -ATOM 709 H HA . ARG A1 1 47 ? -17.675 12.465 -28.026 1.0 52.1 47 A 10 -ATOM 710 H HB2 . ARG A1 1 47 ? -19.13 14.92 -29.024 1.0 12.43 47 A 10 -ATOM 711 H HB3 . ARG A1 1 47 ? -17.382 14.728 -29.013 1.0 31.22 47 A 10 -ATOM 712 H HG2 . ARG A1 1 47 ? -17.759 14.087 -31.142 1.0 2.15 47 A 10 -ATOM 713 H HG3 . ARG A1 1 47 ? -18.032 12.525 -30.367 1.0 3.22 47 A 10 -ATOM 714 H HD2 . ARG A1 1 47 ? -20.47 13.157 -30.227 1.0 62.34 47 A 10 -ATOM 715 H HD3 . ARG A1 1 47 ? -20.09 14.528 -31.268 1.0 4.32 47 A 10 -ATOM 716 H HE . ARG A1 1 47 ? -20.307 11.767 -32.043 1.0 51.12 47 A 10 -ATOM 717 H HH11 . ARG A1 1 47 ? -18.948 14.872 -32.837 1.0 35.02 47 A 10 -ATOM 718 H HH12 . ARG A1 1 47 ? -18.785 14.515 -34.524 1.0 42.25 47 A 10 -ATOM 719 H HH21 . ARG A1 1 47 ? -20.097 11.285 -34.263 1.0 32.54 47 A 10 -ATOM 720 H HH22 . ARG A1 1 47 ? -19.44 12.474 -35.334 1.0 51.04 47 A 10 -ATOM 721 N N . LEU A1 1 48 ? -16.975 14.302 -26.317 1.0 13.42 48 A 10 -ATOM 722 C CA . LEU A1 1 48 ? -16.638 15.008 -25.086 1.0 63.04 48 A 10 -ATOM 723 C C . LEU A1 1 48 ? -16.316 16.472 -25.369 1.0 70.54 48 A 10 -ATOM 724 O O . LEU A1 1 48 ? -15.748 16.803 -26.41 1.0 13.22 48 A 10 -ATOM 725 C CB . LEU A1 1 48 ? -15.447 14.336 -24.4 1.0 73.22 48 A 10 -ATOM 726 C CG . LEU A1 1 48 ? -15.363 12.816 -24.538 1.0 23.01 48 A 10 -ATOM 727 C CD1 . LEU A1 1 48 ? -16.741 12.189 -24.389 1.0 2.23 48 A 10 -ATOM 728 C CD2 . LEU A1 1 48 ? -14.744 12.435 -25.875 1.0 62.5 48 A 10 -ATOM 729 H H . LEU A1 1 48 ? -16.261 14.077 -26.949 1.0 13.1 48 A 10 -ATOM 730 H HA . LEU A1 1 48 ? -17.495 14.96 -24.431 1.0 5.14 48 A 10 -ATOM 731 H HB2 . LEU A1 1 48 ? -14.545 14.756 -24.816 1.0 14.35 48 A 10 -ATOM 732 H HB3 . LEU A1 1 48 ? -15.498 14.571 -23.346 1.0 62.22 48 A 10 -ATOM 733 H HG . LEU A1 1 48 ? -14.732 12.423 -23.752 1.0 74.12 48 A 10 -ATOM 734 H HD11 . LEU A1 1 48 ? -17.377 12.849 -23.819 1.0 72.12 48 A 10 -ATOM 735 H HD12 . LEU A1 1 48 ? -16.652 11.243 -23.876 1.0 51.52 48 A 10 -ATOM 736 H HD13 . LEU A1 1 48 ? -17.171 12.029 -25.367 1.0 50.13 48 A 10 -ATOM 737 H HD21 . LEU A1 1 48 ? -14.196 11.51 -25.768 1.0 32.51 48 A 10 -ATOM 738 H HD22 . LEU A1 1 48 ? -14.071 13.217 -26.195 1.0 4.35 48 A 10 -ATOM 739 H HD23 . LEU A1 1 48 ? -15.525 12.309 -26.611 1.0 44.23 48 A 10 -ATOM 740 N N . ILE A1 1 49 ? -16.682 17.343 -24.435 1.0 13.31 49 A 10 -ATOM 741 C CA . ILE A1 1 49 ? -16.429 18.771 -24.582 1.0 13.25 49 A 10 -ATOM 742 C C . ILE A1 1 49 ? -15.989 19.391 -23.26 1.0 73.24 49 A 10 -ATOM 743 O O . ILE A1 1 49 ? -16.67 19.258 -22.243 1.0 20.41 49 A 10 -ATOM 744 C CB . ILE A1 1 49 ? -17.678 19.514 -25.094 1.0 42.12 49 A 10 -ATOM 745 C CG1 . ILE A1 1 49 ? -17.681 19.557 -26.623 1.0 21.4 49 A 10 -ATOM 746 C CG2 . ILE A1 1 49 ? -17.73 20.922 -24.519 1.0 44.11 49 A 10 -ATOM 747 C CD1 . ILE A1 1 49 ? -18.967 19.05 -27.239 1.0 30.32 49 A 10 -ATOM 748 H H . ILE A1 1 49 ? -17.131 17.018 -23.627 1.0 11.12 49 A 10 -ATOM 749 H HA . ILE A1 1 49 ? -15.638 18.897 -25.307 1.0 31.54 49 A 10 -ATOM 750 H HB . ILE A1 1 49 ? -18.552 18.98 -24.753 1.0 10.22 49 A 10 -ATOM 751 H HG12 . ILE A1 1 49 ? -17.537 20.575 -26.949 1.0 52.53 49 A 10 -ATOM 752 H HG13 . ILE A1 1 49 ? -16.871 18.946 -26.995 1.0 23.14 49 A 10 -ATOM 753 H HG21 . ILE A1 1 49 ? -16.75 21.371 -24.58 1.0 54.41 49 A 10 -ATOM 754 H HG22 . ILE A1 1 49 ? -18.433 21.515 -25.084 1.0 2.4 49 A 10 -ATOM 755 H HG23 . ILE A1 1 49 ? -18.042 20.878 -23.486 1.0 53.42 49 A 10 -ATOM 756 H HD11 . ILE A1 1 49 ? -19.801 19.328 -26.61 1.0 43.14 49 A 10 -ATOM 757 H HD12 . ILE A1 1 49 ? -19.094 19.487 -28.218 1.0 61.33 49 A 10 -ATOM 758 H HD13 . ILE A1 1 49 ? -18.926 17.975 -27.326 1.0 3.14 49 A 10 -ATOM 759 N N . PHE A1 1 50 ? -14.847 20.07 -23.283 1.0 0.44 50 A 10 -ATOM 760 C CA . PHE A1 1 50 ? -14.316 20.712 -22.086 1.0 63.4 50 A 10 -ATOM 761 C C . PHE A1 1 50 ? -13.979 22.175 -22.358 1.0 34.31 50 A 10 -ATOM 762 O O . PHE A1 1 50 ? -13.167 22.486 -23.229 1.0 24.03 50 A 10 -ATOM 763 C CB . PHE A1 1 50 ? -13.069 19.973 -21.596 1.0 1.31 50 A 10 -ATOM 764 C CG . PHE A1 1 50 ? -12.754 20.223 -20.149 1.0 63.44 50 A 10 -ATOM 765 C CD1 . PHE A1 1 50 ? -12.429 21.496 -19.707 1.0 63.22 50 A 10 -ATOM 766 C CD2 . PHE A1 1 50 ? -12.783 19.187 -19.23 1.0 31.12 50 A 10 -ATOM 767 C CE1 . PHE A1 1 50 ? -12.138 21.729 -18.376 1.0 44.05 50 A 10 -ATOM 768 C CE2 . PHE A1 1 50 ? -12.493 19.414 -17.898 1.0 53.14 50 A 10 -ATOM 769 C CZ . PHE A1 1 50 ? -12.171 20.687 -17.47 1.0 64.24 50 A 10 -ATOM 770 H H . PHE A1 1 50 ? -14.349 20.141 -24.124 1.0 32.43 50 A 10 -ATOM 771 H HA . PHE A1 1 50 ? -15.075 20.666 -21.321 1.0 55.42 50 A 10 -ATOM 772 H HB2 . PHE A1 1 50 ? -13.215 18.911 -21.724 1.0 72.21 50 A 10 -ATOM 773 H HB3 . PHE A1 1 50 ? -12.219 20.288 -22.181 1.0 52.42 50 A 10 -ATOM 774 H HD1 . PHE A1 1 50 ? -12.404 22.312 -20.414 1.0 64.41 50 A 10 -ATOM 775 H HD2 . PHE A1 1 50 ? -13.035 18.19 -19.564 1.0 25.0 50 A 10 -ATOM 776 H HE1 . PHE A1 1 50 ? -11.887 22.725 -18.045 1.0 33.34 50 A 10 -ATOM 777 H HE2 . PHE A1 1 50 ? -12.519 18.596 -17.192 1.0 34.14 50 A 10 -ATOM 778 H HZ . PHE A1 1 50 ? -11.943 20.866 -16.43 1.0 42.2 50 A 10 -ATOM 779 N N . GLY A1 1 51 ? -14.61 23.072 -21.605 1.0 53.44 51 A 10 -ATOM 780 C CA . GLY A1 1 51 ? -14.365 24.491 -21.78 1.0 33.5 51 A 10 -ATOM 781 C C . GLY A1 1 51 ? -14.886 25.011 -23.105 1.0 34.32 51 A 10 -ATOM 782 O O . GLY A1 1 51 ? -14.634 26.157 -23.473 1.0 0.02 51 A 10 -ATOM 783 H H . GLY A1 1 51 ? -15.247 22.766 -20.926 1.0 14.34 51 A 10 -ATOM 784 H HA2 . GLY A1 1 51 ? -14.849 25.03 -20.979 1.0 71.3 51 A 10 -ATOM 785 H HA3 . GLY A1 1 51 ? -13.301 24.67 -21.73 1.0 2.33 51 A 10 -ATOM 786 N N . GLY A1 1 52 ? -15.615 24.163 -23.826 1.0 51.33 52 A 10 -ATOM 787 C CA . GLY A1 1 52 ? -16.159 24.561 -25.111 1.0 70.11 52 A 10 -ATOM 788 C C . GLY A1 1 52 ? -15.558 23.779 -26.263 1.0 64.35 52 A 10 -ATOM 789 O O . GLY A1 1 52 ? -16.209 23.567 -27.286 1.0 21.12 52 A 10 -ATOM 790 H H . GLY A1 1 52 ? -15.784 23.261 -23.483 1.0 52.33 52 A 10 -ATOM 791 H HA2 . GLY A1 1 52 ? -17.227 24.404 -25.102 1.0 34.31 52 A 10 -ATOM 792 H HA3 . GLY A1 1 52 ? -15.962 25.612 -25.264 1.0 33.12 52 A 10 -ATOM 793 N N . LYS A1 1 53 ? -14.311 23.351 -26.097 1.0 4.12 53 A 10 -ATOM 794 C CA . LYS A1 1 53 ? -13.621 22.588 -27.131 1.0 20.15 53 A 10 -ATOM 795 C C . LYS A1 1 53 ? -13.776 21.089 -26.896 1.0 12.34 53 A 10 -ATOM 796 O O . LYS A1 1 53 ? -13.843 20.635 -25.754 1.0 53.3 53 A 10 -ATOM 797 C CB . LYS A1 1 53 ? -12.136 22.959 -27.161 1.0 12.13 53 A 10 -ATOM 798 C CG . LYS A1 1 53 ? -11.449 22.828 -25.813 1.0 34.42 53 A 10 -ATOM 799 C CD . LYS A1 1 53 ? -10.844 21.446 -25.628 1.0 44.0 53 A 10 -ATOM 800 C CE . LYS A1 1 53 ? -9.721 21.191 -26.621 1.0 75.53 53 A 10 -ATOM 801 N NZ . LYS A1 1 53 ? -8.58 20.469 -25.994 1.0 61.53 53 A 10 -ATOM 802 H H . LYS A1 1 53 ? -13.844 23.551 -25.259 1.0 32.12 53 A 10 -ATOM 803 H HA . LYS A1 1 53 ? -14.066 22.839 -28.082 1.0 74.23 53 A 10 -ATOM 804 H HB2 . LYS A1 1 53 ? -11.631 22.314 -27.865 1.0 34.02 53 A 10 -ATOM 805 H HB3 . LYS A1 1 53 ? -12.041 23.984 -27.492 1.0 32.22 53 A 10 -ATOM 806 H HG2 . LYS A1 1 53 ? -10.662 23.565 -25.748 1.0 24.24 53 A 10 -ATOM 807 H HG3 . LYS A1 1 53 ? -12.174 23.002 -25.031 1.0 53.0 53 A 10 -ATOM 808 H HD2 . LYS A1 1 53 ? -10.449 21.367 -24.626 1.0 22.42 53 A 10 -ATOM 809 H HD3 . LYS A1 1 53 ? -11.616 20.703 -25.772 1.0 0.05 53 A 10 -ATOM 810 H HE2 . LYS A1 1 53 ? -10.107 20.599 -27.436 1.0 25.2 53 A 10 -ATOM 811 H HE3 . LYS A1 1 53 ? -9.371 22.14 -27.0 1.0 75.24 53 A 10 -ATOM 812 H HZ1 . LYS A1 1 53 ? -7.729 20.563 -26.584 1.0 1.33 53 A 10 -ATOM 813 H HZ2 . LYS A1 1 53 ? -8.809 19.459 -25.893 1.0 14.14 53 A 10 -ATOM 814 H HZ3 . LYS A1 1 53 ? -8.381 20.863 -25.053 1.0 31.25 53 A 10 -ATOM 815 N N . GLN A1 1 54 ? -13.83 20.327 -27.983 1.0 32.1 54 A 10 -ATOM 816 C CA . GLN A1 1 54 ? -13.976 18.879 -27.894 1.0 3.14 54 A 10 -ATOM 817 C C . GLN A1 1 54 ? -12.679 18.229 -27.423 1.0 14.5 54 A 10 -ATOM 818 O O . GLN A1 1 54 ? -11.622 18.861 -27.415 1.0 22.04 54 A 10 -ATOM 819 C CB . GLN A1 1 54 ? -14.386 18.302 -29.25 1.0 14.03 54 A 10 -ATOM 820 C CG . GLN A1 1 54 ? -15.837 17.852 -29.306 1.0 52.41 54 A 10 -ATOM 821 C CD . GLN A1 1 54 ? -16.29 17.515 -30.713 1.0 44.23 54 A 10 -ATOM 822 O OE1 . GLN A1 1 54 ? -17.342 17.97 -31.165 1.0 25.33 54 A 10 -ATOM 823 N NE2 . GLN A1 1 54 ? -15.496 16.715 -31.415 1.0 63.1 54 A 10 -ATOM 824 H H . GLN A1 1 54 ? -13.77 20.748 -28.865 1.0 52.11 54 A 10 -ATOM 825 H HA . GLN A1 1 54 ? -14.752 18.668 -27.174 1.0 62.04 54 A 10 -ATOM 826 H HB2 . GLN A1 1 54 ? -14.235 19.054 -30.009 1.0 31.24 54 A 10 -ATOM 827 H HB3 . GLN A1 1 54 ? -13.76 17.45 -29.469 1.0 25.42 54 A 10 -ATOM 828 H HG2 . GLN A1 1 54 ? -15.953 16.975 -28.687 1.0 52.11 54 A 10 -ATOM 829 H HG3 . GLN A1 1 54 ? -16.461 18.646 -28.923 1.0 53.52 54 A 10 -ATOM 830 H HE21 . GLN A1 1 54 ? -14.675 16.39 -30.989 1.0 45.55 54 A 10 -ATOM 831 H HE22 . GLN A1 1 54 ? -15.765 16.48 -32.326 1.0 62.42 54 A 10 -ATOM 832 N N . LEU A1 1 55 ? -12.766 16.963 -27.03 1.0 51.34 55 A 10 -ATOM 833 C CA . LEU A1 1 55 ? -11.599 16.226 -26.557 1.0 40.45 55 A 10 -ATOM 834 C C . LEU A1 1 55 ? -11.26 15.078 -27.502 1.0 63.5 55 A 10 -ATOM 835 O O . LEU A1 1 55 ? -12.112 14.248 -27.815 1.0 52.11 55 A 10 -ATOM 836 C CB . LEU A1 1 55 ? -11.85 15.685 -25.148 1.0 25.03 55 A 10 -ATOM 837 C CG . LEU A1 1 55 ? -12.291 16.711 -24.104 1.0 41.33 55 A 10 -ATOM 838 C CD1 . LEU A1 1 55 ? -12.344 16.078 -22.722 1.0 33.24 55 A 10 -ATOM 839 C CD2 . LEU A1 1 55 ? -11.354 17.911 -24.106 1.0 52.23 55 A 10 -ATOM 840 H H . LEU A1 1 55 ? -13.635 16.512 -27.059 1.0 12.34 55 A 10 -ATOM 841 H HA . LEU A1 1 55 ? -10.765 16.911 -26.527 1.0 22.21 55 A 10 -ATOM 842 H HB2 . LEU A1 1 55 ? -12.619 14.931 -25.216 1.0 55.1 55 A 10 -ATOM 843 H HB3 . LEU A1 1 55 ? -10.933 15.231 -24.801 1.0 51.11 55 A 10 -ATOM 844 H HG . LEU A1 1 55 ? -13.284 17.061 -24.348 1.0 72.12 55 A 10 -ATOM 845 H HD11 . LEU A1 1 55 ? -11.383 15.647 -22.486 1.0 32.04 55 A 10 -ATOM 846 H HD12 . LEU A1 1 55 ? -13.098 15.305 -22.71 1.0 44.35 55 A 10 -ATOM 847 H HD13 . LEU A1 1 55 ? -12.591 16.832 -21.989 1.0 32.21 55 A 10 -ATOM 848 H HD21 . LEU A1 1 55 ? -10.482 17.685 -24.701 1.0 33.14 55 A 10 -ATOM 849 H HD22 . LEU A1 1 55 ? -11.052 18.133 -23.093 1.0 72.01 55 A 10 -ATOM 850 H HD23 . LEU A1 1 55 ? -11.866 18.766 -24.525 1.0 74.33 55 A 10 -ATOM 851 N N . GLU A1 1 56 ? -10.009 15.037 -27.95 1.0 12.02 56 A 10 -ATOM 852 C CA . GLU A1 1 56 ? -9.557 13.99 -28.858 1.0 31.33 56 A 10 -ATOM 853 C C . GLU A1 1 56 ? -9.589 12.626 -28.174 1.0 62.51 56 A 10 -ATOM 854 O O . GLU A1 1 56 ? -10.042 12.501 -27.036 1.0 51.02 56 A 10 -ATOM 855 C CB . GLU A1 1 56 ? -8.142 14.29 -29.355 1.0 62.01 56 A 10 -ATOM 856 C CG . GLU A1 1 56 ? -7.99 15.677 -29.957 1.0 21.02 56 A 10 -ATOM 857 C CD . GLU A1 1 56 ? -6.767 15.796 -30.846 1.0 1.0 56 A 10 -ATOM 858 O OE1 . GLU A1 1 56 ? -6.055 14.785 -31.016 1.0 61.34 56 A 10 -ATOM 859 O OE2 . GLU A1 1 56 ? -6.523 16.902 -31.373 1.0 22.01 56 A 10 -ATOM 860 H H . GLU A1 1 56 ? -9.375 15.728 -27.664 1.0 72.43 56 A 10 -ATOM 861 H HA . GLU A1 1 56 ? -10.229 13.971 -29.703 1.0 4.21 56 A 10 -ATOM 862 H HB2 . GLU A1 1 56 ? -7.456 14.202 -28.526 1.0 41.11 56 A 10 -ATOM 863 H HB3 . GLU A1 1 56 ? -7.876 13.563 -30.109 1.0 51.02 56 A 10 -ATOM 864 H HG2 . GLU A1 1 56 ? -8.867 15.898 -30.546 1.0 71.31 56 A 10 -ATOM 865 H HG3 . GLU A1 1 56 ? -7.905 16.396 -29.156 1.0 60.44 56 A 10 -ATOM 866 N N . ASP A1 1 57 ? -9.106 11.607 -28.876 1.0 71.03 57 A 10 -ATOM 867 C CA . ASP A1 1 57 ? -9.078 10.252 -28.338 1.0 63.41 57 A 10 -ATOM 868 C C . ASP A1 1 57 ? -8.006 10.118 -27.261 1.0 21.4 57 A 10 -ATOM 869 O O . ASP A1 1 57 ? -8.102 9.264 -26.379 1.0 43.31 57 A 10 -ATOM 870 C CB . ASP A1 1 57 ? -8.823 9.241 -29.457 1.0 45.31 57 A 10 -ATOM 871 C CG . ASP A1 1 57 ? -9.769 9.423 -30.628 1.0 55.43 57 A 10 -ATOM 872 O OD1 . ASP A1 1 57 ? -9.522 10.325 -31.456 1.0 72.35 57 A 10 -ATOM 873 O OD2 . ASP A1 1 57 ? -10.756 8.664 -30.717 1.0 15.11 57 A 10 -ATOM 874 H H . ASP A1 1 57 ? -8.759 11.771 -29.779 1.0 23.12 57 A 10 -ATOM 875 H HA . ASP A1 1 57 ? -10.042 10.051 -27.896 1.0 62.14 57 A 10 -ATOM 876 H HB2 . ASP A1 1 57 ? -7.811 9.357 -29.815 1.0 24.44 57 A 10 -ATOM 877 H HB3 . ASP A1 1 57 ? -8.951 8.242 -29.066 1.0 64.03 57 A 10 -ATOM 878 N N . SER A1 1 58 ? -6.986 10.966 -27.339 1.0 32.51 58 A 10 -ATOM 879 C CA . SER A1 1 58 ? -5.893 10.938 -26.373 1.0 62.24 58 A 10 -ATOM 880 C C . SER A1 1 58 ? -5.931 12.171 -25.476 1.0 2.12 58 A 10 -ATOM 881 O O . SER A1 1 58 ? -5.049 12.373 -24.642 1.0 12.21 58 A 10 -ATOM 882 C CB . SER A1 1 58 ? -4.547 10.861 -27.097 1.0 65.11 58 A 10 -ATOM 883 O OG . SER A1 1 58 ? -3.482 10.704 -26.175 1.0 34.21 58 A 10 -ATOM 884 H H . SER A1 1 58 ? -6.966 11.624 -28.065 1.0 21.03 58 A 10 -ATOM 885 H HA . SER A1 1 58 ? -6.014 10.058 -25.761 1.0 33.55 58 A 10 -ATOM 886 H HB2 . SER A1 1 58 ? -4.551 10.017 -27.77 1.0 31.42 58 A 10 -ATOM 887 H HB3 . SER A1 1 58 ? -4.391 11.77 -27.659 1.0 40.4 58 A 10 -ATOM 888 H HG . SER A1 1 58 ? -2.75 11.27 -26.433 1.0 10.23 58 A 10 -ATOM 889 N N . ASN A1 1 59 ? -6.959 12.994 -25.653 1.0 35.41 59 A 10 -ATOM 890 C CA . ASN A1 1 59 ? -7.113 14.208 -24.86 1.0 52.34 59 A 10 -ATOM 891 C C . ASN A1 1 59 ? -7.797 13.906 -23.53 1.0 4.01 59 A 10 -ATOM 892 O O . ASN A1 1 59 ? -8.986 14.173 -23.358 1.0 42.21 59 A 10 -ATOM 893 C CB . ASN A1 1 59 ? -7.92 15.251 -25.637 1.0 21.1 59 A 10 -ATOM 894 C CG . ASN A1 1 59 ? -7.801 16.638 -25.037 1.0 14.54 59 A 10 -ATOM 895 O OD1 . ASN A1 1 59 ? -8.328 16.907 -23.957 1.0 24.42 59 A 10 -ATOM 896 N ND2 . ASN A1 1 59 ? -7.106 17.528 -25.736 1.0 14.44 59 A 10 -ATOM 897 H H . ASN A1 1 59 ? -7.631 12.78 -26.334 1.0 5.51 59 A 10 -ATOM 898 H HA . ASN A1 1 59 ? -6.127 14.602 -24.664 1.0 74.51 59 A 10 -ATOM 899 H HB2 . ASN A1 1 59 ? -7.562 15.288 -26.655 1.0 43.43 59 A 10 -ATOM 900 H HB3 . ASN A1 1 59 ? -8.961 14.966 -25.635 1.0 11.21 59 A 10 -ATOM 901 H HD21 . ASN A1 1 59 ? -6.715 17.243 -26.589 1.0 21.33 59 A 10 -ATOM 902 H HD22 . ASN A1 1 59 ? -7.013 18.432 -25.372 1.0 12.0 59 A 10 -ATOM 903 N N . ALA A1 1 60 ? -7.037 13.35 -22.593 1.0 13.11 60 A 10 -ATOM 904 C CA . ALA A1 1 60 ? -7.568 13.014 -21.278 1.0 35.51 60 A 10 -ATOM 905 C C . ALA A1 1 60 ? -6.457 12.565 -20.335 1.0 74.01 60 A 10 -ATOM 906 O O . ALA A1 1 60 ? -5.97 13.347 -19.518 1.0 74.24 60 A 10 -ATOM 907 C CB . ALA A1 1 60 ? -8.63 11.931 -21.398 1.0 64.13 60 A 10 -ATOM 908 H H . ALA A1 1 60 ? -6.096 13.161 -22.791 1.0 31.12 60 A 10 -ATOM 909 H HA . ALA A1 1 60 ? -8.036 13.899 -20.871 1.0 20.01 60 A 10 -ATOM 910 H HB1 . ALA A1 1 60 ? -8.199 11.056 -21.862 1.0 72.33 60 A 10 -ATOM 911 H HB2 . ALA A1 1 60 ? -8.996 11.675 -20.415 1.0 25.02 60 A 10 -ATOM 912 H HB3 . ALA A1 1 60 ? -9.447 12.295 -22.004 1.0 51.02 60 A 10 -ATOM 913 N N . MET A1 1 61 ? -6.061 11.302 -20.453 1.0 21.52 61 A 10 -ATOM 914 C CA . MET A1 1 61 ? -5.006 10.75 -19.611 1.0 32.03 61 A 10 -ATOM 915 C C . MET A1 1 61 ? -3.639 11.276 -20.037 1.0 55.14 61 A 10 -ATOM 916 O O . MET A1 1 61 ? -2.93 11.898 -19.246 1.0 73.23 61 A 10 -ATOM 917 C CB . MET A1 1 61 ? -5.021 9.222 -19.675 1.0 33.12 61 A 10 -ATOM 918 C CG . MET A1 1 61 ? -6.419 8.627 -19.685 1.0 10.31 61 A 10 -ATOM 919 S SD . MET A1 1 61 ? -7.479 9.322 -18.403 1.0 3.45 61 A 10 -ATOM 920 C CE . MET A1 1 61 ? -9.075 9.266 -19.215 1.0 11.34 61 A 10 -ATOM 921 H H . MET A1 1 61 ? -6.487 10.727 -21.123 1.0 44.35 61 A 10 -ATOM 922 H HA . MET A1 1 61 ? -5.198 11.061 -18.595 1.0 14.21 61 A 10 -ATOM 923 H HB2 . MET A1 1 61 ? -4.512 8.906 -20.574 1.0 14.23 61 A 10 -ATOM 924 H HB3 . MET A1 1 61 ? -4.494 8.832 -18.817 1.0 0.24 61 A 10 -ATOM 925 H HG2 . MET A1 1 61 ? -6.871 8.818 -20.647 1.0 62.14 61 A 10 -ATOM 926 H HG3 . MET A1 1 61 ? -6.343 7.56 -19.532 1.0 32.0 61 A 10 -ATOM 927 H HE1 . MET A1 1 61 ? -9.645 8.433 -18.83 1.0 54.23 61 A 10 -ATOM 928 H HE2 . MET A1 1 61 ? -9.608 10.185 -19.024 1.0 64.31 61 A 10 -ATOM 929 H HE3 . MET A1 1 61 ? -8.933 9.145 -20.278 1.0 24.11 61 A 10 -ATOM 930 N N . SER A1 1 62 ? -3.276 11.022 -21.29 1.0 73.15 62 A 10 -ATOM 931 C CA . SER A1 1 62 ? -1.992 11.466 -21.819 1.0 12.22 62 A 10 -ATOM 932 C C . SER A1 1 62 ? -1.85 12.98 -21.699 1.0 13.52 62 A 10 -ATOM 933 O O . SER A1 1 62 ? -0.751 13.498 -21.499 1.0 42.51 62 A 10 -ATOM 934 C CB . SER A1 1 62 ? -1.846 11.043 -23.282 1.0 62.33 62 A 10 -ATOM 935 O OG . SER A1 1 62 ? -1.165 9.805 -23.389 1.0 14.13 62 A 10 -ATOM 936 H H . SER A1 1 62 ? -3.886 10.521 -21.871 1.0 74.25 62 A 10 -ATOM 937 H HA . SER A1 1 62 ? -1.213 10.996 -21.237 1.0 74.15 62 A 10 -ATOM 938 H HB2 . SER A1 1 62 ? -2.825 10.941 -23.724 1.0 54.41 62 A 10 -ATOM 939 H HB3 . SER A1 1 62 ? -1.285 11.796 -23.817 1.0 23.45 62 A 10 -ATOM 940 H HG . SER A1 1 62 ? -0.635 9.799 -24.19 1.0 1.23 62 A 10 -ATOM 941 N N . ASP A1 1 63 ? -2.969 13.685 -21.822 1.0 34.33 63 A 10 -ATOM 942 C CA . ASP A1 1 63 ? -2.971 15.14 -21.727 1.0 10.21 63 A 10 -ATOM 943 C C . ASP A1 1 63 ? -2.497 15.595 -20.35 1.0 63.54 63 A 10 -ATOM 944 O O . ASP A1 1 63 ? -1.999 16.71 -20.191 1.0 31.33 63 A 10 -ATOM 945 C CB . ASP A1 1 63 ? -4.372 15.689 -22.004 1.0 21.1 63 A 10 -ATOM 946 C CG . ASP A1 1 63 ? -4.347 17.135 -22.457 1.0 12.2 63 A 10 -ATOM 947 O OD1 . ASP A1 1 63 ? -3.265 17.615 -22.854 1.0 53.24 63 A 10 -ATOM 948 O OD2 . ASP A1 1 63 ? -5.411 17.787 -22.416 1.0 3.13 63 A 10 -ATOM 949 H H . ASP A1 1 63 ? -3.815 13.215 -21.981 1.0 14.4 63 A 10 -ATOM 950 H HA . ASP A1 1 63 ? -2.291 15.522 -22.473 1.0 72.42 63 A 10 -ATOM 951 H HB2 . ASP A1 1 63 ? -4.837 15.096 -22.779 1.0 63.34 63 A 10 -ATOM 952 H HB3 . ASP A1 1 63 ? -4.962 15.622 -21.102 1.0 44.51 63 A 10 -ATOM 953 N N . TYR A1 1 64 ? -2.654 14.725 -19.359 1.0 43.15 64 A 10 -ATOM 954 C CA . TYR A1 1 64 ? -2.245 15.039 -17.995 1.0 74.44 64 A 10 -ATOM 955 C C . TYR A1 1 64 ? -3.274 15.933 -17.309 1.0 35.31 64 A 10 -ATOM 956 O O . TYR A1 1 64 ? -2.945 16.692 -16.399 1.0 63.11 64 A 10 -ATOM 957 C CB . TYR A1 1 64 ? -0.878 15.723 -17.995 1.0 41.31 64 A 10 -ATOM 958 C CG . TYR A1 1 64 ? 0.071 15.181 -16.95 1.0 35.31 64 A 10 -ATOM 959 C CD1 . TYR A1 1 64 ? -0.32 15.065 -15.622 1.0 10.21 64 A 10 -ATOM 960 C CD2 . TYR A1 1 64 ? 1.359 14.785 -17.29 1.0 61.0 64 A 10 -ATOM 961 C CE1 . TYR A1 1 64 ? 0.544 14.57 -14.663 1.0 31.32 64 A 10 -ATOM 962 C CE2 . TYR A1 1 64 ? 2.228 14.288 -16.339 1.0 3.01 64 A 10 -ATOM 963 C CZ . TYR A1 1 64 ? 1.816 14.183 -15.027 1.0 35.43 64 A 10 -ATOM 964 O OH . TYR A1 1 64 ? 2.68 13.69 -14.076 1.0 23.32 64 A 10 -ATOM 965 H H . TYR A1 1 64 ? -3.057 13.852 -19.548 1.0 10.22 64 A 10 -ATOM 966 H HA . TYR A1 1 64 ? -2.172 14.11 -17.449 1.0 40.51 64 A 10 -ATOM 967 H HB2 . TYR A1 1 64 ? -0.416 15.591 -18.961 1.0 75.32 64 A 10 -ATOM 968 H HB3 . TYR A1 1 64 ? -1.011 16.779 -17.806 1.0 32.34 64 A 10 -ATOM 969 H HD1 . TYR A1 1 64 ? -1.317 15.369 -15.34 1.0 1.35 64 A 10 -ATOM 970 H HD2 . TYR A1 1 64 ? 1.678 14.869 -18.319 1.0 32.41 64 A 10 -ATOM 971 H HE1 . TYR A1 1 64 ? 0.222 14.488 -13.636 1.0 52.21 64 A 10 -ATOM 972 H HE2 . TYR A1 1 64 ? 3.225 13.985 -16.624 1.0 43.14 64 A 10 -ATOM 973 H HH . TYR A1 1 64 ? 3.217 12.993 -14.462 1.0 23.33 64 A 10 -ATOM 974 N N . ASN A1 1 65 ? -4.523 15.836 -17.754 1.0 61.21 65 A 10 -ATOM 975 C CA . ASN A1 1 65 ? -5.601 16.635 -17.185 1.0 70.22 65 A 10 -ATOM 976 C C . ASN A1 1 65 ? -6.6 15.752 -16.443 1.0 21.44 65 A 10 -ATOM 977 O O . ASN A1 1 65 ? -7.697 16.191 -16.097 1.0 22.24 65 A 10 -ATOM 978 C CB . ASN A1 1 65 ? -6.318 17.421 -18.285 1.0 30.31 65 A 10 -ATOM 979 C CG . ASN A1 1 65 ? -7.157 18.556 -17.732 1.0 75.23 65 A 10 -ATOM 980 O OD1 . ASN A1 1 65 ? -8.372 18.426 -17.577 1.0 74.2 65 A 10 -ATOM 981 N ND2 . ASN A1 1 65 ? -6.512 19.677 -17.43 1.0 12.4 65 A 10 -ATOM 982 H H . ASN A1 1 65 ? -4.724 15.212 -18.483 1.0 72.01 65 A 10 -ATOM 983 H HA . ASN A1 1 65 ? -5.164 17.331 -16.484 1.0 43.44 65 A 10 -ATOM 984 H HB2 . ASN A1 1 65 ? -5.582 17.838 -18.958 1.0 12.24 65 A 10 -ATOM 985 H HB3 . ASN A1 1 65 ? -6.964 16.753 -18.834 1.0 73.02 65 A 10 -ATOM 986 H HD21 . ASN A1 1 65 ? -5.544 19.709 -17.58 1.0 23.44 65 A 10 -ATOM 987 H HD22 . ASN A1 1 65 ? -7.03 20.427 -17.07 1.0 32.24 65 A 10 -ATOM 988 N N . VAL A1 1 66 ? -6.212 14.503 -16.201 1.0 11.4 66 A 10 -ATOM 989 C CA . VAL A1 1 66 ? -7.072 13.558 -15.499 1.0 70.45 66 A 10 -ATOM 990 C C . VAL A1 1 66 ? -6.853 13.631 -13.992 1.0 73.11 66 A 10 -ATOM 991 O O . VAL A1 1 66 ? -5.731 13.477 -13.511 1.0 33.12 66 A 10 -ATOM 992 C CB . VAL A1 1 66 ? -6.823 12.114 -15.974 1.0 40.11 66 A 10 -ATOM 993 C CG1 . VAL A1 1 66 ? -5.395 11.689 -15.667 1.0 32.21 66 A 10 -ATOM 994 C CG2 . VAL A1 1 66 ? -7.821 11.163 -15.331 1.0 25.13 66 A 10 -ATOM 995 H H . VAL A1 1 66 ? -5.326 14.212 -16.502 1.0 25.31 66 A 10 -ATOM 996 H HA . VAL A1 1 66 ? -8.098 13.815 -15.717 1.0 44.24 66 A 10 -ATOM 997 H HB . VAL A1 1 66 ? -6.963 12.079 -17.044 1.0 65.05 66 A 10 -ATOM 998 H HG11 . VAL A1 1 66 ? -5.165 10.783 -16.208 1.0 62.5 66 A 10 -ATOM 999 H HG12 . VAL A1 1 66 ? -4.714 12.472 -15.967 1.0 4.5 66 A 10 -ATOM 1000 H HG13 . VAL A1 1 66 ? -5.294 11.51 -14.607 1.0 12.32 66 A 10 -ATOM 1001 H HG21 . VAL A1 1 66 ? -8.825 11.475 -15.576 1.0 23.4 66 A 10 -ATOM 1002 H HG22 . VAL A1 1 66 ? -7.653 10.162 -15.701 1.0 64.2 66 A 10 -ATOM 1003 H HG23 . VAL A1 1 66 ? -7.692 11.176 -14.258 1.0 74.31 66 A 10 -ATOM 1004 N N . GLN A1 1 67 ? -7.933 13.866 -13.254 1.0 5.43 67 A 10 -ATOM 1005 C CA . GLN A1 1 67 ? -7.859 13.959 -11.801 1.0 15.5 67 A 10 -ATOM 1006 C C . GLN A1 1 67 ? -8.794 12.95 -11.142 1.0 62.54 67 A 10 -ATOM 1007 O O . GLN A1 1 67 ? -9.456 12.166 -11.821 1.0 44.01 67 A 10 -ATOM 1008 C CB . GLN A1 1 67 ? -8.21 15.375 -11.341 1.0 35.11 67 A 10 -ATOM 1009 C CG . GLN A1 1 67 ? -9.647 15.773 -11.64 1.0 11.21 67 A 10 -ATOM 1010 C CD . GLN A1 1 67 ? -10.108 16.959 -10.817 1.0 34.44 67 A 10 -ATOM 1011 O OE1 . GLN A1 1 67 ? -10.362 16.836 -9.618 1.0 41.54 67 A 10 -ATOM 1012 N NE2 . GLN A1 1 67 ? -10.217 18.117 -11.456 1.0 50.51 67 A 10 -ATOM 1013 H H . GLN A1 1 67 ? -8.799 13.98 -13.697 1.0 54.23 67 A 10 -ATOM 1014 H HA . GLN A1 1 67 ? -6.844 13.736 -11.506 1.0 21.13 67 A 10 -ATOM 1015 H HB2 . GLN A1 1 67 ? -8.055 15.443 -10.274 1.0 61.05 67 A 10 -ATOM 1016 H HB3 . GLN A1 1 67 ? -7.555 16.075 -11.838 1.0 21.05 67 A 10 -ATOM 1017 H HG2 . GLN A1 1 67 ? -9.725 16.028 -12.686 1.0 63.24 67 A 10 -ATOM 1018 H HG3 . GLN A1 1 67 ? -10.291 14.932 -11.427 1.0 63.02 67 A 10 -ATOM 1019 H HE21 . GLN A1 1 67 ? -9.999 18.14 -12.412 1.0 0.12 67 A 10 -ATOM 1020 H HE22 . GLN A1 1 67 ? -10.514 18.9 -10.949 1.0 72.41 67 A 10 -ATOM 1021 N N . LYS A1 1 68 ? -8.843 12.976 -9.814 1.0 63.33 68 A 10 -ATOM 1022 C CA . LYS A1 1 68 ? -9.698 12.066 -9.062 1.0 34.0 68 A 10 -ATOM 1023 C C . LYS A1 1 68 ? -11.171 12.347 -9.34 1.0 33.21 68 A 10 -ATOM 1024 O O . LYS A1 1 68 ? -12.003 11.441 -9.304 1.0 33.01 68 A 10 -ATOM 1025 C CB . LYS A1 1 68 ? -9.418 12.192 -7.563 1.0 41.41 68 A 10 -ATOM 1026 C CG . LYS A1 1 68 ? -10.018 11.068 -6.736 1.0 61.44 68 A 10 -ATOM 1027 C CD . LYS A1 1 68 ? -9.338 9.74 -7.022 1.0 43.41 68 A 10 -ATOM 1028 C CE . LYS A1 1 68 ? -8.06 9.582 -6.214 1.0 23.43 68 A 10 -ATOM 1029 N NZ . LYS A1 1 68 ? -8.323 9.611 -4.748 1.0 52.05 68 A 10 -ATOM 1030 H H . LYS A1 1 68 ? -8.292 13.625 -9.328 1.0 75.53 68 A 10 -ATOM 1031 H HA . LYS A1 1 68 ? -9.47 11.059 -9.379 1.0 31.4 68 A 10 -ATOM 1032 H HB2 . LYS A1 1 68 ? -8.349 12.194 -7.408 1.0 51.5 68 A 10 -ATOM 1033 H HB3 . LYS A1 1 68 ? -9.826 13.128 -7.21 1.0 62.4 68 A 10 -ATOM 1034 H HG2 . LYS A1 1 68 ? -9.9 11.302 -5.688 1.0 22.33 68 A 10 -ATOM 1035 H HG3 . LYS A1 1 68 ? -11.07 10.982 -6.971 1.0 45.02 68 A 10 -ATOM 1036 H HD2 . LYS A1 1 68 ? -10.014 8.937 -6.767 1.0 14.2 68 A 10 -ATOM 1037 H HD3 . LYS A1 1 68 ? -9.097 9.689 -8.075 1.0 13.53 68 A 10 -ATOM 1038 H HE2 . LYS A1 1 68 ? -7.601 8.639 -6.47 1.0 43.13 68 A 10 -ATOM 1039 H HE3 . LYS A1 1 68 ? -7.388 10.389 -6.466 1.0 63.42 68 A 10 -ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.612 9.042 -4.246 1.0 1.54 68 A 10 -ATOM 1041 H HZ2 . LYS A1 1 68 ? -9.267 9.223 -4.548 1.0 73.32 68 A 10 -ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.281 10.589 -4.397 1.0 23.44 68 A 10 -ATOM 1043 N N . GLU A1 1 69 ? -11.486 13.608 -9.62 1.0 51.1 69 A 10 -ATOM 1044 C CA . GLU A1 1 69 ? -12.859 14.007 -9.904 1.0 15.41 69 A 10 -ATOM 1045 C C . GLU A1 1 69 ? -12.893 15.208 -10.845 1.0 20.25 69 A 10 -ATOM 1046 O O . GLU A1 1 69 ? -13.001 16.352 -10.404 1.0 55.15 69 A 10 -ATOM 1047 C CB . GLU A1 1 69 ? -13.596 14.341 -8.606 1.0 42.14 69 A 10 -ATOM 1048 C CG . GLU A1 1 69 ? -12.799 15.227 -7.664 1.0 32.44 69 A 10 -ATOM 1049 C CD . GLU A1 1 69 ? -13.656 16.278 -6.985 1.0 60.3 69 A 10 -ATOM 1050 O OE1 . GLU A1 1 69 ? -14.35 15.934 -6.006 1.0 52.11 69 A 10 -ATOM 1051 O OE2 . GLU A1 1 69 ? -13.632 17.443 -7.434 1.0 33.22 69 A 10 -ATOM 1052 H H . GLU A1 1 69 ? -10.778 14.286 -9.634 1.0 51.55 69 A 10 -ATOM 1053 H HA . GLU A1 1 69 ? -13.353 13.176 -10.384 1.0 21.13 69 A 10 -ATOM 1054 H HB2 . GLU A1 1 69 ? -14.518 14.848 -8.85 1.0 70.35 69 A 10 -ATOM 1055 H HB3 . GLU A1 1 69 ? -13.828 13.421 -8.091 1.0 25.14 69 A 10 -ATOM 1056 H HG2 . GLU A1 1 69 ? -12.347 14.607 -6.903 1.0 60.54 69 A 10 -ATOM 1057 H HG3 . GLU A1 1 69 ? -12.024 15.725 -8.228 1.0 2.43 69 A 10 -ATOM 1058 N N . SER A1 1 70 ? -12.798 14.939 -12.143 1.0 51.41 70 A 10 -ATOM 1059 C CA . SER A1 1 70 ? -12.813 15.997 -13.146 1.0 50.24 70 A 10 -ATOM 1060 C C . SER A1 1 70 ? -14.201 16.142 -13.762 1.0 72.1 70 A 10 -ATOM 1061 O O . SER A1 1 70 ? -14.87 15.151 -14.057 1.0 13.02 70 A 10 -ATOM 1062 C CB . SER A1 1 70 ? -11.785 15.705 -14.241 1.0 75.43 70 A 10 -ATOM 1063 O OG . SER A1 1 70 ? -10.992 16.847 -14.514 1.0 45.33 70 A 10 -ATOM 1064 H H . SER A1 1 70 ? -12.713 14.006 -12.432 1.0 42.55 70 A 10 -ATOM 1065 H HA . SER A1 1 70 ? -12.55 16.923 -12.656 1.0 61.25 70 A 10 -ATOM 1066 H HB2 . SER A1 1 70 ? -11.139 14.902 -13.921 1.0 1.23 70 A 10 -ATOM 1067 H HB3 . SER A1 1 70 ? -12.299 15.414 -15.146 1.0 50.33 70 A 10 -ATOM 1068 H HG . SER A1 1 70 ? -10.875 16.937 -15.463 1.0 14.24 70 A 10 -ATOM 1069 N N . THR A1 1 71 ? -14.629 17.386 -13.953 1.0 52.55 71 A 10 -ATOM 1070 C CA . THR A1 1 71 ? -15.938 17.663 -14.532 1.0 43.33 71 A 10 -ATOM 1071 C C . THR A1 1 71 ? -15.839 17.875 -16.039 1.0 63.44 71 A 10 -ATOM 1072 O O . THR A1 1 71 ? -15.212 18.829 -16.502 1.0 13.52 71 A 10 -ATOM 1073 C CB . THR A1 1 71 ? -16.584 18.906 -13.892 1.0 4.41 71 A 10 -ATOM 1074 O OG1 . THR A1 1 71 ? -15.621 19.962 -13.791 1.0 4.41 71 A 10 -ATOM 1075 C CG2 . THR A1 1 71 ? -17.133 18.58 -12.511 1.0 4.35 71 A 10 -ATOM 1076 H H . THR A1 1 71 ? -14.051 18.134 -13.698 1.0 14.04 71 A 10 -ATOM 1077 H HA . THR A1 1 71 ? -16.575 16.812 -14.339 1.0 24.13 71 A 10 -ATOM 1078 H HB . THR A1 1 71 ? -17.4 19.233 -14.52 1.0 70.41 71 A 10 -ATOM 1079 H HG1 . THR A1 1 71 ? -15.898 20.584 -13.114 1.0 53.11 71 A 10 -ATOM 1080 H HG21 . THR A1 1 71 ? -18.178 18.321 -12.592 1.0 12.42 71 A 10 -ATOM 1081 H HG22 . THR A1 1 71 ? -17.024 19.441 -11.868 1.0 75.2 71 A 10 -ATOM 1082 H HG23 . THR A1 1 71 ? -16.586 17.748 -12.094 1.0 31.12 71 A 10 -ATOM 1083 N N . LEU A1 1 72 ? -16.461 16.981 -16.799 1.0 74.32 72 A 10 -ATOM 1084 C CA . LEU A1 1 72 ? -16.444 17.071 -18.255 1.0 62.12 72 A 10 -ATOM 1085 C C . LEU A1 1 72 ? -17.86 17.026 -18.82 1.0 14.1 72 A 10 -ATOM 1086 O O . LEU A1 1 72 ? -18.738 16.358 -18.273 1.0 22.33 72 A 10 -ATOM 1087 C CB . LEU A1 1 72 ? -15.611 15.932 -18.846 1.0 54.24 72 A 10 -ATOM 1088 C CG . LEU A1 1 72 ? -15.91 15.566 -20.3 1.0 12.34 72 A 10 -ATOM 1089 C CD1 . LEU A1 1 72 ? -15.547 16.717 -21.226 1.0 71.53 72 A 10 -ATOM 1090 C CD2 . LEU A1 1 72 ? -15.16 14.303 -20.698 1.0 45.31 72 A 10 -ATOM 1091 H H . LEU A1 1 72 ? -16.944 16.243 -16.373 1.0 40.44 72 A 10 -ATOM 1092 H HA . LEU A1 1 72 ? -15.992 18.014 -18.524 1.0 22.23 72 A 10 -ATOM 1093 H HB2 . LEU A1 1 72 ? -14.572 16.216 -18.784 1.0 24.33 72 A 10 -ATOM 1094 H HB3 . LEU A1 1 72 ? -15.779 15.052 -18.241 1.0 64.44 72 A 10 -ATOM 1095 H HG . LEU A1 1 72 ? -16.969 15.374 -20.406 1.0 60.22 72 A 10 -ATOM 1096 H HD11 . LEU A1 1 72 ? -14.788 16.394 -21.921 1.0 22.12 72 A 10 -ATOM 1097 H HD12 . LEU A1 1 72 ? -15.173 17.544 -20.641 1.0 11.12 72 A 10 -ATOM 1098 H HD13 . LEU A1 1 72 ? -16.426 17.031 -21.771 1.0 74.11 72 A 10 -ATOM 1099 H HD21 . LEU A1 1 72 ? -14.981 13.699 -19.82 1.0 45.11 72 A 10 -ATOM 1100 H HD22 . LEU A1 1 72 ? -14.215 14.573 -21.147 1.0 64.51 72 A 10 -ATOM 1101 H HD23 . LEU A1 1 72 ? -15.75 13.742 -21.408 1.0 15.53 72 A 10 -ATOM 1102 N N . HIS A1 1 73 ? -18.076 17.74 -19.921 1.0 22.1 73 A 10 -ATOM 1103 C CA . HIS A1 1 73 ? -19.385 17.78 -20.562 1.0 43.22 73 A 10 -ATOM 1104 C C . HIS A1 1 73 ? -19.454 16.787 -21.719 1.0 1.12 73 A 10 -ATOM 1105 O O . HIS A1 1 73 ? -18.68 16.875 -22.673 1.0 41.41 73 A 10 -ATOM 1106 C CB . HIS A1 1 73 ? -19.686 19.191 -21.068 1.0 34.11 73 A 10 -ATOM 1107 C CG . HIS A1 1 73 ? -19.52 20.25 -20.022 1.0 25.31 73 A 10 -ATOM 1108 N ND1 . HIS A1 1 73 ? -19.343 21.584 -20.323 1.0 22.31 73 A 10 -ATOM 1109 C CD2 . HIS A1 1 73 ? -19.507 20.166 -18.671 1.0 30.12 73 A 10 -ATOM 1110 C CE1 . HIS A1 1 73 ? -19.226 22.274 -19.202 1.0 74.03 73 A 10 -ATOM 1111 N NE2 . HIS A1 1 73 ? -19.323 21.437 -18.185 1.0 22.32 73 A 10 -ATOM 1112 H H . HIS A1 1 73 ? -17.336 18.252 -20.31 1.0 41.1 73 A 10 -ATOM 1113 H HA . HIS A1 1 73 ? -20.124 17.506 -19.825 1.0 23.25 73 A 10 -ATOM 1114 H HB2 . HIS A1 1 73 ? -19.018 19.424 -21.884 1.0 51.13 73 A 10 -ATOM 1115 H HB3 . HIS A1 1 73 ? -20.706 19.23 -21.421 1.0 64.13 73 A 10 -ATOM 1116 H HD1 . HIS A1 1 73 ? -19.306 21.968 -21.223 1.0 63.31 73 A 10 -ATOM 1117 H HD2 . HIS A1 1 73 ? -19.62 19.266 -18.083 1.0 71.43 73 A 10 -ATOM 1118 H HE1 . HIS A1 1 73 ? -19.078 23.341 -19.129 1.0 3.34 73 A 10 -ATOM 1119 N N . LEU A1 1 74 ? -20.384 15.843 -21.627 1.0 31.4 74 A 10 -ATOM 1120 C CA . LEU A1 1 74 ? -20.553 14.833 -22.665 1.0 41.22 74 A 10 -ATOM 1121 C C . LEU A1 1 74 ? -21.86 15.044 -23.422 1.0 21.0 74 A 10 -ATOM 1122 O O . LEU A1 1 74 ? -22.944 14.967 -22.844 1.0 70.53 74 A 10 -ATOM 1123 C CB . LEU A1 1 74 ? -20.527 13.432 -22.051 1.0 42.32 74 A 10 -ATOM 1124 C CG . LEU A1 1 74 ? -21.197 12.328 -22.868 1.0 13.02 74 A 10 -ATOM 1125 C CD1 . LEU A1 1 74 ? -20.623 12.282 -24.276 1.0 50.12 74 A 10 -ATOM 1126 C CD2 . LEU A1 1 74 ? -21.034 10.98 -22.18 1.0 22.4 74 A 10 -ATOM 1127 H H . LEU A1 1 74 ? -20.971 15.824 -20.843 1.0 53.04 74 A 10 -ATOM 1128 H HA . LEU A1 1 74 ? -19.73 14.929 -23.358 1.0 65.43 74 A 10 -ATOM 1129 H HB2 . LEU A1 1 74 ? -19.494 13.155 -21.905 1.0 22.02 74 A 10 -ATOM 1130 H HB3 . LEU A1 1 74 ? -21.023 13.483 -21.092 1.0 20.31 74 A 10 -ATOM 1131 H HG . LEU A1 1 74 ? -22.255 12.538 -22.947 1.0 34.12 74 A 10 -ATOM 1132 H HD11 . LEU A1 1 74 ? -21.228 12.889 -24.931 1.0 33.01 74 A 10 -ATOM 1133 H HD12 . LEU A1 1 74 ? -20.62 11.262 -24.63 1.0 1.34 74 A 10 -ATOM 1134 H HD13 . LEU A1 1 74 ? -19.612 12.661 -24.264 1.0 63.14 74 A 10 -ATOM 1135 H HD21 . LEU A1 1 74 ? -21.583 10.983 -21.25 1.0 12.32 74 A 10 -ATOM 1136 H HD22 . LEU A1 1 74 ? -19.988 10.803 -21.98 1.0 54.43 74 A 10 -ATOM 1137 H HD23 . LEU A1 1 74 ? -21.415 10.2 -22.822 1.0 14.02 74 A 10 -ATOM 1138 N N . VAL A1 1 75 ? -21.751 15.307 -24.72 1.0 43.5 75 A 10 -ATOM 1139 C CA . VAL A1 1 75 ? -22.924 15.526 -25.558 1.0 52.32 75 A 10 -ATOM 1140 C C . VAL A1 1 75 ? -23.042 14.449 -26.63 1.0 61.15 75 A 10 -ATOM 1141 O O . VAL A1 1 75 ? -22.041 14.016 -27.204 1.0 54.31 75 A 10 -ATOM 1142 C CB . VAL A1 1 75 ? -22.879 16.908 -26.237 1.0 24.5 75 A 10 -ATOM 1143 C CG1 . VAL A1 1 75 ? -23.246 18.002 -25.246 1.0 55.3 75 A 10 -ATOM 1144 C CG2 . VAL A1 1 75 ? -21.505 17.161 -26.839 1.0 64.14 75 A 10 -ATOM 1145 H H . VAL A1 1 75 ? -20.859 15.355 -25.125 1.0 70.11 75 A 10 -ATOM 1146 H HA . VAL A1 1 75 ? -23.798 15.487 -24.925 1.0 60.52 75 A 10 -ATOM 1147 H HB . VAL A1 1 75 ? -23.606 16.918 -27.035 1.0 44.41 75 A 10 -ATOM 1148 H HG11 . VAL A1 1 75 ? -23.938 17.608 -24.515 1.0 31.54 75 A 10 -ATOM 1149 H HG12 . VAL A1 1 75 ? -22.354 18.351 -24.747 1.0 61.34 75 A 10 -ATOM 1150 H HG13 . VAL A1 1 75 ? -23.71 18.823 -25.772 1.0 54.52 75 A 10 -ATOM 1151 H HG21 . VAL A1 1 75 ? -21.212 16.312 -27.437 1.0 5.24 75 A 10 -ATOM 1152 H HG22 . VAL A1 1 75 ? -21.543 18.044 -27.459 1.0 61.35 75 A 10 -ATOM 1153 H HG23 . VAL A1 1 75 ? -20.786 17.309 -26.046 1.0 24.43 75 A 10 -ATOM 1154 N N . LEU A1 1 76 ? -24.271 14.02 -26.898 1.0 35.1 76 A 10 -ATOM 1155 C CA . LEU A1 1 76 ? -24.521 12.993 -27.903 1.0 22.53 76 A 10 -ATOM 1156 C C . LEU A1 1 76 ? -25.441 13.518 -29.0 1.0 2.14 76 A 10 -ATOM 1157 O O . LEU A1 1 76 ? -26.419 14.212 -28.724 1.0 21.5 76 A 10 -ATOM 1158 C CB . LEU A1 1 76 ? -25.139 11.755 -27.252 1.0 73.12 76 A 10 -ATOM 1159 C CG . LEU A1 1 76 ? -25.096 11.707 -25.724 1.0 64.45 76 A 10 -ATOM 1160 C CD1 . LEU A1 1 76 ? -25.934 10.55 -25.202 1.0 24.13 76 A 10 -ATOM 1161 C CD2 . LEU A1 1 76 ? -23.66 11.592 -25.234 1.0 22.03 76 A 10 -ATOM 1162 H H . LEU A1 1 76 ? -25.028 14.403 -26.408 1.0 44.32 76 A 10 -ATOM 1163 H HA . LEU A1 1 76 ? -23.573 12.723 -28.343 1.0 53.04 76 A 10 -ATOM 1164 H HB2 . LEU A1 1 76 ? -26.174 11.704 -27.555 1.0 71.31 76 A 10 -ATOM 1165 H HB3 . LEU A1 1 76 ? -24.614 10.888 -27.626 1.0 62.14 76 A 10 -ATOM 1166 H HG . LEU A1 1 76 ? -25.512 12.624 -25.33 1.0 42.11 76 A 10 -ATOM 1167 H HD11 . LEU A1 1 76 ? -26.78 10.936 -24.654 1.0 12.14 76 A 10 -ATOM 1168 H HD12 . LEU A1 1 76 ? -25.332 9.936 -24.549 1.0 23.21 76 A 10 -ATOM 1169 H HD13 . LEU A1 1 76 ? -26.283 9.955 -26.033 1.0 40.2 76 A 10 -ATOM 1170 H HD21 . LEU A1 1 76 ? -23.562 12.095 -24.284 1.0 53.24 76 A 10 -ATOM 1171 H HD22 . LEU A1 1 76 ? -22.997 12.048 -25.955 1.0 72.02 76 A 10 -ATOM 1172 H HD23 . LEU A1 1 76 ? -23.402 10.549 -25.118 1.0 63.4 76 A 10 -ATOM 1173 N N . ARG A1 1 77 ? -25.121 13.18 -30.245 1.0 50.44 77 A 10 -ATOM 1174 C CA . ARG A1 1 77 ? -25.919 13.616 -31.384 1.0 12.4 77 A 10 -ATOM 1175 C C . ARG A1 1 77 ? -26.547 12.422 -32.098 1.0 10.32 77 A 10 -ATOM 1176 O O . ARG A1 1 77 ? -26.049 11.97 -33.13 1.0 12.43 77 A 10 -ATOM 1177 C CB . ARG A1 1 77 ? -25.056 14.413 -32.364 1.0 55.35 77 A 10 -ATOM 1178 C CG . ARG A1 1 77 ? -24.567 15.739 -31.805 1.0 12.22 77 A 10 -ATOM 1179 C CD . ARG A1 1 77 ? -23.053 15.761 -31.669 1.0 60.22 77 A 10 -ATOM 1180 N NE . ARG A1 1 77 ? -22.577 16.995 -31.049 1.0 64.33 77 A 10 -ATOM 1181 C CZ . ARG A1 1 77 ? -22.55 18.168 -31.673 1.0 13.31 77 A 10 -ATOM 1182 N NH1 . ARG A1 1 77 ? -22.97 18.265 -32.927 1.0 63.3 77 A 10 -ATOM 1183 N NH2 . ARG A1 1 77 ? -22.104 19.246 -31.042 1.0 70.54 77 A 10 -ATOM 1184 H H . ARG A1 1 77 ? -24.329 12.624 -30.401 1.0 2.41 77 A 10 -ATOM 1185 H HA . ARG A1 1 77 ? -26.708 14.253 -31.013 1.0 53.23 77 A 10 -ATOM 1186 H HB2 . ARG A1 1 77 ? -24.193 13.82 -32.631 1.0 41.04 77 A 10 -ATOM 1187 H HB3 . ARG A1 1 77 ? -25.634 14.613 -33.254 1.0 23.23 77 A 10 -ATOM 1188 H HG2 . ARG A1 1 77 ? -24.869 16.533 -32.472 1.0 3.21 77 A 10 -ATOM 1189 H HG3 . ARG A1 1 77 ? -25.01 15.894 -30.833 1.0 45.32 77 A 10 -ATOM 1190 H HD2 . ARG A1 1 77 ? -22.747 14.924 -31.06 1.0 24.22 77 A 10 -ATOM 1191 H HD3 . ARG A1 1 77 ? -22.615 15.671 -32.652 1.0 55.12 77 A 10 -ATOM 1192 H HE . ARG A1 1 77 ? -22.262 16.946 -30.123 1.0 41.44 77 A 10 -ATOM 1193 H HH11 . ARG A1 1 77 ? -23.308 17.454 -33.404 1.0 31.24 77 A 10 -ATOM 1194 H HH12 . ARG A1 1 77 ? -22.95 19.15 -33.394 1.0 72.5 77 A 10 -ATOM 1195 H HH21 . ARG A1 1 77 ? -21.787 19.177 -30.097 1.0 71.34 77 A 10 -ATOM 1196 H HH22 . ARG A1 1 77 ? -22.084 20.128 -31.512 1.0 1.44 77 A 10 -ATOM 1197 N N . LEU A1 1 78 ? -27.641 11.915 -31.541 1.0 31.03 78 A 10 -ATOM 1198 C CA . LEU A1 1 78 ? -28.337 10.773 -32.123 1.0 51.32 78 A 10 -ATOM 1199 C C . LEU A1 1 78 ? -29.16 11.197 -33.335 1.0 14.11 78 A 10 -ATOM 1200 O O . LEU A1 1 78 ? -29.106 10.561 -34.388 1.0 12.31 78 A 10 -ATOM 1201 C CB . LEU A1 1 78 ? -29.244 10.117 -31.08 1.0 42.51 78 A 10 -ATOM 1202 C CG . LEU A1 1 78 ? -28.537 9.447 -29.902 1.0 51.45 78 A 10 -ATOM 1203 C CD1 . LEU A1 1 78 ? -27.402 8.562 -30.394 1.0 14.44 78 A 10 -ATOM 1204 C CD2 . LEU A1 1 78 ? -28.016 10.492 -28.927 1.0 25.32 78 A 10 -ATOM 1205 H H . LEU A1 1 78 ? -27.991 12.318 -30.719 1.0 75.31 78 A 10 -ATOM 1206 H HA . LEU A1 1 78 ? -27.593 10.058 -32.441 1.0 64.2 78 A 10 -ATOM 1207 H HB2 . LEU A1 1 78 ? -29.896 10.88 -30.683 1.0 61.14 78 A 10 -ATOM 1208 H HB3 . LEU A1 1 78 ? -29.836 9.366 -31.583 1.0 62.32 78 A 10 -ATOM 1209 H HG . LEU A1 1 78 ? -29.244 8.82 -29.375 1.0 53.42 78 A 10 -ATOM 1210 H HD11 . LEU A1 1 78 ? -26.463 9.081 -30.274 1.0 3.24 78 A 10 -ATOM 1211 H HD12 . LEU A1 1 78 ? -27.555 8.329 -31.438 1.0 74.14 78 A 10 -ATOM 1212 H HD13 . LEU A1 1 78 ? -27.385 7.647 -29.82 1.0 11.41 78 A 10 -ATOM 1213 H HD21 . LEU A1 1 78 ? -27.131 10.957 -29.337 1.0 65.32 78 A 10 -ATOM 1214 H HD22 . LEU A1 1 78 ? -27.772 10.018 -27.988 1.0 65.43 78 A 10 -ATOM 1215 H HD23 . LEU A1 1 78 ? -28.776 11.243 -28.765 1.0 34.04 78 A 10 -ATOM 1216 N N . ARG A1 1 79 ? -29.921 12.275 -33.18 1.0 44.5 79 A 10 -ATOM 1217 C CA . ARG A1 1 79 ? -30.755 12.785 -34.262 1.0 54.44 79 A 10 -ATOM 1218 C C . ARG A1 1 79 ? -29.896 13.356 -35.386 1.0 43.43 79 A 10 -ATOM 1219 O O . ARG A1 1 79 ? -29.597 14.549 -35.408 1.0 24.23 79 A 10 -ATOM 1220 C CB . ARG A1 1 79 ? -31.708 13.86 -33.737 1.0 53.1 79 A 10 -ATOM 1221 C CG . ARG A1 1 79 ? -32.962 13.298 -33.088 1.0 62.42 79 A 10 -ATOM 1222 C CD . ARG A1 1 79 ? -33.05 13.683 -31.619 1.0 15.2 79 A 10 -ATOM 1223 N NE . ARG A1 1 79 ? -33.765 14.941 -31.425 1.0 22.21 79 A 10 -ATOM 1224 C CZ . ARG A1 1 79 ? -34.09 15.425 -30.231 1.0 43.33 79 A 10 -ATOM 1225 N NH1 . ARG A1 1 79 ? -33.766 14.759 -29.131 1.0 51.34 79 A 10 -ATOM 1226 N NH2 . ARG A1 1 79 ? -34.741 16.577 -30.136 1.0 24.34 79 A 10 -ATOM 1227 H H . ARG A1 1 79 ? -29.922 12.74 -32.316 1.0 30.43 79 A 10 -ATOM 1228 H HA . ARG A1 1 79 ? -31.334 11.961 -34.65 1.0 75.12 79 A 10 -ATOM 1229 H HB2 . ARG A1 1 79 ? -31.188 14.459 -33.004 1.0 72.51 79 A 10 -ATOM 1230 H HB3 . ARG A1 1 79 ? -32.006 14.492 -34.559 1.0 62.3 79 A 10 -ATOM 1231 H HG2 . ARG A1 1 79 ? -33.828 13.687 -33.603 1.0 34.21 79 A 10 -ATOM 1232 H HG3 . ARG A1 1 79 ? -32.946 12.221 -33.169 1.0 51.44 79 A 10 -ATOM 1233 H HD2 . ARG A1 1 79 ? -33.567 12.9 -31.086 1.0 21.42 79 A 10 -ATOM 1234 H HD3 . ARG A1 1 79 ? -32.049 13.784 -31.227 1.0 24.22 79 A 10 -ATOM 1235 H HE . ARG A1 1 79 ? -34.015 15.449 -32.224 1.0 63.2 79 A 10 -ATOM 1236 H HH11 . ARG A1 1 79 ? -33.274 13.891 -29.2 1.0 0.03 79 A 10 -ATOM 1237 H HH12 . ARG A1 1 79 ? -34.011 15.126 -28.234 1.0 54.33 79 A 10 -ATOM 1238 H HH21 . ARG A1 1 79 ? -34.988 17.082 -30.963 1.0 72.3 79 A 10 -ATOM 1239 H HH22 . ARG A1 1 79 ? -34.986 16.94 -29.237 1.0 2.44 79 A 10 -ATOM 1240 N N . GLY A1 1 80 ? -29.502 12.495 -36.319 1.0 11.03 80 A 10 -ATOM 1241 C CA . GLY A1 1 80 ? -28.682 12.932 -37.434 1.0 3.12 80 A 10 -ATOM 1242 C C . GLY A1 1 80 ? -27.45 12.068 -37.621 1.0 52.34 80 A 10 -ATOM 1243 O O . GLY A1 1 80 ? -26.324 12.562 -37.575 1.0 43.44 80 A 10 -ATOM 1244 H H . GLY A1 1 80 ? -29.771 11.554 -36.25 1.0 0.24 80 A 10 -ATOM 1245 H HA2 . GLY A1 1 80 ? -29.273 12.898 -38.337 1.0 71.24 80 A 10 -ATOM 1246 H HA3 . GLY A1 1 80 ? -28.369 13.951 -37.258 1.0 43.14 80 A 10 -ATOM 1247 N N . GLY A1 1 81 ? -27.664 10.772 -37.831 1.0 43.34 81 A 10 -ATOM 1248 C CA . GLY A1 1 81 ? -26.553 9.859 -38.02 1.0 20.2 81 A 10 -ATOM 1249 C C . GLY A1 1 81 ? -26.951 8.411 -37.813 1.0 63.23 81 A 10 -ATOM 1250 O O . GLY A1 1 81 ? -28.106 8.115 -37.506 1.0 30.24 81 A 10 -ATOM 1251 H H . GLY A1 1 81 ? -28.584 10.435 -37.857 1.0 11.33 81 A 10 -ATOM 1252 H HA2 . GLY A1 1 81 ? -26.171 9.976 -39.023 1.0 30.51 81 A 10 -ATOM 1253 H HA3 . GLY A1 1 81 ? -25.772 10.109 -37.317 1.0 55.14 81 A 10 -ATOM 1254 N N . VAL A1 1 82 ? -25.993 7.505 -37.983 1.0 30.52 82 A 10 -ATOM 1255 C CA . VAL A1 1 82 ? -26.25 6.08 -37.813 1.0 4.45 82 A 10 -ATOM 1256 C C . VAL A1 1 82 ? -25.05 5.376 -37.189 1.0 63.52 82 A 10 -ATOM 1257 O O . VAL A1 1 82 ? -24.155 6.02 -36.642 1.0 12.52 82 A 10 -ATOM 1258 C CB . VAL A1 1 82 ? -26.584 5.406 -39.157 1.0 53.54 82 A 10 -ATOM 1259 C CG1 . VAL A1 1 82 ? -25.44 5.585 -40.144 1.0 33.31 82 A 10 -ATOM 1260 C CG2 . VAL A1 1 82 ? -26.895 3.931 -38.951 1.0 1.13 82 A 10 -ATOM 1261 H H . VAL A1 1 82 ? -25.092 7.802 -38.228 1.0 42.11 82 A 10 -ATOM 1262 H HA . VAL A1 1 82 ? -27.101 5.969 -37.158 1.0 65.12 82 A 10 -ATOM 1263 H HB . VAL A1 1 82 ? -27.462 5.883 -39.568 1.0 3.02 82 A 10 -ATOM 1264 H HG11 . VAL A1 1 82 ? -25.603 4.95 -41.002 1.0 71.54 82 A 10 -ATOM 1265 H HG12 . VAL A1 1 82 ? -25.396 6.616 -40.461 1.0 43.52 82 A 10 -ATOM 1266 H HG13 . VAL A1 1 82 ? -24.509 5.314 -39.668 1.0 60.31 82 A 10 -ATOM 1267 H HG21 . VAL A1 1 82 ? -26.003 3.347 -39.123 1.0 51.1 82 A 10 -ATOM 1268 H HG22 . VAL A1 1 82 ? -27.238 3.775 -37.939 1.0 43.42 82 A 10 -ATOM 1269 H HG23 . VAL A1 1 82 ? -27.665 3.624 -39.644 1.0 61.21 82 A 10 -# -loop_ -_chem_comp.id -_chem_comp.type -_chem_comp.name -_chem_comp.pdbx_synonyms -_chem_comp.formula -_chem_comp.formula_weight -ALA 'L-PEPTIDE LINKING' ALANINE ? 'C3 H7 N O2' 89.093 -ARG 'L-PEPTIDE LINKING' ARGININE ? 'C6 H15 N4 O2' 175.209 -ASN 'L-PEPTIDE LINKING' ASPARAGINE ? 'C4 H8 N2 O3' 132.118 -ASP 'L-PEPTIDE LINKING' 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 -GLN 'L-PEPTIDE LINKING' GLUTAMINE ? 'C5 H10 N2 O3' 146.144 -GLU 'L-PEPTIDE LINKING' 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 -GLY 'PEPTIDE LINKING' GLYCINE ? 'C2 H5 N O2' 75.067 -HIS 'L-PEPTIDE LINKING' HISTIDINE ? 'C6 H10 N3 O2' 156.162 -ILE 'L-PEPTIDE LINKING' ISOLEUCINE ? 'C6 H13 N O2' 131.173 -LEU 'L-PEPTIDE LINKING' LEUCINE ? 'C6 H13 N O2' 131.173 -LYS 'L-PEPTIDE LINKING' LYSINE ? 'C6 H15 N2 O2' 147.195 -MET 'L-PEPTIDE LINKING' METHIONINE ? 'C5 H11 N O2 S' 149.211 -PHE 'L-PEPTIDE LINKING' PHENYLALANINE ? 'C9 H11 N O2' 165.189 -PRO 'L-PEPTIDE LINKING' PROLINE ? 'C5 H9 N O2' 115.130 -SER 'L-PEPTIDE LINKING' SERINE ? 'C3 H7 N O3' 105.093 -THR 'L-PEPTIDE LINKING' THREONINE ? 'C4 H9 N O3' 119.119 -TYR 'L-PEPTIDE LINKING' TYROSINE ? 'C9 H11 N O3' 181.189 -VAL 'L-PEPTIDE LINKING' VALINE ? 'C5 H11 N O2' 117.146 -# -loop_ -_chem_comp_atom.comp_id -_chem_comp_atom.atom_id -_chem_comp_atom.type_symbol -_chem_comp_atom.pdbx_aromatic_flag -_chem_comp_atom.pdbx_stereo_config -_chem_comp_atom.pdbx_ordinal -ALA N N N N 1 -ALA CA C N S 2 -ALA C C N N 3 -ALA O O N N 4 -ALA CB C N N 5 -ALA OXT O N N 6 -ALA H H N N 7 -ALA H2 H N N 8 -ALA HA H N N 9 -ALA HB1 H N N 10 -ALA HB2 H N N 11 -ALA HB3 H N N 12 -ALA HXT H N N 13 -ARG N N N N 14 -ARG CA C N S 15 -ARG C C N N 16 -ARG O O N N 17 -ARG CB C N N 18 -ARG CG C N N 19 -ARG CD C N N 20 -ARG NE N N N 21 -ARG CZ C N N 22 -ARG NH1 N N N 23 -ARG NH2 N N N 24 -ARG OXT O N N 25 -ARG H H N N 26 -ARG H2 H N N 27 -ARG HA H N N 28 -ARG HB2 H N N 29 -ARG HB3 H N N 30 -ARG HG2 H N N 31 -ARG HG3 H N N 32 -ARG HD2 H N N 33 -ARG HD3 H N N 34 -ARG HE H N N 35 -ARG HH11 H N N 36 -ARG HH12 H N N 37 -ARG HH21 H N N 38 -ARG HH22 H N N 39 -ARG HXT H N N 40 -ASN N N N N 41 -ASN CA C N S 42 -ASN C C N N 43 -ASN O O N N 44 -ASN CB C N N 45 -ASN CG C N N 46 -ASN OD1 O N N 47 -ASN ND2 N N N 48 -ASN OXT O N N 49 -ASN H H N N 50 -ASN H2 H N N 51 -ASN HA H N N 52 -ASN HB2 H N N 53 -ASN HB3 H N N 54 -ASN HD21 H N N 55 -ASN HD22 H N N 56 -ASN HXT H N N 57 -ASP N N N N 58 -ASP CA C N S 59 -ASP C C N N 60 -ASP O O N N 61 -ASP CB C N N 62 -ASP CG C N N 63 -ASP OD1 O N N 64 -ASP OD2 O N N 65 -ASP OXT O N N 66 -ASP H H N N 67 -ASP H2 H N N 68 -ASP HA H N N 69 -ASP HB2 H N N 70 -ASP HB3 H N N 71 -ASP HD2 H N N 72 -ASP HXT H N N 73 -GLN N N N N 74 -GLN CA C N S 75 -GLN C C N N 76 -GLN O O N N 77 -GLN CB C N N 78 -GLN CG C N N 79 -GLN CD C N N 80 -GLN OE1 O N N 81 -GLN NE2 N N N 82 -GLN OXT O N N 83 -GLN H H N N 84 -GLN H2 H N N 85 -GLN HA H N N 86 -GLN HB2 H N N 87 -GLN HB3 H N N 88 -GLN HG2 H N N 89 -GLN HG3 H N N 90 -GLN HE21 H N N 91 -GLN HE22 H N N 92 -GLN HXT H N N 93 -GLU N N N N 94 -GLU CA C N S 95 -GLU C C N N 96 -GLU O O N N 97 -GLU CB C N N 98 -GLU CG C N N 99 -GLU CD C N N 100 -GLU OE1 O N N 101 -GLU OE2 O N N 102 -GLU OXT O N N 103 -GLU H H N N 104 -GLU H2 H N N 105 -GLU HA H N N 106 -GLU HB2 H N N 107 -GLU HB3 H N N 108 -GLU HG2 H N N 109 -GLU HG3 H N N 110 -GLU HE2 H N N 111 -GLU HXT H N N 112 -GLY N N N N 113 -GLY CA C N N 114 -GLY C C N N 115 -GLY O O N N 116 -GLY OXT O N N 117 -GLY H H N N 118 -GLY H2 H N N 119 -GLY HA2 H N N 120 -GLY HA3 H N N 121 -GLY HXT H N N 122 -HIS N N N N 123 -HIS CA C N S 124 -HIS C C N N 125 -HIS O O N N 126 -HIS CB C N N 127 -HIS CG C Y N 128 -HIS ND1 N Y N 129 -HIS CD2 C Y N 130 -HIS CE1 C Y N 131 -HIS NE2 N Y N 132 -HIS OXT O N N 133 -HIS H H N N 134 -HIS H2 H N N 135 -HIS HA H N N 136 -HIS HB2 H N N 137 -HIS HB3 H N N 138 -HIS HD1 H N N 139 -HIS HD2 H N N 140 -HIS HE1 H N N 141 -HIS HE2 H N N 142 -HIS HXT H N N 143 -ILE N N N N 144 -ILE CA C N S 145 -ILE C C N N 146 -ILE O O N N 147 -ILE CB C N S 148 -ILE CG1 C N N 149 -ILE CG2 C N N 150 -ILE CD1 C N N 151 -ILE OXT O N N 152 -ILE H H N N 153 -ILE H2 H N N 154 -ILE HA H N N 155 -ILE HB H N N 156 -ILE HG12 H N N 157 -ILE HG13 H N N 158 -ILE HG21 H N N 159 -ILE HG22 H N N 160 -ILE HG23 H N N 161 -ILE HD11 H N N 162 -ILE HD12 H N N 163 -ILE HD13 H N N 164 -ILE HXT H N N 165 -LEU N N N N 166 -LEU CA C N S 167 -LEU C C N N 168 -LEU O O N N 169 -LEU CB C N N 170 -LEU CG C N N 171 -LEU CD1 C N N 172 -LEU CD2 C N N 173 -LEU OXT O N N 174 -LEU H H N N 175 -LEU H2 H N N 176 -LEU HA H N N 177 -LEU HB2 H N N 178 -LEU HB3 H N N 179 -LEU HG H N N 180 -LEU HD11 H N N 181 -LEU HD12 H N N 182 -LEU HD13 H N N 183 -LEU HD21 H N N 184 -LEU HD22 H N N 185 -LEU HD23 H N N 186 -LEU HXT H N N 187 -LYS N N N N 188 -LYS CA C N S 189 -LYS C C N N 190 -LYS O O N N 191 -LYS CB C N N 192 -LYS CG C N N 193 -LYS CD C N N 194 -LYS CE C N N 195 -LYS NZ N N N 196 -LYS OXT O N N 197 -LYS H H N N 198 -LYS H2 H N N 199 -LYS HA H N N 200 -LYS HB2 H N N 201 -LYS HB3 H N N 202 -LYS HG2 H N N 203 -LYS HG3 H N N 204 -LYS HD2 H N N 205 -LYS HD3 H N N 206 -LYS HE2 H N N 207 -LYS HE3 H N N 208 -LYS HZ1 H N N 209 -LYS HZ2 H N N 210 -LYS HZ3 H N N 211 -LYS HXT H N N 212 -MET N N N N 213 -MET CA C N S 214 -MET C C N N 215 -MET O O N N 216 -MET CB C N N 217 -MET CG C N N 218 -MET SD S N N 219 -MET CE C N N 220 -MET OXT O N N 221 -MET H H N N 222 -MET H2 H N N 223 -MET HA H N N 224 -MET HB2 H N N 225 -MET HB3 H N N 226 -MET HG2 H N N 227 -MET HG3 H N N 228 -MET HE1 H N N 229 -MET HE2 H N N 230 -MET HE3 H N N 231 -MET HXT H N N 232 -PHE N N N N 233 -PHE CA C N S 234 -PHE C C N N 235 -PHE O O N N 236 -PHE CB C N N 237 -PHE CG C Y N 238 -PHE CD1 C Y N 239 -PHE CD2 C Y N 240 -PHE CE1 C Y N 241 -PHE CE2 C Y N 242 -PHE CZ C Y N 243 -PHE OXT O N N 244 -PHE H H N N 245 -PHE H2 H N N 246 -PHE HA H N N 247 -PHE HB2 H N N 248 -PHE HB3 H N N 249 -PHE HD1 H N N 250 -PHE HD2 H N N 251 -PHE HE1 H N N 252 -PHE HE2 H N N 253 -PHE HZ H N N 254 -PHE HXT H N N 255 -PRO N N N N 256 -PRO CA C N S 257 -PRO C C N N 258 -PRO O O N N 259 -PRO CB C N N 260 -PRO CG C N N 261 -PRO CD C N N 262 -PRO OXT O N N 263 -PRO H H N N 264 -PRO HA H N N 265 -PRO HB2 H N N 266 -PRO HB3 H N N 267 -PRO HG2 H N N 268 -PRO HG3 H N N 269 -PRO HD2 H N N 270 -PRO HD3 H N N 271 -PRO HXT H N N 272 -SER N N N N 273 -SER CA C N S 274 -SER C C N N 275 -SER O O N N 276 -SER CB C N N 277 -SER OG O N N 278 -SER OXT O N N 279 -SER H H N N 280 -SER H2 H N N 281 -SER HA H N N 282 -SER HB2 H N N 283 -SER HB3 H N N 284 -SER HG H N N 285 -SER HXT H N N 286 -THR N N N N 287 -THR CA C N S 288 -THR C C N N 289 -THR O O N N 290 -THR CB C N R 291 -THR OG1 O N N 292 -THR CG2 C N N 293 -THR OXT O N N 294 -THR H H N N 295 -THR H2 H N N 296 -THR HA H N N 297 -THR HB H N N 298 -THR HG1 H N N 299 -THR HG21 H N N 300 -THR HG22 H N N 301 -THR HG23 H N N 302 -THR HXT H N N 303 -TYR N N N N 304 -TYR CA C N S 305 -TYR C C N N 306 -TYR O O N N 307 -TYR CB C N N 308 -TYR CG C Y N 309 -TYR CD1 C Y N 310 -TYR CD2 C Y N 311 -TYR CE1 C Y N 312 -TYR CE2 C Y N 313 -TYR CZ C Y N 314 -TYR OH O N N 315 -TYR OXT O N N 316 -TYR H H N N 317 -TYR H2 H N N 318 -TYR HA H N N 319 -TYR HB2 H N N 320 -TYR HB3 H N N 321 -TYR HD1 H N N 322 -TYR HD2 H N N 323 -TYR HE1 H N N 324 -TYR HE2 H N N 325 -TYR HH H N N 326 -TYR HXT H N N 327 -VAL N N N N 328 -VAL CA C N S 329 -VAL C C N N 330 -VAL O O N N 331 -VAL CB C N N 332 -VAL CG1 C N N 333 -VAL CG2 C N N 334 -VAL OXT O N N 335 -VAL H H N N 336 -VAL H2 H N N 337 -VAL HA H N N 338 -VAL HB H N N 339 -VAL HG11 H N N 340 -VAL HG12 H N N 341 -VAL HG13 H N N 342 -VAL HG21 H N N 343 -VAL HG22 H N N 344 -VAL HG23 H N N 345 -VAL HXT H N N 346 -# -loop_ -_chem_comp_bond.comp_id -_chem_comp_bond.atom_id_1 -_chem_comp_bond.atom_id_2 -_chem_comp_bond.value_order -_chem_comp_bond.pdbx_aromatic_flag -_chem_comp_bond.pdbx_stereo_config -_chem_comp_bond.pdbx_ordinal -ALA N CA SING N N 1 -ALA N H SING N N 2 -ALA N H2 SING N N 3 -ALA CA C SING N N 4 -ALA CA CB SING N N 5 -ALA CA HA SING N N 6 -ALA C O DOUB N N 7 -ALA C OXT SING N N 8 -ALA CB HB1 SING N N 9 -ALA CB HB2 SING N N 10 -ALA CB HB3 SING N N 11 -ALA OXT HXT SING N N 12 -ARG N CA SING N N 13 -ARG N H SING N N 14 -ARG N H2 SING N N 15 -ARG CA C SING N N 16 -ARG CA CB SING N N 17 -ARG CA HA SING N N 18 -ARG C O DOUB N N 19 -ARG C OXT SING N N 20 -ARG CB CG SING N N 21 -ARG CB HB2 SING N N 22 -ARG CB HB3 SING N N 23 -ARG CG CD SING N N 24 -ARG CG HG2 SING N N 25 -ARG CG HG3 SING N N 26 -ARG CD NE SING N N 27 -ARG CD HD2 SING N N 28 -ARG CD HD3 SING N N 29 -ARG NE CZ SING N N 30 -ARG NE HE SING N N 31 -ARG CZ NH1 SING N N 32 -ARG CZ NH2 DOUB N N 33 -ARG NH1 HH11 SING N N 34 -ARG NH1 HH12 SING N N 35 -ARG NH2 HH21 SING N N 36 -ARG NH2 HH22 SING N N 37 -ARG OXT HXT SING N N 38 -ASN N CA SING N N 39 -ASN N H SING N N 40 -ASN N H2 SING N N 41 -ASN CA C SING N N 42 -ASN CA CB SING N N 43 -ASN CA HA SING N N 44 -ASN C O DOUB N N 45 -ASN C OXT SING N N 46 -ASN CB CG SING N N 47 -ASN CB HB2 SING N N 48 -ASN CB HB3 SING N N 49 -ASN CG OD1 DOUB N N 50 -ASN CG ND2 SING N N 51 -ASN ND2 HD21 SING N N 52 -ASN ND2 HD22 SING N N 53 -ASN OXT HXT SING N N 54 -ASP N CA SING N N 55 -ASP N H SING N N 56 -ASP N H2 SING N N 57 -ASP CA C SING N N 58 -ASP CA CB SING N N 59 -ASP CA HA SING N N 60 -ASP C O DOUB N N 61 -ASP C OXT SING N N 62 -ASP CB CG SING N N 63 -ASP CB HB2 SING N N 64 -ASP CB HB3 SING N N 65 -ASP CG OD1 DOUB N N 66 -ASP CG OD2 SING N N 67 -ASP OD2 HD2 SING N N 68 -ASP OXT HXT SING N N 69 -GLN N CA SING N N 70 -GLN N H SING N N 71 -GLN N H2 SING N N 72 -GLN CA C SING N N 73 -GLN CA CB SING N N 74 -GLN CA HA SING N N 75 -GLN C O DOUB N N 76 -GLN C OXT SING N N 77 -GLN CB CG SING N N 78 -GLN CB HB2 SING N N 79 -GLN CB HB3 SING N N 80 -GLN CG CD SING N N 81 -GLN CG HG2 SING N N 82 -GLN CG HG3 SING N N 83 -GLN CD OE1 DOUB N N 84 -GLN CD NE2 SING N N 85 -GLN NE2 HE21 SING N N 86 -GLN NE2 HE22 SING N N 87 -GLN OXT HXT SING N N 88 -GLU N CA SING N N 89 -GLU N H SING N N 90 -GLU N H2 SING N N 91 -GLU CA C SING N N 92 -GLU CA CB SING N N 93 -GLU CA HA SING N N 94 -GLU C O DOUB N N 95 -GLU C OXT SING N N 96 -GLU CB CG SING N N 97 -GLU CB HB2 SING N N 98 -GLU CB HB3 SING N N 99 -GLU CG CD SING N N 100 -GLU CG HG2 SING N N 101 -GLU CG HG3 SING N N 102 -GLU CD OE1 DOUB N N 103 -GLU CD OE2 SING N N 104 -GLU OE2 HE2 SING N N 105 -GLU OXT HXT SING N N 106 -GLY N CA SING N N 107 -GLY N H SING N N 108 -GLY N H2 SING N N 109 -GLY CA C SING N N 110 -GLY CA HA2 SING N N 111 -GLY CA HA3 SING N N 112 -GLY C O DOUB N N 113 -GLY C OXT SING N N 114 -GLY OXT HXT SING N N 115 -HIS N CA SING N N 116 -HIS N H SING N N 117 -HIS N H2 SING N N 118 -HIS CA C SING N N 119 -HIS CA CB SING N N 120 -HIS CA HA SING N N 121 -HIS C O DOUB N N 122 -HIS C OXT SING N N 123 -HIS CB CG SING N N 124 -HIS CB HB2 SING N N 125 -HIS CB HB3 SING N N 126 -HIS CG ND1 SING Y N 127 -HIS CG CD2 DOUB Y N 128 -HIS ND1 CE1 DOUB Y N 129 -HIS ND1 HD1 SING N N 130 -HIS CD2 NE2 SING Y N 131 -HIS CD2 HD2 SING N N 132 -HIS CE1 NE2 SING Y N 133 -HIS CE1 HE1 SING N N 134 -HIS NE2 HE2 SING N N 135 -HIS OXT HXT SING N N 136 -ILE N CA SING N N 137 -ILE N H SING N N 138 -ILE N H2 SING N N 139 -ILE CA C SING N N 140 -ILE CA CB SING N N 141 -ILE CA HA SING N N 142 -ILE C O DOUB N N 143 -ILE C OXT SING N N 144 -ILE CB CG1 SING N N 145 -ILE CB CG2 SING N N 146 -ILE CB HB SING N N 147 -ILE CG1 CD1 SING N N 148 -ILE CG1 HG12 SING N N 149 -ILE CG1 HG13 SING N N 150 -ILE CG2 HG21 SING N N 151 -ILE CG2 HG22 SING N N 152 -ILE CG2 HG23 SING N N 153 -ILE CD1 HD11 SING N N 154 -ILE CD1 HD12 SING N N 155 -ILE CD1 HD13 SING N N 156 -ILE OXT HXT SING N N 157 -LEU N CA SING N N 158 -LEU N H SING N N 159 -LEU N H2 SING N N 160 -LEU CA C SING N N 161 -LEU CA CB SING N N 162 -LEU CA HA SING N N 163 -LEU C O DOUB N N 164 -LEU C OXT SING N N 165 -LEU CB CG SING N N 166 -LEU CB HB2 SING N N 167 -LEU CB HB3 SING N N 168 -LEU CG CD1 SING N N 169 -LEU CG CD2 SING N N 170 -LEU CG HG SING N N 171 -LEU CD1 HD11 SING N N 172 -LEU CD1 HD12 SING N N 173 -LEU CD1 HD13 SING N N 174 -LEU CD2 HD21 SING N N 175 -LEU CD2 HD22 SING N N 176 -LEU CD2 HD23 SING N N 177 -LEU OXT HXT SING N N 178 -LYS N CA SING N N 179 -LYS N H SING N N 180 -LYS N H2 SING N N 181 -LYS CA C SING N N 182 -LYS CA CB SING N N 183 -LYS CA HA SING N N 184 -LYS C O DOUB N N 185 -LYS C OXT SING N N 186 -LYS CB CG SING N N 187 -LYS CB HB2 SING N N 188 -LYS CB HB3 SING N N 189 -LYS CG CD SING N N 190 -LYS CG HG2 SING N N 191 -LYS CG HG3 SING N N 192 -LYS CD CE SING N N 193 -LYS CD HD2 SING N N 194 -LYS CD HD3 SING N N 195 -LYS CE NZ SING N N 196 -LYS CE HE2 SING N N 197 -LYS CE HE3 SING N N 198 -LYS NZ HZ1 SING N N 199 -LYS NZ HZ2 SING N N 200 -LYS NZ HZ3 SING N N 201 -LYS OXT HXT SING N N 202 -MET N CA SING N N 203 -MET N H SING N N 204 -MET N H2 SING N N 205 -MET CA C SING N N 206 -MET CA CB SING N N 207 -MET CA HA SING N N 208 -MET C O DOUB N N 209 -MET C OXT SING N N 210 -MET CB CG SING N N 211 -MET CB HB2 SING N N 212 -MET CB HB3 SING N N 213 -MET CG SD SING N N 214 -MET CG HG2 SING N N 215 -MET CG HG3 SING N N 216 -MET SD CE SING N N 217 -MET CE HE1 SING N N 218 -MET CE HE2 SING N N 219 -MET CE HE3 SING N N 220 -MET OXT HXT SING N N 221 -PHE N CA SING N N 222 -PHE N H SING N N 223 -PHE N H2 SING N N 224 -PHE CA C SING N N 225 -PHE CA CB SING N N 226 -PHE CA HA SING N N 227 -PHE C O DOUB N N 228 -PHE C OXT SING N N 229 -PHE CB CG SING N N 230 -PHE CB HB2 SING N N 231 -PHE CB HB3 SING N N 232 -PHE CG CD1 DOUB Y N 233 -PHE CG CD2 SING Y N 234 -PHE CD1 CE1 SING Y N 235 -PHE CD1 HD1 SING N N 236 -PHE CD2 CE2 DOUB Y N 237 -PHE CD2 HD2 SING N N 238 -PHE CE1 CZ DOUB Y N 239 -PHE CE1 HE1 SING N N 240 -PHE CE2 CZ SING Y N 241 -PHE CE2 HE2 SING N N 242 -PHE CZ HZ SING N N 243 -PHE OXT HXT SING N N 244 -PRO N CA SING N N 245 -PRO N CD SING N N 246 -PRO N H SING N N 247 -PRO CA C SING N N 248 -PRO CA CB SING N N 249 -PRO CA HA SING N N 250 -PRO C O DOUB N N 251 -PRO C OXT SING N N 252 -PRO CB CG SING N N 253 -PRO CB HB2 SING N N 254 -PRO CB HB3 SING N N 255 -PRO CG CD SING N N 256 -PRO CG HG2 SING N N 257 -PRO CG HG3 SING N N 258 -PRO CD HD2 SING N N 259 -PRO CD HD3 SING N N 260 -PRO OXT HXT SING N N 261 -SER N CA SING N N 262 -SER N H SING N N 263 -SER N H2 SING N N 264 -SER CA C SING N N 265 -SER CA CB SING N N 266 -SER CA HA SING N N 267 -SER C O DOUB N N 268 -SER C OXT SING N N 269 -SER CB OG SING N N 270 -SER CB HB2 SING N N 271 -SER CB HB3 SING N N 272 -SER OG HG SING N N 273 -SER OXT HXT SING N N 274 -THR N CA SING N N 275 -THR N H SING N N 276 -THR N H2 SING N N 277 -THR CA C SING N N 278 -THR CA CB SING N N 279 -THR CA HA SING N N 280 -THR C O DOUB N N 281 -THR C OXT SING N N 282 -THR CB OG1 SING N N 283 -THR CB CG2 SING N N 284 -THR CB HB SING N N 285 -THR OG1 HG1 SING N N 286 -THR CG2 HG21 SING N N 287 -THR CG2 HG22 SING N N 288 -THR CG2 HG23 SING N N 289 -THR OXT HXT SING N N 290 -TYR N CA SING N N 291 -TYR N H SING N N 292 -TYR N H2 SING N N 293 -TYR CA C SING N N 294 -TYR CA CB SING N N 295 -TYR CA HA SING N N 296 -TYR C O DOUB N N 297 -TYR C OXT SING N N 298 -TYR CB CG SING N N 299 -TYR CB HB2 SING N N 300 -TYR CB HB3 SING N N 301 -TYR CG CD1 DOUB Y N 302 -TYR CG CD2 SING Y N 303 -TYR CD1 CE1 SING Y N 304 -TYR CD1 HD1 SING N N 305 -TYR CD2 CE2 DOUB Y N 306 -TYR CD2 HD2 SING N N 307 -TYR CE1 CZ DOUB Y N 308 -TYR CE1 HE1 SING N N 309 -TYR CE2 CZ SING Y N 310 -TYR CE2 HE2 SING N N 311 -TYR CZ OH SING N N 312 -TYR OH HH SING N N 313 -TYR OXT HXT SING N N 314 -VAL N CA SING N N 315 -VAL N H SING N N 316 -VAL N H2 SING N N 317 -VAL CA C SING N N 318 -VAL CA CB SING N N 319 -VAL CA HA SING N N 320 -VAL C O DOUB N N 321 -VAL C OXT SING N N 322 -VAL CB CG1 SING N N 323 -VAL CB CG2 SING N N 324 -VAL CB HB SING N N 325 -VAL CG1 HG11 SING N N 326 -VAL CG1 HG12 SING N N 327 -VAL CG1 HG13 SING N N 328 -VAL CG2 HG21 SING N N 329 -VAL CG2 HG22 SING N N 330 -VAL CG2 HG23 SING N N 331 -VAL OXT HXT SING N N 332 -# +data_N +# +_entry.id N +# +loop_ +_atom_type.symbol +C +H +N +O +S +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +chiLife 1 +'Maxx Tessmer' 2 +'Stefan Stoll' 3 +# +_citation.book_publisher ? +_citation.country US +_citation.id primary +_citation.journal_full 'PLoS Computational Biology' +_citation.journal_id_ISSN 1553-734X +_citation.journal_volume 19 +_citation.journal_issue 3 +_citation.journal_page_first e1010834 +_citation.journal_page_last e1010834 +_citation.title +'chiLife: An open-source Python package for in silico spin labeling and integrative protein modeling' +_citation.year 2023 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +primary 'Maxx Tessmer' 1 +primary 'Stefan Stoll' 2 +# +loop_ +_entity.id +_entity.pdbx_description +_entity.type +1 . polymer +# +loop_ +_entity_poly.entity_id +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_type +1 A1 polypeptide +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.hetero +_entity_poly_seq.mon_id +_entity_poly_seq.num +1 n GLY 1 +1 n PRO 2 +1 n LEU 3 +1 n GLY 4 +1 n SER 5 +1 n MET 6 +1 n GLN 7 +1 n ILE 8 +1 n PHE 9 +1 n VAL 10 +1 n LYS 11 +1 n THR 12 +1 n LEU 13 +1 n THR 14 +1 n GLY 15 +1 n LYS 16 +1 n THR 17 +1 n ILE 18 +1 n THR 19 +1 n ILE 20 +1 n ASP 21 +1 n VAL 22 +1 n ASP 23 +1 n HIS 24 +1 n ALA 25 +1 n ASP 26 +1 n THR 27 +1 n VAL 28 +1 n GLY 29 +1 n ALA 30 +1 n VAL 31 +1 n LYS 32 +1 n ALA 33 +1 n LYS 34 +1 n ILE 35 +1 n TYR 36 +1 n ASP 37 +1 n LYS 38 +1 n GLU 39 +1 n GLY 40 +1 n ILE 41 +1 n PRO 42 +1 n PRO 43 +1 n ASP 44 +1 n GLN 45 +1 n GLN 46 +1 n ARG 47 +1 n LEU 48 +1 n ILE 49 +1 n PHE 50 +1 n GLY 51 +1 n GLY 52 +1 n LYS 53 +1 n GLN 54 +1 n LEU 55 +1 n GLU 56 +1 n ASP 57 +1 n SER 58 +1 n ASN 59 +1 n ALA 60 +1 n MET 61 +1 n SER 62 +1 n ASP 63 +1 n TYR 64 +1 n ASN 65 +1 n VAL 66 +1 n GLN 67 +1 n LYS 68 +1 n GLU 69 +1 n SER 70 +1 n THR 71 +1 n LEU 72 +1 n HIS 73 +1 n LEU 74 +1 n VAL 75 +1 n LEU 76 +1 n ARG 77 +1 n LEU 78 +1 n ARG 79 +1 n GLY 80 +1 n GLY 81 +1 n VAL 82 +# +_ma_data.content_type model_coordinates +_ma_data.name Model +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.hetero +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.seq_id +A1 1 1 n GLY . 1 A1 1 +A1 2 1 n PRO . 2 A1 2 +A1 3 1 n LEU . 3 A1 3 +A1 4 1 n GLY . 4 A1 4 +A1 5 1 n SER . 5 A1 5 +A1 6 1 n MET . 6 A1 6 +A1 7 1 n GLN . 7 A1 7 +A1 8 1 n ILE . 8 A1 8 +A1 9 1 n PHE . 9 A1 9 +A1 10 1 n VAL . 10 A1 10 +A1 11 1 n LYS . 11 A1 11 +A1 12 1 n THR . 12 A1 12 +A1 13 1 n LEU . 13 A1 13 +A1 14 1 n THR . 14 A1 14 +A1 15 1 n GLY . 15 A1 15 +A1 16 1 n LYS . 16 A1 16 +A1 17 1 n THR . 17 A1 17 +A1 18 1 n ILE . 18 A1 18 +A1 19 1 n THR . 19 A1 19 +A1 20 1 n ILE . 20 A1 20 +A1 21 1 n ASP . 21 A1 21 +A1 22 1 n VAL . 22 A1 22 +A1 23 1 n ASP . 23 A1 23 +A1 24 1 n HIS . 24 A1 24 +A1 25 1 n ALA . 25 A1 25 +A1 26 1 n ASP . 26 A1 26 +A1 27 1 n THR . 27 A1 27 +A1 28 1 n VAL . 28 A1 28 +A1 29 1 n GLY . 29 A1 29 +A1 30 1 n ALA . 30 A1 30 +A1 31 1 n VAL . 31 A1 31 +A1 32 1 n LYS . 32 A1 32 +A1 33 1 n ALA . 33 A1 33 +A1 34 1 n LYS . 34 A1 34 +A1 35 1 n ILE . 35 A1 35 +A1 36 1 n TYR . 36 A1 36 +A1 37 1 n ASP . 37 A1 37 +A1 38 1 n LYS . 38 A1 38 +A1 39 1 n GLU . 39 A1 39 +A1 40 1 n GLY . 40 A1 40 +A1 41 1 n ILE . 41 A1 41 +A1 42 1 n PRO . 42 A1 42 +A1 43 1 n PRO . 43 A1 43 +A1 44 1 n ASP . 44 A1 44 +A1 45 1 n GLN . 45 A1 45 +A1 46 1 n GLN . 46 A1 46 +A1 47 1 n ARG . 47 A1 47 +A1 48 1 n LEU . 48 A1 48 +A1 49 1 n ILE . 49 A1 49 +A1 50 1 n PHE . 50 A1 50 +A1 51 1 n GLY . 51 A1 51 +A1 52 1 n GLY . 52 A1 52 +A1 53 1 n LYS . 53 A1 53 +A1 54 1 n GLN . 54 A1 54 +A1 55 1 n LEU . 55 A1 55 +A1 56 1 n GLU . 56 A1 56 +A1 57 1 n ASP . 57 A1 57 +A1 58 1 n SER . 58 A1 58 +A1 59 1 n ASN . 59 A1 59 +A1 60 1 n ALA . 60 A1 60 +A1 61 1 n MET . 61 A1 61 +A1 62 1 n SER . 62 A1 62 +A1 63 1 n ASP . 63 A1 63 +A1 64 1 n TYR . 64 A1 64 +A1 65 1 n ASN . 65 A1 65 +A1 66 1 n VAL . 66 A1 66 +A1 67 1 n GLN . 67 A1 67 +A1 68 1 n LYS . 68 A1 68 +A1 69 1 n GLU . 69 A1 69 +A1 70 1 n SER . 70 A1 70 +A1 71 1 n THR . 71 A1 71 +A1 72 1 n LEU . 72 A1 72 +A1 73 1 n HIS . 73 A1 73 +A1 74 1 n LEU . 74 A1 74 +A1 75 1 n VAL . 75 A1 75 +A1 76 1 n LEU . 76 A1 76 +A1 77 1 n ARG . 77 A1 77 +A1 78 1 n LEU . 78 A1 78 +A1 79 1 n ARG . 79 A1 79 +A1 80 1 n GLY . 80 A1 80 +A1 81 1 n GLY . 81 A1 81 +A1 82 1 n VAL . 82 A1 82 +# +_software.classification 'model building' +_software.date 2023-03-31 +_software.description 'Protein modeling' +_software.name chiLife +_software.pdbx_ordinal 1 +_software.type 'python package' +_software.version 1.2.2 +# +loop_ +_struct_asym.entity_id +_struct_asym.id +1 A1 +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_asym_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . GLY A1 1 1 ? 1.33 0.0 0.0 1.0 13.0 ? 1 A 1 +ATOM 2 C CA . GLY A1 1 1 ? 2.071 0.001 -1.247 1.0 45.03 ? 1 A 1 +ATOM 3 C C . GLY A1 1 1 ? 1.548 1.028 -2.232 1.0 65.21 ? 1 A 1 +ATOM 4 O O . GLY A1 1 1 ? 0.779 1.922 -1.88 1.0 33.34 ? 1 A 1 +ATOM 5 H H1 . GLY A1 1 1 ? 1.811 -0.001 0.854 1.0 52.4 ? 1 A 1 +ATOM 6 H HA2 . GLY A1 1 1 ? 3.109 0.215 -1.037 1.0 14.15 ? 1 A 1 +ATOM 7 H HA3 . GLY A1 1 1 ? 2.001 -0.979 -1.696 1.0 34.23 ? 1 A 1 +ATOM 8 N N . PRO A1 1 2 ? 1.972 0.907 -3.499 1.0 55.32 ? 2 A 1 +ATOM 9 C CA . PRO A1 1 2 ? 1.554 1.825 -4.564 1.0 21.43 ? 2 A 1 +ATOM 10 C C . PRO A1 1 2 ? 0.085 1.652 -4.934 1.0 41.45 ? 2 A 1 +ATOM 11 O O . PRO A1 1 2 ? -0.585 0.739 -4.451 1.0 62.42 ? 2 A 1 +ATOM 12 C CB . PRO A1 1 2 ? 2.452 1.434 -5.74 1.0 51.45 ? 2 A 1 +ATOM 13 C CG . PRO A1 1 2 ? 2.814 0.012 -5.485 1.0 43.11 ? 2 A 1 +ATOM 14 C CD . PRO A1 1 2 ? 2.889 -0.134 -3.99 1.0 64.14 ? 2 A 1 +ATOM 15 H HA . PRO A1 1 2 ? 1.738 2.855 -4.295 1.0 31.54 ? 2 A 1 +ATOM 16 H HB2 . PRO A1 1 2 ? 1.904 1.543 -6.666 1.0 42.4 ? 2 A 1 +ATOM 17 H HB3 . PRO A1 1 2 ? 3.326 2.068 -5.756 1.0 62.54 ? 2 A 1 +ATOM 18 H HG2 . PRO A1 1 2 ? 2.053 -0.639 -5.888 1.0 3.22 ? 2 A 1 +ATOM 19 H HG3 . PRO A1 1 2 ? 3.773 -0.208 -5.931 1.0 51.14 ? 2 A 1 +ATOM 20 H HD2 . PRO A1 1 2 ? 2.555 -1.116 -3.69 1.0 11.0 ? 2 A 1 +ATOM 21 H HD3 . PRO A1 1 2 ? 3.896 0.046 -3.644 1.0 24.12 ? 2 A 1 +ATOM 22 N N . LEU A1 1 3 ? -0.41 2.535 -5.795 1.0 34.12 ? 3 A 1 +ATOM 23 C CA . LEU A1 1 3 ? -1.801 2.48 -6.231 1.0 54.03 ? 3 A 1 +ATOM 24 C C . LEU A1 1 3 ? -2.068 3.503 -7.331 1.0 63.21 ? 3 A 1 +ATOM 25 O O . LEU A1 1 3 ? -1.295 4.441 -7.521 1.0 11.24 ? 3 A 1 +ATOM 26 C CB . LEU A1 1 3 ? -2.738 2.731 -5.048 1.0 60.12 ? 3 A 1 +ATOM 27 C CG . LEU A1 1 3 ? -3.691 1.589 -4.692 1.0 64.13 ? 3 A 1 +ATOM 28 C CD1 . LEU A1 1 3 ? -3.952 1.559 -3.194 1.0 62.25 ? 3 A 1 +ATOM 29 C CD2 . LEU A1 1 3 ? -4.997 1.725 -5.461 1.0 0.12 ? 3 A 1 +ATOM 30 H H . LEU A1 1 3 ? 0.172 3.24 -6.145 1.0 52.35 ? 3 A 1 +ATOM 31 H HA . LEU A1 1 3 ? -1.987 1.491 -6.623 1.0 43.13 ? 3 A 1 +ATOM 32 H HB2 . LEU A1 1 3 ? -2.128 2.935 -4.181 1.0 74.24 ? 3 A 1 +ATOM 33 H HB3 . LEU A1 1 3 ? -3.335 3.602 -5.279 1.0 72.41 ? 3 A 1 +ATOM 34 H HG . LEU A1 1 3 ? -3.235 0.648 -4.97 1.0 43.5 ? 3 A 1 +ATOM 35 H HD11 . LEU A1 1 3 ? -3.269 2.23 -2.696 1.0 50.45 ? 3 A 1 +ATOM 36 H HD12 . LEU A1 1 3 ? -3.805 0.555 -2.824 1.0 4.34 ? 3 A 1 +ATOM 37 H HD13 . LEU A1 1 3 ? -4.968 1.868 -3.0 1.0 54.42 ? 3 A 1 +ATOM 38 H HD21 . LEU A1 1 3 ? -4.854 1.389 -6.477 1.0 23.33 ? 3 A 1 +ATOM 39 H HD22 . LEU A1 1 3 ? -5.306 2.76 -5.464 1.0 1.01 ? 3 A 1 +ATOM 40 H HD23 . LEU A1 1 3 ? -5.758 1.124 -4.985 1.0 75.24 ? 3 A 1 +ATOM 41 N N . GLY A1 1 4 ? -3.169 3.315 -8.053 1.0 4.21 ? 4 A 1 +ATOM 42 C CA . GLY A1 1 4 ? -3.519 4.23 -9.123 1.0 43.34 ? 4 A 1 +ATOM 43 C C . GLY A1 1 4 ? -4.943 4.041 -9.606 1.0 32.24 ? 4 A 1 +ATOM 44 O O . GLY A1 1 4 ? -5.239 3.091 -10.33 1.0 73.31 ? 4 A 1 +ATOM 45 H H . GLY A1 1 4 ? -3.748 2.549 -7.857 1.0 2.13 ? 4 A 1 +ATOM 46 H HA2 . GLY A1 1 4 ? -3.401 5.243 -8.769 1.0 53.5 ? 4 A 1 +ATOM 47 H HA3 . GLY A1 1 4 ? -2.846 4.07 -9.953 1.0 61.41 ? 4 A 1 +ATOM 48 N N . SER A1 1 5 ? -5.828 4.946 -9.202 1.0 14.33 ? 5 A 1 +ATOM 49 C CA . SER A1 1 5 ? -7.231 4.871 -9.593 1.0 12.42 ? 5 A 1 +ATOM 50 C C . SER A1 1 5 ? -7.919 6.221 -9.411 1.0 43.22 ? 5 A 1 +ATOM 51 O O . SER A1 1 5 ? -7.815 6.846 -8.356 1.0 33.52 ? 5 A 1 +ATOM 52 C CB . SER A1 1 5 ? -7.955 3.803 -8.771 1.0 72.02 ? 5 A 1 +ATOM 53 O OG . SER A1 1 5 ? -7.409 2.518 -9.012 1.0 21.35 ? 5 A 1 +ATOM 54 H H . SER A1 1 5 ? -5.531 5.681 -8.625 1.0 31.12 ? 5 A 1 +ATOM 55 H HA . SER A1 1 5 ? -7.27 4.598 -10.637 1.0 12.32 ? 5 A 1 +ATOM 56 H HB2 . SER A1 1 5 ? -7.857 4.032 -7.721 1.0 41.01 ? 5 A 1 +ATOM 57 H HB3 . SER A1 1 5 ? -9.001 3.793 -9.041 1.0 74.13 ? 5 A 1 +ATOM 58 H HG . SER A1 1 5 ? -7.616 1.939 -8.275 1.0 33.45 ? 5 A 1 +ATOM 59 N N . MET A1 1 6 ? -8.62 6.665 -10.449 1.0 14.01 ? 6 A 1 +ATOM 60 C CA . MET A1 1 6 ? -9.326 7.94 -10.404 1.0 54.33 ? 6 A 1 +ATOM 61 C C . MET A1 1 6 ? -10.558 7.912 -11.304 1.0 31.44 ? 6 A 1 +ATOM 62 O O . MET A1 1 6 ? -10.47 7.561 -12.48 1.0 1.11 ? 6 A 1 +ATOM 63 C CB . MET A1 1 6 ? -8.396 9.078 -10.83 1.0 70.21 ? 6 A 1 +ATOM 64 C CG . MET A1 1 6 ? -7.818 8.9 -12.225 1.0 25.05 ? 6 A 1 +ATOM 65 S SD . MET A1 1 6 ? -6.019 8.776 -12.22 1.0 3.44 ? 6 A 1 +ATOM 66 C CE . MET A1 1 6 ? -5.791 7.175 -11.45 1.0 13.21 ? 6 A 1 +ATOM 67 H H . MET A1 1 6 ? -8.666 6.122 -11.264 1.0 2.32 ? 6 A 1 +ATOM 68 H HA . MET A1 1 6 ? -9.643 8.108 -9.386 1.0 5.22 ? 6 A 1 +ATOM 69 H HB2 . MET A1 1 6 ? -8.948 10.006 -10.808 1.0 62.43 ? 6 A 1 +ATOM 70 H HB3 . MET A1 1 6 ? -7.577 9.139 -10.129 1.0 63.34 ? 6 A 1 +ATOM 71 H HG2 . MET A1 1 6 ? -8.224 7.998 -12.657 1.0 33.13 ? 6 A 1 +ATOM 72 H HG3 . MET A1 1 6 ? -8.105 9.747 -12.829 1.0 12.41 ? 6 A 1 +ATOM 73 H HE1 . MET A1 1 6 ? -5.835 7.283 -10.376 1.0 12.23 ? 6 A 1 +ATOM 74 H HE2 . MET A1 1 6 ? -6.572 6.504 -11.776 1.0 52.54 ? 6 A 1 +ATOM 75 H HE3 . MET A1 1 6 ? -4.83 6.773 -11.733 1.0 2.41 ? 6 A 1 +ATOM 76 N N . GLN A1 1 7 ? -11.704 8.282 -10.742 1.0 13.12 ? 7 A 1 +ATOM 77 C CA . GLN A1 1 7 ? -12.953 8.297 -11.494 1.0 13.2 ? 7 A 1 +ATOM 78 C C . GLN A1 1 7 ? -13.209 9.674 -12.097 1.0 42.42 ? 7 A 1 +ATOM 79 O O . GLN A1 1 7 ? -12.659 10.676 -11.637 1.0 71.33 ? 7 A 1 +ATOM 80 C CB . GLN A1 1 7 ? -14.122 7.898 -10.591 1.0 42.01 ? 7 A 1 +ATOM 81 C CG . GLN A1 1 7 ? -13.784 6.78 -9.618 1.0 12.34 ? 7 A 1 +ATOM 82 C CD . GLN A1 1 7 ? -13.385 7.298 -8.25 1.0 44.31 ? 7 A 1 +ATOM 83 O OE1 . GLN A1 1 7 ? -13.361 8.507 -8.014 1.0 33.44 ? 7 A 1 +ATOM 84 N NE2 . GLN A1 1 7 ? -13.067 6.385 -7.34 1.0 73.32 ? 7 A 1 +ATOM 85 H H . GLN A1 1 7 ? -11.71 8.551 -9.8 1.0 71.21 ? 7 A 1 +ATOM 86 H HA . GLN A1 1 7 ? -12.867 7.578 -12.294 1.0 62.03 ? 7 A 1 +ATOM 87 H HB2 . GLN A1 1 7 ? -14.432 8.761 -10.022 1.0 13.25 ? 7 A 1 +ATOM 88 H HB3 . GLN A1 1 7 ? -14.944 7.57 -11.21 1.0 41.42 ? 7 A 1 +ATOM 89 H HG2 . GLN A1 1 7 ? -14.65 6.144 -9.505 1.0 43.33 ? 7 A 1 +ATOM 90 H HG3 . GLN A1 1 7 ? -12.965 6.204 -10.022 1.0 33.21 ? 7 A 1 +ATOM 91 H HE21 . GLN A1 1 7 ? -13.107 5.44 -7.6 1.0 52.01 ? 7 A 1 +ATOM 92 H HE22 . GLN A1 1 7 ? -12.804 6.691 -6.448 1.0 55.43 ? 7 A 1 +ATOM 93 N N . ILE A1 1 8 ? -14.045 9.717 -13.129 1.0 12.12 ? 8 A 1 +ATOM 94 C CA . ILE A1 1 8 ? -14.374 10.972 -13.794 1.0 64.2 ? 8 A 1 +ATOM 95 C C . ILE A1 1 8 ? -15.883 11.149 -13.919 1.0 0.33 ? 8 A 1 +ATOM 96 O O . ILE A1 1 8 ? -16.637 10.176 -13.9 1.0 11.35 ? 8 A 1 +ATOM 97 C CB . ILE A1 1 8 ? -13.742 11.048 -15.196 1.0 65.34 ? 8 A 1 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.943 9.776 -15.489 1.0 72.33 ? 8 A 1 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.851 12.276 -15.31 1.0 55.24 ? 8 A 1 +ATOM 100 C CD1 . ILE A1 1 8 ? -12.441 9.692 -16.914 1.0 11.02 ? 8 A 1 +ATOM 101 H H . ILE A1 1 8 ? -14.452 8.885 -13.449 1.0 43.45 ? 8 A 1 +ATOM 102 H HA . ILE A1 1 8 ? -13.975 11.779 -13.197 1.0 41.41 ? 8 A 1 +ATOM 103 H HB . ILE A1 1 8 ? -14.536 11.14 -15.921 1.0 13.24 ? 8 A 1 +ATOM 104 H HG12 . ILE A1 1 8 ? -12.088 9.736 -14.834 1.0 4.11 ? 8 A 1 +ATOM 105 H HG13 . ILE A1 1 8 ? -13.571 8.916 -15.307 1.0 33.41 ? 8 A 1 +ATOM 106 H HG21 . ILE A1 1 8 ? -13.465 13.153 -15.455 1.0 12.11 ? 8 A 1 +ATOM 107 H HG22 . ILE A1 1 8 ? -12.274 12.387 -14.405 1.0 14.43 ? 8 A 1 +ATOM 108 H HG23 . ILE A1 1 8 ? -12.184 12.161 -16.151 1.0 53.13 ? 8 A 1 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.638 10.626 -17.42 1.0 4.51 ? 8 A 1 +ATOM 110 H HD12 . ILE A1 1 8 ? -11.378 9.503 -16.911 1.0 22.53 ? 8 A 1 +ATOM 111 H HD13 . ILE A1 1 8 ? -12.949 8.891 -17.429 1.0 32.23 ? 8 A 1 +ATOM 112 N N . PHE A1 1 9 ? -16.318 12.398 -14.048 1.0 44.42 ? 9 A 1 +ATOM 113 C CA . PHE A1 1 9 ? -17.738 12.704 -14.177 1.0 45.42 ? 9 A 1 +ATOM 114 C C . PHE A1 1 9 ? -18.066 13.177 -15.59 1.0 62.05 ? 9 A 1 +ATOM 115 O O . PHE A1 1 9 ? -17.464 14.125 -16.096 1.0 33.13 ? 9 A 1 +ATOM 116 C CB . PHE A1 1 9 ? -18.145 13.774 -13.162 1.0 42.3 ? 9 A 1 +ATOM 117 C CG . PHE A1 1 9 ? -19.027 13.253 -12.063 1.0 44.44 ? 9 A 1 +ATOM 118 C CD1 . PHE A1 1 9 ? -20.265 12.703 -12.353 1.0 24.21 ? 9 A 1 +ATOM 119 C CD2 . PHE A1 1 9 ? -18.618 13.315 -10.741 1.0 24.11 ? 9 A 1 +ATOM 120 C CE1 . PHE A1 1 9 ? -21.078 12.222 -11.344 1.0 54.33 ? 9 A 1 +ATOM 121 C CE2 . PHE A1 1 9 ? -19.427 12.836 -9.728 1.0 62.43 ? 9 A 1 +ATOM 122 C CZ . PHE A1 1 9 ? -20.659 12.29 -10.03 1.0 72.21 ? 9 A 1 +ATOM 123 H H . PHE A1 1 9 ? -15.667 13.132 -14.057 1.0 15.35 ? 9 A 1 +ATOM 124 H HA . PHE A1 1 9 ? -18.29 11.8 -13.975 1.0 72.15 ? 9 A 1 +ATOM 125 H HB2 . PHE A1 1 9 ? -17.256 14.185 -12.707 1.0 13.22 ? 9 A 1 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.679 14.561 -13.674 1.0 20.44 ? 9 A 1 +ATOM 127 H HD1 . PHE A1 1 9 ? -20.594 12.65 -13.381 1.0 63.23 ? 9 A 1 +ATOM 128 H HD2 . PHE A1 1 9 ? -17.655 13.742 -10.503 1.0 43.5 ? 9 A 1 +ATOM 129 H HE1 . PHE A1 1 9 ? -22.041 11.796 -11.584 1.0 53.21 ? 9 A 1 +ATOM 130 H HE2 . PHE A1 1 9 ? -19.097 12.89 -8.701 1.0 61.25 ? 9 A 1 +ATOM 131 H HZ . PHE A1 1 9 ? -21.293 11.914 -9.241 1.0 11.33 ? 9 A 1 +ATOM 132 N N . VAL A1 1 10 ? -19.024 12.509 -16.224 1.0 35.51 ? 10 A 1 +ATOM 133 C CA . VAL A1 1 10 ? -19.434 12.859 -17.578 1.0 51.35 ? 10 A 1 +ATOM 134 C C . VAL A1 1 10 ? -20.874 13.36 -17.605 1.0 20.3 ? 10 A 1 +ATOM 135 O O . VAL A1 1 10 ? -21.771 12.734 -17.041 1.0 33.54 ? 10 A 1 +ATOM 136 C CB . VAL A1 1 10 ? -19.302 11.658 -18.534 1.0 1.24 ? 10 A 1 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.919 12.125 -19.929 1.0 43.55 ? 10 A 1 +ATOM 138 C CG2 . VAL A1 1 10 ? -18.285 10.662 -17.998 1.0 70.41 ? 10 A 1 +ATOM 139 H H . VAL A1 1 10 ? -19.467 11.762 -15.769 1.0 13.11 ? 10 A 1 +ATOM 140 H HA . VAL A1 1 10 ? -18.783 13.646 -17.931 1.0 52.2 ? 10 A 1 +ATOM 141 H HB . VAL A1 1 10 ? -20.261 11.165 -18.594 1.0 21.21 ? 10 A 1 +ATOM 142 H HG11 . VAL A1 1 10 ? -17.843 12.2 -20.001 1.0 75.22 ? 10 A 1 +ATOM 143 H HG12 . VAL A1 1 10 ? -19.281 11.416 -20.659 1.0 54.41 ? 10 A 1 +ATOM 144 H HG13 . VAL A1 1 10 ? -19.359 13.094 -20.118 1.0 61.31 ? 10 A 1 +ATOM 145 H HG21 . VAL A1 1 10 ? -18.694 10.157 -17.136 1.0 13.24 ? 10 A 1 +ATOM 146 H HG22 . VAL A1 1 10 ? -18.055 9.937 -18.764 1.0 62.44 ? 10 A 1 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.383 11.184 -17.715 1.0 2.35 ? 10 A 1 +ATOM 148 N N . LYS A1 1 11 ? -21.089 14.493 -18.265 1.0 23.3 ? 11 A 1 +ATOM 149 C CA . LYS A1 1 11 ? -22.42 15.078 -18.368 1.0 10.31 ? 11 A 1 +ATOM 150 C C . LYS A1 1 11 ? -22.966 14.943 -19.786 1.0 22.12 ? 11 A 1 +ATOM 151 O O . LYS A1 1 11 ? -22.436 15.536 -20.726 1.0 63.21 ? 11 A 1 +ATOM 152 C CB . LYS A1 1 11 ? -22.383 16.554 -17.963 1.0 34.41 ? 11 A 1 +ATOM 153 C CG . LYS A1 1 11 ? -23.659 17.308 -18.297 1.0 63.11 ? 11 A 1 +ATOM 154 C CD . LYS A1 1 11 ? -23.539 18.784 -17.958 1.0 3.15 ? 11 A 1 +ATOM 155 C CE . LYS A1 1 11 ? -23.013 19.586 -19.138 1.0 2.52 ? 11 A 1 +ATOM 156 N NZ . LYS A1 1 11 ? -23.113 21.053 -18.9 1.0 51.12 ? 11 A 1 +ATOM 157 H H . LYS A1 1 11 ? -20.333 14.946 -18.695 1.0 4.15 ? 11 A 1 +ATOM 158 H HA . LYS A1 1 11 ? -23.071 14.544 -17.692 1.0 44.21 ? 11 A 1 +ATOM 159 H HB2 . LYS A1 1 11 ? -22.22 16.618 -16.897 1.0 75.01 ? 11 A 1 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.561 17.034 -18.474 1.0 15.43 ? 11 A 1 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.859 17.208 -19.353 1.0 73.24 ? 11 A 1 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.476 16.883 -17.732 1.0 30.03 ? 11 A 1 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.513 19.163 -17.685 1.0 63.51 ? 11 A 1 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.86 18.899 -17.124 1.0 61.22 ? 11 A 1 +ATOM 165 H HE2 . LYS A1 1 11 ? -21.978 19.327 -19.3 1.0 70.24 ? 11 A 1 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.59 19.332 -20.015 1.0 3.13 ? 11 A 1 +ATOM 167 H HZ1 . LYS A1 1 11 ? -23.763 21.483 -19.589 1.0 1.34 ? 11 A 1 +ATOM 168 H HZ2 . LYS A1 1 11 ? -22.177 21.496 -18.999 1.0 61.44 ? 11 A 1 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.47 21.236 -17.941 1.0 12.11 ? 11 A 1 +ATOM 170 N N . THR A1 1 12 ? -24.03 14.16 -19.933 1.0 60.33 ? 12 A 1 +ATOM 171 C CA . THR A1 1 12 ? -24.648 13.947 -21.236 1.0 63.11 ? 12 A 1 +ATOM 172 C C . THR A1 1 12 ? -25.436 15.175 -21.678 1.0 63.2 ? 12 A 1 +ATOM 173 O O . THR A1 1 12 ? -25.789 16.026 -20.861 1.0 23.14 ? 12 A 1 +ATOM 174 C CB . THR A1 1 12 ? -25.587 12.726 -21.22 1.0 13.53 ? 12 A 1 +ATOM 175 O OG1 . THR A1 1 12 ? -26.7 12.976 -20.353 1.0 44.22 ? 12 A 1 +ATOM 176 C CG2 . THR A1 1 12 ? -24.848 11.48 -20.757 1.0 44.25 ? 12 A 1 +ATOM 177 H H . THR A1 1 12 ? -24.407 13.714 -19.146 1.0 50.31 ? 12 A 1 +ATOM 178 H HA . THR A1 1 12 ? -23.86 13.759 -21.952 1.0 15.31 ? 12 A 1 +ATOM 179 H HB . THR A1 1 12 ? -25.953 12.559 -22.223 1.0 3.11 ? 12 A 1 +ATOM 180 H HG1 . THR A1 1 12 ? -27.49 12.577 -20.724 1.0 54.01 ? 12 A 1 +ATOM 181 H HG21 . THR A1 1 12 ? -25.377 11.034 -19.929 1.0 54.24 ? 12 A 1 +ATOM 182 H HG22 . THR A1 1 12 ? -23.85 11.749 -20.443 1.0 51.32 ? 12 A 1 +ATOM 183 H HG23 . THR A1 1 12 ? -24.79 10.773 -21.571 1.0 74.05 ? 12 A 1 +ATOM 184 N N . LEU A1 1 13 ? -25.709 15.261 -22.975 1.0 74.21 ? 13 A 1 +ATOM 185 C CA . LEU A1 1 13 ? -26.457 16.386 -23.526 1.0 74.52 ? 13 A 1 +ATOM 186 C C . LEU A1 1 13 ? -27.837 16.49 -22.883 1.0 25.21 ? 13 A 1 +ATOM 187 O O . LEU A1 1 13 ? -28.479 17.539 -22.932 1.0 11.35 ? 13 A 1 +ATOM 188 C CB . LEU A1 1 13 ? -26.599 16.236 -25.042 1.0 31.51 ? 13 A 1 +ATOM 189 C CG . LEU A1 1 13 ? -27.097 17.47 -25.795 1.0 30.32 ? 13 A 1 +ATOM 190 C CD1 . LEU A1 1 13 ? -25.937 18.392 -26.134 1.0 44.31 ? 13 A 1 +ATOM 191 C CD2 . LEU A1 1 13 ? -27.842 17.06 -27.057 1.0 64.01 ? 13 A 1 +ATOM 192 H H . LEU A1 1 13 ? -25.402 14.552 -23.577 1.0 42.02 ? 13 A 1 +ATOM 193 H HA . LEU A1 1 13 ? -25.904 17.288 -23.312 1.0 34.1 ? 13 A 1 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.631 15.974 -25.44 1.0 62.11 ? 13 A 1 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.294 15.429 -25.23 1.0 43.21 ? 13 A 1 +ATOM 196 H HG . LEU A1 1 13 ? -27.784 18.016 -25.163 1.0 45.4 ? 13 A 1 +ATOM 197 H HD11 . LEU A1 1 13 ? -25.014 17.833 -26.112 1.0 62.23 ? 13 A 1 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.89 19.193 -25.411 1.0 23.44 ? 13 A 1 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.084 18.808 -27.121 1.0 25.55 ? 13 A 1 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.19 16.043 -26.955 1.0 62.14 ? 13 A 1 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.177 17.13 -27.905 1.0 41.34 ? 13 A 1 +ATOM 202 H HD23 . LEU A1 1 13 ? -28.686 17.717 -27.206 1.0 51.42 ? 13 A 1 +ATOM 203 N N . THR A1 1 14 ? -28.286 15.395 -22.278 1.0 31.41 ? 14 A 1 +ATOM 204 C CA . THR A1 1 14 ? -29.588 15.363 -21.624 1.0 30.33 ? 14 A 1 +ATOM 205 C C . THR A1 1 14 ? -29.474 15.746 -20.153 1.0 22.13 ? 14 A 1 +ATOM 206 O O . THR A1 1 14 ? -30.434 15.623 -19.393 1.0 5.31 ? 14 A 1 +ATOM 207 C CB . THR A1 1 14 ? -30.236 13.97 -21.731 1.0 34.54 ? 14 A 1 +ATOM 208 O OG1 . THR A1 1 14 ? -29.473 13.015 -20.985 1.0 3.22 ? 14 A 1 +ATOM 209 C CG2 . THR A1 1 14 ? -30.331 13.527 -23.183 1.0 34.11 ? 14 A 1 +ATOM 210 H H . THR A1 1 14 ? -27.728 14.589 -22.273 1.0 2.31 ? 14 A 1 +ATOM 211 H HA . THR A1 1 14 ? -30.23 16.075 -22.123 1.0 25.44 ? 14 A 1 +ATOM 212 H HB . THR A1 1 14 ? -31.234 14.021 -21.319 1.0 55.24 ? 14 A 1 +ATOM 213 H HG1 . THR A1 1 14 ? -30.068 12.435 -20.504 1.0 24.42 ? 14 A 1 +ATOM 214 H HG21 . THR A1 1 14 ? -30.887 14.261 -23.747 1.0 1.02 ? 14 A 1 +ATOM 215 H HG22 . THR A1 1 14 ? -30.837 12.574 -23.237 1.0 12.23 ? 14 A 1 +ATOM 216 H HG23 . THR A1 1 14 ? -29.338 13.431 -23.596 1.0 12.42 ? 14 A 1 +ATOM 217 N N . GLY A1 1 15 ? -28.293 16.212 -19.757 1.0 61.2 ? 15 A 1 +ATOM 218 C CA . GLY A1 1 15 ? -28.076 16.607 -18.378 1.0 25.44 ? 15 A 1 +ATOM 219 C C . GLY A1 1 15 ? -28.057 15.422 -17.432 1.0 2.34 ? 15 A 1 +ATOM 220 O O . GLY A1 1 15 ? -28.844 15.36 -16.487 1.0 24.03 ? 15 A 1 +ATOM 221 H H . GLY A1 1 15 ? -27.563 16.288 -20.407 1.0 73.22 ? 15 A 1 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.131 17.125 -18.308 1.0 10.15 ? 15 A 1 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.867 17.279 -18.079 1.0 23.53 ? 15 A 1 +ATOM 224 N N . LYS A1 1 16 ? -27.157 14.478 -17.686 1.0 11.21 ? 16 A 1 +ATOM 225 C CA . LYS A1 1 16 ? -27.038 13.289 -16.851 1.0 34.13 ? 16 A 1 +ATOM 226 C C . LYS A1 1 16 ? -25.614 13.132 -16.327 1.0 15.24 ? 16 A 1 +ATOM 227 O O . LYS A1 1 16 ? -24.664 13.025 -17.102 1.0 50.04 ? 16 A 1 +ATOM 228 C CB . LYS A1 1 16 ? -27.442 12.043 -17.642 1.0 31.42 ? 16 A 1 +ATOM 229 C CG . LYS A1 1 16 ? -28.098 10.969 -16.791 1.0 73.35 ? 16 A 1 +ATOM 230 C CD . LYS A1 1 16 ? -27.069 10.023 -16.195 1.0 50.3 ? 16 A 1 +ATOM 231 C CE . LYS A1 1 16 ? -26.406 9.172 -17.267 1.0 52.44 ? 16 A 1 +ATOM 232 N NZ . LYS A1 1 16 ? -26.843 7.75 -17.196 1.0 2.53 ? 16 A 1 +ATOM 233 H H . LYS A1 1 16 ? -26.557 14.584 -18.454 1.0 52.54 ? 16 A 1 +ATOM 234 H HA . LYS A1 1 16 ? -27.707 13.405 -16.012 1.0 34.34 ? 16 A 1 +ATOM 235 H HB2 . LYS A1 1 16 ? -28.136 12.332 -18.417 1.0 44.24 ? 16 A 1 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.559 11.62 -18.1 1.0 12.13 ? 16 A 1 +ATOM 237 H HG2 . LYS A1 1 16 ? -28.645 11.441 -15.989 1.0 3.41 ? 16 A 1 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.78 10.401 -17.408 1.0 74.14 ? 16 A 1 +ATOM 239 H HD2 . LYS A1 1 16 ? -26.31 10.603 -15.691 1.0 63.23 ? 16 A 1 +ATOM 240 H HD3 . LYS A1 1 16 ? -27.559 9.373 -15.484 1.0 14.51 ? 16 A 1 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.666 9.571 -18.236 1.0 44.12 ? 16 A 1 +ATOM 242 H HE3 . LYS A1 1 16 ? -25.335 9.219 -17.134 1.0 75.31 ? 16 A 1 +ATOM 243 H HZ1 . LYS A1 1 16 ? -27.802 7.691 -16.798 1.0 61.55 ? 16 A 1 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.194 7.208 -16.591 1.0 23.15 ? 16 A 1 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.846 7.329 -18.146 1.0 43.23 ? 16 A 1 +ATOM 246 N N . THR A1 1 17 ? -25.473 13.118 -15.005 1.0 33.03 ? 17 A 1 +ATOM 247 C CA . THR A1 1 17 ? -24.166 12.974 -14.377 1.0 61.21 ? 17 A 1 +ATOM 248 C C . THR A1 1 17 ? -23.827 11.506 -14.143 1.0 13.11 ? 17 A 1 +ATOM 249 O O . THR A1 1 17 ? -24.531 10.806 -13.415 1.0 32.24 ? 17 A 1 +ATOM 250 C CB . THR A1 1 17 ? -24.102 13.725 -13.034 1.0 22.54 ? 17 A 1 +ATOM 251 O OG1 . THR A1 1 17 ? -25.414 13.833 -12.47 1.0 24.32 ? 17 A 1 +ATOM 252 C CG2 . THR A1 1 17 ? -23.507 15.113 -13.217 1.0 72.42 ? 17 A 1 +ATOM 253 H H . THR A1 1 17 ? -26.269 13.208 -14.439 1.0 63.53 ? 17 A 1 +ATOM 254 H HA . THR A1 1 17 ? -23.428 13.402 -15.041 1.0 15.15 ? 17 A 1 +ATOM 255 H HB . THR A1 1 17 ? -23.472 13.166 -12.356 1.0 61.22 ? 17 A 1 +ATOM 256 H HG1 . THR A1 1 17 ? -25.36 14.271 -11.617 1.0 54.0 ? 17 A 1 +ATOM 257 H HG21 . THR A1 1 17 ? -24.301 15.844 -13.24 1.0 31.34 ? 17 A 1 +ATOM 258 H HG22 . THR A1 1 17 ? -22.958 15.149 -14.147 1.0 12.24 ? 17 A 1 +ATOM 259 H HG23 . THR A1 1 17 ? -22.84 15.33 -12.396 1.0 74.01 ? 17 A 1 +ATOM 260 N N . ILE A1 1 18 ? -22.746 11.047 -14.764 1.0 21.15 ? 18 A 1 +ATOM 261 C CA . ILE A1 1 18 ? -22.314 9.662 -14.62 1.0 42.23 ? 18 A 1 +ATOM 262 C C . ILE A1 1 18 ? -20.885 9.584 -14.094 1.0 2.02 ? 18 A 1 +ATOM 263 O O . ILE A1 1 18 ? -20.033 10.399 -14.452 1.0 34.24 ? 18 A 1 +ATOM 264 C CB . ILE A1 1 18 ? -22.398 8.905 -15.959 1.0 20.13 ? 18 A 1 +ATOM 265 C CG1 . ILE A1 1 18 ? -21.691 7.552 -15.85 1.0 0.43 ? 18 A 1 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.79 9.738 -17.078 1.0 34.34 ? 18 A 1 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.953 6.637 -17.025 1.0 41.12 ? 18 A 1 +ATOM 268 H H . ILE A1 1 18 ? -22.226 11.654 -15.33 1.0 72.35 ? 18 A 1 +ATOM 269 H HA . ILE A1 1 18 ? -22.973 9.179 -13.914 1.0 33.1 ? 18 A 1 +ATOM 270 H HB . ILE A1 1 18 ? -23.439 8.741 -16.189 1.0 55.23 ? 18 A 1 +ATOM 271 H HG12 . ILE A1 1 18 ? -20.626 7.714 -15.787 1.0 35.45 ? 18 A 1 +ATOM 272 H HG13 . ILE A1 1 18 ? -22.028 7.049 -14.955 1.0 15.51 ? 18 A 1 +ATOM 273 H HG21 . ILE A1 1 18 ? -21.662 9.122 -17.956 1.0 31.24 ? 18 A 1 +ATOM 274 H HG22 . ILE A1 1 18 ? -22.448 10.562 -17.31 1.0 60.32 ? 18 A 1 +ATOM 275 H HG23 . ILE A1 1 18 ? -20.831 10.12 -16.762 1.0 71.44 ? 18 A 1 +ATOM 276 H HD11 . ILE A1 1 18 ? -22.28 7.224 -17.872 1.0 32.31 ? 18 A 1 +ATOM 277 H HD12 . ILE A1 1 18 ? -21.045 6.112 -17.282 1.0 60.24 ? 18 A 1 +ATOM 278 H HD13 . ILE A1 1 18 ? -22.721 5.925 -16.764 1.0 25.35 ? 18 A 1 +ATOM 279 N N . THR A1 1 19 ? -20.627 8.596 -13.242 1.0 42.32 ? 19 A 1 +ATOM 280 C CA . THR A1 1 19 ? -19.301 8.41 -12.666 1.0 41.24 ? 19 A 1 +ATOM 281 C C . THR A1 1 19 ? -18.67 7.109 -13.148 1.0 70.21 ? 19 A 1 +ATOM 282 O O . THR A1 1 19 ? -19.325 6.066 -13.182 1.0 44.42 ? 19 A 1 +ATOM 283 C CB . THR A1 1 19 ? -19.353 8.403 -11.127 1.0 2.4 ? 19 A 1 +ATOM 284 O OG1 . THR A1 1 19 ? -20.631 8.868 -10.678 1.0 22.32 ? 19 A 1 +ATOM 285 C CG2 . THR A1 1 19 ? -18.255 9.281 -10.545 1.0 13.14 ? 19 A 1 +ATOM 286 H H . THR A1 1 19 ? -21.347 7.979 -12.996 1.0 1.15 ? 19 A 1 +ATOM 287 H HA . THR A1 1 19 ? -18.682 9.238 -12.981 1.0 65.43 ? 19 A 1 +ATOM 288 H HB . THR A1 1 19 ? -19.205 7.39 -10.781 1.0 44.24 ? 19 A 1 +ATOM 289 H HG1 . THR A1 1 19 ? -20.846 8.452 -9.839 1.0 60.25 ? 19 A 1 +ATOM 290 H HG21 . THR A1 1 19 ? -18.525 10.32 -10.662 1.0 73.33 ? 19 A 1 +ATOM 291 H HG22 . THR A1 1 19 ? -17.328 9.09 -11.064 1.0 23.45 ? 19 A 1 +ATOM 292 H HG23 . THR A1 1 19 ? -18.134 9.057 -9.495 1.0 51.03 ? 19 A 1 +ATOM 293 N N . ILE A1 1 20 ? -17.396 7.176 -13.519 1.0 2.13 ? 20 A 1 +ATOM 294 C CA . ILE A1 1 20 ? -16.677 6.002 -13.997 1.0 23.24 ? 20 A 1 +ATOM 295 C C . ILE A1 1 20 ? -15.231 6.008 -13.512 1.0 21.51 ? 20 A 1 +ATOM 296 O O . ILE A1 1 20 ? -14.54 7.022 -13.601 1.0 3.54 ? 20 A 1 +ATOM 297 C CB . ILE A1 1 20 ? -16.69 5.92 -15.534 1.0 55.55 ? 20 A 1 +ATOM 298 C CG1 . ILE A1 1 20 ? -16.581 7.32 -16.142 1.0 1.5 ? 20 A 1 +ATOM 299 C CG2 . ILE A1 1 20 ? -17.955 5.225 -16.017 1.0 1.32 ? 20 A 1 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.747 7.368 -17.403 1.0 2.4 ? 20 A 1 +ATOM 301 H H . ILE A1 1 20 ? -16.928 8.036 -13.469 1.0 32.52 ? 20 A 1 +ATOM 302 H HA . ILE A1 1 20 ? -17.173 5.125 -13.605 1.0 40.32 ? 20 A 1 +ATOM 303 H HB . ILE A1 1 20 ? -15.842 5.332 -15.849 1.0 75.22 ? 20 A 1 +ATOM 304 H HG12 . ILE A1 1 20 ? -17.569 7.679 -16.385 1.0 4.24 ? 20 A 1 +ATOM 305 H HG13 . ILE A1 1 20 ? -16.129 7.984 -15.419 1.0 20.02 ? 20 A 1 +ATOM 306 H HG21 . ILE A1 1 20 ? -18.761 5.942 -16.072 1.0 41.11 ? 20 A 1 +ATOM 307 H HG22 . ILE A1 1 20 ? -17.782 4.803 -16.995 1.0 51.34 ? 20 A 1 +ATOM 308 H HG23 . ILE A1 1 20 ? -18.219 4.439 -15.326 1.0 74.34 ? 20 A 1 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.707 6.383 -17.845 1.0 44.23 ? 20 A 1 +ATOM 310 H HD12 . ILE A1 1 20 ? -16.193 8.058 -18.104 1.0 43.31 ? 20 A 1 +ATOM 311 H HD13 . ILE A1 1 20 ? -14.747 7.695 -17.162 1.0 23.14 ? 20 A 1 +ATOM 312 N N . ASP A1 1 21 ? -14.78 4.867 -13.001 1.0 44.41 ? 21 A 1 +ATOM 313 C CA . ASP A1 1 21 ? -13.414 4.739 -12.505 1.0 13.43 ? 21 A 1 +ATOM 314 C C . ASP A1 1 21 ? -12.438 4.504 -13.653 1.0 74.52 ? 21 A 1 +ATOM 315 O O . ASP A1 1 21 ? -12.66 3.64 -14.503 1.0 3.25 ? 21 A 1 +ATOM 316 C CB . ASP A1 1 21 ? -13.321 3.593 -11.496 1.0 40.32 ? 21 A 1 +ATOM 317 C CG . ASP A1 1 21 ? -13.941 2.312 -12.017 1.0 70.32 ? 21 A 1 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.229 1.541 -12.695 1.0 34.41 ? 21 A 1 +ATOM 319 O OD2 . ASP A1 1 21 ? -15.138 2.079 -11.747 1.0 4.34 ? 21 A 1 +ATOM 320 H H . ASP A1 1 21 ? -15.379 4.093 -12.957 1.0 61.24 ? 21 A 1 +ATOM 321 H HA . ASP A1 1 21 ? -13.153 5.663 -12.011 1.0 0.1 ? 21 A 1 +ATOM 322 H HB2 . ASP A1 1 21 ? -12.281 3.403 -11.272 1.0 73.15 ? 21 A 1 +ATOM 323 H HB3 . ASP A1 1 21 ? -13.834 3.878 -10.589 1.0 61.23 ? 21 A 1 +ATOM 324 N N . VAL A1 1 22 ? -11.358 5.278 -13.674 1.0 30.34 ? 22 A 1 +ATOM 325 C CA . VAL A1 1 22 ? -10.348 5.153 -14.718 1.0 1.34 ? 22 A 1 +ATOM 326 C C . VAL A1 1 22 ? -8.946 5.35 -14.152 1.0 61.2 ? 22 A 1 +ATOM 327 O O . VAL A1 1 22 ? -8.779 5.83 -13.031 1.0 34.03 ? 22 A 1 +ATOM 328 C CB . VAL A1 1 22 ? -10.581 6.173 -15.848 1.0 60.13 ? 22 A 1 +ATOM 329 C CG1 . VAL A1 1 22 ? -12.045 6.58 -15.907 1.0 14.0 ? 22 A 1 +ATOM 330 C CG2 . VAL A1 1 22 ? -9.688 7.39 -15.66 1.0 61.12 ? 22 A 1 +ATOM 331 H H . VAL A1 1 22 ? -11.237 5.948 -12.969 1.0 71.0 ? 22 A 1 +ATOM 332 H HA . VAL A1 1 22 ? -10.421 4.16 -15.136 1.0 41.13 ? 22 A 1 +ATOM 333 H HB . VAL A1 1 22 ? -10.323 5.705 -16.787 1.0 23.42 ? 22 A 1 +ATOM 334 H HG11 . VAL A1 1 22 ? -12.666 5.696 -15.88 1.0 3.13 ? 22 A 1 +ATOM 335 H HG12 . VAL A1 1 22 ? -12.278 7.211 -15.062 1.0 11.12 ? 22 A 1 +ATOM 336 H HG13 . VAL A1 1 22 ? -12.232 7.121 -16.823 1.0 2.3 ? 22 A 1 +ATOM 337 H HG21 . VAL A1 1 22 ? -8.666 7.125 -15.886 1.0 43.3 ? 22 A 1 +ATOM 338 H HG22 . VAL A1 1 22 ? -10.011 8.179 -16.323 1.0 71.52 ? 22 A 1 +ATOM 339 H HG23 . VAL A1 1 22 ? -9.754 7.731 -14.637 1.0 24.41 ? 22 A 1 +ATOM 340 N N . ASP A1 1 23 ? -7.94 4.976 -14.935 1.0 73.14 ? 23 A 1 +ATOM 341 C CA . ASP A1 1 23 ? -6.551 5.112 -14.514 1.0 0.33 ? 23 A 1 +ATOM 342 C C . ASP A1 1 23 ? -5.788 6.044 -15.45 1.0 62.12 ? 23 A 1 +ATOM 343 O O . ASP A1 1 23 ? -6.102 6.143 -16.637 1.0 35.34 ? 23 A 1 +ATOM 344 C CB . ASP A1 1 23 ? -5.872 3.743 -14.472 1.0 24.44 ? 23 A 1 +ATOM 345 C CG . ASP A1 1 23 ? -6.694 2.711 -13.725 1.0 11.25 ? 23 A 1 +ATOM 346 O OD1 . ASP A1 1 23 ? -6.853 2.857 -12.494 1.0 71.52 ? 23 A 1 +ATOM 347 O OD2 . ASP A1 1 23 ? -7.179 1.759 -14.37 1.0 54.12 ? 23 A 1 +ATOM 348 H H . ASP A1 1 23 ? -8.137 4.6 -15.819 1.0 71.31 ? 23 A 1 +ATOM 349 H HA . ASP A1 1 23 ? -6.546 5.537 -13.521 1.0 62.03 ? 23 A 1 +ATOM 350 H HB2 . ASP A1 1 23 ? -5.72 3.392 -15.482 1.0 75.32 ? 23 A 1 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.914 3.838 -13.981 1.0 32.1 ? 23 A 1 +ATOM 352 N N . HIS A1 1 24 ? -4.784 6.726 -14.909 1.0 3.42 ? 24 A 1 +ATOM 353 C CA . HIS A1 1 24 ? -3.976 7.651 -15.696 1.0 64.1 ? 24 A 1 +ATOM 354 C C . HIS A1 1 24 ? -3.315 6.932 -16.869 1.0 13.22 ? 24 A 1 +ATOM 355 O O . HIS A1 1 24 ? -2.85 7.566 -17.815 1.0 40.32 ? 24 A 1 +ATOM 356 C CB . HIS A1 1 24 ? -2.909 8.304 -14.817 1.0 43.52 ? 24 A 1 +ATOM 357 C CG . HIS A1 1 24 ? -1.83 7.361 -14.383 1.0 63.23 ? 24 A 1 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.599 7.289 -15.002 1.0 33.23 ? 24 A 1 +ATOM 359 C CD2 . HIS A1 1 24 ? -1.801 6.448 -13.384 1.0 70.35 ? 24 A 1 +ATOM 360 C CE1 . HIS A1 1 24 ? 0.139 6.371 -14.403 1.0 52.22 ? 24 A 1 +ATOM 361 N NE2 . HIS A1 1 24 ? -0.567 5.846 -13.418 1.0 51.1 ? 24 A 1 +ATOM 362 H H . HIS A1 1 24 ? -4.581 6.605 -13.958 1.0 35.01 ? 24 A 1 +ATOM 363 H HA . HIS A1 1 24 ? -4.63 8.417 -16.082 1.0 52.33 ? 24 A 1 +ATOM 364 H HB2 . HIS A1 1 24 ? -2.443 9.11 -15.366 1.0 74.33 ? 24 A 1 +ATOM 365 H HB3 . HIS A1 1 24 ? -3.378 8.704 -13.93 1.0 2.24 ? 24 A 1 +ATOM 366 H HD1 . HIS A1 1 24 ? -0.311 7.829 -15.766 1.0 61.24 ? 24 A 1 +ATOM 367 H HD2 . HIS A1 1 24 ? -2.6 6.231 -12.69 1.0 14.35 ? 24 A 1 +ATOM 368 H HE1 . HIS A1 1 24 ? 1.148 6.097 -14.672 1.0 73.24 ? 24 A 1 +ATOM 369 N N . ALA A1 1 25 ? -3.278 5.606 -16.798 1.0 63.43 ? 25 A 1 +ATOM 370 C CA . ALA A1 1 25 ? -2.676 4.801 -17.854 1.0 43.32 ? 25 A 1 +ATOM 371 C C . ALA A1 1 25 ? -3.689 4.485 -18.949 1.0 33.54 ? 25 A 1 +ATOM 372 O O . ALA A1 1 25 ? -3.408 3.709 -19.863 1.0 12.23 ? 25 A 1 +ATOM 373 C CB . ALA A1 1 25 ? -2.101 3.516 -17.276 1.0 51.34 ? 25 A 1 +ATOM 374 H H . ALA A1 1 25 ? -3.665 5.157 -16.018 1.0 55.41 ? 25 A 1 +ATOM 375 H HA . ALA A1 1 25 ? -1.863 5.369 -18.284 1.0 23.12 ? 25 A 1 +ATOM 376 H HB1 . ALA A1 1 25 ? -1.774 2.875 -18.082 1.0 42.21 ? 25 A 1 +ATOM 377 H HB2 . ALA A1 1 25 ? -1.262 3.752 -16.64 1.0 3.14 ? 25 A 1 +ATOM 378 H HB3 . ALA A1 1 25 ? -2.861 3.01 -16.699 1.0 44.44 ? 25 A 1 +ATOM 379 N N . ASP A1 1 26 ? -4.868 5.088 -18.849 1.0 53.31 ? 26 A 1 +ATOM 380 C CA . ASP A1 1 26 ? -5.924 4.871 -19.831 1.0 71.32 ? 26 A 1 +ATOM 381 C C . ASP A1 1 26 ? -5.969 6.012 -20.843 1.0 31.24 ? 26 A 1 +ATOM 382 O O . ASP A1 1 26 ? -5.057 6.837 -20.905 1.0 53.43 ? 26 A 1 +ATOM 383 C CB . ASP A1 1 26 ? -7.279 4.737 -19.134 1.0 21.1 ? 26 A 1 +ATOM 384 C CG . ASP A1 1 26 ? -7.276 3.662 -18.065 1.0 73.54 ? 26 A 1 +ATOM 385 O OD1 . ASP A1 1 26 ? -6.29 2.899 -17.994 1.0 73.22 ? 26 A 1 +ATOM 386 O OD2 . ASP A1 1 26 ? -8.261 3.582 -17.301 1.0 2.02 ? 26 A 1 +ATOM 387 H H . ASP A1 1 26 ? -5.032 5.696 -18.097 1.0 73.33 ? 26 A 1 +ATOM 388 H HA . ASP A1 1 26 ? -5.706 3.952 -20.354 1.0 35.3 ? 26 A 1 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.532 5.679 -18.669 1.0 71.15 ? 26 A 1 +ATOM 390 H HB3 . ASP A1 1 26 ? -8.031 4.488 -19.868 1.0 51.4 ? 26 A 1 +ATOM 391 N N . THR A1 1 27 ? -7.036 6.052 -21.635 1.0 11.22 ? 27 A 1 +ATOM 392 C CA . THR A1 1 27 ? -7.199 7.09 -22.645 1.0 12.11 ? 27 A 1 +ATOM 393 C C . THR A1 1 27 ? -8.67 7.443 -22.839 1.0 24.55 ? 27 A 1 +ATOM 394 O O . THR A1 1 27 ? -9.556 6.73 -22.368 1.0 14.34 ? 27 A 1 +ATOM 395 C CB . THR A1 1 27 ? -6.605 6.656 -23.998 1.0 24.42 ? 27 A 1 +ATOM 396 O OG1 . THR A1 1 27 ? -6.649 5.229 -24.117 1.0 51.41 ? 27 A 1 +ATOM 397 C CG2 . THR A1 1 27 ? -5.168 7.137 -24.137 1.0 72.22 ? 27 A 1 +ATOM 398 H H . THR A1 1 27 ? -7.729 5.366 -21.537 1.0 1.33 ? 27 A 1 +ATOM 399 H HA . THR A1 1 27 ? -6.669 7.969 -22.308 1.0 54.42 ? 27 A 1 +ATOM 400 H HB . THR A1 1 27 ? -7.194 7.094 -24.79 1.0 51.23 ? 27 A 1 +ATOM 401 H HG1 . THR A1 1 27 ? -7.493 4.966 -24.493 1.0 23.44 ? 27 A 1 +ATOM 402 H HG21 . THR A1 1 27 ? -4.762 6.789 -25.075 1.0 20.21 ? 27 A 1 +ATOM 403 H HG22 . THR A1 1 27 ? -4.577 6.746 -23.322 1.0 40.31 ? 27 A 1 +ATOM 404 H HG23 . THR A1 1 27 ? -5.146 8.216 -24.113 1.0 53.14 ? 27 A 1 +ATOM 405 N N . VAL A1 1 28 ? -8.922 8.546 -23.535 1.0 70.04 ? 28 A 1 +ATOM 406 C CA . VAL A1 1 28 ? -10.286 8.992 -23.793 1.0 40.12 ? 28 A 1 +ATOM 407 C C . VAL A1 1 28 ? -11.089 7.916 -24.516 1.0 43.3 ? 28 A 1 +ATOM 408 O O . VAL A1 1 28 ? -12.207 7.59 -24.12 1.0 51.44 ? 28 A 1 +ATOM 409 C CB . VAL A1 1 28 ? -10.305 10.283 -24.633 1.0 70.14 ? 28 A 1 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.697 10.895 -24.64 1.0 13.41 ? 28 A 1 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.279 11.276 -24.107 1.0 73.55 ? 28 A 1 +ATOM 412 H H . VAL A1 1 28 ? -8.173 9.072 -23.885 1.0 50.23 ? 28 A 1 +ATOM 413 H HA . VAL A1 1 28 ? -10.755 9.2 -22.842 1.0 62.42 ? 28 A 1 +ATOM 414 H HB . VAL A1 1 28 ? -10.042 10.03 -25.65 1.0 52.41 ? 28 A 1 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.764 11.628 -25.431 1.0 72.32 ? 28 A 1 +ATOM 416 H HG12 . VAL A1 1 28 ? -12.431 10.12 -24.802 1.0 75.12 ? 28 A 1 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.884 11.375 -23.69 1.0 43.12 ? 28 A 1 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.563 11.499 -24.884 1.0 22.23 ? 28 A 1 +ATOM 419 H HG22 . VAL A1 1 28 ? -9.78 12.184 -23.807 1.0 21.24 ? 28 A 1 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.767 10.848 -23.257 1.0 51.43 ? 28 A 1 +ATOM 421 N N . GLY A1 1 29 ? -10.509 7.367 -25.579 1.0 51.02 ? 29 A 1 +ATOM 422 C CA . GLY A1 1 29 ? -11.185 6.333 -26.341 1.0 24.21 ? 29 A 1 +ATOM 423 C C . GLY A1 1 29 ? -11.727 5.225 -25.46 1.0 62.32 ? 29 A 1 +ATOM 424 O O . GLY A1 1 29 ? -12.894 4.85 -25.57 1.0 1.41 ? 29 A 1 +ATOM 425 H H . GLY A1 1 29 ? -9.616 7.667 -25.849 1.0 25.44 ? 29 A 1 +ATOM 426 H HA2 . GLY A1 1 29 ? -12.003 6.779 -26.886 1.0 33.14 ? 29 A 1 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.486 5.907 -27.046 1.0 61.11 ? 29 A 1 +ATOM 428 N N . ALA A1 1 30 ? -10.877 4.697 -24.585 1.0 0.3 ? 30 A 1 +ATOM 429 C CA . ALA A1 1 30 ? -11.278 3.626 -23.682 1.0 24.42 ? 30 A 1 +ATOM 430 C C . ALA A1 1 30 ? -12.417 4.072 -22.772 1.0 23.15 ? 30 A 1 +ATOM 431 O O . ALA A1 1 30 ? -13.353 3.315 -22.515 1.0 23.32 ? 30 A 1 +ATOM 432 C CB . ALA A1 1 30 ? -10.089 3.161 -22.854 1.0 4.23 ? 30 A 1 +ATOM 433 H H . ALA A1 1 30 ? -9.959 5.038 -24.545 1.0 13.0 ? 30 A 1 +ATOM 434 H HA . ALA A1 1 30 ? -11.615 2.792 -24.281 1.0 42.35 ? 30 A 1 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.853 2.138 -23.107 1.0 24.3 ? 30 A 1 +ATOM 436 H HB2 . ALA A1 1 30 ? -9.236 3.79 -23.064 1.0 15.25 ? 30 A 1 +ATOM 437 H HB3 . ALA A1 1 30 ? -10.334 3.225 -21.804 1.0 54.13 ? 30 A 1 +ATOM 438 N N . VAL A1 1 31 ? -12.331 5.306 -22.285 1.0 44.02 ? 31 A 1 +ATOM 439 C CA . VAL A1 1 31 ? -13.355 5.853 -21.403 1.0 44.43 ? 31 A 1 +ATOM 440 C C . VAL A1 1 31 ? -14.7 5.947 -22.115 1.0 22.33 ? 31 A 1 +ATOM 441 O O . VAL A1 1 31 ? -15.739 5.605 -21.549 1.0 41.34 ? 31 A 1 +ATOM 442 C CB . VAL A1 1 31 ? -12.962 7.25 -20.886 1.0 42.01 ? 31 A 1 +ATOM 443 C CG1 . VAL A1 1 31 ? -14.098 7.86 -20.079 1.0 61.22 ? 31 A 1 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.689 7.172 -20.056 1.0 34.2 ? 31 A 1 +ATOM 445 H H . VAL A1 1 31 ? -11.56 5.862 -22.526 1.0 33.11 ? 31 A 1 +ATOM 446 H HA . VAL A1 1 31 ? -13.452 5.192 -20.554 1.0 53.53 ? 31 A 1 +ATOM 447 H HB . VAL A1 1 31 ? -12.772 7.887 -21.738 1.0 34.14 ? 31 A 1 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.603 8.606 -20.676 1.0 24.43 ? 31 A 1 +ATOM 449 H HG12 . VAL A1 1 31 ? -14.798 7.086 -19.8 1.0 62.24 ? 31 A 1 +ATOM 450 H HG13 . VAL A1 1 31 ? -13.699 8.322 -19.189 1.0 4.44 ? 31 A 1 +ATOM 451 H HG21 . VAL A1 1 31 ? -11.793 7.792 -19.178 1.0 32.4 ? 31 A 1 +ATOM 452 H HG22 . VAL A1 1 31 ? -11.518 6.149 -19.757 1.0 31.51 ? 31 A 1 +ATOM 453 H HG23 . VAL A1 1 31 ? -10.853 7.519 -20.645 1.0 2.41 ? 31 A 1 +ATOM 454 N N . LYS A1 1 32 ? -14.674 6.411 -23.359 1.0 44.33 ? 32 A 1 +ATOM 455 C CA . LYS A1 1 32 ? -15.89 6.549 -24.151 1.0 33.41 ? 32 A 1 +ATOM 456 C C . LYS A1 1 32 ? -16.633 5.22 -24.242 1.0 33.52 ? 32 A 1 +ATOM 457 O O . LYS A1 1 32 ? -17.858 5.174 -24.136 1.0 55.22 ? 32 A 1 +ATOM 458 C CB . LYS A1 1 32 ? -15.555 7.055 -25.556 1.0 21.43 ? 32 A 1 +ATOM 459 C CG . LYS A1 1 32 ? -16.128 8.428 -25.86 1.0 62.04 ? 32 A 1 +ATOM 460 C CD . LYS A1 1 32 ? -15.045 9.494 -25.869 1.0 13.3 ? 32 A 1 +ATOM 461 C CE . LYS A1 1 32 ? -14.666 9.892 -27.287 1.0 61.02 ? 32 A 1 +ATOM 462 N NZ . LYS A1 1 32 ? -15.772 10.613 -27.976 1.0 10.13 ? 32 A 1 +ATOM 463 H H . LYS A1 1 32 ? -13.814 6.667 -23.756 1.0 0.43 ? 32 A 1 +ATOM 464 H HA . LYS A1 1 32 ? -16.526 7.27 -23.66 1.0 20.21 ? 32 A 1 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.481 7.104 -25.661 1.0 31.13 ? 32 A 1 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.947 6.355 -26.28 1.0 51.43 ? 32 A 1 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.601 8.404 -26.831 1.0 34.55 ? 32 A 1 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.86 8.678 -25.106 1.0 75.31 ? 32 A 1 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.408 10.368 -25.347 1.0 62.53 ? 32 A 1 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.169 9.11 -25.366 1.0 34.24 ? 32 A 1 +ATOM 471 H HE2 . LYS A1 1 32 ? -13.799 10.534 -27.248 1.0 32.35 ? 32 A 1 +ATOM 472 H HE3 . LYS A1 1 32 ? -14.427 8.999 -27.846 1.0 31.14 ? 32 A 1 +ATOM 473 H HZ1 . LYS A1 1 32 ? -15.412 11.483 -28.417 1.0 3.34 ? 32 A 1 +ATOM 474 H HZ2 . LYS A1 1 32 ? -16.514 10.865 -27.292 1.0 11.13 ? 32 A 1 +ATOM 475 H HZ3 . LYS A1 1 32 ? -16.187 10.009 -28.714 1.0 13.55 ? 32 A 1 +ATOM 476 N N . ALA A1 1 33 ? -15.883 4.14 -24.437 1.0 34.21 ? 33 A 1 +ATOM 477 C CA . ALA A1 1 33 ? -16.471 2.81 -24.538 1.0 60.31 ? 33 A 1 +ATOM 478 C C . ALA A1 1 33 ? -17.144 2.406 -23.231 1.0 31.03 ? 33 A 1 +ATOM 479 O O . ALA A1 1 33 ? -18.225 1.817 -23.233 1.0 31.32 ? 33 A 1 +ATOM 480 C CB . ALA A1 1 33 ? -15.408 1.791 -24.923 1.0 54.24 ? 33 A 1 +ATOM 481 H H . ALA A1 1 33 ? -14.912 4.24 -24.513 1.0 43.1 ? 33 A 1 +ATOM 482 H HA . ALA A1 1 33 ? -17.214 2.832 -25.322 1.0 53.01 ? 33 A 1 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.571 1.872 -24.246 1.0 2.33 ? 33 A 1 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.825 0.797 -24.864 1.0 61.23 ? 33 A 1 +ATOM 485 H HB3 . ALA A1 1 33 ? -15.075 1.983 -25.932 1.0 53.23 ? 33 A 1 +ATOM 486 N N . LYS A1 1 34 ? -16.498 2.726 -22.115 1.0 30.14 ? 34 A 1 +ATOM 487 C CA . LYS A1 1 34 ? -17.034 2.397 -20.799 1.0 3.41 ? 34 A 1 +ATOM 488 C C . LYS A1 1 34 ? -18.391 3.059 -20.583 1.0 51.04 ? 34 A 1 +ATOM 489 O O . LYS A1 1 34 ? -19.331 2.426 -20.102 1.0 30.3 ? 34 A 1 +ATOM 490 C CB . LYS A1 1 34 ? -16.06 2.839 -19.704 1.0 63.02 ? 34 A 1 +ATOM 491 C CG . LYS A1 1 34 ? -16.516 2.476 -18.302 1.0 24.43 ? 34 A 1 +ATOM 492 C CD . LYS A1 1 34 ? -16.539 0.97 -18.095 1.0 44.42 ? 34 A 1 +ATOM 493 C CE . LYS A1 1 34 ? -15.138 0.379 -18.15 1.0 34.12 ? 34 A 1 +ATOM 494 N NZ . LYS A1 1 34 ? -14.96 -0.517 -19.326 1.0 13.0 ? 34 A 1 +ATOM 495 H H . LYS A1 1 34 ? -15.64 3.196 -22.177 1.0 65.25 ? 34 A 1 +ATOM 496 H HA . LYS A1 1 34 ? -17.157 1.326 -20.749 1.0 3.22 ? 34 A 1 +ATOM 497 H HB2 . LYS A1 1 34 ? -15.102 2.372 -19.881 1.0 71.03 ? 34 A 1 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.942 3.912 -19.755 1.0 71.12 ? 34 A 1 +ATOM 499 H HG2 . LYS A1 1 34 ? -15.837 2.916 -17.587 1.0 24.23 ? 34 A 1 +ATOM 500 H HG3 . LYS A1 1 34 ? -17.511 2.867 -18.144 1.0 22.21 ? 34 A 1 +ATOM 501 H HD2 . LYS A1 1 34 ? -16.971 0.755 -17.129 1.0 63.43 ? 34 A 1 +ATOM 502 H HD3 . LYS A1 1 34 ? -17.141 0.519 -18.87 1.0 75.33 ? 34 A 1 +ATOM 503 H HE2 . LYS A1 1 34 ? -14.423 1.185 -18.211 1.0 34.14 ? 34 A 1 +ATOM 504 H HE3 . LYS A1 1 34 ? -14.966 -0.188 -17.247 1.0 0.12 ? 34 A 1 +ATOM 505 H HZ1 . LYS A1 1 34 ? -14.378 -0.047 -20.048 1.0 62.42 ? 34 A 1 +ATOM 506 H HZ2 . LYS A1 1 34 ? -15.885 -0.751 -19.74 1.0 14.2 ? 34 A 1 +ATOM 507 H HZ3 . LYS A1 1 34 ? -14.491 -1.398 -19.036 1.0 65.2 ? 34 A 1 +ATOM 508 N N . ILE A1 1 35 ? -18.486 4.334 -20.944 1.0 14.42 ? 35 A 1 +ATOM 509 C CA . ILE A1 1 35 ? -19.73 5.08 -20.792 1.0 22.32 ? 35 A 1 +ATOM 510 C C . ILE A1 1 35 ? -20.818 4.525 -21.704 1.0 74.31 ? 35 A 1 +ATOM 511 O O . ILE A1 1 35 ? -21.992 4.486 -21.335 1.0 33.23 ? 35 A 1 +ATOM 512 C CB . ILE A1 1 35 ? -19.531 6.575 -21.1 1.0 42.5 ? 35 A 1 +ATOM 513 C CG1 . ILE A1 1 35 ? -18.403 7.15 -20.241 1.0 22.04 ? 35 A 1 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.825 7.341 -20.866 1.0 45.14 ? 35 A 1 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.603 6.933 -18.757 1.0 11.1 ? 35 A 1 +ATOM 516 H H . ILE A1 1 35 ? -17.702 4.784 -21.321 1.0 54.44 ? 35 A 1 +ATOM 517 H HA . ILE A1 1 35 ? -20.052 4.984 -19.765 1.0 30.01 ? 35 A 1 +ATOM 518 H HB . ILE A1 1 35 ? -19.266 6.673 -22.142 1.0 2.44 ? 35 A 1 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.472 6.683 -20.521 1.0 3.24 ? 35 A 1 +ATOM 520 H HG13 . ILE A1 1 35 ? -18.334 8.214 -20.415 1.0 0.11 ? 35 A 1 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.709 8.358 -21.212 1.0 65.32 ? 35 A 1 +ATOM 522 H HG22 . ILE A1 1 35 ? -21.627 6.866 -21.411 1.0 43.1 ? 35 A 1 +ATOM 523 H HG23 . ILE A1 1 35 ? -21.056 7.344 -19.812 1.0 75.41 ? 35 A 1 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.863 6.235 -18.392 1.0 43.52 ? 35 A 1 +ATOM 525 H HD12 . ILE A1 1 35 ? -18.496 7.874 -18.237 1.0 71.15 ? 35 A 1 +ATOM 526 H HD13 . ILE A1 1 35 ? -19.59 6.534 -18.581 1.0 74.3 ? 35 A 1 +ATOM 527 N N . TYR A1 1 36 ? -20.421 4.095 -22.896 1.0 62.53 ? 36 A 1 +ATOM 528 C CA . TYR A1 1 36 ? -21.363 3.542 -23.862 1.0 64.44 ? 36 A 1 +ATOM 529 C C . TYR A1 1 36 ? -22.125 2.362 -23.266 1.0 53.42 ? 36 A 1 +ATOM 530 O O . TYR A1 1 36 ? -23.344 2.263 -23.406 1.0 34.33 ? 36 A 1 +ATOM 531 C CB . TYR A1 1 36 ? -20.626 3.1 -25.128 1.0 74.42 ? 36 A 1 +ATOM 532 C CG . TYR A1 1 36 ? -21.029 1.725 -25.614 1.0 43.51 ? 36 A 1 +ATOM 533 C CD1 . TYR A1 1 36 ? -22.27 1.51 -26.2 1.0 62.31 ? 36 A 1 +ATOM 534 C CD2 . TYR A1 1 36 ? -20.167 0.643 -25.488 1.0 22.21 ? 36 A 1 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.642 0.256 -26.645 1.0 25.24 ? 36 A 1 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.53 -0.614 -25.931 1.0 24.41 ? 36 A 1 +ATOM 537 C CZ . TYR A1 1 36 ? -21.768 -0.803 -26.508 1.0 51.0 ? 36 A 1 +ATOM 538 O OH . TYR A1 1 36 ? -22.134 -2.053 -26.951 1.0 31.41 ? 36 A 1 +ATOM 539 H H . TYR A1 1 36 ? -19.472 4.151 -23.133 1.0 42.53 ? 36 A 1 +ATOM 540 H HA . TYR A1 1 36 ? -22.068 4.318 -24.12 1.0 45.34 ? 36 A 1 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.831 3.804 -25.92 1.0 32.41 ? 36 A 1 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.564 3.085 -24.932 1.0 73.31 ? 36 A 1 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.951 2.341 -26.306 1.0 14.41 ? 36 A 1 +ATOM 544 H HD2 . TYR A1 1 36 ? -19.197 0.794 -25.035 1.0 73.43 ? 36 A 1 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.611 0.108 -27.097 1.0 30.0 ? 36 A 1 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.846 -1.444 -25.824 1.0 11.1 ? 36 A 1 +ATOM 547 H HH . TYR A1 1 36 ? -22.413 -2.588 -26.204 1.0 20.21 ? 36 A 1 +ATOM 548 N N . ASP A1 1 37 ? -21.398 1.472 -22.601 1.0 31.31 ? 37 A 1 +ATOM 549 C CA . ASP A1 1 37 ? -22.005 0.299 -21.981 1.0 4.3 ? 37 A 1 +ATOM 550 C C . ASP A1 1 37 ? -22.749 0.683 -20.706 1.0 30.32 ? 37 A 1 +ATOM 551 O O . ASP A1 1 37 ? -23.743 0.054 -20.341 1.0 62.0 ? 37 A 1 +ATOM 552 C CB . ASP A1 1 37 ? -20.935 -0.748 -21.667 1.0 35.43 ? 37 A 1 +ATOM 553 C CG . ASP A1 1 37 ? -20.95 -1.903 -22.649 1.0 34.32 ? 37 A 1 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.986 -2.596 -22.735 1.0 31.12 ? 37 A 1 +ATOM 555 O OD2 . ASP A1 1 37 ? -19.927 -2.114 -23.332 1.0 3.2 ? 37 A 1 +ATOM 556 H H . ASP A1 1 37 ? -20.43 1.606 -22.524 1.0 51.42 ? 37 A 1 +ATOM 557 H HA . ASP A1 1 37 ? -22.71 -0.119 -22.683 1.0 32.24 ? 37 A 1 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.962 -0.282 -21.703 1.0 43.14 ? 37 A 1 +ATOM 559 H HB3 . ASP A1 1 37 ? -21.105 -1.14 -20.675 1.0 34.23 ? 37 A 1 +ATOM 560 N N . LYS A1 1 38 ? -22.261 1.718 -20.031 1.0 33.03 ? 38 A 1 +ATOM 561 C CA . LYS A1 1 38 ? -22.879 2.187 -18.796 1.0 33.5 ? 38 A 1 +ATOM 562 C C . LYS A1 1 38 ? -24.362 2.478 -19.006 1.0 62.1 ? 38 A 1 +ATOM 563 O O . LYS A1 1 38 ? -25.202 2.073 -18.204 1.0 13.24 ? 38 A 1 +ATOM 564 C CB . LYS A1 1 38 ? -22.168 3.444 -18.291 1.0 32.13 ? 38 A 1 +ATOM 565 C CG . LYS A1 1 38 ? -21.459 3.249 -16.962 1.0 11.13 ? 38 A 1 +ATOM 566 C CD . LYS A1 1 38 ? -20.009 2.838 -17.158 1.0 55.11 ? 38 A 1 +ATOM 567 C CE . LYS A1 1 38 ? -19.878 1.336 -17.359 1.0 12.13 ? 38 A 1 +ATOM 568 N NZ . LYS A1 1 38 ? -19.34 0.66 -16.146 1.0 62.42 ? 38 A 1 +ATOM 569 H H . LYS A1 1 38 ? -21.466 2.179 -20.372 1.0 40.1 ? 38 A 1 +ATOM 570 H HA . LYS A1 1 38 ? -22.779 1.405 -18.058 1.0 13.43 ? 38 A 1 +ATOM 571 H HB2 . LYS A1 1 38 ? -21.436 3.748 -19.024 1.0 53.44 ? 38 A 1 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.897 4.233 -18.173 1.0 74.35 ? 38 A 1 +ATOM 573 H HG2 . LYS A1 1 38 ? -21.487 4.177 -16.409 1.0 72.35 ? 38 A 1 +ATOM 574 H HG3 . LYS A1 1 38 ? -21.97 2.479 -16.401 1.0 65.33 ? 38 A 1 +ATOM 575 H HD2 . LYS A1 1 38 ? -19.616 3.342 -18.029 1.0 31.44 ? 38 A 1 +ATOM 576 H HD3 . LYS A1 1 38 ? -19.441 3.127 -16.285 1.0 51.13 ? 38 A 1 +ATOM 577 H HE2 . LYS A1 1 38 ? -20.852 0.93 -17.584 1.0 72.24 ? 38 A 1 +ATOM 578 H HE3 . LYS A1 1 38 ? -19.211 1.154 -18.188 1.0 52.14 ? 38 A 1 +ATOM 579 H HZ1 . LYS A1 1 38 ? -19.073 -0.32 -16.372 1.0 12.21 ? 38 A 1 +ATOM 580 H HZ2 . LYS A1 1 38 ? -20.059 0.648 -15.395 1.0 31.3 ? 38 A 1 +ATOM 581 H HZ3 . LYS A1 1 38 ? -18.5 1.165 -15.798 1.0 72.13 ? 38 A 1 +ATOM 582 N N . GLU A1 1 39 ? -24.674 3.181 -20.09 1.0 74.33 ? 39 A 1 +ATOM 583 C CA . GLU A1 1 39 ? -26.056 3.525 -20.405 1.0 31.43 ? 39 A 1 +ATOM 584 C C . GLU A1 1 39 ? -26.508 2.838 -21.69 1.0 55.55 ? 39 A 1 +ATOM 585 O O . GLU A1 1 39 ? -27.529 2.151 -21.714 1.0 44.25 ? 39 A 1 +ATOM 586 C CB . GLU A1 1 39 ? -26.209 5.041 -20.542 1.0 31.12 ? 39 A 1 +ATOM 587 C CG . GLU A1 1 39 ? -25.077 5.7 -21.312 1.0 22.34 ? 39 A 1 +ATOM 588 C CD . GLU A1 1 39 ? -25.113 7.213 -21.222 1.0 34.02 ? 39 A 1 +ATOM 589 O OE1 . GLU A1 1 39 ? -26.157 7.804 -21.57 1.0 60.52 ? 39 A 1 +ATOM 590 O OE2 . GLU A1 1 39 ? -24.098 7.807 -20.803 1.0 24.54 ? 39 A 1 +ATOM 591 H H . GLU A1 1 39 ? -23.959 3.475 -20.692 1.0 53.12 ? 39 A 1 +ATOM 592 H HA . GLU A1 1 39 ? -26.677 3.182 -19.591 1.0 24.23 ? 39 A 1 +ATOM 593 H HB2 . GLU A1 1 39 ? -27.136 5.252 -21.054 1.0 13.32 ? 39 A 1 +ATOM 594 H HB3 . GLU A1 1 39 ? -26.246 5.477 -19.554 1.0 53.15 ? 39 A 1 +ATOM 595 H HG2 . GLU A1 1 39 ? -24.136 5.354 -20.91 1.0 73.51 ? 39 A 1 +ATOM 596 H HG3 . GLU A1 1 39 ? -25.15 5.413 -22.35 1.0 55.55 ? 39 A 1 +ATOM 597 N N . GLY A1 1 40 ? -25.741 3.031 -22.759 1.0 41.31 ? 40 A 1 +ATOM 598 C CA . GLY A1 1 40 ? -26.079 2.426 -24.034 1.0 23.2 ? 40 A 1 +ATOM 599 C C . GLY A1 1 40 ? -26.15 3.441 -25.157 1.0 54.31 ? 40 A 1 +ATOM 600 O O . GLY A1 1 40 ? -27.115 3.463 -25.922 1.0 62.35 ? 40 A 1 +ATOM 601 H H . GLY A1 1 40 ? -24.939 3.589 -22.681 1.0 1.31 ? 40 A 1 +ATOM 602 H HA2 . GLY A1 1 40 ? -25.331 1.686 -24.278 1.0 42.33 ? 40 A 1 +ATOM 603 H HA3 . GLY A1 1 40 ? -27.038 1.937 -23.944 1.0 42.25 ? 40 A 1 +ATOM 604 N N . ILE A1 1 41 ? -25.129 4.285 -25.256 1.0 11.45 ? 41 A 1 +ATOM 605 C CA . ILE A1 1 41 ? -25.081 5.308 -26.293 1.0 13.21 ? 41 A 1 +ATOM 606 C C . ILE A1 1 41 ? -23.88 5.105 -27.21 1.0 73.14 ? 41 A 1 +ATOM 607 O O . ILE A1 1 41 ? -22.854 4.549 -26.817 1.0 54.03 ? 41 A 1 +ATOM 608 C CB . ILE A1 1 41 ? -25.016 6.722 -25.687 1.0 13.54 ? 41 A 1 +ATOM 609 C CG1 . ILE A1 1 41 ? -23.749 6.882 -24.844 1.0 35.25 ? 41 A 1 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.255 6.996 -24.848 1.0 15.54 ? 41 A 1 +ATOM 611 C CD1 . ILE A1 1 41 ? -22.569 7.419 -25.622 1.0 51.21 ? 41 A 1 +ATOM 612 H H . ILE A1 1 41 ? -24.39 4.218 -24.616 1.0 10.31 ? 41 A 1 +ATOM 613 H HA . ILE A1 1 41 ? -25.986 5.231 -26.879 1.0 22.4 ? 41 A 1 +ATOM 614 H HB . ILE A1 1 41 ? -24.994 7.436 -26.496 1.0 2.22 ? 41 A 1 +ATOM 615 H HG12 . ILE A1 1 41 ? -23.948 7.563 -24.031 1.0 53.25 ? 41 A 1 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.471 5.919 -24.44 1.0 73.21 ? 41 A 1 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.476 6.132 -24.238 1.0 41.34 ? 41 A 1 +ATOM 618 H HG22 . ILE A1 1 41 ? -26.076 7.849 -24.21 1.0 35.01 ? 41 A 1 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.093 7.202 -25.498 1.0 24.24 ? 41 A 1 +ATOM 620 H HD11 . ILE A1 1 41 ? -21.852 6.626 -25.782 1.0 13.35 ? 41 A 1 +ATOM 621 H HD12 . ILE A1 1 41 ? -22.908 7.794 -26.577 1.0 5.02 ? 41 A 1 +ATOM 622 H HD13 . ILE A1 1 41 ? -22.103 8.218 -25.065 1.0 73.01 ? 41 A 1 +ATOM 623 N N . PRO A1 1 42 ? -24.008 5.567 -28.463 1.0 42.01 ? 42 A 1 +ATOM 624 C CA . PRO A1 1 42 ? -22.942 5.45 -29.462 1.0 63.34 ? 42 A 1 +ATOM 625 C C . PRO A1 1 42 ? -21.751 6.348 -29.148 1.0 4.23 ? 42 A 1 +ATOM 626 O O . PRO A1 1 42 ? -21.857 7.575 -29.123 1.0 21.54 ? 42 A 1 +ATOM 627 C CB . PRO A1 1 42 ? -23.621 5.897 -30.759 1.0 63.45 ? 42 A 1 +ATOM 628 C CG . PRO A1 1 42 ? -24.73 6.788 -30.319 1.0 31.23 ? 42 A 1 +ATOM 629 C CD . PRO A1 1 42 ? -25.202 6.24 -29.0 1.0 52.22 ? 42 A 1 +ATOM 630 H HA . PRO A1 1 42 ? -22.604 4.429 -29.564 1.0 60.32 ? 42 A 1 +ATOM 631 H HB2 . PRO A1 1 42 ? -22.909 6.426 -31.377 1.0 50.23 ? 42 A 1 +ATOM 632 H HB3 . PRO A1 1 42 ? -23.995 5.034 -31.29 1.0 64.01 ? 42 A 1 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.365 7.796 -30.197 1.0 0.11 ? 42 A 1 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.531 6.762 -31.043 1.0 1.1 ? 42 A 1 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.518 7.042 -28.35 1.0 11.32 ? 42 A 1 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.006 5.535 -29.151 1.0 34.03 ? 42 A 1 +ATOM 637 N N . PRO A1 1 43 ? -20.588 5.726 -28.902 1.0 1.41 ? 43 A 1 +ATOM 638 C CA . PRO A1 1 43 ? -19.354 6.452 -28.585 1.0 62.53 ? 43 A 1 +ATOM 639 C C . PRO A1 1 43 ? -18.805 7.214 -29.787 1.0 21.35 ? 43 A 1 +ATOM 640 O O . PRO A1 1 43 ? -18.131 8.233 -29.632 1.0 73.42 ? 43 A 1 +ATOM 641 C CB . PRO A1 1 43 ? -18.386 5.341 -28.169 1.0 74.43 ? 43 A 1 +ATOM 642 C CG . PRO A1 1 43 ? -18.893 4.12 -28.857 1.0 42.11 ? 43 A 1 +ATOM 643 C CD . PRO A1 1 43 ? -20.388 4.268 -28.915 1.0 32.53 ? 43 A 1 +ATOM 644 H HA . PRO A1 1 43 ? -19.496 7.135 -27.761 1.0 3.1 ? 43 A 1 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.386 5.591 -28.493 1.0 1.2 ? 43 A 1 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.405 5.225 -27.096 1.0 52.2 ? 43 A 1 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.483 4.064 -29.854 1.0 21.5 ? 43 A 1 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.625 3.241 -28.289 1.0 41.32 ? 43 A 1 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.775 3.833 -29.824 1.0 55.24 ? 43 A 1 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.846 3.809 -28.051 1.0 31.14 ? 43 A 1 +ATOM 651 N N . ASP A1 1 44 ? -19.097 6.714 -30.982 1.0 54.12 ? 44 A 1 +ATOM 652 C CA . ASP A1 1 44 ? -18.634 7.349 -32.21 1.0 51.34 ? 44 A 1 +ATOM 653 C C . ASP A1 1 44 ? -19.502 8.555 -32.559 1.0 65.34 ? 44 A 1 +ATOM 654 O O . ASP A1 1 44 ? -19.12 9.388 -33.38 1.0 41.23 ? 44 A 1 +ATOM 655 C CB . ASP A1 1 44 ? -18.646 6.346 -33.365 1.0 23.35 ? 44 A 1 +ATOM 656 C CG . ASP A1 1 44 ? -17.858 6.834 -34.564 1.0 52.14 ? 44 A 1 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.719 7.31 -34.373 1.0 70.43 ? 44 A 1 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.38 6.74 -35.695 1.0 15.14 ? 44 A 1 +ATOM 659 H H . ASP A1 1 44 ? -19.639 5.899 -31.04 1.0 64.31 ? 44 A 1 +ATOM 660 H HA . ASP A1 1 44 ? -17.621 7.686 -32.048 1.0 72.42 ? 44 A 1 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.213 5.415 -33.028 1.0 64.21 ? 44 A 1 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.666 6.173 -33.672 1.0 74.33 ? 44 A 1 +ATOM 663 N N . GLN A1 1 45 ? -20.67 8.639 -31.931 1.0 24.51 ? 45 A 1 +ATOM 664 C CA . GLN A1 1 45 ? -21.591 9.741 -32.177 1.0 55.1 ? 45 A 1 +ATOM 665 C C . GLN A1 1 45 ? -21.511 10.778 -31.061 1.0 65.33 ? 45 A 1 +ATOM 666 O O . GLN A1 1 45 ? -22.036 11.883 -31.19 1.0 0.12 ? 45 A 1 +ATOM 667 C CB . GLN A1 1 45 ? -23.024 9.218 -32.301 1.0 3.33 ? 45 A 1 +ATOM 668 C CG . GLN A1 1 45 ? -23.396 8.792 -33.711 1.0 71.05 ? 45 A 1 +ATOM 669 C CD . GLN A1 1 45 ? -24.4 7.656 -33.732 1.0 50.21 ? 45 A 1 +ATOM 670 O OE1 . GLN A1 1 45 ? -25.529 7.802 -33.263 1.0 30.33 ? 45 A 1 +ATOM 671 N NE2 . GLN A1 1 45 ? -23.993 6.516 -34.278 1.0 54.11 ? 45 A 1 +ATOM 672 H H . GLN A1 1 45 ? -20.917 7.943 -31.288 1.0 33.14 ? 45 A 1 +ATOM 673 H HA . GLN A1 1 45 ? -21.307 10.209 -33.107 1.0 54.13 ? 45 A 1 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.141 8.367 -31.647 1.0 72.22 ? 45 A 1 +ATOM 675 H HB3 . GLN A1 1 45 ? -23.706 9.996 -31.991 1.0 51.24 ? 45 A 1 +ATOM 676 H HG2 . GLN A1 1 45 ? -23.823 9.638 -34.229 1.0 11.31 ? 45 A 1 +ATOM 677 H HG3 . GLN A1 1 45 ? -22.501 8.472 -34.225 1.0 33.23 ? 45 A 1 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.079 6.473 -34.631 1.0 35.4 ? 45 A 1 +ATOM 679 H HE22 . GLN A1 1 45 ? -24.621 5.765 -34.304 1.0 53.4 ? 45 A 1 +ATOM 680 N N . GLN A1 1 46 ? -20.85 10.412 -29.968 1.0 5.34 ? 46 A 1 +ATOM 681 C CA . GLN A1 1 46 ? -20.701 11.311 -28.829 1.0 54.21 ? 46 A 1 +ATOM 682 C C . GLN A1 1 46 ? -19.3 11.911 -28.788 1.0 23.33 ? 46 A 1 +ATOM 683 O O . GLN A1 1 46 ? -18.343 11.311 -29.278 1.0 42.0 ? 46 A 1 +ATOM 684 C CB . GLN A1 1 46 ? -20.989 10.567 -27.524 1.0 54.1 ? 46 A 1 +ATOM 685 C CG . GLN A1 1 46 ? -19.947 9.516 -27.18 1.0 63.33 ? 46 A 1 +ATOM 686 C CD . GLN A1 1 46 ? -19.004 9.966 -26.081 1.0 73.34 ? 46 A 1 +ATOM 687 O OE1 . GLN A1 1 46 ? -18.04 10.689 -26.332 1.0 62.34 ? 46 A 1 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.279 9.539 -24.854 1.0 52.51 ? 46 A 1 +ATOM 689 H H . GLN A1 1 46 ? -20.453 9.518 -29.925 1.0 61.13 ? 46 A 1 +ATOM 690 H HA . GLN A1 1 46 ? -21.418 12.11 -28.943 1.0 1.54 ? 46 A 1 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.028 11.283 -26.716 1.0 70.34 ? 46 A 1 +ATOM 692 H HB3 . GLN A1 1 46 ? -21.949 10.078 -27.607 1.0 24.41 ? 46 A 1 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.452 8.619 -26.854 1.0 71.34 ? 46 A 1 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.367 9.299 -28.066 1.0 12.44 ? 46 A 1 +ATOM 695 H HE21 . GLN A1 1 46 ? -20.064 8.965 -24.729 1.0 61.21 ? 46 A 1 +ATOM 696 H HE22 . GLN A1 1 46 ? -18.686 9.814 -24.125 1.0 54.41 ? 46 A 1 +ATOM 697 N N . ARG A1 1 47 ? -19.186 13.097 -28.2 1.0 11.31 ? 47 A 1 +ATOM 698 C CA . ARG A1 1 47 ? -17.901 13.779 -28.096 1.0 74.42 ? 47 A 1 +ATOM 699 C C . ARG A1 1 47 ? -17.752 14.453 -26.736 1.0 0.05 ? 47 A 1 +ATOM 700 O O . ARG A1 1 47 ? -18.741 14.723 -26.052 1.0 62.43 ? 47 A 1 +ATOM 701 C CB . ARG A1 1 47 ? -17.759 14.817 -29.21 1.0 53.24 ? 47 A 1 +ATOM 702 C CG . ARG A1 1 47 ? -17.216 14.246 -30.51 1.0 25.13 ? 47 A 1 +ATOM 703 C CD . ARG A1 1 47 ? -18.33 13.969 -31.506 1.0 74.31 ? 47 A 1 +ATOM 704 N NE . ARG A1 1 47 ? -17.828 13.861 -32.873 1.0 72.02 ? 47 A 1 +ATOM 705 C CZ . ARG A1 1 47 ? -18.615 13.767 -33.94 1.0 4.33 ? 47 A 1 +ATOM 706 N NH1 . ARG A1 1 47 ? -19.933 13.769 -33.798 1.0 22.33 ? 47 A 1 +ATOM 707 N NH2 . ARG A1 1 47 ? -18.083 13.673 -35.152 1.0 24.44 ? 47 A 1 +ATOM 708 H H . ARG A1 1 47 ? -19.985 13.525 -27.828 1.0 14.32 ? 47 A 1 +ATOM 709 H HA . ARG A1 1 47 ? -17.123 13.038 -28.205 1.0 52.1 ? 47 A 1 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.729 15.248 -29.411 1.0 12.43 ? 47 A 1 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.09 15.596 -28.877 1.0 31.22 ? 47 A 1 +ATOM 712 H HG2 . ARG A1 1 47 ? -16.528 14.956 -30.945 1.0 2.15 ? 47 A 1 +ATOM 713 H HG3 . ARG A1 1 47 ? -16.697 13.323 -30.297 1.0 3.22 ? 47 A 1 +ATOM 714 H HD2 . ARG A1 1 47 ? -18.814 13.042 -31.236 1.0 62.34 ? 47 A 1 +ATOM 715 H HD3 . ARG A1 1 47 ? -19.047 14.775 -31.458 1.0 4.32 ? 47 A 1 +ATOM 716 H HE . ARG A1 1 47 ? -16.857 13.858 -33.001 1.0 51.12 ? 47 A 1 +ATOM 717 H HH11 . ARG A1 1 47 ? -20.336 13.841 -32.886 1.0 35.02 ? 47 A 1 +ATOM 718 H HH12 . ARG A1 1 47 ? -20.523 13.699 -34.602 1.0 42.25 ? 47 A 1 +ATOM 719 H HH21 . ARG A1 1 47 ? -17.089 13.672 -35.263 1.0 32.54 ? 47 A 1 +ATOM 720 H HH22 . ARG A1 1 47 ? -18.675 13.602 -35.953 1.0 51.04 ? 47 A 1 +ATOM 721 N N . LEU A1 1 48 ? -16.51 14.722 -26.348 1.0 13.42 ? 48 A 1 +ATOM 722 C CA . LEU A1 1 48 ? -16.231 15.365 -25.068 1.0 63.04 ? 48 A 1 +ATOM 723 C C . LEU A1 1 48 ? -15.831 16.824 -25.267 1.0 70.54 ? 48 A 1 +ATOM 724 O O . LEU A1 1 48 ? -15.192 17.172 -26.261 1.0 13.22 ? 48 A 1 +ATOM 725 C CB . LEU A1 1 48 ? -15.119 14.616 -24.331 1.0 73.22 ? 48 A 1 +ATOM 726 C CG . LEU A1 1 48 ? -15.103 13.097 -24.507 1.0 23.01 ? 48 A 1 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.517 12.539 -24.464 1.0 2.23 ? 48 A 1 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.418 12.719 -25.812 1.0 62.5 ? 48 A 1 +ATOM 729 H H . LEU A1 1 48 ? -15.763 14.484 -26.935 1.0 13.1 ? 48 A 1 +ATOM 730 H HA . LEU A1 1 48 ? -17.133 15.329 -24.476 1.0 5.14 ? 48 A 1 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.173 14.999 -24.682 1.0 14.35 ? 48 A 1 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.223 14.827 -23.276 1.0 62.22 ? 48 A 1 +ATOM 733 H HG . LEU A1 1 48 ? -14.544 12.653 -23.694 1.0 74.12 ? 48 A 1 +ATOM 734 H HD11 . LEU A1 1 48 ? -16.909 12.475 -25.467 1.0 72.12 ? 48 A 1 +ATOM 735 H HD12 . LEU A1 1 48 ? -17.143 13.191 -23.873 1.0 51.52 ? 48 A 1 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.502 11.555 -24.018 1.0 50.13 ? 48 A 1 +ATOM 737 H HD21 . LEU A1 1 48 ? -13.722 13.496 -26.092 1.0 32.51 ? 48 A 1 +ATOM 738 H HD22 . LEU A1 1 48 ? -15.161 12.603 -26.588 1.0 4.35 ? 48 A 1 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.886 11.787 -25.682 1.0 44.23 ? 48 A 1 +ATOM 740 N N . ILE A1 1 49 ? -16.209 17.67 -24.316 1.0 13.31 ? 49 A 1 +ATOM 741 C CA . ILE A1 1 49 ? -15.887 19.09 -24.386 1.0 13.25 ? 49 A 1 +ATOM 742 C C . ILE A1 1 49 ? -15.495 19.633 -23.015 1.0 73.24 ? 49 A 1 +ATOM 743 O O . ILE A1 1 49 ? -16.186 19.401 -22.023 1.0 20.41 ? 49 A 1 +ATOM 744 C CB . ILE A1 1 49 ? -17.072 19.91 -24.93 1.0 42.12 ? 49 A 1 +ATOM 745 C CG1 . ILE A1 1 49 ? -16.976 20.037 -26.452 1.0 21.4 ? 49 A 1 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.108 21.285 -24.28 1.0 44.11 ? 49 A 1 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.167 19.458 -27.183 1.0 30.32 ? 49 A 1 +ATOM 748 H H . ILE A1 1 49 ? -16.716 17.332 -23.549 1.0 11.12 ? 49 A 1 +ATOM 749 H HA . ILE A1 1 49 ? -15.052 19.21 -25.061 1.0 31.54 ? 49 A 1 +ATOM 750 H HB . ILE A1 1 49 ? -17.985 19.394 -24.676 1.0 10.22 ? 49 A 1 +ATOM 751 H HG12 . ILE A1 1 49 ? -16.9 21.079 -26.716 1.0 52.53 ? 49 A 1 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.092 19.518 -26.794 1.0 23.14 ? 49 A 1 +ATOM 753 H HG21 . ILE A1 1 49 ? -17.468 21.194 -23.266 1.0 54.41 ? 49 A 1 +ATOM 754 H HG22 . ILE A1 1 49 ? -16.113 21.704 -24.271 1.0 2.4 ? 49 A 1 +ATOM 755 H HG23 . ILE A1 1 49 ? -17.766 21.931 -24.84 1.0 53.42 ? 49 A 1 +ATOM 756 H HD11 . ILE A1 1 49 ? -17.994 19.506 -28.248 1.0 43.14 ? 49 A 1 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.305 18.428 -26.888 1.0 61.33 ? 49 A 1 +ATOM 758 H HD13 . ILE A1 1 49 ? -19.052 20.025 -26.937 1.0 3.14 ? 49 A 1 +ATOM 759 N N . PHE A1 1 50 ? -14.383 20.358 -22.969 1.0 0.44 ? 50 A 1 +ATOM 760 C CA . PHE A1 1 50 ? -13.899 20.936 -21.72 1.0 63.4 ? 50 A 1 +ATOM 761 C C . PHE A1 1 50 ? -13.618 22.427 -21.883 1.0 34.31 ? 50 A 1 +ATOM 762 O O . PHE A1 1 50 ? -12.673 22.821 -22.564 1.0 24.03 ? 50 A 1 +ATOM 763 C CB . PHE A1 1 50 ? -12.631 20.214 -21.258 1.0 1.31 ? 50 A 1 +ATOM 764 C CG . PHE A1 1 50 ? -12.262 20.506 -19.831 1.0 63.44 ? 50 A 1 +ATOM 765 C CD1 . PHE A1 1 50 ? -11.525 21.634 -19.509 1.0 63.22 ? 50 A 1 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.651 19.651 -18.813 1.0 31.12 ? 50 A 1 +ATOM 767 C CE1 . PHE A1 1 50 ? -11.184 21.905 -18.197 1.0 44.05 ? 50 A 1 +ATOM 768 C CE2 . PHE A1 1 50 ? -12.313 19.917 -17.499 1.0 53.14 ? 50 A 1 +ATOM 769 C CZ . PHE A1 1 50 ? -11.578 21.045 -17.191 1.0 64.24 ? 50 A 1 +ATOM 770 H H . PHE A1 1 50 ? -13.875 20.509 -23.794 1.0 32.43 ? 50 A 1 +ATOM 771 H HA . PHE A1 1 50 ? -14.668 20.805 -20.975 1.0 55.42 ? 50 A 1 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.777 19.149 -21.351 1.0 72.21 ? 50 A 1 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.805 20.516 -21.884 1.0 52.42 ? 50 A 1 +ATOM 774 H HD1 . PHE A1 1 50 ? -11.216 22.308 -20.296 1.0 64.41 ? 50 A 1 +ATOM 775 H HD2 . PHE A1 1 50 ? -13.226 18.768 -19.052 1.0 25.0 ? 50 A 1 +ATOM 776 H HE1 . PHE A1 1 50 ? -10.608 22.788 -17.961 1.0 33.34 ? 50 A 1 +ATOM 777 H HE2 . PHE A1 1 50 ? -12.622 19.243 -16.715 1.0 34.14 ? 50 A 1 +ATOM 778 H HZ . PHE A1 1 50 ? -11.313 21.255 -16.166 1.0 42.2 ? 50 A 1 +ATOM 779 N N . GLY A1 1 51 ? -14.449 23.251 -21.252 1.0 53.44 ? 51 A 1 +ATOM 780 C CA . GLY A1 1 51 ? -14.275 24.69 -21.34 1.0 33.5 ? 51 A 1 +ATOM 781 C C . GLY A1 1 51 ? -14.662 25.239 -22.699 1.0 34.32 ? 51 A 1 +ATOM 782 O O . GLY A1 1 51 ? -14.58 26.443 -22.936 1.0 0.02 ? 51 A 1 +ATOM 783 H H . GLY A1 1 51 ? -15.186 22.88 -20.724 1.0 14.34 ? 51 A 1 +ATOM 784 H HA2 . GLY A1 1 51 ? -14.886 25.162 -20.585 1.0 71.3 ? 51 A 1 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.239 24.927 -21.151 1.0 2.33 ? 51 A 1 +ATOM 786 N N . GLY A1 1 52 ? -15.085 24.352 -23.595 1.0 51.33 ? 52 A 1 +ATOM 787 C CA . GLY A1 1 52 ? -15.478 24.774 -24.927 1.0 70.11 ? 52 A 1 +ATOM 788 C C . GLY A1 1 52 ? -14.75 24.011 -26.015 1.0 64.35 ? 52 A 1 +ATOM 789 O O . GLY A1 1 52 ? -15.261 23.856 -27.125 1.0 21.12 ? 52 A 1 +ATOM 790 H H . GLY A1 1 52 ? -15.13 23.404 -23.35 1.0 52.33 ? 52 A 1 +ATOM 791 H HA2 . GLY A1 1 52 ? -16.54 24.62 -25.043 1.0 34.31 ? 52 A 1 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.263 25.827 -25.037 1.0 33.12 ? 52 A 1 +ATOM 793 N N . LYS A1 1 53 ? -13.551 23.533 -25.7 1.0 4.12 ? 53 A 1 +ATOM 794 C CA . LYS A1 1 53 ? -12.749 22.782 -26.659 1.0 20.15 ? 53 A 1 +ATOM 795 C C . LYS A1 1 53 ? -12.996 21.283 -26.519 1.0 12.34 ? 53 A 1 +ATOM 796 O O . LYS A1 1 53 ? -13.229 20.784 -25.418 1.0 53.3 ? 53 A 1 +ATOM 797 C CB . LYS A1 1 53 ? -11.262 23.085 -26.46 1.0 12.13 ? 53 A 1 +ATOM 798 C CG . LYS A1 1 53 ? -10.764 22.793 -25.055 1.0 34.42 ? 53 A 1 +ATOM 799 C CD . LYS A1 1 53 ? -10.214 21.381 -24.941 1.0 44.0 ? 53 A 1 +ATOM 800 C CE . LYS A1 1 53 ? -8.987 21.189 -25.82 1.0 75.53 ? 53 A 1 +ATOM 801 N NZ . LYS A1 1 53 ? -7.89 20.49 -25.096 1.0 61.53 ? 53 A 1 +ATOM 802 H H . LYS A1 1 53 ? -13.196 23.689 -24.799 1.0 32.12 ? 53 A 1 +ATOM 803 H HA . LYS A1 1 53 ? -13.041 23.092 -27.65 1.0 74.23 ? 53 A 1 +ATOM 804 H HB2 . LYS A1 1 53 ? -10.689 22.488 -27.154 1.0 34.02 ? 53 A 1 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.089 24.131 -26.67 1.0 32.22 ? 53 A 1 +ATOM 806 H HG2 . LYS A1 1 53 ? -9.982 23.494 -24.807 1.0 24.24 ? 53 A 1 +ATOM 807 H HG3 . LYS A1 1 53 ? -11.585 22.906 -24.361 1.0 53.0 ? 53 A 1 +ATOM 808 H HD2 . LYS A1 1 53 ? -9.939 21.193 -23.914 1.0 22.42 ? 53 A 1 +ATOM 809 H HD3 . LYS A1 1 53 ? -10.978 20.68 -25.246 1.0 0.05 ? 53 A 1 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.268 20.604 -26.683 1.0 25.2 ? 53 A 1 +ATOM 811 H HE3 . LYS A1 1 53 ? -8.635 22.158 -26.141 1.0 75.24 ? 53 A 1 +ATOM 812 H HZ1 . LYS A1 1 53 ? -6.99 20.989 -25.243 1.0 1.33 ? 53 A 1 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.794 19.515 -25.448 1.0 14.14 ? 53 A 1 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.096 20.46 -24.078 1.0 31.25 ? 53 A 1 +ATOM 815 N N . GLN A1 1 54 ? -12.942 20.572 -27.64 1.0 32.1 ? 54 A 1 +ATOM 816 C CA . GLN A1 1 54 ? -13.16 19.13 -27.641 1.0 3.14 ? 54 A 1 +ATOM 817 C C . GLN A1 1 54 ? -11.927 18.393 -27.126 1.0 14.5 ? 54 A 1 +ATOM 818 O O . GLN A1 1 54 ? -10.818 18.928 -27.147 1.0 22.04 ? 54 A 1 +ATOM 819 C CB . GLN A1 1 54 ? -13.506 18.646 -29.05 1.0 14.03 ? 54 A 1 +ATOM 820 C CG . GLN A1 1 54 ? -14.917 18.093 -29.173 1.0 52.41 ? 54 A 1 +ATOM 821 C CD . GLN A1 1 54 ? -15.451 18.166 -30.59 1.0 44.23 ? 54 A 1 +ATOM 822 O OE1 . GLN A1 1 54 ? -15.44 17.176 -31.322 1.0 25.33 ? 54 A 1 +ATOM 823 N NE2 . GLN A1 1 54 ? -15.922 19.343 -30.986 1.0 63.1 ? 54 A 1 +ATOM 824 H H . GLN A1 1 54 ? -12.752 21.027 -28.486 1.0 52.11 ? 54 A 1 +ATOM 825 H HA . GLN A1 1 54 ? -13.99 18.92 -26.983 1.0 62.04 ? 54 A 1 +ATOM 826 H HB2 . GLN A1 1 54 ? -13.405 19.473 -29.737 1.0 31.24 ? 54 A 1 +ATOM 827 H HB3 . GLN A1 1 54 ? -12.813 17.868 -29.331 1.0 25.42 ? 54 A 1 +ATOM 828 H HG2 . GLN A1 1 54 ? -14.914 17.06 -28.859 1.0 52.11 ? 54 A 1 +ATOM 829 H HG3 . GLN A1 1 54 ? -15.57 18.662 -28.528 1.0 53.52 ? 54 A 1 +ATOM 830 H HE21 . GLN A1 1 54 ? -15.898 20.088 -30.349 1.0 45.55 ? 54 A 1 +ATOM 831 H HE22 . GLN A1 1 54 ? -16.272 19.419 -31.897 1.0 62.42 ? 54 A 1 +ATOM 832 N N . LEU A1 1 55 ? -12.129 17.164 -26.664 1.0 51.34 ? 55 A 1 +ATOM 833 C CA . LEU A1 1 55 ? -11.034 16.353 -26.143 1.0 40.45 ? 55 A 1 +ATOM 834 C C . LEU A1 1 55 ? -10.706 15.207 -27.094 1.0 63.5 ? 55 A 1 +ATOM 835 O O . LEU A1 1 55 ? -11.58 14.422 -27.46 1.0 52.11 ? 55 A 1 +ATOM 836 C CB . LEU A1 1 55 ? -11.395 15.8 -24.764 1.0 25.03 ? 55 A 1 +ATOM 837 C CG . LEU A1 1 55 ? -11.813 16.831 -23.715 1.0 41.33 ? 55 A 1 +ATOM 838 C CD1 . LEU A1 1 55 ? -11.987 16.171 -22.357 1.0 33.24 ? 55 A 1 +ATOM 839 C CD2 . LEU A1 1 55 ? -10.791 17.956 -23.636 1.0 52.23 ? 55 A 1 +ATOM 840 H H . LEU A1 1 55 ? -13.035 16.792 -26.674 1.0 12.34 ? 55 A 1 +ATOM 841 H HA . LEU A1 1 55 ? -10.166 16.989 -26.052 1.0 22.21 ? 55 A 1 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.211 15.106 -24.889 1.0 55.1 ? 55 A 1 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.531 15.272 -24.384 1.0 51.11 ? 55 A 1 +ATOM 844 H HG . LEU A1 1 55 ? -12.763 17.261 -24.001 1.0 72.12 ? 55 A 1 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.135 15.541 -22.151 1.0 32.04 ? 55 A 1 +ATOM 846 H HD12 . LEU A1 1 55 ? -12.886 15.571 -22.36 1.0 44.35 ? 55 A 1 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.066 16.932 -21.594 1.0 32.21 ? 55 A 1 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.191 18.84 -24.111 1.0 33.14 ? 55 A 1 +ATOM 849 H HD22 . LEU A1 1 55 ? -9.885 17.655 -24.141 1.0 72.01 ? 55 A 1 +ATOM 850 H HD23 . LEU A1 1 55 ? -10.571 18.171 -22.6 1.0 74.33 ? 55 A 1 +ATOM 851 N N . GLU A1 1 56 ? -9.439 15.115 -27.488 1.0 12.02 ? 56 A 1 +ATOM 852 C CA . GLU A1 1 56 ? -8.996 14.063 -28.395 1.0 31.33 ? 56 A 1 +ATOM 853 C C . GLU A1 1 56 ? -9.123 12.691 -27.739 1.0 62.51 ? 56 A 1 +ATOM 854 O O . GLU A1 1 56 ? -9.651 12.565 -26.634 1.0 51.02 ? 56 A 1 +ATOM 855 C CB . GLU A1 1 56 ? -7.547 14.304 -28.822 1.0 62.01 ? 56 A 1 +ATOM 856 C CG . GLU A1 1 56 ? -7.281 15.722 -29.299 1.0 21.02 ? 56 A 1 +ATOM 857 C CD . GLU A1 1 56 ? -6.596 15.764 -30.651 1.0 1.0 ? 56 A 1 +ATOM 858 O OE1 . GLU A1 1 56 ? -5.755 14.881 -30.918 1.0 61.34 ? 56 A 1 +ATOM 859 O OE2 . GLU A1 1 56 ? -6.902 16.681 -31.442 1.0 22.01 ? 56 A 1 +ATOM 860 H H . GLU A1 1 56 ? -8.788 15.771 -27.161 1.0 72.43 ? 56 A 1 +ATOM 861 H HA . GLU A1 1 56 ? -9.629 14.09 -29.269 1.0 4.21 ? 56 A 1 +ATOM 862 H HB2 . GLU A1 1 56 ? -6.898 14.1 -27.983 1.0 41.11 ? 56 A 1 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.304 13.625 -29.626 1.0 51.02 ? 56 A 1 +ATOM 864 H HG2 . GLU A1 1 56 ? -8.222 16.246 -29.373 1.0 71.31 ? 56 A 1 +ATOM 865 H HG3 . GLU A1 1 56 ? -6.65 16.219 -28.576 1.0 60.44 ? 56 A 1 +ATOM 866 N N . ASP A1 1 57 ? -8.635 11.665 -28.428 1.0 71.03 ? 57 A 1 +ATOM 867 C CA . ASP A1 1 57 ? -8.693 10.302 -27.914 1.0 63.41 ? 57 A 1 +ATOM 868 C C . ASP A1 1 57 ? -7.701 10.11 -26.771 1.0 21.4 ? 57 A 1 +ATOM 869 O O . ASP A1 1 57 ? -7.874 9.23 -25.927 1.0 43.31 ? 57 A 1 +ATOM 870 C CB . ASP A1 1 57 ? -8.402 9.299 -29.032 1.0 45.31 ? 57 A 1 +ATOM 871 C CG . ASP A1 1 57 ? -9.234 9.557 -30.272 1.0 55.43 ? 57 A 1 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.478 9.52 -30.169 1.0 72.35 ? 57 A 1 +ATOM 873 O OD2 . ASP A1 1 57 ? -8.642 9.796 -31.346 1.0 15.11 ? 57 A 1 +ATOM 874 H H . ASP A1 1 57 ? -8.226 11.829 -29.304 1.0 23.12 ? 57 A 1 +ATOM 875 H HA . ASP A1 1 57 ? -9.691 10.13 -27.54 1.0 62.14 ? 57 A 1 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.358 9.365 -29.303 1.0 24.44 ? 57 A 1 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.616 8.302 -28.677 1.0 64.03 ? 57 A 1 +ATOM 878 N N . SER A1 1 58 ? -6.661 10.938 -26.751 1.0 32.51 ? 58 A 1 +ATOM 879 C CA . SER A1 1 58 ? -5.639 10.856 -25.714 1.0 62.24 ? 58 A 1 +ATOM 880 C C . SER A1 1 58 ? -5.708 12.065 -24.787 1.0 2.12 ? 58 A 1 +ATOM 881 O O . SER A1 1 58 ? -4.882 12.219 -23.888 1.0 12.21 ? 58 A 1 +ATOM 882 C CB . SER A1 1 58 ? -4.249 10.762 -26.346 1.0 65.11 ? 58 A 1 +ATOM 883 O OG . SER A1 1 58 ? -3.273 10.405 -25.382 1.0 34.21 ? 58 A 1 +ATOM 884 H H . SER A1 1 58 ? -6.579 11.618 -27.452 1.0 21.03 ? 58 A 1 +ATOM 885 H HA . SER A1 1 58 ? -5.823 9.963 -25.137 1.0 33.55 ? 58 A 1 +ATOM 886 H HB2 . SER A1 1 58 ? -4.259 10.014 -27.124 1.0 31.42 ? 58 A 1 +ATOM 887 H HB3 . SER A1 1 58 ? -3.984 11.719 -26.771 1.0 40.4 ? 58 A 1 +ATOM 888 H HG . SER A1 1 58 ? -2.763 9.658 -25.704 1.0 10.23 ? 58 A 1 +ATOM 889 N N . ASN A1 1 59 ? -6.699 12.921 -25.013 1.0 35.41 ? 59 A 1 +ATOM 890 C CA . ASN A1 1 59 ? -6.877 14.117 -24.198 1.0 52.34 ? 59 A 1 +ATOM 891 C C . ASN A1 1 59 ? -7.676 13.803 -22.937 1.0 4.01 ? 59 A 1 +ATOM 892 O O . ASN A1 1 59 ? -8.876 14.066 -22.868 1.0 42.21 ? 59 A 1 +ATOM 893 C CB . ASN A1 1 59 ? -7.585 15.208 -25.005 1.0 21.1 ? 59 A 1 +ATOM 894 C CG . ASN A1 1 59 ? -7.348 16.593 -24.436 1.0 14.54 ? 59 A 1 +ATOM 895 O OD1 . ASN A1 1 59 ? -7.828 16.921 -23.35 1.0 24.42 ? 59 A 1 +ATOM 896 N ND2 . ASN A1 1 59 ? -6.606 17.415 -25.169 1.0 14.44 ? 59 A 1 +ATOM 897 H H . ASN A1 1 59 ? -7.327 12.743 -25.745 1.0 5.51 ? 59 A 1 +ATOM 898 H HA . ASN A1 1 59 ? -5.898 14.472 -23.912 1.0 74.51 ? 59 A 1 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.219 15.19 -26.021 1.0 43.43 ? 59 A 1 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.647 15.015 -25.006 1.0 11.21 ? 59 A 1 +ATOM 901 H HD21 . ASN A1 1 59 ? -6.258 17.087 -26.024 1.0 21.33 ? 59 A 1 +ATOM 902 H HD22 . ASN A1 1 59 ? -6.437 18.317 -24.824 1.0 12.0 ? 59 A 1 +ATOM 903 N N . ALA A1 1 60 ? -7.0 13.239 -21.941 1.0 13.11 ? 60 A 1 +ATOM 904 C CA . ALA A1 1 60 ? -7.645 12.892 -20.681 1.0 35.51 ? 60 A 1 +ATOM 905 C C . ALA A1 1 60 ? -6.623 12.418 -19.653 1.0 74.01 ? 60 A 1 +ATOM 906 O O . ALA A1 1 60 ? -6.203 13.182 -18.784 1.0 74.24 ? 60 A 1 +ATOM 907 C CB . ALA A1 1 60 ? -8.704 11.822 -20.907 1.0 64.13 ? 60 A 1 +ATOM 908 H H . ALA A1 1 60 ? -6.045 13.054 -22.056 1.0 31.12 ? 60 A 1 +ATOM 909 H HA . ALA A1 1 60 ? -8.138 13.776 -20.303 1.0 20.01 ? 60 A 1 +ATOM 910 H HB1 . ALA A1 1 60 ? -8.246 10.955 -21.361 1.0 72.33 ? 60 A 1 +ATOM 911 H HB2 . ALA A1 1 60 ? -9.143 11.544 -19.961 1.0 25.02 ? 60 A 1 +ATOM 912 H HB3 . ALA A1 1 60 ? -9.471 12.208 -21.561 1.0 51.02 ? 60 A 1 +ATOM 913 N N . MET A1 1 61 ? -6.228 11.154 -19.758 1.0 21.52 ? 61 A 1 +ATOM 914 C CA . MET A1 1 61 ? -5.254 10.579 -18.837 1.0 32.03 ? 61 A 1 +ATOM 915 C C . MET A1 1 61 ? -3.851 11.099 -19.134 1.0 55.14 ? 61 A 1 +ATOM 916 O O . MET A1 1 61 ? -3.214 11.717 -18.281 1.0 73.23 ? 61 A 1 +ATOM 917 C CB . MET A1 1 61 ? -5.274 9.052 -18.927 1.0 33.12 ? 61 A 1 +ATOM 918 C CG . MET A1 1 61 ? -6.672 8.469 -19.059 1.0 10.31 ? 61 A 1 +ATOM 919 S SD . MET A1 1 61 ? -7.819 9.13 -17.835 1.0 3.45 ? 61 A 1 +ATOM 920 C CE . MET A1 1 61 ? -9.369 9.011 -18.724 1.0 11.34 ? 61 A 1 +ATOM 921 H H . MET A1 1 61 ? -6.599 10.593 -20.471 1.0 44.35 ? 61 A 1 +ATOM 922 H HA . MET A1 1 61 ? -5.53 10.875 -17.836 1.0 14.21 ? 61 A 1 +ATOM 923 H HB2 . MET A1 1 61 ? -4.697 8.746 -19.787 1.0 14.23 ? 61 A 1 +ATOM 924 H HB3 . MET A1 1 61 ? -4.821 8.644 -18.036 1.0 0.24 ? 61 A 1 +ATOM 925 H HG2 . MET A1 1 61 ? -7.051 8.696 -20.044 1.0 62.14 ? 61 A 1 +ATOM 926 H HG3 . MET A1 1 61 ? -6.613 7.398 -18.936 1.0 32.0 ? 61 A 1 +ATOM 927 H HE1 . MET A1 1 61 ? -9.979 9.874 -18.499 1.0 54.23 ? 61 A 1 +ATOM 928 H HE2 . MET A1 1 61 ? -9.174 8.975 -19.785 1.0 64.31 ? 61 A 1 +ATOM 929 H HE3 . MET A1 1 61 ? -9.889 8.114 -18.422 1.0 24.11 ? 61 A 1 +ATOM 930 N N . SER A1 1 62 ? -3.376 10.845 -20.349 1.0 73.15 ? 62 A 1 +ATOM 931 C CA . SER A1 1 62 ? -2.047 11.284 -20.758 1.0 12.22 ? 62 A 1 +ATOM 932 C C . SER A1 1 62 ? -1.912 12.798 -20.63 1.0 13.52 ? 62 A 1 +ATOM 933 O O . SER A1 1 62 ? -0.836 13.313 -20.327 1.0 42.51 ? 62 A 1 +ATOM 934 C CB . SER A1 1 62 ? -1.766 10.856 -22.199 1.0 62.33 ? 62 A 1 +ATOM 935 O OG . SER A1 1 62 ? -0.388 10.583 -22.391 1.0 14.13 ? 62 A 1 +ATOM 936 H H . SER A1 1 62 ? -3.932 10.348 -20.985 1.0 74.25 ? 62 A 1 +ATOM 937 H HA . SER A1 1 62 ? -1.327 10.814 -20.104 1.0 74.15 ? 62 A 1 +ATOM 938 H HB2 . SER A1 1 62 ? -2.331 9.964 -22.424 1.0 54.41 ? 62 A 1 +ATOM 939 H HB3 . SER A1 1 62 ? -2.061 11.649 -22.872 1.0 23.45 ? 62 A 1 +ATOM 940 H HG . SER A1 1 62 ? -0.226 10.389 -23.317 1.0 1.23 ? 62 A 1 +ATOM 941 N N . ASP A1 1 63 ? -3.012 13.506 -20.863 1.0 34.33 ? 63 A 1 +ATOM 942 C CA . ASP A1 1 63 ? -3.019 14.961 -20.773 1.0 10.21 ? 63 A 1 +ATOM 943 C C . ASP A1 1 63 ? -2.648 15.421 -19.366 1.0 63.54 ? 63 A 1 +ATOM 944 O O . ASP A1 1 63 ? -2.19 16.547 -19.171 1.0 31.33 ? 63 A 1 +ATOM 945 C CB . ASP A1 1 63 ? -4.394 15.511 -21.156 1.0 21.1 ? 63 A 1 +ATOM 946 C CG . ASP A1 1 63 ? -4.337 16.963 -21.587 1.0 12.2 ? 63 A 1 +ATOM 947 O OD1 . ASP A1 1 63 ? -3.937 17.811 -20.762 1.0 53.24 ? 63 A 1 +ATOM 948 O OD2 . ASP A1 1 63 ? -4.694 17.252 -22.749 1.0 3.13 ? 63 A 1 +ATOM 949 H H . ASP A1 1 63 ? -3.84 13.037 -21.1 1.0 14.4 ? 63 A 1 +ATOM 950 H HA . ASP A1 1 63 ? -2.284 15.34 -21.467 1.0 72.42 ? 63 A 1 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.793 14.928 -21.973 1.0 63.34 ? 63 A 1 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.056 15.431 -20.306 1.0 44.51 ? 63 A 1 +ATOM 953 N N . TYR A1 1 64 ? -2.849 14.542 -18.39 1.0 43.15 ? 64 A 1 +ATOM 954 C CA . TYR A1 1 64 ? -2.538 14.859 -17.001 1.0 74.44 ? 64 A 1 +ATOM 955 C C . TYR A1 1 64 ? -3.586 15.796 -16.409 1.0 35.31 ? 64 A 1 +ATOM 956 O O . TYR A1 1 64 ? -3.257 16.741 -15.694 1.0 63.11 ? 64 A 1 +ATOM 957 C CB . TYR A1 1 64 ? -1.152 15.496 -16.899 1.0 41.31 ? 64 A 1 +ATOM 958 C CG . TYR A1 1 64 ? -0.104 14.807 -17.744 1.0 35.31 ? 64 A 1 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.224 13.474 -17.528 1.0 10.21 ? 64 A 1 +ATOM 960 C CD2 . TYR A1 1 64 ? 0.556 15.488 -18.759 1.0 61.0 ? 64 A 1 +ATOM 961 C CE1 . TYR A1 1 64 ? 1.181 12.841 -18.297 1.0 31.32 ? 64 A 1 +ATOM 962 C CE2 . TYR A1 1 64 ? 1.513 14.862 -19.534 1.0 3.01 ? 64 A 1 +ATOM 963 C CZ . TYR A1 1 64 ? 1.823 13.539 -19.299 1.0 35.43 ? 64 A 1 +ATOM 964 O OH . TYR A1 1 64 ? 2.775 12.911 -20.068 1.0 23.32 ? 64 A 1 +ATOM 965 H H . TYR A1 1 64 ? -3.216 13.66 -18.609 1.0 10.22 ? 64 A 1 +ATOM 966 H HA . TYR A1 1 64 ? -2.541 13.934 -16.442 1.0 40.51 ? 64 A 1 +ATOM 967 H HB2 . TYR A1 1 64 ? -1.211 16.525 -17.22 1.0 75.32 ? 64 A 1 +ATOM 968 H HB3 . TYR A1 1 64 ? -0.823 15.464 -15.871 1.0 32.34 ? 64 A 1 +ATOM 969 H HD1 . TYR A1 1 64 ? -0.281 12.93 -16.743 1.0 1.35 ? 64 A 1 +ATOM 970 H HD2 . TYR A1 1 64 ? 0.312 16.525 -18.941 1.0 32.41 ? 64 A 1 +ATOM 971 H HE1 . TYR A1 1 64 ? 1.423 11.804 -18.113 1.0 52.21 ? 64 A 1 +ATOM 972 H HE2 . TYR A1 1 64 ? 2.016 15.408 -20.318 1.0 43.14 ? 64 A 1 +ATOM 973 H HH . TYR A1 1 64 ? 3.016 12.076 -19.66 1.0 23.33 ? 64 A 1 +ATOM 974 N N . ASN A1 1 65 ? -4.852 15.525 -16.712 1.0 61.21 ? 65 A 1 +ATOM 975 C CA . ASN A1 1 65 ? -5.95 16.343 -16.21 1.0 70.22 ? 65 A 1 +ATOM 976 C C . ASN A1 1 65 ? -7.038 15.472 -15.59 1.0 21.44 ? 65 A 1 +ATOM 977 O O . ASN A1 1 65 ? -8.109 15.96 -15.229 1.0 22.24 ? 65 A 1 +ATOM 978 C CB . ASN A1 1 65 ? -6.541 17.189 -17.34 1.0 30.31 ? 65 A 1 +ATOM 979 C CG . ASN A1 1 65 ? -7.412 18.317 -16.822 1.0 75.23 ? 65 A 1 +ATOM 980 O OD1 . ASN A1 1 65 ? -7.212 18.812 -15.713 1.0 74.2 ? 65 A 1 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.386 18.728 -17.626 1.0 12.4 ? 65 A 1 +ATOM 982 H H . ASN A1 1 65 ? -5.052 14.757 -17.287 1.0 72.01 ? 65 A 1 +ATOM 983 H HA . ASN A1 1 65 ? -5.554 16.999 -15.45 1.0 43.44 ? 65 A 1 +ATOM 984 H HB2 . ASN A1 1 65 ? -5.736 17.618 -17.919 1.0 12.24 ? 65 A 1 +ATOM 985 H HB3 . ASN A1 1 65 ? -7.141 16.558 -17.978 1.0 73.02 ? 65 A 1 +ATOM 986 H HD21 . ASN A1 1 65 ? -8.487 18.288 -18.496 1.0 23.44 ? 65 A 1 +ATOM 987 H HD22 . ASN A1 1 65 ? -8.964 19.457 -17.317 1.0 32.24 ? 65 A 1 +ATOM 988 N N . VAL A1 1 66 ? -6.755 14.178 -15.468 1.0 11.4 ? 66 A 1 +ATOM 989 C CA . VAL A1 1 66 ? -7.708 13.239 -14.889 1.0 70.45 ? 66 A 1 +ATOM 990 C C . VAL A1 1 66 ? -7.51 13.113 -13.383 1.0 73.11 ? 66 A 1 +ATOM 991 O O . VAL A1 1 66 ? -6.424 12.77 -12.917 1.0 33.12 ? 66 A 1 +ATOM 992 C CB . VAL A1 1 66 ? -7.581 11.844 -15.531 1.0 40.11 ? 66 A 1 +ATOM 993 C CG1 . VAL A1 1 66 ? -6.21 11.249 -15.248 1.0 32.21 ? 66 A 1 +ATOM 994 C CG2 . VAL A1 1 66 ? -8.685 10.925 -15.03 1.0 25.13 ? 66 A 1 +ATOM 995 H H . VAL A1 1 66 ? -5.885 13.849 -15.774 1.0 25.31 ? 66 A 1 +ATOM 996 H HA . VAL A1 1 66 ? -8.704 13.611 -15.082 1.0 44.24 ? 66 A 1 +ATOM 997 H HB . VAL A1 1 66 ? -7.689 11.951 -16.6 1.0 65.05 ? 66 A 1 +ATOM 998 H HG11 . VAL A1 1 66 ? -6.034 10.419 -15.916 1.0 62.5 ? 66 A 1 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.452 12.002 -15.4 1.0 4.5 ? 66 A 1 +ATOM 1000 H HG13 . VAL A1 1 66 ? -6.173 10.901 -14.226 1.0 12.32 ? 66 A 1 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.9 11.151 -13.996 1.0 23.4 ? 66 A 1 +ATOM 1002 H HG22 . VAL A1 1 66 ? -9.574 11.074 -15.624 1.0 64.2 ? 66 A 1 +ATOM 1003 H HG23 . VAL A1 1 66 ? -8.363 9.897 -15.114 1.0 74.31 ? 66 A 1 +ATOM 1004 N N . GLN A1 1 67 ? -8.568 13.392 -12.628 1.0 5.43 ? 67 A 1 +ATOM 1005 C CA . GLN A1 1 67 ? -8.509 13.31 -11.173 1.0 15.5 ? 67 A 1 +ATOM 1006 C C . GLN A1 1 67 ? -9.566 12.349 -10.639 1.0 62.54 ? 67 A 1 +ATOM 1007 O O . GLN A1 1 67 ? -10.355 11.79 -11.402 1.0 44.01 ? 67 A 1 +ATOM 1008 C CB . GLN A1 1 67 ? -8.705 14.696 -10.555 1.0 35.11 ? 67 A 1 +ATOM 1009 C CG . GLN A1 1 67 ? -10.05 15.324 -10.884 1.0 11.21 ? 67 A 1 +ATOM 1010 C CD . GLN A1 1 67 ? -10.464 16.378 -9.876 1.0 34.44 ? 67 A 1 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.496 16.122 -8.671 1.0 41.54 ? 67 A 1 +ATOM 1012 N NE2 . GLN A1 1 67 ? -10.785 17.57 -10.363 1.0 50.51 ? 67 A 1 +ATOM 1013 H H . GLN A1 1 67 ? -9.405 13.66 -13.058 1.0 54.23 ? 67 A 1 +ATOM 1014 H HA . GLN A1 1 67 ? -7.533 12.94 -10.901 1.0 21.13 ? 67 A 1 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.624 14.613 -9.481 1.0 61.05 ? 67 A 1 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.928 15.352 -10.918 1.0 21.05 ? 67 A 1 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.989 15.786 -11.858 1.0 63.24 ? 67 A 1 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.801 14.548 -10.901 1.0 63.02 ? 67 A 1 +ATOM 1019 H HE21 . GLN A1 1 67 ? -10.738 17.701 -11.334 1.0 0.12 ? 67 A 1 +ATOM 1020 H HE22 . GLN A1 1 67 ? -11.057 18.27 -9.734 1.0 72.41 ? 67 A 1 +ATOM 1021 N N . LYS A1 1 68 ? -9.576 12.159 -9.324 1.0 63.33 ? 68 A 1 +ATOM 1022 C CA . LYS A1 1 68 ? -10.535 11.265 -8.687 1.0 34.0 ? 68 A 1 +ATOM 1023 C C . LYS A1 1 68 ? -11.964 11.643 -9.064 1.0 33.21 ? 68 A 1 +ATOM 1024 O O . LYS A1 1 68 ? -12.846 10.787 -9.124 1.0 33.01 ? 68 A 1 +ATOM 1025 C CB . LYS A1 1 68 ? -10.37 11.306 -7.166 1.0 41.41 ? 68 A 1 +ATOM 1026 C CG . LYS A1 1 68 ? -11.212 10.276 -6.434 1.0 61.44 ? 68 A 1 +ATOM 1027 C CD . LYS A1 1 68 ? -10.715 8.863 -6.694 1.0 43.41 ? 68 A 1 +ATOM 1028 C CE . LYS A1 1 68 ? -9.68 8.439 -5.664 1.0 23.43 ? 68 A 1 +ATOM 1029 N NZ . LYS A1 1 68 ? -10.241 8.43 -4.284 1.0 52.05 ? 68 A 1 +ATOM 1030 H H . LYS A1 1 68 ? -8.921 12.633 -8.768 1.0 75.53 ? 68 A 1 +ATOM 1031 H HA . LYS A1 1 68 ? -10.337 10.263 -9.035 1.0 31.4 ? 68 A 1 +ATOM 1032 H HB2 . LYS A1 1 68 ? -9.332 11.13 -6.924 1.0 51.5 ? 68 A 1 +ATOM 1033 H HB3 . LYS A1 1 68 ? -10.652 12.288 -6.812 1.0 62.4 ? 68 A 1 +ATOM 1034 H HG2 . LYS A1 1 68 ? -11.165 10.473 -5.374 1.0 22.33 ? 68 A 1 +ATOM 1035 H HG3 . LYS A1 1 68 ? -12.236 10.355 -6.772 1.0 45.02 ? 68 A 1 +ATOM 1036 H HD2 . LYS A1 1 68 ? -11.551 8.182 -6.649 1.0 14.2 ? 68 A 1 +ATOM 1037 H HD3 . LYS A1 1 68 ? -10.268 8.823 -7.678 1.0 13.53 ? 68 A 1 +ATOM 1038 H HE2 . LYS A1 1 68 ? -9.334 7.446 -5.908 1.0 43.13 ? 68 A 1 +ATOM 1039 H HE3 . LYS A1 1 68 ? -8.85 9.129 -5.701 1.0 63.42 ? 68 A 1 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -11.25 8.178 -4.311 1.0 1.54 ? 68 A 1 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -10.14 9.371 -3.852 1.0 73.32 ? 68 A 1 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.737 7.736 -3.698 1.0 23.44 ? 68 A 1 +ATOM 1043 N N . GLU A1 1 69 ? -12.184 12.929 -9.318 1.0 51.1 ? 69 A 1 +ATOM 1044 C CA . GLU A1 1 69 ? -13.506 13.418 -9.69 1.0 15.41 ? 69 A 1 +ATOM 1045 C C . GLU A1 1 69 ? -13.402 14.711 -10.495 1.0 20.25 ? 69 A 1 +ATOM 1046 O O . GLU A1 1 69 ? -13.245 15.794 -9.931 1.0 55.15 ? 69 A 1 +ATOM 1047 C CB . GLU A1 1 69 ? -14.359 13.65 -8.44 1.0 42.14 ? 69 A 1 +ATOM 1048 C CG . GLU A1 1 69 ? -13.648 14.445 -7.358 1.0 32.44 ? 69 A 1 +ATOM 1049 C CD . GLU A1 1 69 ? -14.544 15.486 -6.715 1.0 60.3 ? 69 A 1 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.769 16.542 -7.342 1.0 52.11 ? 69 A 1 +ATOM 1051 O OE2 . GLU A1 1 69 ? -15.019 15.245 -5.586 1.0 33.22 ? 69 A 1 +ATOM 1052 H H . GLU A1 1 69 ? -11.44 13.563 -9.253 1.0 51.55 ? 69 A 1 +ATOM 1053 H HA . GLU A1 1 69 ? -13.979 12.665 -10.302 1.0 21.13 ? 69 A 1 +ATOM 1054 H HB2 . GLU A1 1 69 ? -15.253 14.186 -8.723 1.0 70.35 ? 69 A 1 +ATOM 1055 H HB3 . GLU A1 1 69 ? -14.64 12.692 -8.029 1.0 25.14 ? 69 A 1 +ATOM 1056 H HG2 . GLU A1 1 69 ? -13.309 13.763 -6.592 1.0 60.54 ? 69 A 1 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.797 14.944 -7.796 1.0 2.43 ? 69 A 1 +ATOM 1058 N N . SER A1 1 70 ? -13.489 14.587 -11.815 1.0 51.41 ? 70 A 1 +ATOM 1059 C CA . SER A1 1 70 ? -13.4 15.744 -12.698 1.0 50.24 ? 70 A 1 +ATOM 1060 C C . SER A1 1 70 ? -14.717 15.968 -13.435 1.0 72.1 ? 70 A 1 +ATOM 1061 O O . SER A1 1 70 ? -15.397 15.016 -13.82 1.0 13.02 ? 70 A 1 +ATOM 1062 C CB . SER A1 1 70 ? -12.264 15.557 -13.706 1.0 75.43 ? 70 A 1 +ATOM 1063 O OG . SER A1 1 70 ? -11.478 16.73 -13.812 1.0 45.33 ? 70 A 1 +ATOM 1064 H H . SER A1 1 70 ? -13.614 13.696 -12.204 1.0 42.55 ? 70 A 1 +ATOM 1065 H HA . SER A1 1 70 ? -13.19 16.611 -12.089 1.0 61.25 ? 70 A 1 +ATOM 1066 H HB2 . SER A1 1 70 ? -11.633 14.742 -13.386 1.0 1.23 ? 70 A 1 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.682 15.328 -14.676 1.0 50.33 ? 70 A 1 +ATOM 1068 H HG . SER A1 1 70 ? -12.049 17.487 -13.96 1.0 14.24 ? 70 A 1 +ATOM 1069 N N . THR A1 1 71 ? -15.072 17.234 -13.628 1.0 52.55 ? 71 A 1 +ATOM 1070 C CA . THR A1 1 71 ? -16.308 17.585 -14.317 1.0 43.33 ? 71 A 1 +ATOM 1071 C C . THR A1 1 71 ? -16.058 17.84 -15.799 1.0 63.44 ? 71 A 1 +ATOM 1072 O O . THR A1 1 71 ? -15.341 18.771 -16.168 1.0 13.52 ? 71 A 1 +ATOM 1073 C CB . THR A1 1 71 ? -16.962 18.834 -13.697 1.0 4.41 ? 71 A 1 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.955 19.785 -13.334 1.0 4.41 ? 71 A 1 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.782 18.463 -12.471 1.0 4.35 ? 71 A 1 +ATOM 1076 H H . THR A1 1 71 ? -14.488 17.949 -13.299 1.0 14.04 ? 71 A 1 +ATOM 1077 H HA . THR A1 1 71 ? -16.994 16.757 -14.215 1.0 24.13 ? 71 A 1 +ATOM 1078 H HB . THR A1 1 71 ? -17.619 19.28 -14.43 1.0 70.41 ? 71 A 1 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.368 20.549 -12.924 1.0 53.11 ? 71 A 1 +ATOM 1080 H HG21 . THR A1 1 71 ? -17.373 17.57 -12.022 1.0 12.42 ? 71 A 1 +ATOM 1081 H HG22 . THR A1 1 71 ? -18.805 18.283 -12.763 1.0 75.2 ? 71 A 1 +ATOM 1082 H HG23 . THR A1 1 71 ? -17.748 19.273 -11.757 1.0 31.12 ? 71 A 1 +ATOM 1083 N N . LEU A1 1 72 ? -16.652 17.007 -16.646 1.0 74.32 ? 72 A 1 +ATOM 1084 C CA . LEU A1 1 72 ? -16.495 17.142 -18.09 1.0 62.12 ? 72 A 1 +ATOM 1085 C C . LEU A1 1 72 ? -17.852 17.202 -18.783 1.0 14.1 ? 72 A 1 +ATOM 1086 O O . LEU A1 1 72 ? -18.819 16.586 -18.333 1.0 22.33 ? 72 A 1 +ATOM 1087 C CB . LEU A1 1 72 ? -15.677 15.974 -18.645 1.0 54.24 ? 72 A 1 +ATOM 1088 C CG . LEU A1 1 72 ? -15.846 15.686 -20.138 1.0 12.34 ? 72 A 1 +ATOM 1089 C CD1 . LEU A1 1 72 ? -15.307 16.841 -20.968 1.0 71.53 ? 72 A 1 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.15 14.386 -20.512 1.0 45.31 ? 72 A 1 +ATOM 1091 H H . LEU A1 1 72 ? -17.211 16.283 -16.293 1.0 40.44 ? 72 A 1 +ATOM 1092 H HA . LEU A1 1 72 ? -15.966 18.064 -18.281 1.0 22.23 ? 72 A 1 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.635 16.186 -18.466 1.0 24.33 ? 72 A 1 +ATOM 1094 H HB3 . LEU A1 1 72 ? -15.962 15.085 -18.101 1.0 64.44 ? 72 A 1 +ATOM 1095 H HG . LEU A1 1 72 ? -16.899 15.579 -20.36 1.0 60.22 ? 72 A 1 +ATOM 1096 H HD11 . LEU A1 1 72 ? -16.044 17.131 -21.702 1.0 22.12 ? 72 A 1 +ATOM 1097 H HD12 . LEU A1 1 72 ? -14.402 16.531 -21.47 1.0 11.12 ? 72 A 1 +ATOM 1098 H HD13 . LEU A1 1 72 ? -15.091 17.679 -20.322 1.0 74.11 ? 72 A 1 +ATOM 1099 H HD21 . LEU A1 1 72 ? -15.669 13.925 -21.339 1.0 45.11 ? 72 A 1 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.157 13.718 -19.664 1.0 64.51 ? 72 A 1 +ATOM 1101 H HD23 . LEU A1 1 72 ? -14.128 14.594 -20.798 1.0 15.53 ? 72 A 1 +ATOM 1102 N N . HIS A1 1 73 ? -17.918 17.947 -19.882 1.0 22.1 ? 73 A 1 +ATOM 1103 C CA . HIS A1 1 73 ? -19.157 18.085 -20.639 1.0 43.22 ? 73 A 1 +ATOM 1104 C C . HIS A1 1 73 ? -19.179 17.125 -21.825 1.0 1.12 ? 73 A 1 +ATOM 1105 O O . HIS A1 1 73 ? -18.312 17.18 -22.698 1.0 41.41 ? 73 A 1 +ATOM 1106 C CB . HIS A1 1 73 ? -19.321 19.524 -21.13 1.0 34.11 ? 73 A 1 +ATOM 1107 C CG . HIS A1 1 73 ? -20.679 19.813 -21.694 1.0 25.31 ? 73 A 1 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.391 20.955 -21.394 1.0 22.31 ? 73 A 1 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.453 19.101 -22.546 1.0 30.12 ? 73 A 1 +ATOM 1110 C CE1 . HIS A1 1 73 ? -22.545 20.932 -22.035 1.0 74.03 ? 73 A 1 +ATOM 1111 N NE2 . HIS A1 1 73 ? -22.608 19.818 -22.742 1.0 22.32 ? 73 A 1 +ATOM 1112 H H . HIS A1 1 73 ? -17.114 18.414 -20.191 1.0 41.1 ? 73 A 1 +ATOM 1113 H HA . HIS A1 1 73 ? -19.977 17.843 -19.981 1.0 23.25 ? 73 A 1 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.155 20.2 -20.304 1.0 51.13 ? 73 A 1 +ATOM 1115 H HB3 . HIS A1 1 73 ? -18.592 19.72 -21.902 1.0 64.13 ? 73 A 1 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.095 21.674 -20.798 1.0 63.31 ? 73 A 1 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.209 18.146 -22.989 1.0 71.43 ? 73 A 1 +ATOM 1118 H HE1 . HIS A1 1 73 ? -23.309 21.694 -21.991 1.0 3.34 ? 73 A 1 +ATOM 1119 N N . LEU A1 1 74 ? -20.174 16.246 -21.849 1.0 31.4 ? 74 A 1 +ATOM 1120 C CA . LEU A1 1 74 ? -20.309 15.272 -22.927 1.0 41.22 ? 74 A 1 +ATOM 1121 C C . LEU A1 1 74 ? -21.536 15.573 -23.782 1.0 21.0 ? 74 A 1 +ATOM 1122 O O . LEU A1 1 74 ? -22.666 15.551 -23.294 1.0 70.53 ? 74 A 1 +ATOM 1123 C CB . LEU A1 1 74 ? -20.407 13.857 -22.354 1.0 42.32 ? 74 A 1 +ATOM 1124 C CG . LEU A1 1 74 ? -21.014 12.8 -23.277 1.0 13.02 ? 74 A 1 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.296 12.785 -24.617 1.0 50.12 ? 74 A 1 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.958 11.427 -22.624 1.0 22.4 ? 74 A 1 +ATOM 1127 H H . LEU A1 1 74 ? -20.834 16.25 -21.125 1.0 53.04 ? 74 A 1 +ATOM 1128 H HA . LEU A1 1 74 ? -19.428 15.341 -23.547 1.0 65.43 ? 74 A 1 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.41 13.536 -22.095 1.0 22.02 ? 74 A 1 +ATOM 1130 H HB3 . LEU A1 1 74 ? -21.012 13.905 -21.46 1.0 20.31 ? 74 A 1 +ATOM 1131 H HG . LEU A1 1 74 ? -22.052 13.043 -23.458 1.0 34.12 ? 74 A 1 +ATOM 1132 H HD11 . LEU A1 1 74 ? -20.256 11.774 -24.993 1.0 33.01 ? 74 A 1 +ATOM 1133 H HD12 . LEU A1 1 74 ? -19.292 13.162 -24.492 1.0 1.34 ? 74 A 1 +ATOM 1134 H HD13 . LEU A1 1 74 ? -20.83 13.41 -25.318 1.0 63.14 ? 74 A 1 +ATOM 1135 H HD21 . LEU A1 1 74 ? -19.928 11.116 -22.527 1.0 12.32 ? 74 A 1 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.492 10.715 -23.236 1.0 54.43 ? 74 A 1 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.414 11.474 -21.646 1.0 14.02 ? 74 A 1 +ATOM 1138 N N . VAL A1 1 75 ? -21.306 15.852 -25.061 1.0 43.5 ? 75 A 1 +ATOM 1139 C CA . VAL A1 1 75 ? -22.392 16.154 -25.985 1.0 52.32 ? 75 A 1 +ATOM 1140 C C . VAL A1 1 75 ? -22.532 15.066 -27.043 1.0 61.15 ? 75 A 1 +ATOM 1141 O O . VAL A1 1 75 ? -21.606 14.813 -27.816 1.0 54.31 ? 75 A 1 +ATOM 1142 C CB . VAL A1 1 75 ? -22.175 17.51 -26.684 1.0 24.5 ? 75 A 1 +ATOM 1143 C CG1 . VAL A1 1 75 ? -22.475 18.656 -25.731 1.0 55.3 ? 75 A 1 +ATOM 1144 C CG2 . VAL A1 1 75 ? -20.755 17.61 -27.22 1.0 64.14 ? 75 A 1 +ATOM 1145 H H . VAL A1 1 75 ? -20.383 15.855 -25.391 1.0 70.11 ? 75 A 1 +ATOM 1146 H HA . VAL A1 1 75 ? -23.309 16.21 -25.416 1.0 60.52 ? 75 A 1 +ATOM 1147 H HB . VAL A1 1 75 ? -22.858 17.575 -27.518 1.0 44.41 ? 75 A 1 +ATOM 1148 H HG11 . VAL A1 1 75 ? -21.558 19.173 -25.489 1.0 31.54 ? 75 A 1 +ATOM 1149 H HG12 . VAL A1 1 75 ? -23.164 19.344 -26.2 1.0 61.34 ? 75 A 1 +ATOM 1150 H HG13 . VAL A1 1 75 ? -22.917 18.265 -24.826 1.0 54.52 ? 75 A 1 +ATOM 1151 H HG21 . VAL A1 1 75 ? -20.599 16.85 -27.972 1.0 5.24 ? 75 A 1 +ATOM 1152 H HG22 . VAL A1 1 75 ? -20.604 18.586 -27.657 1.0 61.35 ? 75 A 1 +ATOM 1153 H HG23 . VAL A1 1 75 ? -20.053 17.466 -26.412 1.0 24.43 ? 75 A 1 +ATOM 1154 N N . LEU A1 1 76 ? -23.694 14.424 -27.074 1.0 35.1 ? 76 A 1 +ATOM 1155 C CA . LEU A1 1 76 ? -23.957 13.362 -28.039 1.0 22.53 ? 76 A 1 +ATOM 1156 C C . LEU A1 1 76 ? -25.073 13.761 -28.999 1.0 2.14 ? 76 A 1 +ATOM 1157 O O . LEU A1 1 76 ? -26.09 14.319 -28.586 1.0 21.5 ? 76 A 1 +ATOM 1158 C CB . LEU A1 1 76 ? -24.331 12.068 -27.313 1.0 73.12 ? 76 A 1 +ATOM 1159 C CG . LEU A1 1 76 ? -23.826 11.934 -25.876 1.0 64.45 ? 76 A 1 +ATOM 1160 C CD1 . LEU A1 1 76 ? -24.855 12.474 -24.896 1.0 24.13 ? 76 A 1 +ATOM 1161 C CD2 . LEU A1 1 76 ? -23.496 10.482 -25.561 1.0 22.03 ? 76 A 1 +ATOM 1162 H H . LEU A1 1 76 ? -24.394 14.669 -26.433 1.0 44.32 ? 76 A 1 +ATOM 1163 H HA . LEU A1 1 76 ? -23.052 13.198 -28.605 1.0 53.04 ? 76 A 1 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.408 12.001 -27.292 1.0 71.31 ? 76 A 1 +ATOM 1165 H HB3 . LEU A1 1 76 ? -23.932 11.242 -27.884 1.0 62.14 ? 76 A 1 +ATOM 1166 H HG . LEU A1 1 76 ? -22.921 12.515 -25.764 1.0 42.11 ? 76 A 1 +ATOM 1167 H HD11 . LEU A1 1 76 ? -25.455 13.227 -25.383 1.0 12.14 ? 76 A 1 +ATOM 1168 H HD12 . LEU A1 1 76 ? -24.349 12.91 -24.047 1.0 23.21 ? 76 A 1 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.49 11.667 -24.56 1.0 40.2 ? 76 A 1 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.666 9.875 -26.437 1.0 53.24 ? 76 A 1 +ATOM 1171 H HD22 . LEU A1 1 76 ? -24.127 10.137 -24.755 1.0 72.02 ? 76 A 1 +ATOM 1172 H HD23 . LEU A1 1 76 ? -22.46 10.405 -25.264 1.0 63.4 ? 76 A 1 +ATOM 1173 N N . ARG A1 1 77 ? -24.876 13.47 -30.28 1.0 50.44 ? 77 A 1 +ATOM 1174 C CA . ARG A1 1 77 ? -25.866 13.798 -31.299 1.0 12.4 ? 77 A 1 +ATOM 1175 C C . ARG A1 1 77 ? -26.636 12.553 -31.73 1.0 10.32 ? 77 A 1 +ATOM 1176 O O . ARG A1 1 77 ? -26.551 12.125 -32.882 1.0 12.43 ? 77 A 1 +ATOM 1177 C CB . ARG A1 1 77 ? -25.188 14.437 -32.512 1.0 55.35 ? 77 A 1 +ATOM 1178 C CG . ARG A1 1 77 ? -24.609 15.814 -32.232 1.0 12.22 ? 77 A 1 +ATOM 1179 C CD . ARG A1 1 77 ? -23.089 15.796 -32.262 1.0 60.22 ? 77 A 1 +ATOM 1180 N NE . ARG A1 1 77 ? -22.529 17.134 -32.432 1.0 64.33 ? 77 A 1 +ATOM 1181 C CZ . ARG A1 1 77 ? -22.48 17.767 -33.599 1.0 13.31 ? 77 A 1 +ATOM 1182 N NH1 . ARG A1 1 77 ? -22.957 17.188 -34.692 1.0 63.3 ? 77 A 1 +ATOM 1183 N NH2 . ARG A1 1 77 ? -21.955 18.984 -33.673 1.0 70.54 ? 77 A 1 +ATOM 1184 H H . ARG A1 1 77 ? -24.045 13.025 -30.548 1.0 2.41 ? 77 A 1 +ATOM 1185 H HA . ARG A1 1 77 ? -26.56 14.506 -30.871 1.0 53.23 ? 77 A 1 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.386 13.794 -32.842 1.0 41.04 ? 77 A 1 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.914 14.531 -33.307 1.0 23.23 ? 77 A 1 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.965 16.504 -32.983 1.0 3.21 ? 77 A 1 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.938 16.14 -31.256 1.0 45.32 ? 77 A 1 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.729 15.381 -31.333 1.0 24.22 ? 77 A 1 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.766 15.173 -33.083 1.0 55.12 ? 77 A 1 +ATOM 1192 H HE . ARG A1 1 77 ? -22.171 17.58 -31.637 1.0 41.44 ? 77 A 1 +ATOM 1193 H HH11 . ARG A1 1 77 ? -23.354 16.272 -34.639 1.0 31.24 ? 77 A 1 +ATOM 1194 H HH12 . ARG A1 1 77 ? -22.92 17.668 -35.569 1.0 72.5 ? 77 A 1 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.595 19.424 -32.851 1.0 71.34 ? 77 A 1 +ATOM 1196 H HH22 . ARG A1 1 77 ? -21.919 19.459 -34.552 1.0 1.44 ? 77 A 1 +ATOM 1197 N N . LEU A1 1 78 ? -27.386 11.976 -30.798 1.0 31.03 ? 78 A 1 +ATOM 1198 C CA . LEU A1 1 78 ? -28.171 10.779 -31.08 1.0 51.32 ? 78 A 1 +ATOM 1199 C C . LEU A1 1 78 ? -29.425 11.126 -31.876 1.0 14.11 ? 78 A 1 +ATOM 1200 O O . LEU A1 1 78 ? -29.683 10.546 -32.931 1.0 12.31 ? 78 A 1 +ATOM 1201 C CB . LEU A1 1 78 ? -28.558 10.079 -29.776 1.0 42.51 ? 78 A 1 +ATOM 1202 C CG . LEU A1 1 78 ? -27.551 9.063 -29.235 1.0 51.45 ? 78 A 1 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.209 9.729 -28.973 1.0 14.44 ? 78 A 1 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.082 8.41 -27.968 1.0 25.32 ? 78 A 1 +ATOM 1205 H H . LEU A1 1 78 ? -27.413 12.363 -29.898 1.0 75.31 ? 78 A 1 +ATOM 1206 H HA . LEU A1 1 78 ? -27.559 10.113 -31.669 1.0 64.2 ? 78 A 1 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.698 10.839 -29.022 1.0 61.14 ? 78 A 1 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.493 9.564 -29.943 1.0 62.32 ? 78 A 1 +ATOM 1209 H HG . LEU A1 1 78 ? -27.399 8.288 -29.974 1.0 53.42 ? 78 A 1 +ATOM 1210 H HD11 . LEU A1 1 78 ? -25.536 9.516 -29.789 1.0 3.24 ? 78 A 1 +ATOM 1211 H HD12 . LEU A1 1 78 ? -25.792 9.348 -28.052 1.0 74.14 ? 78 A 1 +ATOM 1212 H HD13 . LEU A1 1 78 ? -26.348 10.797 -28.889 1.0 11.41 ? 78 A 1 +ATOM 1213 H HD21 . LEU A1 1 78 ? -29.161 8.451 -27.966 1.0 65.32 ? 78 A 1 +ATOM 1214 H HD22 . LEU A1 1 78 ? -27.7 8.936 -27.105 1.0 65.43 ? 78 A 1 +ATOM 1215 H HD23 . LEU A1 1 78 ? -27.759 7.379 -27.933 1.0 34.04 ? 78 A 1 +ATOM 1216 N N . ARG A1 1 79 ? -30.201 12.076 -31.364 1.0 44.5 ? 79 A 1 +ATOM 1217 C CA . ARG A1 1 79 ? -31.427 12.501 -32.027 1.0 54.44 ? 79 A 1 +ATOM 1218 C C . ARG A1 1 79 ? -32.402 11.335 -32.167 1.0 43.43 ? 79 A 1 +ATOM 1219 O O . ARG A1 1 79 ? -33.196 11.286 -33.106 1.0 24.23 ? 79 A 1 +ATOM 1220 C CB . ARG A1 1 79 ? -31.111 13.084 -33.406 1.0 53.1 ? 79 A 1 +ATOM 1221 C CG . ARG A1 1 79 ? -32.115 14.127 -33.871 1.0 62.42 ? 79 A 1 +ATOM 1222 C CD . ARG A1 1 79 ? -31.475 15.133 -34.815 1.0 15.2 ? 79 A 1 +ATOM 1223 N NE . ARG A1 1 79 ? -31.728 14.807 -36.216 1.0 22.21 ? 79 A 1 +ATOM 1224 C CZ . ARG A1 1 79 ? -32.924 14.895 -36.787 1.0 43.33 ? 79 A 1 +ATOM 1225 N NH1 . ARG A1 1 79 ? -33.971 15.298 -36.081 1.0 51.34 ? 79 A 1 +ATOM 1226 N NH2 . ARG A1 1 79 ? -33.074 14.581 -38.068 1.0 24.34 ? 79 A 1 +ATOM 1227 H H . ARG A1 1 79 ? -29.942 12.502 -30.52 1.0 30.43 ? 79 A 1 +ATOM 1228 H HA . ARG A1 1 79 ? -31.885 13.267 -31.419 1.0 75.12 ? 79 A 1 +ATOM 1229 H HB2 . ARG A1 1 79 ? -30.135 13.546 -33.374 1.0 72.51 ? 79 A 1 +ATOM 1230 H HB3 . ARG A1 1 79 ? -31.098 12.282 -34.128 1.0 62.3 ? 79 A 1 +ATOM 1231 H HG2 . ARG A1 1 79 ? -32.923 13.63 -34.387 1.0 34.21 ? 79 A 1 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.502 14.649 -33.009 1.0 51.44 ? 79 A 1 +ATOM 1233 H HD2 . ARG A1 1 79 ? -31.881 16.112 -34.605 1.0 21.42 ? 79 A 1 +ATOM 1234 H HD3 . ARG A1 1 79 ? -30.41 15.141 -34.643 1.0 24.22 ? 79 A 1 +ATOM 1235 H HE . ARG A1 1 79 ? -30.968 14.507 -36.756 1.0 63.2 ? 79 A 1 +ATOM 1236 H HH11 . ARG A1 1 79 ? -33.861 15.537 -35.117 1.0 0.03 ? 79 A 1 +ATOM 1237 H HH12 . ARG A1 1 79 ? -34.87 15.365 -36.514 1.0 54.33 ? 79 A 1 +ATOM 1238 H HH21 . ARG A1 1 79 ? -32.286 14.277 -38.603 1.0 72.3 ? 79 A 1 +ATOM 1239 H HH22 . ARG A1 1 79 ? -33.974 14.647 -38.497 1.0 2.44 ? 79 A 1 +ATOM 1240 N N . GLY A1 1 80 ? -32.334 10.398 -31.227 1.0 11.03 ? 80 A 1 +ATOM 1241 C CA . GLY A1 1 80 ? -33.215 9.245 -31.264 1.0 3.12 ? 80 A 1 +ATOM 1242 C C . GLY A1 1 80 ? -32.484 7.969 -31.633 1.0 52.34 ? 80 A 1 +ATOM 1243 O O . GLY A1 1 80 ? -32.035 7.809 -32.767 1.0 43.44 ? 80 A 1 +ATOM 1244 H H . GLY A1 1 80 ? -31.681 10.49 -30.502 1.0 0.24 ? 80 A 1 +ATOM 1245 H HA2 . GLY A1 1 80 ? -33.667 9.12 -30.291 1.0 71.24 ? 80 A 1 +ATOM 1246 H HA3 . GLY A1 1 80 ? -33.993 9.424 -31.991 1.0 43.14 ? 80 A 1 +ATOM 1247 N N . GLY A1 1 81 ? -32.364 7.058 -30.672 1.0 43.34 ? 81 A 1 +ATOM 1248 C CA . GLY A1 1 81 ? -31.68 5.803 -30.922 1.0 20.2 ? 81 A 1 +ATOM 1249 C C . GLY A1 1 81 ? -31.579 4.941 -29.679 1.0 63.23 ? 81 A 1 +ATOM 1250 O O . GLY A1 1 81 ? -32.344 5.114 -28.731 1.0 30.24 ? 81 A 1 +ATOM 1251 H H . GLY A1 1 81 ? -32.742 7.24 -29.787 1.0 11.33 ? 81 A 1 +ATOM 1252 H HA2 . GLY A1 1 81 ? -32.218 5.258 -31.683 1.0 30.51 ? 81 A 1 +ATOM 1253 H HA3 . GLY A1 1 81 ? -30.683 6.014 -31.281 1.0 55.14 ? 81 A 1 +ATOM 1254 N N . VAL A1 1 82 ? -30.632 4.008 -29.684 1.0 30.52 ? 82 A 1 +ATOM 1255 C CA . VAL A1 1 82 ? -30.434 3.114 -28.549 1.0 4.45 ? 82 A 1 +ATOM 1256 C C . VAL A1 1 82 ? -30.241 3.902 -27.257 1.0 63.52 ? 82 A 1 +ATOM 1257 O O . VAL A1 1 82 ? -31.165 4.035 -26.456 1.0 12.52 ? 82 A 1 +ATOM 1258 C CB . VAL A1 1 82 ? -29.216 2.195 -28.763 1.0 53.54 ? 82 A 1 +ATOM 1259 C CG1 . VAL A1 1 82 ? -29.525 1.136 -29.81 1.0 33.31 ? 82 A 1 +ATOM 1260 C CG2 . VAL A1 1 82 ? -27.997 3.012 -29.164 1.0 1.13 ? 82 A 1 +ATOM 1261 H H . VAL A1 1 82 ? -30.053 3.918 -30.469 1.0 42.11 ? 82 A 1 +ATOM 1262 H HA . VAL A1 1 82 ? -31.314 2.495 -28.453 1.0 65.12 ? 82 A 1 +ATOM 1263 H HB . VAL A1 1 82 ? -28.999 1.696 -27.831 1.0 3.02 ? 82 A 1 +ATOM 1264 H HG11 . VAL A1 1 82 ? -29.329 1.535 -30.794 1.0 71.54 ? 82 A 1 +ATOM 1265 H HG12 . VAL A1 1 82 ? -28.903 0.269 -29.64 1.0 43.52 ? 82 A 1 +ATOM 1266 H HG13 . VAL A1 1 82 ? -30.565 0.852 -29.738 1.0 60.31 ? 82 A 1 +ATOM 1267 H HG21 . VAL A1 1 82 ? -27.114 2.588 -28.709 1.0 51.1 ? 82 A 1 +ATOM 1268 H HG22 . VAL A1 1 82 ? -27.892 2.997 -30.238 1.0 43.42 ? 82 A 1 +ATOM 1269 H HG23 . VAL A1 1 82 ? -28.12 4.032 -28.828 1.0 61.21 ? 82 A 1 +ATOM 1 N N . GLY A1 1 1 ? -15.058 -3.936 -6.094 1.0 13.0 ? 1 A 2 +ATOM 2 C CA . GLY A1 1 1 ? -14.031 -3.501 -5.166 1.0 45.03 ? 1 A 2 +ATOM 3 C C . GLY A1 1 1 ? -13.291 -2.271 -5.655 1.0 65.21 ? 1 A 2 +ATOM 4 O O . GLY A1 1 1 ? -13.379 -1.89 -6.822 1.0 33.34 ? 1 A 2 +ATOM 5 H H1 . GLY A1 1 1 ? -15.465 -3.29 -6.709 1.0 52.4 ? 1 A 2 +ATOM 6 H HA2 . GLY A1 1 1 ? -14.491 -3.277 -4.215 1.0 14.15 ? 1 A 2 +ATOM 7 H HA3 . GLY A1 1 1 ? -13.321 -4.303 -5.03 1.0 34.23 ? 1 A 2 +ATOM 8 N N . PRO A1 1 2 ? -12.541 -1.627 -4.748 1.0 55.32 ? 2 A 2 +ATOM 9 C CA . PRO A1 1 2 ? -11.769 -0.423 -5.069 1.0 21.43 ? 2 A 2 +ATOM 10 C C . PRO A1 1 2 ? -10.584 -0.721 -5.981 1.0 41.45 ? 2 A 2 +ATOM 11 O O . PRO A1 1 2 ? -9.89 -1.723 -5.806 1.0 62.42 ? 2 A 2 +ATOM 12 C CB . PRO A1 1 2 ? -11.283 0.063 -3.702 1.0 51.45 ? 2 A 2 +ATOM 13 C CG . PRO A1 1 2 ? -11.259 -1.161 -2.852 1.0 43.11 ? 2 A 2 +ATOM 14 C CD . PRO A1 1 2 ? -12.39 -2.025 -3.338 1.0 64.14 ? 2 A 2 +ATOM 15 H HA . PRO A1 1 2 ? -12.389 0.336 -5.523 1.0 31.54 ? 2 A 2 +ATOM 16 H HB2 . PRO A1 1 2 ? -10.298 0.496 -3.8 1.0 42.4 ? 2 A 2 +ATOM 17 H HB3 . PRO A1 1 2 ? -11.969 0.8 -3.313 1.0 62.54 ? 2 A 2 +ATOM 18 H HG2 . PRO A1 1 2 ? -10.317 -1.673 -2.972 1.0 3.22 ? 2 A 2 +ATOM 19 H HG3 . PRO A1 1 2 ? -11.412 -0.891 -1.817 1.0 51.14 ? 2 A 2 +ATOM 20 H HD2 . PRO A1 1 2 ? -12.127 -3.07 -3.258 1.0 11.0 ? 2 A 2 +ATOM 21 H HD3 . PRO A1 1 2 ? -13.291 -1.816 -2.78 1.0 24.12 ? 2 A 2 +ATOM 22 N N . LEU A1 1 3 ? -10.357 0.155 -6.954 1.0 34.12 ? 3 A 2 +ATOM 23 C CA . LEU A1 1 3 ? -9.254 -0.014 -7.894 1.0 54.03 ? 3 A 2 +ATOM 24 C C . LEU A1 1 3 ? -9.178 1.163 -8.861 1.0 63.21 ? 3 A 2 +ATOM 25 O O . LEU A1 1 3 ? -10.184 1.808 -9.15 1.0 11.24 ? 3 A 2 +ATOM 26 C CB . LEU A1 1 3 ? -9.419 -1.32 -8.674 1.0 60.12 ? 3 A 2 +ATOM 27 C CG . LEU A1 1 3 ? -10.771 -1.527 -9.359 1.0 64.13 ? 3 A 2 +ATOM 28 C CD1 . LEU A1 1 3 ? -10.7 -1.106 -10.818 1.0 62.25 ? 3 A 2 +ATOM 29 C CD2 . LEU A1 1 3 ? -11.211 -2.979 -9.241 1.0 0.12 ? 3 A 2 +ATOM 30 H H . LEU A1 1 3 ? -10.945 0.934 -7.043 1.0 52.35 ? 3 A 2 +ATOM 31 H HA . LEU A1 1 3 ? -8.338 -0.058 -7.325 1.0 43.13 ? 3 A 2 +ATOM 32 H HB2 . LEU A1 1 3 ? -8.655 -1.348 -9.436 1.0 74.24 ? 3 A 2 +ATOM 33 H HB3 . LEU A1 1 3 ? -9.267 -2.138 -7.984 1.0 72.41 ? 3 A 2 +ATOM 34 H HG . LEU A1 1 3 ? -11.513 -0.911 -8.869 1.0 43.5 ? 3 A 2 +ATOM 35 H HD11 . LEU A1 1 3 ? -11.6 -0.571 -11.082 1.0 50.45 ? 3 A 2 +ATOM 36 H HD12 . LEU A1 1 3 ? -10.607 -1.982 -11.442 1.0 4.34 ? 3 A 2 +ATOM 37 H HD13 . LEU A1 1 3 ? -9.843 -0.465 -10.967 1.0 54.42 ? 3 A 2 +ATOM 38 H HD21 . LEU A1 1 3 ? -11.808 -3.103 -8.35 1.0 23.33 ? 3 A 2 +ATOM 39 H HD22 . LEU A1 1 3 ? -10.34 -3.615 -9.183 1.0 1.01 ? 3 A 2 +ATOM 40 H HD23 . LEU A1 1 3 ? -11.796 -3.249 -10.109 1.0 75.24 ? 3 A 2 +ATOM 41 N N . GLY A1 1 4 ? -7.975 1.436 -9.359 1.0 4.21 ? 4 A 2 +ATOM 42 C CA . GLY A1 1 4 ? -7.789 2.534 -10.289 1.0 43.34 ? 4 A 2 +ATOM 43 C C . GLY A1 1 4 ? -6.847 3.594 -9.754 1.0 32.24 ? 4 A 2 +ATOM 44 O O . GLY A1 1 4 ? -6.263 3.432 -8.683 1.0 73.31 ? 4 A 2 +ATOM 45 H H . GLY A1 1 4 ? -7.208 0.887 -9.092 1.0 2.13 ? 4 A 2 +ATOM 46 H HA2 . GLY A1 1 4 ? -7.389 2.144 -11.213 1.0 53.5 ? 4 A 2 +ATOM 47 H HA3 . GLY A1 1 4 ? -8.749 2.989 -10.488 1.0 61.41 ? 4 A 2 +ATOM 48 N N . SER A1 1 5 ? -6.698 4.682 -10.503 1.0 14.33 ? 5 A 2 +ATOM 49 C CA . SER A1 1 5 ? -5.815 5.771 -10.1 1.0 12.42 ? 5 A 2 +ATOM 50 C C . SER A1 1 5 ? -6.608 7.053 -9.863 1.0 43.22 ? 5 A 2 +ATOM 51 O O . SER A1 1 5 ? -6.73 7.52 -8.731 1.0 33.52 ? 5 A 2 +ATOM 52 C CB . SER A1 1 5 ? -4.745 6.01 -11.167 1.0 72.02 ? 5 A 2 +ATOM 53 O OG . SER A1 1 5 ? -3.601 6.634 -10.611 1.0 21.35 ? 5 A 2 +ATOM 54 H H . SER A1 1 5 ? -7.191 4.753 -11.347 1.0 31.12 ? 5 A 2 +ATOM 55 H HA . SER A1 1 5 ? -5.334 5.484 -9.177 1.0 12.32 ? 5 A 2 +ATOM 56 H HB2 . SER A1 1 5 ? -4.451 5.064 -11.596 1.0 41.01 ? 5 A 2 +ATOM 57 H HB3 . SER A1 1 5 ? -5.148 6.647 -11.941 1.0 74.13 ? 5 A 2 +ATOM 58 H HG . SER A1 1 5 ? -3.289 6.122 -9.861 1.0 33.45 ? 5 A 2 +ATOM 59 N N . MET A1 1 6 ? -7.144 7.618 -10.941 1.0 14.01 ? 6 A 2 +ATOM 60 C CA . MET A1 1 6 ? -7.926 8.845 -10.851 1.0 54.33 ? 6 A 2 +ATOM 61 C C . MET A1 1 6 ? -9.241 8.709 -11.612 1.0 31.44 ? 6 A 2 +ATOM 62 O O . MET A1 1 6 ? -9.257 8.297 -12.771 1.0 1.11 ? 6 A 2 +ATOM 63 C CB . MET A1 1 6 ? -7.125 10.027 -11.401 1.0 70.21 ? 6 A 2 +ATOM 64 C CG . MET A1 1 6 ? -6.734 9.869 -12.861 1.0 25.05 ? 6 A 2 +ATOM 65 S SD . MET A1 1 6 ? -4.993 10.234 -13.157 1.0 3.44 ? 6 A 2 +ATOM 66 C CE . MET A1 1 6 ? -4.209 9.061 -12.054 1.0 13.21 ? 6 A 2 +ATOM 67 H H . MET A1 1 6 ? -7.012 7.199 -11.817 1.0 2.32 ? 6 A 2 +ATOM 68 H HA . MET A1 1 6 ? -8.144 9.024 -9.808 1.0 5.22 ? 6 A 2 +ATOM 69 H HB2 . MET A1 1 6 ? -7.717 10.924 -11.304 1.0 62.43 ? 6 A 2 +ATOM 70 H HB3 . MET A1 1 6 ? -6.222 10.137 -10.819 1.0 63.34 ? 6 A 2 +ATOM 71 H HG2 . MET A1 1 6 ? -6.93 8.851 -13.165 1.0 33.13 ? 6 A 2 +ATOM 72 H HG3 . MET A1 1 6 ? -7.335 10.541 -13.455 1.0 12.41 ? 6 A 2 +ATOM 73 H HE1 . MET A1 1 6 ? -4.958 8.6 -11.427 1.0 12.23 ? 6 A 2 +ATOM 74 H HE2 . MET A1 1 6 ? -3.708 8.3 -12.634 1.0 52.54 ? 6 A 2 +ATOM 75 H HE3 . MET A1 1 6 ? -3.488 9.575 -11.436 1.0 2.41 ? 6 A 2 +ATOM 76 N N . GLN A1 1 7 ? -10.341 9.058 -10.952 1.0 13.12 ? 7 A 2 +ATOM 77 C CA . GLN A1 1 7 ? -11.66 8.973 -11.567 1.0 13.2 ? 7 A 2 +ATOM 78 C C . GLN A1 1 7 ? -12.062 10.311 -12.178 1.0 42.42 ? 7 A 2 +ATOM 79 O O . GLN A1 1 7 ? -11.548 11.361 -11.791 1.0 71.33 ? 7 A 2 +ATOM 80 C CB . GLN A1 1 7 ? -12.7 8.537 -10.534 1.0 42.01 ? 7 A 2 +ATOM 81 C CG . GLN A1 1 7 ? -12.202 7.459 -9.585 1.0 12.34 ? 7 A 2 +ATOM 82 C CD . GLN A1 1 7 ? -11.543 8.032 -8.346 1.0 44.31 ? 7 A 2 +ATOM 83 O OE1 . GLN A1 1 7 ? -11.491 9.248 -8.162 1.0 33.44 ? 7 A 2 +ATOM 84 N NE2 . GLN A1 1 7 ? -11.036 7.156 -7.486 1.0 73.32 ? 7 A 2 +ATOM 85 H H . GLN A1 1 7 ? -10.263 9.379 -10.03 1.0 71.21 ? 7 A 2 +ATOM 86 H HA . GLN A1 1 7 ? -11.612 8.233 -12.351 1.0 62.03 ? 7 A 2 +ATOM 87 H HB2 . GLN A1 1 7 ? -12.991 9.396 -9.948 1.0 13.25 ? 7 A 2 +ATOM 88 H HB3 . GLN A1 1 7 ? -13.567 8.156 -11.053 1.0 41.42 ? 7 A 2 +ATOM 89 H HG2 . GLN A1 1 7 ? -13.04 6.85 -9.28 1.0 43.33 ? 7 A 2 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.482 6.844 -10.106 1.0 33.21 ? 7 A 2 +ATOM 91 H HE21 . GLN A1 1 7 ? -11.114 6.202 -7.698 1.0 52.01 ? 7 A 2 +ATOM 92 H HE22 . GLN A1 1 7 ? -10.604 7.499 -6.677 1.0 55.43 ? 7 A 2 +ATOM 93 N N . ILE A1 1 8 ? -12.984 10.265 -13.135 1.0 12.12 ? 8 A 2 +ATOM 94 C CA . ILE A1 1 8 ? -13.455 11.474 -13.799 1.0 64.2 ? 8 A 2 +ATOM 95 C C . ILE A1 1 8 ? -14.978 11.545 -13.796 1.0 0.33 ? 8 A 2 +ATOM 96 O O . ILE A1 1 8 ? -15.657 10.529 -13.645 1.0 11.35 ? 8 A 2 +ATOM 97 C CB . ILE A1 1 8 ? -12.952 11.551 -15.252 1.0 65.34 ? 8 A 2 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.089 10.331 -15.581 1.0 72.33 ? 8 A 2 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.167 12.836 -15.474 1.0 55.24 ? 8 A 2 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.709 10.236 -17.042 1.0 11.02 ? 8 A 2 +ATOM 101 H H . ILE A1 1 8 ? -13.356 9.399 -13.399 1.0 43.45 ? 8 A 2 +ATOM 102 H HA . ILE A1 1 8 ? -13.065 12.325 -13.258 1.0 41.41 ? 8 A 2 +ATOM 103 H HB . ILE A1 1 8 ? -13.81 11.564 -15.907 1.0 13.24 ? 8 A 2 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.179 10.375 -15.005 1.0 4.11 ? 8 A 2 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.633 9.434 -15.32 1.0 33.41 ? 8 A 2 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.566 13.046 -14.601 1.0 12.11 ? 8 A 2 +ATOM 107 H HG22 . ILE A1 1 8 ? -11.524 12.721 -16.333 1.0 14.43 ? 8 A 2 +ATOM 108 H HG23 . ILE A1 1 8 ? -12.853 13.652 -15.643 1.0 53.13 ? 8 A 2 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.28 9.448 -17.512 1.0 4.51 ? 8 A 2 +ATOM 110 H HD12 . ILE A1 1 8 ? -11.923 11.175 -17.532 1.0 22.53 ? 8 A 2 +ATOM 111 H HD13 . ILE A1 1 8 ? -10.656 10.016 -17.127 1.0 32.23 ? 8 A 2 +ATOM 112 N N . PHE A1 1 9 ? -15.51 12.751 -13.965 1.0 44.42 ? 9 A 2 +ATOM 113 C CA . PHE A1 1 9 ? -16.954 12.954 -13.983 1.0 45.42 ? 9 A 2 +ATOM 114 C C . PHE A1 1 9 ? -17.429 13.356 -15.376 1.0 62.05 ? 9 A 2 +ATOM 115 O O . PHE A1 1 9 ? -16.933 14.32 -15.96 1.0 33.13 ? 9 A 2 +ATOM 116 C CB . PHE A1 1 9 ? -17.352 14.027 -12.967 1.0 42.3 ? 9 A 2 +ATOM 117 C CG . PHE A1 1 9 ? -17.511 13.5 -11.57 1.0 44.44 ? 9 A 2 +ATOM 118 C CD1 . PHE A1 1 9 ? -18.673 12.848 -11.19 1.0 24.21 ? 9 A 2 +ATOM 119 C CD2 . PHE A1 1 9 ? -16.498 13.655 -10.637 1.0 24.11 ? 9 A 2 +ATOM 120 C CE1 . PHE A1 1 9 ? -18.822 12.362 -9.904 1.0 54.33 ? 9 A 2 +ATOM 121 C CE2 . PHE A1 1 9 ? -16.641 13.171 -9.35 1.0 62.43 ? 9 A 2 +ATOM 122 C CZ . PHE A1 1 9 ? -17.805 12.523 -8.984 1.0 72.21 ? 9 A 2 +ATOM 123 H H . PHE A1 1 9 ? -14.916 13.523 -14.08 1.0 15.35 ? 9 A 2 +ATOM 124 H HA . PHE A1 1 9 ? -17.422 12.021 -13.711 1.0 72.15 ? 9 A 2 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.591 14.793 -12.947 1.0 13.22 ? 9 A 2 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.291 14.465 -13.267 1.0 20.44 ? 9 A 2 +ATOM 127 H HD1 . PHE A1 1 9 ? -19.469 12.72 -11.908 1.0 63.23 ? 9 A 2 +ATOM 128 H HD2 . PHE A1 1 9 ? -15.587 14.162 -10.923 1.0 43.5 ? 9 A 2 +ATOM 129 H HE1 . PHE A1 1 9 ? -19.732 11.855 -9.62 1.0 53.21 ? 9 A 2 +ATOM 130 H HE2 . PHE A1 1 9 ? -15.844 13.299 -8.633 1.0 61.25 ? 9 A 2 +ATOM 131 H HZ . PHE A1 1 9 ? -17.919 12.145 -7.979 1.0 11.33 ? 9 A 2 +ATOM 132 N N . VAL A1 1 10 ? -18.394 12.609 -15.904 1.0 35.51 ? 10 A 2 +ATOM 133 C CA . VAL A1 1 10 ? -18.937 12.887 -17.228 1.0 51.35 ? 10 A 2 +ATOM 134 C C . VAL A1 1 10 ? -20.397 13.319 -17.144 1.0 20.3 ? 10 A 2 +ATOM 135 O O . VAL A1 1 10 ? -21.222 12.644 -16.528 1.0 33.54 ? 10 A 2 +ATOM 136 C CB . VAL A1 1 10 ? -18.831 11.656 -18.148 1.0 1.24 ? 10 A 2 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.657 12.085 -19.597 1.0 43.55 ? 10 A 2 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.683 10.76 -17.708 1.0 70.41 ? 10 A 2 +ATOM 139 H H . VAL A1 1 10 ? -18.749 11.854 -15.391 1.0 13.11 ? 10 A 2 +ATOM 140 H HA . VAL A1 1 10 ? -18.359 13.688 -17.666 1.0 52.2 ? 10 A 2 +ATOM 141 H HB . VAL A1 1 10 ? -19.749 11.093 -18.07 1.0 21.21 ? 10 A 2 +ATOM 142 H HG11 . VAL A1 1 10 ? -17.607 12.225 -19.807 1.0 75.22 ? 10 A 2 +ATOM 143 H HG12 . VAL A1 1 10 ? -19.058 11.323 -20.249 1.0 54.41 ? 10 A 2 +ATOM 144 H HG13 . VAL A1 1 10 ? -19.184 13.014 -19.762 1.0 61.31 ? 10 A 2 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.407 10.102 -18.518 1.0 13.24 ? 10 A 2 +ATOM 146 H HG22 . VAL A1 1 10 ? -16.835 11.371 -17.435 1.0 62.44 ? 10 A 2 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.991 10.172 -16.856 1.0 2.35 ? 10 A 2 +ATOM 148 N N . LYS A1 1 11 ? -20.71 14.45 -17.767 1.0 23.3 ? 11 A 2 +ATOM 149 C CA . LYS A1 1 11 ? -22.071 14.974 -17.765 1.0 10.31 ? 11 A 2 +ATOM 150 C C . LYS A1 1 11 ? -22.721 14.804 -19.134 1.0 22.12 ? 11 A 2 +ATOM 151 O O . LYS A1 1 11 ? -22.29 15.407 -20.118 1.0 63.21 ? 11 A 2 +ATOM 152 C CB . LYS A1 1 11 ? -22.069 16.452 -17.369 1.0 34.41 ? 11 A 2 +ATOM 153 C CG . LYS A1 1 11 ? -23.392 17.153 -17.627 1.0 63.11 ? 11 A 2 +ATOM 154 C CD . LYS A1 1 11 ? -23.331 18.621 -17.24 1.0 3.15 ? 11 A 2 +ATOM 155 C CE . LYS A1 1 11 ? -22.991 19.498 -18.435 1.0 2.52 ? 11 A 2 +ATOM 156 N NZ . LYS A1 1 11 ? -23.063 20.947 -18.097 1.0 51.12 ? 11 A 2 +ATOM 157 H H . LYS A1 1 11 ? -20.008 14.945 -18.241 1.0 4.15 ? 11 A 2 +ATOM 158 H HA . LYS A1 1 11 ? -22.64 14.416 -17.037 1.0 44.21 ? 11 A 2 +ATOM 159 H HB2 . LYS A1 1 11 ? -21.844 16.53 -16.316 1.0 75.01 ? 11 A 2 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.3 16.963 -17.931 1.0 15.43 ? 11 A 2 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.629 17.078 -18.678 1.0 73.24 ? 11 A 2 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.165 16.668 -17.047 1.0 30.03 ? 11 A 2 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.292 18.921 -16.849 1.0 63.51 ? 11 A 2 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.574 18.752 -16.48 1.0 61.22 ? 11 A 2 +ATOM 165 H HE2 . LYS A1 1 11 ? -21.99 19.264 -18.764 1.0 70.24 ? 11 A 2 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.69 19.288 -19.23 1.0 3.13 ? 11 A 2 +ATOM 167 H HZ1 . LYS A1 1 11 ? -22.176 21.421 -18.362 1.0 1.34 ? 11 A 2 +ATOM 168 H HZ2 . LYS A1 1 11 ? -23.216 21.068 -17.075 1.0 61.44 ? 11 A 2 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.849 21.395 -18.609 1.0 12.11 ? 11 A 2 +ATOM 170 N N . THR A1 1 12 ? -23.764 13.981 -19.191 1.0 60.33 ? 12 A 2 +ATOM 171 C CA . THR A1 1 12 ? -24.474 13.732 -20.439 1.0 63.11 ? 12 A 2 +ATOM 172 C C . THR A1 1 12 ? -25.344 14.924 -20.823 1.0 63.2 ? 12 A 2 +ATOM 173 O O . THR A1 1 12 ? -25.676 15.76 -19.982 1.0 23.14 ? 12 A 2 +ATOM 174 C CB . THR A1 1 12 ? -25.359 12.475 -20.341 1.0 13.53 ? 12 A 2 +ATOM 175 O OG1 . THR A1 1 12 ? -26.511 12.749 -19.536 1.0 44.22 ? 12 A 2 +ATOM 176 C CG2 . THR A1 1 12 ? -24.582 11.312 -19.744 1.0 44.25 ? 12 A 2 +ATOM 177 H H . THR A1 1 12 ? -24.06 13.53 -18.373 1.0 50.31 ? 12 A 2 +ATOM 178 H HA . THR A1 1 12 ? -23.739 13.57 -21.214 1.0 15.31 ? 12 A 2 +ATOM 179 H HB . THR A1 1 12 ? -25.681 12.202 -21.336 1.0 3.11 ? 12 A 2 +ATOM 180 H HG1 . THR A1 1 12 ? -27.271 12.285 -19.897 1.0 54.01 ? 12 A 2 +ATOM 181 H HG21 . THR A1 1 12 ? -24.23 11.581 -18.76 1.0 54.24 ? 12 A 2 +ATOM 182 H HG22 . THR A1 1 12 ? -23.737 11.081 -20.376 1.0 51.32 ? 12 A 2 +ATOM 183 H HG23 . THR A1 1 12 ? -25.226 10.448 -19.673 1.0 74.05 ? 12 A 2 +ATOM 184 N N . LEU A1 1 13 ? -25.711 14.995 -22.098 1.0 74.21 ? 13 A 2 +ATOM 185 C CA . LEU A1 1 13 ? -26.544 16.085 -22.594 1.0 74.52 ? 13 A 2 +ATOM 186 C C . LEU A1 1 13 ? -27.877 16.132 -21.854 1.0 25.21 ? 13 A 2 +ATOM 187 O O . LEU A1 1 13 ? -28.567 17.152 -21.858 1.0 11.35 ? 13 A 2 +ATOM 188 C CB . LEU A1 1 13 ? -26.787 15.925 -24.096 1.0 31.51 ? 13 A 2 +ATOM 189 C CG . LEU A1 1 13 ? -27.406 17.128 -24.808 1.0 30.32 ? 13 A 2 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.588 17.502 -26.034 1.0 44.31 ? 13 A 2 +ATOM 191 C CD2 . LEU A1 1 13 ? -28.848 16.834 -25.196 1.0 64.01 ? 13 A 2 +ATOM 192 H H . LEU A1 1 13 ? -25.415 14.3 -22.721 1.0 42.02 ? 13 A 2 +ATOM 193 H HA . LEU A1 1 13 ? -26.016 17.011 -22.42 1.0 34.1 ? 13 A 2 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.837 15.717 -24.564 1.0 62.11 ? 13 A 2 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.447 15.081 -24.235 1.0 43.21 ? 13 A 2 +ATOM 196 H HG . LEU A1 1 13 ? -27.407 17.975 -24.136 1.0 45.4 ? 13 A 2 +ATOM 197 H HD11 . LEU A1 1 13 ? -25.537 17.448 -25.795 1.0 62.23 ? 13 A 2 +ATOM 198 H HD12 . LEU A1 1 13 ? -26.837 18.508 -26.339 1.0 23.44 ? 13 A 2 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.811 16.817 -26.838 1.0 25.55 ? 13 A 2 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.863 16.15 -26.032 1.0 62.14 ? 13 A 2 +ATOM 201 H HD22 . LEU A1 1 13 ? -29.341 17.754 -25.474 1.0 41.34 ? 13 A 2 +ATOM 202 H HD23 . LEU A1 1 13 ? -29.363 16.389 -24.357 1.0 51.42 ? 13 A 2 +ATOM 203 N N . THR A1 1 14 ? -28.233 15.021 -21.216 1.0 31.41 ? 14 A 2 +ATOM 204 C CA . THR A1 1 14 ? -29.482 14.935 -20.471 1.0 30.33 ? 14 A 2 +ATOM 205 C C . THR A1 1 14 ? -29.268 15.27 -18.999 1.0 22.13 ? 14 A 2 +ATOM 206 O O . THR A1 1 14 ? -30.153 15.061 -18.17 1.0 5.31 ? 14 A 2 +ATOM 207 C CB . THR A1 1 14 ? -30.107 13.532 -20.58 1.0 34.54 ? 14 A 2 +ATOM 208 O OG1 . THR A1 1 14 ? -29.195 12.549 -20.077 1.0 3.22 ? 14 A 2 +ATOM 209 C CG2 . THR A1 1 14 ? -30.462 13.209 -22.024 1.0 34.11 ? 14 A 2 +ATOM 210 H H . THR A1 1 14 ? -27.641 14.241 -21.25 1.0 2.31 ? 14 A 2 +ATOM 211 H HA . THR A1 1 14 ? -30.174 15.648 -20.895 1.0 25.44 ? 14 A 2 +ATOM 212 H HB . THR A1 1 14 ? -31.011 13.509 -19.989 1.0 55.24 ? 14 A 2 +ATOM 213 H HG1 . THR A1 1 14 ? -29.683 11.876 -19.596 1.0 24.42 ? 14 A 2 +ATOM 214 H HG21 . THR A1 1 14 ? -30.879 12.214 -22.078 1.0 1.02 ? 14 A 2 +ATOM 215 H HG22 . THR A1 1 14 ? -29.573 13.26 -22.634 1.0 12.23 ? 14 A 2 +ATOM 216 H HG23 . THR A1 1 14 ? -31.188 13.923 -22.384 1.0 12.42 ? 14 A 2 +ATOM 217 N N . GLY A1 1 15 ? -28.088 15.793 -18.681 1.0 61.2 ? 15 A 2 +ATOM 218 C CA . GLY A1 1 15 ? -27.779 16.149 -17.308 1.0 25.44 ? 15 A 2 +ATOM 219 C C . GLY A1 1 15 ? -27.607 14.934 -16.419 1.0 2.34 ? 15 A 2 +ATOM 220 O O . GLY A1 1 15 ? -28.309 14.782 -15.419 1.0 24.03 ? 15 A 2 +ATOM 221 H H . GLY A1 1 15 ? -27.421 15.938 -19.385 1.0 73.22 ? 15 A 2 +ATOM 222 H HA2 . GLY A1 1 15 ? -26.866 16.725 -17.294 1.0 10.15 ? 15 A 2 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.583 16.756 -16.917 1.0 23.53 ? 15 A 2 +ATOM 224 N N . LYS A1 1 16 ? -26.671 14.064 -16.783 1.0 11.21 ? 16 A 2 +ATOM 225 C CA . LYS A1 1 16 ? -26.408 12.855 -16.012 1.0 34.13 ? 16 A 2 +ATOM 226 C C . LYS A1 1 16 ? -24.955 12.81 -15.55 1.0 15.24 ? 16 A 2 +ATOM 227 O O . LYS A1 1 16 ? -24.035 12.737 -16.365 1.0 50.04 ? 16 A 2 +ATOM 228 C CB . LYS A1 1 16 ? -26.727 11.613 -16.847 1.0 31.42 ? 16 A 2 +ATOM 229 C CG . LYS A1 1 16 ? -27.314 10.47 -16.037 1.0 73.35 ? 16 A 2 +ATOM 230 C CD . LYS A1 1 16 ? -26.226 9.601 -15.428 1.0 50.3 ? 16 A 2 +ATOM 231 C CE . LYS A1 1 16 ? -25.458 8.838 -16.497 1.0 52.44 ? 16 A 2 +ATOM 232 N NZ . LYS A1 1 16 ? -25.775 7.383 -16.475 1.0 2.53 ? 16 A 2 +ATOM 233 H H . LYS A1 1 16 ? -26.143 14.24 -17.591 1.0 52.54 ? 16 A 2 +ATOM 234 H HA . LYS A1 1 16 ? -27.049 12.869 -15.144 1.0 34.34 ? 16 A 2 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.436 11.883 -17.616 1.0 44.24 ? 16 A 2 +ATOM 236 H HB3 . LYS A1 1 16 ? -25.818 11.265 -17.315 1.0 12.13 ? 16 A 2 +ATOM 237 H HG2 . LYS A1 1 16 ? -27.921 10.878 -15.243 1.0 3.41 ? 16 A 2 +ATOM 238 H HG3 . LYS A1 1 16 ? -27.928 9.86 -16.685 1.0 74.14 ? 16 A 2 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.536 10.231 -14.886 1.0 63.23 ? 16 A 2 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.68 8.894 -14.749 1.0 14.51 ? 16 A 2 +ATOM 241 H HE2 . LYS A1 1 16 ? -25.718 9.24 -17.464 1.0 44.12 ? 16 A 2 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.4 8.971 -16.325 1.0 75.31 ? 16 A 2 +ATOM 243 H HZ1 . LYS A1 1 16 ? -24.961 6.835 -16.818 1.0 61.55 ? 16 A 2 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.594 7.187 -17.086 1.0 23.15 ? 16 A 2 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.0 7.081 -15.506 1.0 43.23 ? 16 A 2 +ATOM 246 N N . THR A1 1 17 ? -24.755 12.851 -14.236 1.0 33.03 ? 17 A 2 +ATOM 247 C CA . THR A1 1 17 ? -23.414 12.815 -13.666 1.0 61.21 ? 17 A 2 +ATOM 248 C C . THR A1 1 17 ? -22.965 11.381 -13.409 1.0 13.11 ? 17 A 2 +ATOM 249 O O . THR A1 1 17 ? -23.588 10.655 -12.633 1.0 32.24 ? 17 A 2 +ATOM 250 C CB . THR A1 1 17 ? -23.343 13.607 -12.347 1.0 22.54 ? 17 A 2 +ATOM 251 O OG1 . THR A1 1 17 ? -24.664 13.852 -11.851 1.0 24.32 ? 17 A 2 +ATOM 252 C CG2 . THR A1 1 17 ? -22.618 14.929 -12.548 1.0 72.42 ? 17 A 2 +ATOM 253 H H . THR A1 1 17 ? -25.528 12.909 -13.637 1.0 63.53 ? 17 A 2 +ATOM 254 H HA . THR A1 1 17 ? -22.738 13.272 -14.373 1.0 15.15 ? 17 A 2 +ATOM 255 H HB . THR A1 1 17 ? -22.797 13.021 -11.621 1.0 61.22 ? 17 A 2 +ATOM 256 H HG1 . THR A1 1 17 ? -24.741 13.502 -10.96 1.0 54.0 ? 17 A 2 +ATOM 257 H HG21 . THR A1 1 17 ? -22.926 15.369 -13.485 1.0 31.34 ? 17 A 2 +ATOM 258 H HG22 . THR A1 1 17 ? -21.552 14.757 -12.565 1.0 12.24 ? 17 A 2 +ATOM 259 H HG23 . THR A1 1 17 ? -22.862 15.601 -11.739 1.0 74.01 ? 17 A 2 +ATOM 260 N N . ILE A1 1 18 ? -21.88 10.979 -14.063 1.0 21.15 ? 18 A 2 +ATOM 261 C CA . ILE A1 1 18 ? -21.347 9.632 -13.903 1.0 42.23 ? 18 A 2 +ATOM 262 C C . ILE A1 1 18 ? -19.871 9.667 -13.524 1.0 2.02 ? 18 A 2 +ATOM 263 O O . ILE A1 1 18 ? -19.111 10.502 -14.016 1.0 34.24 ? 18 A 2 +ATOM 264 C CB . ILE A1 1 18 ? -21.516 8.803 -15.19 1.0 20.13 ? 18 A 2 +ATOM 265 C CG1 . ILE A1 1 18 ? -20.74 7.489 -15.082 1.0 0.43 ? 18 A 2 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.052 9.602 -16.399 1.0 34.34 ? 18 A 2 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.021 6.526 -16.214 1.0 41.12 ? 18 A 2 +ATOM 268 H H . ILE A1 1 18 ? -21.428 11.604 -14.667 1.0 72.35 ? 18 A 2 +ATOM 269 H HA . ILE A1 1 18 ? -21.9 9.147 -13.111 1.0 33.1 ? 18 A 2 +ATOM 270 H HB . ILE A1 1 18 ? -22.566 8.584 -15.315 1.0 55.23 ? 18 A 2 +ATOM 271 H HG12 . ILE A1 1 18 ? -19.682 7.702 -15.084 1.0 35.45 ? 18 A 2 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.003 7.0 -14.156 1.0 15.51 ? 18 A 2 +ATOM 273 H HG21 . ILE A1 1 18 ? -20.067 10.003 -16.209 1.0 31.24 ? 18 A 2 +ATOM 274 H HG22 . ILE A1 1 18 ? -21.016 8.956 -17.264 1.0 60.32 ? 18 A 2 +ATOM 275 H HG23 . ILE A1 1 18 ? -21.742 10.412 -16.582 1.0 71.44 ? 18 A 2 +ATOM 276 H HD11 . ILE A1 1 18 ? -21.531 7.048 -17.012 1.0 32.31 ? 18 A 2 +ATOM 277 H HD12 . ILE A1 1 18 ? -20.09 6.125 -16.587 1.0 60.24 ? 18 A 2 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.644 5.721 -15.856 1.0 25.35 ? 18 A 2 +ATOM 279 N N . THR A1 1 19 ? -19.469 8.751 -12.648 1.0 42.32 ? 19 A 2 +ATOM 280 C CA . THR A1 1 19 ? -18.083 8.676 -12.203 1.0 41.24 ? 19 A 2 +ATOM 281 C C . THR A1 1 19 ? -17.414 7.4 -12.701 1.0 70.21 ? 19 A 2 +ATOM 282 O O . THR A1 1 19 ? -18.003 6.319 -12.651 1.0 44.42 ? 19 A 2 +ATOM 283 C CB . THR A1 1 19 ? -17.982 8.729 -10.667 1.0 2.4 ? 19 A 2 +ATOM 284 O OG1 . THR A1 1 19 ? -19.156 9.34 -10.12 1.0 22.32 ? 19 A 2 +ATOM 285 C CG2 . THR A1 1 19 ? -16.75 9.507 -10.232 1.0 13.14 ? 19 A 2 +ATOM 286 H H . THR A1 1 19 ? -20.121 8.113 -12.292 1.0 1.15 ? 19 A 2 +ATOM 287 H HA . THR A1 1 19 ? -17.556 9.528 -12.607 1.0 65.43 ? 19 A 2 +ATOM 288 H HB . THR A1 1 19 ? -17.903 7.719 -10.291 1.0 44.24 ? 19 A 2 +ATOM 289 H HG1 . THR A1 1 19 ? -19.289 9.03 -9.221 1.0 60.25 ? 19 A 2 +ATOM 290 H HG21 . THR A1 1 19 ? -16.558 10.301 -10.938 1.0 73.33 ? 19 A 2 +ATOM 291 H HG22 . THR A1 1 19 ? -15.898 8.844 -10.197 1.0 23.45 ? 19 A 2 +ATOM 292 H HG23 . THR A1 1 19 ? -16.918 9.929 -9.252 1.0 51.03 ? 19 A 2 +ATOM 293 N N . ILE A1 1 20 ? -16.182 7.531 -13.181 1.0 2.13 ? 20 A 2 +ATOM 294 C CA . ILE A1 1 20 ? -15.433 6.387 -13.686 1.0 23.24 ? 20 A 2 +ATOM 295 C C . ILE A1 1 20 ? -13.956 6.495 -13.325 1.0 21.51 ? 20 A 2 +ATOM 296 O O . ILE A1 1 20 ? -13.335 7.541 -13.513 1.0 3.54 ? 20 A 2 +ATOM 297 C CB . ILE A1 1 20 ? -15.569 6.256 -15.214 1.0 55.55 ? 20 A 2 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.619 7.64 -15.864 1.0 1.5 ? 20 A 2 +ATOM 299 C CG2 . ILE A1 1 20 ? -16.812 5.454 -15.569 1.0 1.32 ? 20 A 2 +ATOM 300 C CD1 . ILE A1 1 20 ? -14.938 7.699 -17.214 1.0 2.4 ? 20 A 2 +ATOM 301 H H . ILE A1 1 20 ? -15.766 8.418 -13.194 1.0 32.52 ? 20 A 2 +ATOM 302 H HA . ILE A1 1 20 ? -15.84 5.496 -13.23 1.0 40.32 ? 20 A 2 +ATOM 303 H HB . ILE A1 1 20 ? -14.708 5.722 -15.586 1.0 75.22 ? 20 A 2 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.648 7.931 -16.0 1.0 4.24 ? 20 A 2 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.131 8.352 -15.215 1.0 20.02 ? 20 A 2 +ATOM 306 H HG21 . ILE A1 1 20 ? -16.658 4.948 -16.511 1.0 41.11 ? 20 A 2 +ATOM 307 H HG22 . ILE A1 1 20 ? -17.001 4.723 -14.796 1.0 51.34 ? 20 A 2 +ATOM 308 H HG23 . ILE A1 1 20 ? -17.659 6.118 -15.651 1.0 74.34 ? 20 A 2 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.155 6.795 -17.766 1.0 44.23 ? 20 A 2 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.304 8.552 -17.766 1.0 43.31 ? 20 A 2 +ATOM 311 H HD13 . ILE A1 1 20 ? -13.871 7.788 -17.076 1.0 23.14 ? 20 A 2 +ATOM 312 N N . ASP A1 1 21 ? -13.398 5.406 -12.809 1.0 44.41 ? 21 A 2 +ATOM 313 C CA . ASP A1 1 21 ? -11.991 5.376 -12.424 1.0 13.43 ? 21 A 2 +ATOM 314 C C . ASP A1 1 21 ? -11.103 5.106 -13.635 1.0 74.52 ? 21 A 2 +ATOM 315 O O . ASP A1 1 21 ? -11.316 4.144 -14.372 1.0 3.25 ? 21 A 2 +ATOM 316 C CB . ASP A1 1 21 ? -11.755 4.308 -11.355 1.0 40.32 ? 21 A 2 +ATOM 317 C CG . ASP A1 1 21 ? -12.249 2.94 -11.784 1.0 70.32 ? 21 A 2 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.475 2.708 -11.728 1.0 34.41 ? 21 A 2 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.41 2.101 -12.174 1.0 4.34 ? 21 A 2 +ATOM 320 H H . ASP A1 1 21 ? -13.945 4.602 -12.683 1.0 61.24 ? 21 A 2 +ATOM 321 H HA . ASP A1 1 21 ? -11.738 6.343 -12.016 1.0 0.1 ? 21 A 2 +ATOM 322 H HB2 . ASP A1 1 21 ? -10.696 4.24 -11.151 1.0 73.15 ? 21 A 2 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.274 4.592 -10.452 1.0 61.23 ? 21 A 2 +ATOM 324 N N . VAL A1 1 22 ? -10.107 5.964 -13.834 1.0 30.34 ? 22 A 2 +ATOM 325 C CA . VAL A1 1 22 ? -9.186 5.819 -14.955 1.0 1.34 ? 22 A 2 +ATOM 326 C C . VAL A1 1 22 ? -7.747 6.074 -14.521 1.0 61.2 ? 22 A 2 +ATOM 327 O O . VAL A1 1 22 ? -7.5 6.647 -13.459 1.0 34.03 ? 22 A 2 +ATOM 328 C CB . VAL A1 1 22 ? -9.542 6.782 -16.103 1.0 60.13 ? 22 A 2 +ATOM 329 C CG1 . VAL A1 1 22 ? -10.989 7.238 -15.987 1.0 14.0 ? 22 A 2 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.597 7.974 -16.11 1.0 61.12 ? 22 A 2 +ATOM 331 H H . VAL A1 1 22 ? -9.988 6.711 -13.212 1.0 71.0 ? 22 A 2 +ATOM 332 H HA . VAL A1 1 22 ? -9.266 4.807 -15.324 1.0 41.13 ? 22 A 2 +ATOM 333 H HB . VAL A1 1 22 ? -9.428 6.253 -17.038 1.0 23.42 ? 22 A 2 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.618 6.387 -15.774 1.0 3.13 ? 22 A 2 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.076 7.961 -15.19 1.0 11.12 ? 22 A 2 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.299 7.689 -16.918 1.0 2.3 ? 22 A 2 +ATOM 337 H HG21 . VAL A1 1 22 ? -8.987 8.739 -16.766 1.0 43.3 ? 22 A 2 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.509 8.368 -15.109 1.0 71.52 ? 22 A 2 +ATOM 339 H HG23 . VAL A1 1 22 ? -7.624 7.661 -16.46 1.0 24.41 ? 22 A 2 +ATOM 340 N N . ASP A1 1 23 ? -6.8 5.644 -15.348 1.0 73.14 ? 23 A 2 +ATOM 341 C CA . ASP A1 1 23 ? -5.384 5.827 -15.05 1.0 0.33 ? 23 A 2 +ATOM 342 C C . ASP A1 1 23 ? -4.695 6.621 -16.156 1.0 62.12 ? 23 A 2 +ATOM 343 O O . ASP A1 1 23 ? -5.215 6.74 -17.266 1.0 35.34 ? 23 A 2 +ATOM 344 C CB . ASP A1 1 23 ? -4.699 4.471 -14.875 1.0 24.44 ? 23 A 2 +ATOM 345 C CG . ASP A1 1 23 ? -3.569 4.52 -13.864 1.0 11.25 ? 23 A 2 +ATOM 346 O OD1 . ASP A1 1 23 ? -3.035 5.623 -13.625 1.0 71.52 ? 23 A 2 +ATOM 347 O OD2 . ASP A1 1 23 ? -3.219 3.455 -13.313 1.0 54.12 ? 23 A 2 +ATOM 348 H H . ASP A1 1 23 ? -7.06 5.194 -16.179 1.0 71.31 ? 23 A 2 +ATOM 349 H HA . ASP A1 1 23 ? -5.308 6.381 -14.127 1.0 62.03 ? 23 A 2 +ATOM 350 H HB2 . ASP A1 1 23 ? -5.427 3.748 -14.538 1.0 75.32 ? 23 A 2 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.295 4.154 -15.825 1.0 32.1 ? 23 A 2 +ATOM 352 N N . HIS A1 1 24 ? -3.521 7.162 -15.845 1.0 3.42 ? 24 A 2 +ATOM 353 C CA . HIS A1 1 24 ? -2.76 7.945 -16.813 1.0 64.1 ? 24 A 2 +ATOM 354 C C . HIS A1 1 24 ? -2.429 7.11 -18.047 1.0 13.22 ? 24 A 2 +ATOM 355 O O . HIS A1 1 24 ? -2.085 7.649 -19.098 1.0 40.32 ? 24 A 2 +ATOM 356 C CB . HIS A1 1 24 ? -1.472 8.469 -16.177 1.0 43.52 ? 24 A 2 +ATOM 357 C CG . HIS A1 1 24 ? -1.255 9.936 -16.386 1.0 63.23 ? 24 A 2 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.191 10.444 -17.1 1.0 33.23 ? 24 A 2 +ATOM 359 C CD2 . HIS A1 1 24 ? -1.973 11.005 -15.971 1.0 70.35 ? 24 A 2 +ATOM 360 C CE1 . HIS A1 1 24 ? -0.263 11.763 -17.114 1.0 52.22 ? 24 A 2 +ATOM 361 N NE2 . HIS A1 1 24 ? -1.336 12.129 -16.436 1.0 51.1 ? 24 A 2 +ATOM 362 H H . HIS A1 1 24 ? -3.158 7.032 -14.945 1.0 35.01 ? 24 A 2 +ATOM 363 H HA . HIS A1 1 24 ? -3.37 8.783 -17.114 1.0 52.33 ? 24 A 2 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.505 8.287 -15.113 1.0 74.33 ? 24 A 2 +ATOM 365 H HB3 . HIS A1 1 24 ? -0.629 7.943 -16.601 1.0 2.24 ? 24 A 2 +ATOM 366 H HD1 . HIS A1 1 24 ? 0.513 9.917 -17.531 1.0 61.24 ? 24 A 2 +ATOM 367 H HD2 . HIS A1 1 24 ? -2.88 10.98 -15.382 1.0 14.35 ? 24 A 2 +ATOM 368 H HE1 . HIS A1 1 24 ? 0.435 12.43 -17.598 1.0 73.24 ? 24 A 2 +ATOM 369 N N . ALA A1 1 25 ? -2.535 5.793 -17.91 1.0 63.43 ? 25 A 2 +ATOM 370 C CA . ALA A1 1 25 ? -2.248 4.885 -19.013 1.0 43.32 ? 25 A 2 +ATOM 371 C C . ALA A1 1 25 ? -3.505 4.594 -19.826 1.0 33.54 ? 25 A 2 +ATOM 372 O O . ALA A1 1 25 ? -3.491 3.762 -20.733 1.0 12.23 ? 25 A 2 +ATOM 373 C CB . ALA A1 1 25 ? -1.646 3.59 -18.488 1.0 51.34 ? 25 A 2 +ATOM 374 H H . ALA A1 1 25 ? -2.814 5.423 -17.046 1.0 55.41 ? 25 A 2 +ATOM 375 H HA . ALA A1 1 25 ? -1.519 5.358 -19.654 1.0 23.12 ? 25 A 2 +ATOM 376 H HB1 . ALA A1 1 25 ? -0.692 3.799 -18.025 1.0 42.21 ? 25 A 2 +ATOM 377 H HB2 . ALA A1 1 25 ? -2.312 3.152 -17.76 1.0 3.14 ? 25 A 2 +ATOM 378 H HB3 . ALA A1 1 25 ? -1.505 2.901 -19.307 1.0 44.44 ? 25 A 2 +ATOM 379 N N . ASP A1 1 26 ? -4.591 5.284 -19.494 1.0 53.31 ? 26 A 2 +ATOM 380 C CA . ASP A1 1 26 ? -5.857 5.1 -20.194 1.0 71.32 ? 26 A 2 +ATOM 381 C C . ASP A1 1 26 ? -6.209 6.337 -21.015 1.0 31.24 ? 26 A 2 +ATOM 382 O O . ASP A1 1 26 ? -6.357 7.433 -20.474 1.0 53.43 ? 26 A 2 +ATOM 383 C CB . ASP A1 1 26 ? -6.977 4.799 -19.196 1.0 21.1 ? 26 A 2 +ATOM 384 C CG . ASP A1 1 26 ? -6.751 3.5 -18.447 1.0 73.54 ? 26 A 2 +ATOM 385 O OD1 . ASP A1 1 26 ? -6.078 3.531 -17.396 1.0 73.22 ? 26 A 2 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.246 2.452 -18.913 1.0 2.02 ? 26 A 2 +ATOM 387 H H . ASP A1 1 26 ? -4.54 5.933 -18.762 1.0 73.33 ? 26 A 2 +ATOM 388 H HA . ASP A1 1 26 ? -5.748 4.259 -20.862 1.0 35.3 ? 26 A 2 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.034 5.602 -18.476 1.0 71.15 ? 26 A 2 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.914 4.729 -19.728 1.0 51.4 ? 26 A 2 +ATOM 391 N N . THR A1 1 27 ? -6.342 6.153 -22.325 1.0 11.22 ? 27 A 2 +ATOM 392 C CA . THR A1 1 27 ? -6.675 7.254 -23.221 1.0 12.11 ? 27 A 2 +ATOM 393 C C . THR A1 1 27 ? -8.175 7.522 -23.229 1.0 24.55 ? 27 A 2 +ATOM 394 O O . THR A1 1 27 ? -8.961 6.728 -22.711 1.0 14.34 ? 27 A 2 +ATOM 395 C CB . THR A1 1 27 ? -6.207 6.967 -24.66 1.0 24.42 ? 27 A 2 +ATOM 396 O OG1 . THR A1 1 27 ? -6.289 5.564 -24.931 1.0 51.41 ? 27 A 2 +ATOM 397 C CG2 . THR A1 1 27 ? -4.779 7.447 -24.871 1.0 72.22 ? 27 A 2 +ATOM 398 H H . THR A1 1 27 ? -6.213 5.256 -22.696 1.0 1.33 ? 27 A 2 +ATOM 399 H HA . THR A1 1 27 ? -6.163 8.137 -22.868 1.0 54.42 ? 27 A 2 +ATOM 400 H HB . THR A1 1 27 ? -6.855 7.497 -25.345 1.0 51.23 ? 27 A 2 +ATOM 401 H HG1 . THR A1 1 27 ? -5.461 5.142 -24.69 1.0 23.44 ? 27 A 2 +ATOM 402 H HG21 . THR A1 1 27 ? -4.464 7.205 -25.875 1.0 20.21 ? 27 A 2 +ATOM 403 H HG22 . THR A1 1 27 ? -4.127 6.96 -24.162 1.0 40.31 ? 27 A 2 +ATOM 404 H HG23 . THR A1 1 27 ? -4.734 8.516 -24.727 1.0 53.14 ? 27 A 2 +ATOM 405 N N . VAL A1 1 28 ? -8.568 8.644 -23.823 1.0 70.04 ? 28 A 2 +ATOM 406 C CA . VAL A1 1 28 ? -9.976 9.016 -23.901 1.0 40.12 ? 28 A 2 +ATOM 407 C C . VAL A1 1 28 ? -10.809 7.891 -24.504 1.0 43.3 ? 28 A 2 +ATOM 408 O O . VAL A1 1 28 ? -11.861 7.532 -23.977 1.0 51.44 ? 28 A 2 +ATOM 409 C CB . VAL A1 1 28 ? -10.174 10.293 -24.739 1.0 70.14 ? 28 A 2 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.568 10.862 -24.524 1.0 13.41 ? 28 A 2 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.109 11.324 -24.398 1.0 73.55 ? 28 A 2 +ATOM 412 H H . VAL A1 1 28 ? -7.895 9.237 -24.218 1.0 50.23 ? 28 A 2 +ATOM 413 H HA . VAL A1 1 28 ? -10.326 9.212 -22.897 1.0 62.42 ? 28 A 2 +ATOM 414 H HB . VAL A1 1 28 ? -10.072 10.033 -25.783 1.0 52.41 ? 28 A 2 +ATOM 415 H HG11 . VAL A1 1 28 ? -12.292 10.062 -24.558 1.0 72.32 ? 28 A 2 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.613 11.35 -23.562 1.0 75.12 ? 28 A 2 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.787 11.578 -25.302 1.0 43.12 ? 28 A 2 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.511 10.966 -23.573 1.0 22.23 ? 28 A 2 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.477 11.486 -25.258 1.0 21.24 ? 28 A 2 +ATOM 420 H HG23 . VAL A1 1 28 ? -9.584 12.254 -24.121 1.0 51.43 ? 28 A 2 +ATOM 421 N N . GLY A1 1 29 ? -10.329 7.336 -25.613 1.0 51.02 ? 29 A 2 +ATOM 422 C CA . GLY A1 1 29 ? -11.042 6.256 -26.271 1.0 24.21 ? 29 A 2 +ATOM 423 C C . GLY A1 1 29 ? -11.509 5.192 -25.297 1.0 62.32 ? 29 A 2 +ATOM 424 O O . GLY A1 1 29 ? -12.671 4.787 -25.32 1.0 1.41 ? 29 A 2 +ATOM 425 H H . GLY A1 1 29 ? -9.485 7.663 -25.989 1.0 25.44 ? 29 A 2 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.901 6.665 -26.781 1.0 33.14 ? 29 A 2 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.387 5.799 -26.998 1.0 61.11 ? 29 A 2 +ATOM 428 N N . ALA A1 1 30 ? -10.601 4.738 -24.439 1.0 0.3 ? 30 A 2 +ATOM 429 C CA . ALA A1 1 30 ? -10.926 3.715 -23.453 1.0 24.42 ? 30 A 2 +ATOM 430 C C . ALA A1 1 30 ? -11.993 4.209 -22.482 1.0 23.15 ? 30 A 2 +ATOM 431 O O . ALA A1 1 30 ? -12.853 3.443 -22.047 1.0 23.32 ? 30 A 2 +ATOM 432 C CB . ALA A1 1 30 ? -9.675 3.294 -22.697 1.0 4.23 ? 30 A 2 +ATOM 433 H H . ALA A1 1 30 ? -9.691 5.1 -24.47 1.0 13.0 ? 30 A 2 +ATOM 434 H HA . ALA A1 1 30 ? -11.306 2.852 -23.981 1.0 42.35 ? 30 A 2 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.954 2.675 -21.856 1.0 24.3 ? 30 A 2 +ATOM 436 H HB2 . ALA A1 1 30 ? -9.028 2.735 -23.356 1.0 15.25 ? 30 A 2 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.157 4.172 -22.342 1.0 54.13 ? 30 A 2 +ATOM 438 N N . VAL A1 1 31 ? -11.93 5.493 -22.144 1.0 44.02 ? 31 A 2 +ATOM 439 C CA . VAL A1 1 31 ? -12.891 6.089 -21.223 1.0 44.43 ? 31 A 2 +ATOM 440 C C . VAL A1 1 31 ? -14.295 6.084 -21.816 1.0 22.33 ? 31 A 2 +ATOM 441 O O . VAL A1 1 31 ? -15.264 5.729 -21.144 1.0 41.34 ? 31 A 2 +ATOM 442 C CB . VAL A1 1 31 ? -12.502 7.536 -20.865 1.0 42.01 ? 31 A 2 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.589 8.189 -20.026 1.0 61.22 ? 31 A 2 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.166 7.563 -20.138 1.0 34.2 ? 31 A 2 +ATOM 445 H H . VAL A1 1 31 ? -11.221 6.053 -22.524 1.0 33.11 ? 31 A 2 +ATOM 446 H HA . VAL A1 1 31 ? -12.891 5.504 -20.316 1.0 53.53 ? 31 A 2 +ATOM 447 H HB . VAL A1 1 31 ? -12.4 8.097 -21.783 1.0 34.14 ? 31 A 2 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.306 7.441 -19.721 1.0 24.43 ? 31 A 2 +ATOM 449 H HG12 . VAL A1 1 31 ? -13.145 8.642 -19.151 1.0 62.24 ? 31 A 2 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.088 8.948 -20.61 1.0 4.44 ? 31 A 2 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.977 6.597 -19.695 1.0 32.4 ? 31 A 2 +ATOM 452 H HG22 . VAL A1 1 31 ? -10.379 7.798 -20.84 1.0 31.51 ? 31 A 2 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.192 8.316 -19.363 1.0 2.41 ? 31 A 2 +ATOM 454 N N . LYS A1 1 32 ? -14.4 6.481 -23.08 1.0 44.33 ? 32 A 2 +ATOM 455 C CA . LYS A1 1 32 ? -15.686 6.521 -23.766 1.0 33.41 ? 32 A 2 +ATOM 456 C C . LYS A1 1 32 ? -16.367 5.157 -23.725 1.0 33.52 ? 32 A 2 +ATOM 457 O O . LYS A1 1 32 ? -17.57 5.06 -23.485 1.0 55.22 ? 32 A 2 +ATOM 458 C CB . LYS A1 1 32 ? -15.499 6.966 -25.218 1.0 21.43 ? 32 A 2 +ATOM 459 C CG . LYS A1 1 32 ? -16.17 8.291 -25.539 1.0 62.04 ? 32 A 2 +ATOM 460 C CD . LYS A1 1 32 ? -15.159 9.422 -25.625 1.0 13.3 ? 32 A 2 +ATOM 461 C CE . LYS A1 1 32 ? -14.915 9.842 -27.066 1.0 61.02 ? 32 A 2 +ATOM 462 N NZ . LYS A1 1 32 ? -16.108 10.508 -27.659 1.0 10.13 ? 32 A 2 +ATOM 463 H H . LYS A1 1 32 ? -13.591 6.753 -23.564 1.0 0.43 ? 32 A 2 +ATOM 464 H HA . LYS A1 1 32 ? -16.312 7.238 -23.256 1.0 20.21 ? 32 A 2 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.442 7.064 -25.418 1.0 31.13 ? 32 A 2 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.912 6.21 -25.87 1.0 51.43 ? 32 A 2 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.68 8.205 -26.487 1.0 34.55 ? 32 A 2 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.886 8.518 -24.762 1.0 75.31 ? 32 A 2 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.534 10.271 -25.073 1.0 62.53 ? 32 A 2 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.225 9.092 -25.192 1.0 34.24 ? 32 A 2 +ATOM 471 H HE2 . LYS A1 1 32 ? -14.082 10.527 -27.092 1.0 32.35 ? 32 A 2 +ATOM 472 H HE3 . LYS A1 1 32 ? -14.677 8.964 -27.648 1.0 31.14 ? 32 A 2 +ATOM 473 H HZ1 . LYS A1 1 32 ? -15.845 11.439 -28.041 1.0 3.34 ? 32 A 2 +ATOM 474 H HZ2 . LYS A1 1 32 ? -16.842 10.638 -26.934 1.0 11.13 ? 32 A 2 +ATOM 475 H HZ3 . LYS A1 1 32 ? -16.496 9.927 -28.429 1.0 13.55 ? 32 A 2 +ATOM 476 N N . ALA A1 1 33 ? -15.589 4.105 -23.96 1.0 34.21 ? 33 A 2 +ATOM 477 C CA . ALA A1 1 33 ? -16.117 2.746 -23.947 1.0 60.31 ? 33 A 2 +ATOM 478 C C . ALA A1 1 33 ? -16.633 2.371 -22.562 1.0 31.03 ? 33 A 2 +ATOM 479 O O . ALA A1 1 33 ? -17.661 1.707 -22.429 1.0 31.32 ? 33 A 2 +ATOM 480 C CB . ALA A1 1 33 ? -15.05 1.761 -24.4 1.0 54.24 ? 33 A 2 +ATOM 481 H H . ALA A1 1 33 ? -14.638 4.246 -24.146 1.0 43.1 ? 33 A 2 +ATOM 482 H HA . ALA A1 1 33 ? -16.937 2.7 -24.65 1.0 53.01 ? 33 A 2 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.146 1.925 -23.832 1.0 2.33 ? 33 A 2 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.4 0.752 -24.238 1.0 61.23 ? 33 A 2 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.847 1.908 -25.45 1.0 53.23 ? 33 A 2 +ATOM 486 N N . LYS A1 1 34 ? -15.912 2.8 -21.531 1.0 30.14 ? 34 A 2 +ATOM 487 C CA . LYS A1 1 34 ? -16.296 2.51 -20.155 1.0 3.41 ? 34 A 2 +ATOM 488 C C . LYS A1 1 34 ? -17.675 3.083 -19.843 1.0 51.04 ? 34 A 2 +ATOM 489 O O . LYS A1 1 34 ? -18.501 2.425 -19.21 1.0 30.3 ? 34 A 2 +ATOM 490 C CB . LYS A1 1 34 ? -15.262 3.084 -19.184 1.0 63.02 ? 34 A 2 +ATOM 491 C CG . LYS A1 1 34 ? -15.529 2.729 -17.731 1.0 24.43 ? 34 A 2 +ATOM 492 C CD . LYS A1 1 34 ? -15.352 1.241 -17.479 1.0 44.42 ? 34 A 2 +ATOM 493 C CE . LYS A1 1 34 ? -13.887 0.836 -17.539 1.0 34.12 ? 34 A 2 +ATOM 494 N NZ . LYS A1 1 34 ? -13.662 -0.52 -16.967 1.0 13.0 ? 34 A 2 +ATOM 495 H H . LYS A1 1 34 ? -15.101 3.325 -21.701 1.0 65.25 ? 34 A 2 +ATOM 496 H HA . LYS A1 1 34 ? -16.33 1.437 -20.039 1.0 3.22 ? 34 A 2 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.286 2.706 -19.451 1.0 71.03 ? 34 A 2 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.259 4.16 -19.275 1.0 71.12 ? 34 A 2 +ATOM 499 H HG2 . LYS A1 1 34 ? -14.84 3.274 -17.104 1.0 24.23 ? 34 A 2 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.543 3.008 -17.483 1.0 22.21 ? 34 A 2 +ATOM 501 H HD2 . LYS A1 1 34 ? -15.739 1.002 -16.5 1.0 63.43 ? 34 A 2 +ATOM 502 H HD3 . LYS A1 1 34 ? -15.9 0.689 -18.23 1.0 75.33 ? 34 A 2 +ATOM 503 H HE2 . LYS A1 1 34 ? -13.568 0.84 -18.57 1.0 34.14 ? 34 A 2 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.305 1.554 -16.98 1.0 0.12 ? 34 A 2 +ATOM 505 H HZ1 . LYS A1 1 34 ? -13.236 -1.144 -17.682 1.0 62.42 ? 34 A 2 +ATOM 506 H HZ2 . LYS A1 1 34 ? -14.566 -0.932 -16.659 1.0 14.2 ? 34 A 2 +ATOM 507 H HZ3 . LYS A1 1 34 ? -13.024 -0.462 -16.148 1.0 65.2 ? 34 A 2 +ATOM 508 N N . ILE A1 1 35 ? -17.916 4.31 -20.291 1.0 14.42 ? 35 A 2 +ATOM 509 C CA . ILE A1 1 35 ? -19.196 4.969 -20.062 1.0 22.32 ? 35 A 2 +ATOM 510 C C . ILE A1 1 35 ? -20.314 4.285 -20.841 1.0 74.31 ? 35 A 2 +ATOM 511 O O . ILE A1 1 35 ? -21.449 4.199 -20.372 1.0 33.23 ? 35 A 2 +ATOM 512 C CB . ILE A1 1 35 ? -19.143 6.456 -20.46 1.0 42.5 ? 35 A 2 +ATOM 513 C CG1 . ILE A1 1 35 ? -17.971 7.151 -19.764 1.0 22.04 ? 35 A 2 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.455 7.143 -20.114 1.0 45.14 ? 35 A 2 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.034 7.077 -18.254 1.0 11.1 ? 35 A 2 +ATOM 516 H H . ILE A1 1 35 ? -17.217 4.783 -20.79 1.0 54.44 ? 35 A 2 +ATOM 517 H HA . ILE A1 1 35 ? -19.417 4.907 -19.006 1.0 30.01 ? 35 A 2 +ATOM 518 H HB . ILE A1 1 35 ? -19.004 6.514 -21.528 1.0 2.44 ? 35 A 2 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.048 6.69 -20.079 1.0 3.24 ? 35 A 2 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.962 8.194 -20.046 1.0 0.11 ? 35 A 2 +ATOM 521 H HG21 . ILE A1 1 35 ? -21.164 6.409 -19.76 1.0 65.32 ? 35 A 2 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.283 7.878 -19.342 1.0 43.1 ? 35 A 2 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.849 7.63 -20.993 1.0 75.41 ? 35 A 2 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.443 7.876 -17.83 1.0 43.52 ? 35 A 2 +ATOM 525 H HD12 . ILE A1 1 35 ? -19.06 7.179 -17.931 1.0 71.15 ? 35 A 2 +ATOM 526 H HD13 . ILE A1 1 35 ? -17.644 6.127 -17.923 1.0 74.3 ? 35 A 2 +ATOM 527 N N . TYR A1 1 36 ? -19.985 3.798 -22.032 1.0 62.53 ? 36 A 2 +ATOM 528 C CA . TYR A1 1 36 ? -20.962 3.122 -22.878 1.0 64.44 ? 36 A 2 +ATOM 529 C C . TYR A1 1 36 ? -21.59 1.94 -22.146 1.0 53.42 ? 36 A 2 +ATOM 530 O O . TYR A1 1 36 ? -22.807 1.756 -22.171 1.0 34.33 ? 36 A 2 +ATOM 531 C CB . TYR A1 1 36 ? -20.302 2.643 -24.172 1.0 74.42 ? 36 A 2 +ATOM 532 C CG . TYR A1 1 36 ? -20.678 1.23 -24.556 1.0 43.51 ? 36 A 2 +ATOM 533 C CD1 . TYR A1 1 36 ? -21.949 0.932 -25.032 1.0 62.31 ? 36 A 2 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.761 0.191 -24.443 1.0 22.21 ? 36 A 2 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.296 -0.358 -25.384 1.0 25.24 ? 36 A 2 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.1 -1.101 -24.793 1.0 24.41 ? 36 A 2 +ATOM 537 C CZ . TYR A1 1 36 ? -21.369 -1.371 -25.262 1.0 51.0 ? 36 A 2 +ATOM 538 O OH . TYR A1 1 36 ? -21.71 -2.657 -25.612 1.0 31.41 ? 36 A 2 +ATOM 539 H H . TYR A1 1 36 ? -19.064 3.898 -22.352 1.0 42.53 ? 36 A 2 +ATOM 540 H HA . TYR A1 1 36 ? -21.738 3.833 -23.122 1.0 45.34 ? 36 A 2 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.596 3.295 -24.98 1.0 32.41 ? 36 A 2 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.229 2.682 -24.057 1.0 73.31 ? 36 A 2 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.673 1.729 -25.127 1.0 14.41 ? 36 A 2 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.768 0.406 -24.075 1.0 73.43 ? 36 A 2 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.29 -0.569 -25.751 1.0 30.0 ? 36 A 2 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.374 -1.895 -24.698 1.0 11.1 ? 36 A 2 +ATOM 547 H HH . TYR A1 1 36 ? -21.252 -2.901 -26.42 1.0 20.21 ? 36 A 2 +ATOM 548 N N . ASP A1 1 37 ? -20.751 1.142 -21.495 1.0 31.31 ? 37 A 2 +ATOM 549 C CA . ASP A1 1 37 ? -21.222 -0.022 -20.754 1.0 4.3 ? 37 A 2 +ATOM 550 C C . ASP A1 1 37 ? -21.886 0.399 -19.446 1.0 30.32 ? 37 A 2 +ATOM 551 O O . ASP A1 1 37 ? -22.812 -0.257 -18.968 1.0 62.0 ? 37 A 2 +ATOM 552 C CB . ASP A1 1 37 ? -20.06 -0.975 -20.467 1.0 35.43 ? 37 A 2 +ATOM 553 C CG . ASP A1 1 37 ? -20.407 -2.419 -20.772 1.0 34.32 ? 37 A 2 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.364 -2.941 -20.163 1.0 31.12 ? 37 A 2 +ATOM 555 O OD2 . ASP A1 1 37 ? -19.722 -3.026 -21.622 1.0 3.2 ? 37 A 2 +ATOM 556 H H . ASP A1 1 37 ? -19.791 1.342 -21.512 1.0 51.42 ? 37 A 2 +ATOM 557 H HA . ASP A1 1 37 ? -21.951 -0.532 -21.365 1.0 32.24 ? 37 A 2 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.212 -0.692 -21.074 1.0 43.14 ? 37 A 2 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.792 -0.901 -19.423 1.0 34.23 ? 37 A 2 +ATOM 560 N N . LYS A1 1 38 ? -21.406 1.496 -18.871 1.0 33.03 ? 38 A 2 +ATOM 561 C CA . LYS A1 1 38 ? -21.952 2.005 -17.619 1.0 33.5 ? 38 A 2 +ATOM 562 C C . LYS A1 1 38 ? -23.457 2.228 -17.732 1.0 62.1 ? 38 A 2 +ATOM 563 O O . LYS A1 1 38 ? -24.219 1.831 -16.852 1.0 13.24 ? 38 A 2 +ATOM 564 C CB . LYS A1 1 38 ? -21.26 3.314 -17.232 1.0 32.13 ? 38 A 2 +ATOM 565 C CG . LYS A1 1 38 ? -20.428 3.211 -15.965 1.0 11.13 ? 38 A 2 +ATOM 566 C CD . LYS A1 1 38 ? -18.959 2.98 -16.28 1.0 55.11 ? 38 A 2 +ATOM 567 C CE . LYS A1 1 38 ? -18.649 1.5 -16.442 1.0 12.13 ? 38 A 2 +ATOM 568 N NZ . LYS A1 1 38 ? -18.084 0.912 -15.197 1.0 62.42 ? 38 A 2 +ATOM 569 H H . LYS A1 1 38 ? -20.666 1.976 -19.3 1.0 40.1 ? 38 A 2 +ATOM 570 H HA . LYS A1 1 38 ? -21.766 1.269 -16.852 1.0 13.43 ? 38 A 2 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.611 3.617 -18.04 1.0 53.44 ? 38 A 2 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.012 4.075 -17.081 1.0 74.35 ? 38 A 2 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.525 4.129 -15.405 1.0 72.35 ? 38 A 2 +ATOM 574 H HG3 . LYS A1 1 38 ? -20.793 2.384 -15.372 1.0 65.33 ? 38 A 2 +ATOM 575 H HD2 . LYS A1 1 38 ? -18.712 3.491 -17.199 1.0 31.44 ? 38 A 2 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.36 3.378 -15.473 1.0 51.13 ? 38 A 2 +ATOM 577 H HE2 . LYS A1 1 38 ? -19.561 0.98 -16.694 1.0 72.24 ? 38 A 2 +ATOM 578 H HE3 . LYS A1 1 38 ? -17.934 1.381 -17.243 1.0 52.14 ? 38 A 2 +ATOM 579 H HZ1 . LYS A1 1 38 ? -17.816 -0.08 -15.359 1.0 12.21 ? 38 A 2 +ATOM 580 H HZ2 . LYS A1 1 38 ? -18.789 0.949 -14.432 1.0 31.3 ? 38 A 2 +ATOM 581 H HZ3 . LYS A1 1 38 ? -17.241 1.443 -14.901 1.0 72.13 ? 38 A 2 +ATOM 582 N N . GLU A1 1 39 ? -23.876 2.864 -18.822 1.0 74.33 ? 39 A 2 +ATOM 583 C CA . GLU A1 1 39 ? -25.29 3.138 -19.049 1.0 31.43 ? 39 A 2 +ATOM 584 C C . GLU A1 1 39 ? -25.827 2.301 -20.206 1.0 55.55 ? 39 A 2 +ATOM 585 O O . GLU A1 1 39 ? -26.813 1.579 -20.06 1.0 44.25 ? 39 A 2 +ATOM 586 C CB . GLU A1 1 39 ? -25.504 4.625 -19.338 1.0 31.12 ? 39 A 2 +ATOM 587 C CG . GLU A1 1 39 ? -24.358 5.268 -20.1 1.0 22.34 ? 39 A 2 +ATOM 588 C CD . GLU A1 1 39 ? -24.532 6.766 -20.261 1.0 34.02 ? 39 A 2 +ATOM 589 O OE1 . GLU A1 1 39 ? -25.658 7.202 -20.577 1.0 60.52 ? 39 A 2 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.541 7.502 -20.07 1.0 24.54 ? 39 A 2 +ATOM 591 H H . GLU A1 1 39 ? -23.219 3.156 -19.488 1.0 53.12 ? 39 A 2 +ATOM 592 H HA . GLU A1 1 39 ? -25.827 2.874 -18.15 1.0 24.23 ? 39 A 2 +ATOM 593 H HB2 . GLU A1 1 39 ? -26.406 4.74 -19.921 1.0 13.32 ? 39 A 2 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.624 5.148 -18.4 1.0 53.15 ? 39 A 2 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.438 5.084 -19.564 1.0 73.51 ? 39 A 2 +ATOM 596 H HG3 . GLU A1 1 39 ? -24.297 4.82 -21.08 1.0 55.55 ? 39 A 2 +ATOM 597 N N . GLY A1 1 40 ? -25.172 2.405 -21.358 1.0 41.31 ? 40 A 2 +ATOM 598 C CA . GLY A1 1 40 ? -25.598 1.653 -22.525 1.0 23.2 ? 40 A 2 +ATOM 599 C C . GLY A1 1 40 ? -25.921 2.548 -23.705 1.0 54.31 ? 40 A 2 +ATOM 600 O O . GLY A1 1 40 ? -26.988 2.43 -24.307 1.0 62.35 ? 40 A 2 +ATOM 601 H H . GLY A1 1 40 ? -24.392 2.996 -21.417 1.0 1.31 ? 40 A 2 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.809 0.972 -22.808 1.0 42.33 ? 40 A 2 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.478 1.082 -22.269 1.0 42.25 ? 40 A 2 +ATOM 604 N N . ILE A1 1 41 ? -24.999 3.446 -24.034 1.0 11.45 ? 41 A 2 +ATOM 605 C CA . ILE A1 1 41 ? -25.192 4.365 -25.149 1.0 13.21 ? 41 A 2 +ATOM 606 C C . ILE A1 1 41 ? -24.006 4.323 -26.107 1.0 73.14 ? 41 A 2 +ATOM 607 O O . ILE A1 1 41 ? -22.905 3.901 -25.754 1.0 54.03 ? 41 A 2 +ATOM 608 C CB . ILE A1 1 41 ? -25.391 5.811 -24.659 1.0 13.54 ? 41 A 2 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.516 6.082 -23.433 1.0 35.25 ? 41 A 2 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.856 6.065 -24.337 1.0 15.54 ? 41 A 2 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.984 7.497 -23.371 1.0 51.21 ? 41 A 2 +ATOM 612 H H . ILE A1 1 41 ? -24.169 3.492 -23.515 1.0 10.31 ? 41 A 2 +ATOM 613 H HA . ILE A1 1 41 ? -26.082 4.061 -25.681 1.0 22.4 ? 41 A 2 +ATOM 614 H HB . ILE A1 1 41 ? -25.1 6.48 -25.454 1.0 2.22 ? 41 A 2 +ATOM 615 H HG12 . ILE A1 1 41 ? -25.094 5.907 -22.54 1.0 53.25 ? 41 A 2 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.671 5.409 -23.448 1.0 73.21 ? 41 A 2 +ATOM 617 H HG21 . ILE A1 1 41 ? -27.049 7.128 -24.354 1.0 41.34 ? 41 A 2 +ATOM 618 H HG22 . ILE A1 1 41 ? -27.475 5.576 -25.074 1.0 35.01 ? 41 A 2 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.083 5.673 -23.357 1.0 24.24 ? 41 A 2 +ATOM 620 H HD11 . ILE A1 1 41 ? -24.734 8.145 -22.941 1.0 13.35 ? 41 A 2 +ATOM 621 H HD12 . ILE A1 1 41 ? -23.095 7.521 -22.758 1.0 5.02 ? 41 A 2 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.744 7.836 -24.368 1.0 73.01 ? 41 A 2 +ATOM 623 N N . PRO A1 1 42 ? -24.235 4.772 -27.351 1.0 42.01 ? 42 A 2 +ATOM 624 C CA . PRO A1 1 42 ? -23.197 4.799 -28.385 1.0 63.34 ? 42 A 2 +ATOM 625 C C . PRO A1 1 42 ? -22.121 5.841 -28.101 1.0 4.23 ? 42 A 2 +ATOM 626 O O . PRO A1 1 42 ? -22.367 7.047 -28.132 1.0 21.54 ? 42 A 2 +ATOM 627 C CB . PRO A1 1 42 ? -23.971 5.162 -29.655 1.0 63.45 ? 42 A 2 +ATOM 628 C CG . PRO A1 1 42 ? -25.17 5.901 -29.169 1.0 31.23 ? 42 A 2 +ATOM 629 C CD . PRO A1 1 42 ? -25.523 5.29 -27.841 1.0 52.22 ? 42 A 2 +ATOM 630 H HA . PRO A1 1 42 ? -22.734 3.83 -28.509 1.0 60.32 ? 42 A 2 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.354 5.783 -30.29 1.0 50.23 ? 42 A 2 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.249 4.262 -30.182 1.0 64.01 ? 42 A 2 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.933 6.947 -29.049 1.0 0.11 ? 42 A 2 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.985 5.777 -29.867 1.0 1.1 ? 42 A 2 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.917 6.041 -27.173 1.0 11.32 ? 42 A 2 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.235 4.488 -27.972 1.0 34.03 ? 42 A 2 +ATOM 637 N N . PRO A1 1 43 ? -20.898 5.368 -27.816 1.0 1.41 ? 43 A 2 +ATOM 638 C CA . PRO A1 1 43 ? -19.76 6.244 -27.522 1.0 62.53 ? 43 A 2 +ATOM 639 C C . PRO A1 1 43 ? -19.284 7.01 -28.751 1.0 21.35 ? 43 A 2 +ATOM 640 O O . PRO A1 1 43 ? -18.796 8.135 -28.642 1.0 73.42 ? 43 A 2 +ATOM 641 C CB . PRO A1 1 43 ? -18.678 5.271 -27.047 1.0 74.43 ? 43 A 2 +ATOM 642 C CG . PRO A1 1 43 ? -19.031 3.971 -27.684 1.0 42.11 ? 43 A 2 +ATOM 643 C CD . PRO A1 1 43 ? -20.533 3.943 -27.761 1.0 32.53 ? 43 A 2 +ATOM 644 H HA . PRO A1 1 43 ? -19.991 6.942 -26.73 1.0 3.1 ? 43 A 2 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.708 5.62 -27.373 1.0 1.2 ? 43 A 2 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.698 5.201 -25.97 1.0 52.2 ? 43 A 2 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.603 3.918 -28.673 1.0 21.5 ? 43 A 2 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.673 3.155 -27.074 1.0 41.32 ? 43 A 2 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.855 3.428 -28.654 1.0 55.24 ? 43 A 2 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.948 3.473 -26.882 1.0 31.14 ? 43 A 2 +ATOM 651 N N . ASP A1 1 44 ? -19.431 6.395 -29.919 1.0 54.12 ? 44 A 2 +ATOM 652 C CA . ASP A1 1 44 ? -19.017 7.021 -31.17 1.0 51.34 ? 44 A 2 +ATOM 653 C C . ASP A1 1 44 ? -19.978 8.14 -31.561 1.0 65.34 ? 44 A 2 +ATOM 654 O O . ASP A1 1 44 ? -19.655 8.983 -32.397 1.0 41.23 ? 44 A 2 +ATOM 655 C CB . ASP A1 1 44 ? -18.947 5.979 -32.287 1.0 23.35 ? 44 A 2 +ATOM 656 C CG . ASP A1 1 44 ? -18.062 6.421 -33.436 1.0 52.14 ? 44 A 2 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.84 6.173 -33.372 1.0 70.43 ? 44 A 2 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.591 7.015 -34.399 1.0 15.14 ? 44 A 2 +ATOM 659 H H . ASP A1 1 44 ? -19.827 5.498 -29.941 1.0 64.31 ? 44 A 2 +ATOM 660 H HA . ASP A1 1 44 ? -18.035 7.442 -31.021 1.0 72.42 ? 44 A 2 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.551 5.057 -31.887 1.0 64.21 ? 44 A 2 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.941 5.802 -32.67 1.0 74.33 ? 44 A 2 +ATOM 663 N N . GLN A1 1 45 ? -21.159 8.139 -30.951 1.0 24.51 ? 45 A 2 +ATOM 664 C CA . GLN A1 1 45 ? -22.166 9.154 -31.237 1.0 55.1 ? 45 A 2 +ATOM 665 C C . GLN A1 1 45 ? -22.061 10.317 -30.257 1.0 65.33 ? 45 A 2 +ATOM 666 O O . GLN A1 1 45 ? -22.663 11.37 -30.463 1.0 0.12 ? 45 A 2 +ATOM 667 C CB . GLN A1 1 45 ? -23.567 8.543 -31.174 1.0 3.33 ? 45 A 2 +ATOM 668 C CG . GLN A1 1 45 ? -24.028 7.939 -32.491 1.0 71.05 ? 45 A 2 +ATOM 669 C CD . GLN A1 1 45 ? -25.001 6.793 -32.298 1.0 50.21 ? 45 A 2 +ATOM 670 O OE1 . GLN A1 1 45 ? -26.134 6.993 -31.857 1.0 30.33 ? 45 A 2 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.565 5.583 -32.628 1.0 54.11 ? 45 A 2 +ATOM 672 H H . GLN A1 1 45 ? -21.357 7.441 -30.294 1.0 33.14 ? 45 A 2 +ATOM 673 H HA . GLN A1 1 45 ? -21.989 9.523 -32.236 1.0 54.13 ? 45 A 2 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.575 7.767 -30.424 1.0 72.22 ? 45 A 2 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.27 9.313 -30.891 1.0 51.24 ? 45 A 2 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.511 8.707 -33.075 1.0 11.31 ? 45 A 2 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.164 7.572 -33.025 1.0 33.23 ? 45 A 2 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.651 5.499 -32.972 1.0 35.4 ? 45 A 2 +ATOM 679 H HE22 . GLN A1 1 45 ? -25.173 4.824 -32.513 1.0 53.4 ? 45 A 2 +ATOM 680 N N . GLN A1 1 46 ? -21.292 10.119 -29.191 1.0 5.34 ? 46 A 2 +ATOM 681 C CA . GLN A1 1 46 ? -21.109 11.153 -28.179 1.0 54.21 ? 46 A 2 +ATOM 682 C C . GLN A1 1 46 ? -19.665 11.643 -28.156 1.0 23.33 ? 46 A 2 +ATOM 683 O O . GLN A1 1 46 ? -18.744 10.908 -28.512 1.0 42.0 ? 46 A 2 +ATOM 684 C CB . GLN A1 1 46 ? -21.502 10.62 -26.8 1.0 54.1 ? 46 A 2 +ATOM 685 C CG . GLN A1 1 46 ? -20.742 9.368 -26.392 1.0 63.33 ? 46 A 2 +ATOM 686 C CD . GLN A1 1 46 ? -20.699 9.174 -24.889 1.0 73.34 ? 46 A 2 +ATOM 687 O OE1 . GLN A1 1 46 ? -21.738 9.109 -24.231 1.0 62.34 ? 46 A 2 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.495 9.081 -24.338 1.0 52.51 ? 46 A 2 +ATOM 689 H H . GLN A1 1 46 ? -20.838 9.258 -29.083 1.0 61.13 ? 46 A 2 +ATOM 690 H HA . GLN A1 1 46 ? -21.753 11.981 -28.431 1.0 1.54 ? 46 A 2 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.311 11.387 -26.064 1.0 70.34 ? 46 A 2 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.557 10.389 -26.803 1.0 24.41 ? 46 A 2 +ATOM 693 H HG2 . GLN A1 1 46 ? -21.223 8.51 -26.837 1.0 71.34 ? 46 A 2 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.729 9.442 -26.76 1.0 12.44 ? 46 A 2 +ATOM 695 H HE21 . GLN A1 1 46 ? -18.712 9.143 -24.924 1.0 61.21 ? 46 A 2 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.438 8.956 -23.368 1.0 54.41 ? 46 A 2 +ATOM 697 N N . ARG A1 1 47 ? -19.475 12.889 -27.736 1.0 11.31 ? 47 A 2 +ATOM 698 C CA . ARG A1 1 47 ? -18.143 13.478 -27.668 1.0 74.42 ? 47 A 2 +ATOM 699 C C . ARG A1 1 47 ? -17.946 14.226 -26.353 1.0 0.05 ? 47 A 2 +ATOM 700 O O . ARG A1 1 47 ? -18.91 14.538 -25.652 1.0 62.43 ? 47 A 2 +ATOM 701 C CB . ARG A1 1 47 ? -17.922 14.429 -28.846 1.0 53.24 ? 47 A 2 +ATOM 702 C CG . ARG A1 1 47 ? -17.348 13.749 -30.078 1.0 25.13 ? 47 A 2 +ATOM 703 C CD . ARG A1 1 47 ? -17.619 14.558 -31.337 1.0 74.31 ? 47 A 2 +ATOM 704 N NE . ARG A1 1 47 ? -16.727 14.182 -32.431 1.0 72.02 ? 47 A 2 +ATOM 705 C CZ . ARG A1 1 47 ? -16.885 14.597 -33.683 1.0 4.33 ? 47 A 2 +ATOM 706 N NH1 . ARG A1 1 47 ? -17.895 15.396 -33.998 1.0 22.33 ? 47 A 2 +ATOM 707 N NH2 . ARG A1 1 47 ? -16.032 14.212 -34.623 1.0 24.44 ? 47 A 2 +ATOM 708 H H . ARG A1 1 47 ? -20.249 13.426 -27.465 1.0 14.32 ? 47 A 2 +ATOM 709 H HA . ARG A1 1 47 ? -17.423 12.676 -27.724 1.0 52.1 ? 47 A 2 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.868 14.875 -29.116 1.0 12.43 ? 47 A 2 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.24 15.208 -28.54 1.0 31.22 ? 47 A 2 +ATOM 712 H HG2 . ARG A1 1 47 ? -16.281 13.643 -29.955 1.0 2.15 ? 47 A 2 +ATOM 713 H HG3 . ARG A1 1 47 ? -17.8 12.774 -30.182 1.0 3.22 ? 47 A 2 +ATOM 714 H HD2 . ARG A1 1 47 ? -18.641 14.389 -31.644 1.0 62.34 ? 47 A 2 +ATOM 715 H HD3 . ARG A1 1 47 ? -17.479 15.605 -31.114 1.0 4.32 ? 47 A 2 +ATOM 716 H HE . ARG A1 1 47 ? -15.975 13.592 -32.221 1.0 51.12 ? 47 A 2 +ATOM 717 H HH11 . ARG A1 1 47 ? -18.539 15.689 -33.292 1.0 35.02 ? 47 A 2 +ATOM 718 H HH12 . ARG A1 1 47 ? -18.011 15.708 -34.941 1.0 42.25 ? 47 A 2 +ATOM 719 H HH21 . ARG A1 1 47 ? -15.269 13.609 -34.39 1.0 32.54 ? 47 A 2 +ATOM 720 H HH22 . ARG A1 1 47 ? -16.151 14.524 -35.565 1.0 51.04 ? 47 A 2 +ATOM 721 N N . LEU A1 1 48 ? -16.691 14.51 -26.023 1.0 13.42 ? 48 A 2 +ATOM 722 C CA . LEU A1 1 48 ? -16.366 15.221 -24.791 1.0 63.04 ? 48 A 2 +ATOM 723 C C . LEU A1 1 48 ? -16.012 16.677 -25.079 1.0 70.54 ? 48 A 2 +ATOM 724 O O . LEU A1 1 48 ? -15.464 16.995 -26.135 1.0 13.22 ? 48 A 2 +ATOM 725 C CB . LEU A1 1 48 ? -15.202 14.534 -24.074 1.0 73.22 ? 48 A 2 +ATOM 726 C CG . LEU A1 1 48 ? -15.157 13.009 -24.177 1.0 23.01 ? 48 A 2 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.555 12.424 -24.054 1.0 2.23 ? 48 A 2 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.511 12.582 -25.487 1.0 62.5 ? 48 A 2 +ATOM 729 H H . LEU A1 1 48 ? -15.965 14.236 -26.621 1.0 13.1 ? 48 A 2 +ATOM 730 H HA . LEU A1 1 48 ? -17.237 15.194 -24.153 1.0 5.14 ? 48 A 2 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.284 14.921 -24.489 1.0 14.35 ? 48 A 2 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.26 14.795 -23.027 1.0 62.22 ? 48 A 2 +ATOM 733 H HG . LEU A1 1 48 ? -14.559 12.618 -23.365 1.0 74.12 ? 48 A 2 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.179 13.099 -23.488 1.0 72.12 ? 48 A 2 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.503 11.471 -23.547 1.0 51.52 ? 48 A 2 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.975 12.285 -25.039 1.0 50.13 ? 48 A 2 +ATOM 737 H HD21 . LEU A1 1 48 ? -15.28 12.384 -26.219 1.0 32.51 ? 48 A 2 +ATOM 738 H HD22 . LEU A1 1 48 ? -13.928 11.687 -25.326 1.0 4.35 ? 48 A 2 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.867 13.372 -25.845 1.0 44.23 ? 48 A 2 +ATOM 740 N N . ILE A1 1 49 ? -16.329 17.555 -24.134 1.0 13.31 ? 49 A 2 +ATOM 741 C CA . ILE A1 1 49 ? -16.041 18.976 -24.286 1.0 13.25 ? 49 A 2 +ATOM 742 C C . ILE A1 1 49 ? -15.541 19.578 -22.977 1.0 73.24 ? 49 A 2 +ATOM 743 O O . ILE A1 1 49 ? -16.186 19.453 -21.936 1.0 20.41 ? 49 A 2 +ATOM 744 C CB . ILE A1 1 49 ? -17.284 19.755 -24.754 1.0 42.12 ? 49 A 2 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.398 19.708 -26.279 1.0 21.4 ? 49 A 2 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.222 21.195 -24.267 1.0 44.11 ? 49 A 2 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.579 18.9 -26.772 1.0 30.32 ? 49 A 2 +ATOM 748 H H . ILE A1 1 49 ? -16.765 17.24 -23.315 1.0 11.12 ? 49 A 2 +ATOM 749 H HA . ILE A1 1 49 ? -15.271 19.082 -25.036 1.0 31.54 ? 49 A 2 +ATOM 750 H HB . ILE A1 1 49 ? -18.157 19.291 -24.32 1.0 10.22 ? 49 A 2 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.503 20.712 -26.658 1.0 52.53 ? 49 A 2 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.5 19.266 -26.686 1.0 23.14 ? 49 A 2 +ATOM 753 H HG21 . ILE A1 1 49 ? -17.876 21.808 -24.87 1.0 54.41 ? 49 A 2 +ATOM 754 H HG22 . ILE A1 1 49 ? -17.538 21.24 -23.235 1.0 2.4 ? 49 A 2 +ATOM 755 H HG23 . ILE A1 1 49 ? -16.209 21.56 -24.35 1.0 53.42 ? 49 A 2 +ATOM 756 H HD11 . ILE A1 1 49 ? -18.307 18.384 -27.681 1.0 43.14 ? 49 A 2 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.861 18.178 -26.02 1.0 61.33 ? 49 A 2 +ATOM 758 H HD13 . ILE A1 1 49 ? -19.41 19.56 -26.968 1.0 3.14 ? 49 A 2 +ATOM 759 N N . PHE A1 1 50 ? -14.387 20.235 -23.037 1.0 0.44 ? 50 A 2 +ATOM 760 C CA . PHE A1 1 50 ? -13.8 20.858 -21.857 1.0 63.4 ? 50 A 2 +ATOM 761 C C . PHE A1 1 50 ? -13.666 22.366 -22.048 1.0 34.31 ? 50 A 2 +ATOM 762 O O . PHE A1 1 50 ? -12.835 22.834 -22.825 1.0 24.03 ? 50 A 2 +ATOM 763 C CB . PHE A1 1 50 ? -12.429 20.247 -21.56 1.0 1.31 ? 50 A 2 +ATOM 764 C CG . PHE A1 1 50 ? -11.893 20.608 -20.204 1.0 63.44 ? 50 A 2 +ATOM 765 C CD1 . PHE A1 1 50 ? -12.451 20.066 -19.058 1.0 63.22 ? 50 A 2 +ATOM 766 C CD2 . PHE A1 1 50 ? -10.831 21.488 -20.076 1.0 31.12 ? 50 A 2 +ATOM 767 C CE1 . PHE A1 1 50 ? -11.96 20.395 -17.808 1.0 44.05 ? 50 A 2 +ATOM 768 C CE2 . PHE A1 1 50 ? -10.335 21.821 -18.829 1.0 53.14 ? 50 A 2 +ATOM 769 C CZ . PHE A1 1 50 ? -10.901 21.274 -17.694 1.0 64.24 ? 50 A 2 +ATOM 770 H H . PHE A1 1 50 ? -13.919 20.301 -23.896 1.0 32.43 ? 50 A 2 +ATOM 771 H HA . PHE A1 1 50 ? -14.457 20.67 -21.022 1.0 55.42 ? 50 A 2 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.503 19.172 -21.612 1.0 72.21 ? 50 A 2 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.722 20.591 -22.3 1.0 52.42 ? 50 A 2 +ATOM 774 H HD1 . PHE A1 1 50 ? -13.28 19.378 -19.146 1.0 64.41 ? 50 A 2 +ATOM 775 H HD2 . PHE A1 1 50 ? -10.388 21.917 -20.963 1.0 25.0 ? 50 A 2 +ATOM 776 H HE1 . PHE A1 1 50 ? -12.405 19.966 -16.923 1.0 33.34 ? 50 A 2 +ATOM 777 H HE2 . PHE A1 1 50 ? -9.507 22.509 -18.743 1.0 34.14 ? 50 A 2 +ATOM 778 H HZ . PHE A1 1 50 ? -10.515 21.532 -16.719 1.0 42.2 ? 50 A 2 +ATOM 779 N N . GLY A1 1 51 ? -14.493 23.123 -21.333 1.0 53.44 ? 51 A 2 +ATOM 780 C CA . GLY A1 1 51 ? -14.453 24.57 -21.438 1.0 33.5 ? 51 A 2 +ATOM 781 C C . GLY A1 1 51 ? -15.044 25.074 -22.739 1.0 34.32 ? 51 A 2 +ATOM 782 O O . GLY A1 1 51 ? -15.134 26.28 -22.963 1.0 0.02 ? 51 A 2 +ATOM 783 H H . GLY A1 1 51 ? -15.136 22.695 -20.729 1.0 14.34 ? 51 A 2 +ATOM 784 H HA2 . GLY A1 1 51 ? -15.007 24.995 -20.614 1.0 71.3 ? 51 A 2 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.425 24.895 -21.373 1.0 2.33 ? 51 A 2 +ATOM 786 N N . GLY A1 1 52 ? -15.447 24.146 -23.603 1.0 51.33 ? 52 A 2 +ATOM 787 C CA . GLY A1 1 52 ? -16.026 24.523 -24.879 1.0 70.11 ? 52 A 2 +ATOM 788 C C . GLY A1 1 52 ? -15.383 23.796 -26.044 1.0 64.35 ? 52 A 2 +ATOM 789 O O . GLY A1 1 52 ? -16.0 23.624 -27.095 1.0 21.12 ? 52 A 2 +ATOM 790 H H . GLY A1 1 52 ? -15.351 23.199 -23.371 1.0 52.33 ? 52 A 2 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.081 24.295 -24.865 1.0 34.31 ? 52 A 2 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.899 25.586 -25.019 1.0 33.12 ? 52 A 2 +ATOM 793 N N . LYS A1 1 53 ? -14.138 23.37 -25.859 1.0 4.12 ? 53 A 2 +ATOM 794 C CA . LYS A1 1 53 ? -13.409 22.659 -26.902 1.0 20.15 ? 53 A 2 +ATOM 795 C C . LYS A1 1 53 ? -13.578 21.15 -26.752 1.0 12.34 ? 53 A 2 +ATOM 796 O O . LYS A1 1 53 ? -13.666 20.636 -25.637 1.0 53.3 ? 53 A 2 +ATOM 797 C CB . LYS A1 1 53 ? -11.924 23.024 -26.856 1.0 12.13 ? 53 A 2 +ATOM 798 C CG . LYS A1 1 53 ? -11.262 22.71 -25.525 1.0 34.42 ? 53 A 2 +ATOM 799 C CD . LYS A1 1 53 ? -10.633 21.327 -25.528 1.0 44.0 ? 53 A 2 +ATOM 800 C CE . LYS A1 1 53 ? -9.496 21.234 -26.535 1.0 75.53 ? 53 A 2 +ATOM 801 N NZ . LYS A1 1 53 ? -8.188 20.974 -25.873 1.0 61.53 ? 53 A 2 +ATOM 802 H H . LYS A1 1 53 ? -13.699 23.538 -24.999 1.0 32.12 ? 53 A 2 +ATOM 803 H HA . LYS A1 1 53 ? -13.816 22.961 -27.856 1.0 74.23 ? 53 A 2 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.406 22.477 -27.63 1.0 34.02 ? 53 A 2 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.82 24.083 -27.044 1.0 32.22 ? 53 A 2 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.493 23.443 -25.334 1.0 24.24 ? 53 A 2 +ATOM 807 H HG3 . LYS A1 1 53 ? -12.007 22.755 -24.743 1.0 53.0 ? 53 A 2 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.244 21.116 -24.543 1.0 22.42 ? 53 A 2 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.388 20.598 -25.783 1.0 0.05 ? 53 A 2 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.708 20.431 -27.224 1.0 25.2 ? 53 A 2 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.436 22.166 -27.077 1.0 75.24 ? 53 A 2 +ATOM 812 H HZ1 . LYS A1 1 53 ? -8.331 20.417 -25.006 1.0 1.33 ? 53 A 2 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.729 21.873 -25.623 1.0 14.14 ? 53 A 2 +ATOM 814 H HZ3 . LYS A1 1 53 ? -7.563 20.445 -26.513 1.0 31.25 ? 53 A 2 +ATOM 815 N N . GLN A1 1 54 ? -13.62 20.448 -27.88 1.0 32.1 ? 54 A 2 +ATOM 816 C CA . GLN A1 1 54 ? -13.777 18.999 -27.871 1.0 3.14 ? 54 A 2 +ATOM 817 C C . GLN A1 1 54 ? -12.493 18.315 -27.415 1.0 14.5 ? 54 A 2 +ATOM 818 O O . GLN A1 1 54 ? -11.42 18.92 -27.417 1.0 22.04 ? 54 A 2 +ATOM 819 C CB . GLN A1 1 54 ? -14.168 18.499 -29.263 1.0 14.03 ? 54 A 2 +ATOM 820 C CG . GLN A1 1 54 ? -15.381 17.583 -29.262 1.0 52.41 ? 54 A 2 +ATOM 821 C CD . GLN A1 1 54 ? -15.005 16.116 -29.308 1.0 44.23 ? 54 A 2 +ATOM 822 O OE1 . GLN A1 1 54 ? -14.949 15.445 -28.276 1.0 25.33 ? 54 A 2 +ATOM 823 N NE2 . GLN A1 1 54 ? -14.745 15.608 -30.507 1.0 63.1 ? 54 A 2 +ATOM 824 H H . GLN A1 1 54 ? -13.545 20.916 -28.737 1.0 52.11 ? 54 A 2 +ATOM 825 H HA . GLN A1 1 54 ? -14.566 18.755 -27.177 1.0 62.04 ? 54 A 2 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.387 19.35 -29.89 1.0 31.24 ? 54 A 2 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.335 17.956 -29.685 1.0 25.42 ? 54 A 2 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.953 17.765 -28.364 1.0 52.11 ? 54 A 2 +ATOM 829 H HG3 . GLN A1 1 54 ? -15.989 17.811 -30.126 1.0 53.52 ? 54 A 2 +ATOM 830 H HE21 . GLN A1 1 54 ? -14.808 16.202 -31.284 1.0 45.55 ? 54 A 2 +ATOM 831 H HE22 . GLN A1 1 54 ? -14.498 14.662 -30.565 1.0 62.42 ? 54 A 2 +ATOM 832 N N . LEU A1 1 55 ? -12.609 17.051 -27.023 1.0 51.34 ? 55 A 2 +ATOM 833 C CA . LEU A1 1 55 ? -11.456 16.284 -26.562 1.0 40.45 ? 55 A 2 +ATOM 834 C C . LEU A1 1 55 ? -11.183 15.103 -27.489 1.0 63.5 ? 55 A 2 +ATOM 835 O O . LEU A1 1 55 ? -12.068 14.29 -27.75 1.0 52.11 ? 55 A 2 +ATOM 836 C CB . LEU A1 1 55 ? -11.688 15.784 -25.135 1.0 25.03 ? 55 A 2 +ATOM 837 C CG . LEU A1 1 55 ? -12.159 16.832 -24.126 1.0 41.33 ? 55 A 2 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.184 16.246 -22.722 1.0 33.24 ? 55 A 2 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.263 18.061 -24.176 1.0 52.23 ? 55 A 2 +ATOM 840 H H . LEU A1 1 55 ? -13.489 16.623 -27.043 1.0 12.34 ? 55 A 2 +ATOM 841 H HA . LEU A1 1 55 ? -10.598 16.939 -26.571 1.0 22.21 ? 55 A 2 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.434 15.005 -25.175 1.0 55.1 ? 55 A 2 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.757 15.371 -24.775 1.0 51.11 ? 55 A 2 +ATOM 844 H HG . LEU A1 1 55 ? -13.164 17.139 -24.377 1.0 72.12 ? 55 A 2 +ATOM 845 H HD11 . LEU A1 1 55 ? -12.015 17.032 -22.001 1.0 32.04 ? 55 A 2 +ATOM 846 H HD12 . LEU A1 1 55 ? -11.41 15.499 -22.63 1.0 44.35 ? 55 A 2 +ATOM 847 H HD13 . LEU A1 1 55 ? -13.147 15.791 -22.54 1.0 32.21 ? 55 A 2 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.808 18.885 -24.613 1.0 33.14 ? 55 A 2 +ATOM 849 H HD22 . LEU A1 1 55 ? -10.392 17.846 -24.777 1.0 72.01 ? 55 A 2 +ATOM 850 H HD23 . LEU A1 1 55 ? -10.954 18.323 -23.175 1.0 74.33 ? 55 A 2 +ATOM 851 N N . GLU A1 1 56 ? -9.951 15.016 -27.98 1.0 12.02 ? 56 A 2 +ATOM 852 C CA . GLU A1 1 56 ? -9.561 13.934 -28.876 1.0 31.33 ? 56 A 2 +ATOM 853 C C . GLU A1 1 56 ? -9.496 12.605 -28.128 1.0 62.51 ? 56 A 2 +ATOM 854 O O . GLU A1 1 56 ? -9.843 12.526 -26.949 1.0 51.02 ? 56 A 2 +ATOM 855 C CB . GLU A1 1 56 ? -8.206 14.236 -29.519 1.0 62.01 ? 56 A 2 +ATOM 856 C CG . GLU A1 1 56 ? -8.231 14.199 -31.038 1.0 21.02 ? 56 A 2 +ATOM 857 C CD . GLU A1 1 56 ? -7.542 15.396 -31.662 1.0 1.0 ? 56 A 2 +ATOM 858 O OE1 . GLU A1 1 56 ? -7.759 16.526 -31.177 1.0 61.34 ? 56 A 2 +ATOM 859 O OE2 . GLU A1 1 56 ? -6.785 15.203 -32.636 1.0 22.01 ? 56 A 2 +ATOM 860 H H . GLU A1 1 56 ? -9.289 15.696 -27.735 1.0 72.43 ? 56 A 2 +ATOM 861 H HA . GLU A1 1 56 ? -10.309 13.86 -29.652 1.0 4.21 ? 56 A 2 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.886 15.22 -29.208 1.0 41.11 ? 56 A 2 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.487 13.508 -29.174 1.0 51.02 ? 56 A 2 +ATOM 864 H HG2 . GLU A1 1 56 ? -7.731 13.301 -31.371 1.0 71.31 ? 56 A 2 +ATOM 865 H HG3 . GLU A1 1 56 ? -9.259 14.181 -31.368 1.0 60.44 ? 56 A 2 +ATOM 866 N N . ASP A1 1 57 ? -9.051 11.564 -28.822 1.0 71.03 ? 57 A 2 +ATOM 867 C CA . ASP A1 1 57 ? -8.94 10.238 -28.225 1.0 63.41 ? 57 A 2 +ATOM 868 C C . ASP A1 1 57 ? -7.794 10.19 -27.218 1.0 21.4 ? 57 A 2 +ATOM 869 O O . ASP A1 1 57 ? -7.765 9.331 -26.337 1.0 43.31 ? 57 A 2 +ATOM 870 C CB . ASP A1 1 57 ? -8.726 9.182 -29.311 1.0 45.31 ? 57 A 2 +ATOM 871 C CG . ASP A1 1 57 ? -9.517 9.478 -30.569 1.0 55.43 ? 57 A 2 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.674 9.932 -30.449 1.0 72.35 ? 57 A 2 +ATOM 873 O OD2 . ASP A1 1 57 ? -8.98 9.254 -31.675 1.0 15.11 ? 57 A 2 +ATOM 874 H H . ASP A1 1 57 ? -8.789 11.69 -29.758 1.0 23.12 ? 57 A 2 +ATOM 875 H HA . ASP A1 1 57 ? -9.864 10.028 -27.709 1.0 62.14 ? 57 A 2 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.677 9.146 -29.567 1.0 24.44 ? 57 A 2 +ATOM 877 H HB3 . ASP A1 1 57 ? -9.033 8.218 -28.932 1.0 64.03 ? 57 A 2 +ATOM 878 N N . SER A1 1 58 ? -6.852 11.117 -27.357 1.0 32.51 ? 58 A 2 +ATOM 879 C CA . SER A1 1 58 ? -5.701 11.177 -26.463 1.0 62.24 ? 58 A 2 +ATOM 880 C C . SER A1 1 58 ? -5.776 12.407 -25.563 1.0 2.12 ? 58 A 2 +ATOM 881 O O . SER A1 1 58 ? -4.859 12.682 -24.791 1.0 12.21 ? 58 A 2 +ATOM 882 C CB . SER A1 1 58 ? -4.402 11.2 -27.27 1.0 65.11 ? 58 A 2 +ATOM 883 O OG . SER A1 1 58 ? -3.28 10.971 -26.437 1.0 34.21 ? 58 A 2 +ATOM 884 H H . SER A1 1 58 ? -6.932 11.775 -28.079 1.0 21.03 ? 58 A 2 +ATOM 885 H HA . SER A1 1 58 ? -5.716 10.292 -25.844 1.0 33.55 ? 58 A 2 +ATOM 886 H HB2 . SER A1 1 58 ? -4.437 10.43 -28.026 1.0 31.42 ? 58 A 2 +ATOM 887 H HB3 . SER A1 1 58 ? -4.293 12.165 -27.744 1.0 40.4 ? 58 A 2 +ATOM 888 H HG . SER A1 1 58 ? -2.998 10.057 -26.522 1.0 10.23 ? 58 A 2 +ATOM 889 N N . ASN A1 1 59 ? -6.877 13.145 -25.671 1.0 35.41 ? 59 A 2 +ATOM 890 C CA . ASN A1 1 59 ? -7.073 14.347 -24.868 1.0 52.34 ? 59 A 2 +ATOM 891 C C . ASN A1 1 59 ? -7.594 13.994 -23.478 1.0 4.01 ? 59 A 2 +ATOM 892 O O . ASN A1 1 59 ? -8.772 14.187 -23.179 1.0 42.21 ? 59 A 2 +ATOM 893 C CB . ASN A1 1 59 ? -8.048 15.297 -25.565 1.0 21.1 ? 59 A 2 +ATOM 894 C CG . ASN A1 1 59 ? -8.159 16.634 -24.856 1.0 14.54 ? 59 A 2 +ATOM 895 O OD1 . ASN A1 1 59 ? -8.675 16.717 -23.742 1.0 24.42 ? 59 A 2 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.673 17.687 -25.502 1.0 14.44 ? 59 A 2 +ATOM 897 H H . ASN A1 1 59 ? -7.574 12.875 -26.305 1.0 5.51 ? 59 A 2 +ATOM 898 H HA . ASN A1 1 59 ? -6.116 14.837 -24.767 1.0 74.51 ? 59 A 2 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.709 15.475 -26.575 1.0 43.43 ? 59 A 2 +ATOM 900 H HB3 . ASN A1 1 59 ? -9.027 14.843 -25.593 1.0 11.21 ? 59 A 2 +ATOM 901 H HD21 . ASN A1 1 59 ? -7.276 17.546 -26.387 1.0 21.33 ? 59 A 2 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.731 18.564 -25.067 1.0 12.0 ? 59 A 2 +ATOM 903 N N . ALA A1 1 60 ? -6.708 13.477 -22.634 1.0 13.11 ? 60 A 2 +ATOM 904 C CA . ALA A1 1 60 ? -7.077 13.099 -21.275 1.0 35.51 ? 60 A 2 +ATOM 905 C C . ALA A1 1 60 ? -5.84 12.853 -20.418 1.0 74.01 ? 60 A 2 +ATOM 906 O O . ALA A1 1 60 ? -5.336 13.764 -19.763 1.0 74.24 ? 60 A 2 +ATOM 907 C CB . ALA A1 1 60 ? -7.964 11.863 -21.293 1.0 64.13 ? 60 A 2 +ATOM 908 H H . ALA A1 1 60 ? -5.783 13.347 -22.931 1.0 31.12 ? 60 A 2 +ATOM 909 H HA . ALA A1 1 60 ? -7.644 13.913 -20.845 1.0 20.01 ? 60 A 2 +ATOM 910 H HB1 . ALA A1 1 60 ? -7.491 11.09 -21.882 1.0 72.33 ? 60 A 2 +ATOM 911 H HB2 . ALA A1 1 60 ? -8.109 11.509 -20.284 1.0 25.02 ? 60 A 2 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.92 12.113 -21.728 1.0 51.02 ? 60 A 2 +ATOM 913 N N . MET A1 1 61 ? -5.357 11.615 -20.428 1.0 21.52 ? 61 A 2 +ATOM 914 C CA . MET A1 1 61 ? -4.178 11.249 -19.651 1.0 32.03 ? 61 A 2 +ATOM 915 C C . MET A1 1 61 ? -3.027 12.212 -19.925 1.0 55.14 ? 61 A 2 +ATOM 916 O O . MET A1 1 61 ? -2.408 12.734 -18.997 1.0 73.23 ? 61 A 2 +ATOM 917 C CB . MET A1 1 61 ? -3.749 9.817 -19.978 1.0 33.12 ? 61 A 2 +ATOM 918 C CG . MET A1 1 61 ? -4.044 9.407 -21.411 1.0 10.31 ? 61 A 2 +ATOM 919 S SD . MET A1 1 61 ? -2.828 8.248 -22.066 1.0 3.45 ? 61 A 2 +ATOM 920 C CE . MET A1 1 61 ? -1.469 9.355 -22.435 1.0 11.34 ? 61 A 2 +ATOM 921 H H . MET A1 1 61 ? -5.802 10.931 -20.97 1.0 44.35 ? 61 A 2 +ATOM 922 H HA . MET A1 1 61 ? -4.439 11.307 -18.605 1.0 14.21 ? 61 A 2 +ATOM 923 H HB2 . MET A1 1 61 ? -2.686 9.725 -19.811 1.0 14.23 ? 61 A 2 +ATOM 924 H HB3 . MET A1 1 61 ? -4.269 9.139 -19.318 1.0 0.24 ? 61 A 2 +ATOM 925 H HG2 . MET A1 1 61 ? -5.018 8.942 -21.446 1.0 62.14 ? 61 A 2 +ATOM 926 H HG3 . MET A1 1 61 ? -4.048 10.292 -22.031 1.0 32.0 ? 61 A 2 +ATOM 927 H HE1 . MET A1 1 61 ? -1.814 10.377 -22.382 1.0 54.23 ? 61 A 2 +ATOM 928 H HE2 . MET A1 1 61 ? -0.677 9.205 -21.717 1.0 64.31 ? 61 A 2 +ATOM 929 H HE3 . MET A1 1 61 ? -1.098 9.15 -23.428 1.0 24.11 ? 61 A 2 +ATOM 930 N N . SER A1 1 62 ? -2.744 12.442 -21.203 1.0 73.15 ? 62 A 2 +ATOM 931 C CA . SER A1 1 62 ? -1.664 13.338 -21.598 1.0 12.22 ? 62 A 2 +ATOM 932 C C . SER A1 1 62 ? -2.081 14.797 -21.431 1.0 13.52 ? 62 A 2 +ATOM 933 O O . SER A1 1 62 ? -1.257 15.658 -21.121 1.0 42.51 ? 62 A 2 +ATOM 934 C CB . SER A1 1 62 ? -1.259 13.075 -23.049 1.0 62.33 ? 62 A 2 +ATOM 935 O OG . SER A1 1 62 ? 0.0 12.427 -23.118 1.0 14.13 ? 62 A 2 +ATOM 936 H H . SER A1 1 62 ? -3.273 11.995 -21.897 1.0 74.25 ? 62 A 2 +ATOM 937 H HA . SER A1 1 62 ? -0.819 13.142 -20.956 1.0 74.15 ? 62 A 2 +ATOM 938 H HB2 . SER A1 1 62 ? -2.0 12.445 -23.519 1.0 54.41 ? 62 A 2 +ATOM 939 H HB3 . SER A1 1 62 ? -1.196 14.014 -23.579 1.0 23.45 ? 62 A 2 +ATOM 940 H HG . SER A1 1 62 ? 0.571 12.9 -23.727 1.0 1.23 ? 62 A 2 +ATOM 941 N N . ASP A1 1 63 ? -3.365 15.066 -21.64 1.0 34.33 ? 63 A 2 +ATOM 942 C CA . ASP A1 1 63 ? -3.893 16.419 -21.512 1.0 10.21 ? 63 A 2 +ATOM 943 C C . ASP A1 1 63 ? -3.606 16.986 -20.125 1.0 63.54 ? 63 A 2 +ATOM 944 O O . ASP A1 1 63 ? -3.52 18.201 -19.945 1.0 31.33 ? 63 A 2 +ATOM 945 C CB . ASP A1 1 63 ? -5.399 16.429 -21.78 1.0 21.1 ? 63 A 2 +ATOM 946 C CG . ASP A1 1 63 ? -5.914 17.809 -22.139 1.0 12.2 ? 63 A 2 +ATOM 947 O OD1 . ASP A1 1 63 ? -5.201 18.54 -22.858 1.0 53.24 ? 63 A 2 +ATOM 948 O OD2 . ASP A1 1 63 ? -7.029 18.159 -21.699 1.0 3.13 ? 63 A 2 +ATOM 949 H H . ASP A1 1 63 ? -3.972 14.336 -21.885 1.0 14.4 ? 63 A 2 +ATOM 950 H HA . ASP A1 1 63 ? -3.402 17.038 -22.248 1.0 72.42 ? 63 A 2 +ATOM 951 H HB2 . ASP A1 1 63 ? -5.617 15.76 -22.6 1.0 63.34 ? 63 A 2 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.917 16.089 -20.896 1.0 44.51 ? 63 A 2 +ATOM 953 N N . TYR A1 1 64 ? -3.461 16.098 -19.148 1.0 43.15 ? 64 A 2 +ATOM 954 C CA . TYR A1 1 64 ? -3.188 16.51 -17.776 1.0 74.44 ? 64 A 2 +ATOM 955 C C . TYR A1 1 64 ? -4.438 17.09 -17.122 1.0 35.31 ? 64 A 2 +ATOM 956 O O . TYR A1 1 64 ? -4.355 17.805 -16.124 1.0 63.11 ? 64 A 2 +ATOM 957 C CB . TYR A1 1 64 ? -2.058 17.54 -17.746 1.0 41.31 ? 64 A 2 +ATOM 958 C CG . TYR A1 1 64 ? -0.929 17.173 -16.809 1.0 35.31 ? 64 A 2 +ATOM 959 C CD1 . TYR A1 1 64 ? -1.186 16.75 -15.511 1.0 10.21 ? 64 A 2 +ATOM 960 C CD2 . TYR A1 1 64 ? 0.395 17.247 -17.224 1.0 61.0 ? 64 A 2 +ATOM 961 C CE1 . TYR A1 1 64 ? -0.158 16.415 -14.652 1.0 31.32 ? 64 A 2 +ATOM 962 C CE2 . TYR A1 1 64 ? 1.43 16.912 -16.372 1.0 3.01 ? 64 A 2 +ATOM 963 C CZ . TYR A1 1 64 ? 1.149 16.497 -15.087 1.0 35.43 ? 64 A 2 +ATOM 964 O OH . TYR A1 1 64 ? 2.176 16.162 -14.235 1.0 23.32 ? 64 A 2 +ATOM 965 H H . TYR A1 1 64 ? -3.541 15.143 -19.353 1.0 10.22 ? 64 A 2 +ATOM 966 H HA . TYR A1 1 64 ? -2.88 15.635 -17.222 1.0 40.51 ? 64 A 2 +ATOM 967 H HB2 . TYR A1 1 64 ? -1.645 17.641 -18.738 1.0 75.32 ? 64 A 2 +ATOM 968 H HB3 . TYR A1 1 64 ? -2.456 18.492 -17.428 1.0 32.34 ? 64 A 2 +ATOM 969 H HD1 . TYR A1 1 64 ? -2.211 16.687 -15.173 1.0 1.35 ? 64 A 2 +ATOM 970 H HD2 . TYR A1 1 64 ? 0.613 17.572 -18.231 1.0 32.41 ? 64 A 2 +ATOM 971 H HE1 . TYR A1 1 64 ? -0.378 16.089 -13.646 1.0 52.21 ? 64 A 2 +ATOM 972 H HE2 . TYR A1 1 64 ? 2.453 16.976 -16.712 1.0 43.14 ? 64 A 2 +ATOM 973 H HH . TYR A1 1 64 ? 1.946 15.364 -13.755 1.0 23.33 ? 64 A 2 +ATOM 974 N N . ASN A1 1 65 ? -5.597 16.777 -17.693 1.0 61.21 ? 65 A 2 +ATOM 975 C CA . ASN A1 1 65 ? -6.866 17.266 -17.167 1.0 70.22 ? 65 A 2 +ATOM 976 C C . ASN A1 1 65 ? -7.664 16.133 -16.529 1.0 21.44 ? 65 A 2 +ATOM 977 O O . ASN A1 1 65 ? -8.843 16.292 -16.212 1.0 22.24 ? 65 A 2 +ATOM 978 C CB . ASN A1 1 65 ? -7.686 17.919 -18.282 1.0 30.31 ? 65 A 2 +ATOM 979 C CG . ASN A1 1 65 ? -8.661 16.951 -18.924 1.0 75.23 ? 65 A 2 +ATOM 980 O OD1 . ASN A1 1 65 ? -9.871 17.179 -18.924 1.0 74.2 ? 65 A 2 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.138 15.862 -19.475 1.0 12.4 ? 65 A 2 +ATOM 982 H H . ASN A1 1 65 ? -5.599 16.202 -18.487 1.0 72.01 ? 65 A 2 +ATOM 983 H HA . ASN A1 1 65 ? -6.648 18.007 -16.413 1.0 43.44 ? 65 A 2 +ATOM 984 H HB2 . ASN A1 1 65 ? -8.247 18.745 -17.871 1.0 12.24 ? 65 A 2 +ATOM 985 H HB3 . ASN A1 1 65 ? -7.017 18.287 -19.045 1.0 73.02 ? 65 A 2 +ATOM 986 H HD21 . ASN A1 1 65 ? -7.165 15.746 -19.438 1.0 23.44 ? 65 A 2 +ATOM 987 H HD22 . ASN A1 1 65 ? -8.745 15.22 -19.898 1.0 32.24 ? 65 A 2 +ATOM 988 N N . VAL A1 1 66 ? -7.013 14.99 -16.344 1.0 11.4 ? 66 A 2 +ATOM 989 C CA . VAL A1 1 66 ? -7.66 13.83 -15.742 1.0 70.45 ? 66 A 2 +ATOM 990 C C . VAL A1 1 66 ? -7.218 13.643 -14.295 1.0 73.11 ? 66 A 2 +ATOM 991 O O . VAL A1 1 66 ? -6.287 12.889 -14.014 1.0 33.12 ? 66 A 2 +ATOM 992 C CB . VAL A1 1 66 ? -7.354 12.544 -16.532 1.0 40.11 ? 66 A 2 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.857 12.4 -16.759 1.0 32.21 ? 66 A 2 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.91 11.328 -15.805 1.0 25.13 ? 66 A 2 +ATOM 995 H H . VAL A1 1 66 ? -6.074 14.924 -16.617 1.0 25.31 ? 66 A 2 +ATOM 996 H HA . VAL A1 1 66 ? -8.728 13.995 -15.764 1.0 44.24 ? 66 A 2 +ATOM 997 H HB . VAL A1 1 66 ? -7.837 12.613 -17.495 1.0 65.05 ? 66 A 2 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.326 13.056 -16.084 1.0 62.5 ? 66 A 2 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.561 11.378 -16.578 1.0 4.5 ? 66 A 2 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.621 12.668 -17.779 1.0 12.32 ? 66 A 2 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.5 10.737 -16.49 1.0 23.4 ? 66 A 2 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.093 10.732 -15.426 1.0 64.2 ? 66 A 2 +ATOM 1003 H HG23 . VAL A1 1 66 ? -8.531 11.652 -14.983 1.0 74.31 ? 66 A 2 +ATOM 1004 N N . GLN A1 1 67 ? -7.893 14.333 -13.382 1.0 5.43 ? 67 A 2 +ATOM 1005 C CA . GLN A1 1 67 ? -7.569 14.242 -11.963 1.0 15.5 ? 67 A 2 +ATOM 1006 C C . GLN A1 1 67 ? -8.491 13.254 -11.256 1.0 62.54 ? 67 A 2 +ATOM 1007 O O . GLN A1 1 67 ? -9.339 12.621 -11.885 1.0 44.01 ? 67 A 2 +ATOM 1008 C CB . GLN A1 1 67 ? -7.677 15.619 -11.305 1.0 35.11 ? 67 A 2 +ATOM 1009 C CG . GLN A1 1 67 ? -9.014 16.302 -11.538 1.0 11.21 ? 67 A 2 +ATOM 1010 C CD . GLN A1 1 67 ? -9.208 17.523 -10.661 1.0 34.44 ? 67 A 2 +ATOM 1011 O OE1 . GLN A1 1 67 ? -9.081 17.449 -9.438 1.0 41.54 ? 67 A 2 +ATOM 1012 N NE2 . GLN A1 1 67 ? -9.515 18.656 -11.281 1.0 50.51 ? 67 A 2 +ATOM 1013 H H . GLN A1 1 67 ? -8.625 14.917 -13.668 1.0 54.23 ? 67 A 2 +ATOM 1014 H HA . GLN A1 1 67 ? -6.552 13.891 -11.877 1.0 21.13 ? 67 A 2 +ATOM 1015 H HB2 . GLN A1 1 67 ? -7.534 15.508 -10.24 1.0 61.05 ? 67 A 2 +ATOM 1016 H HB3 . GLN A1 1 67 ? -6.899 16.255 -11.699 1.0 21.05 ? 67 A 2 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.072 16.609 -12.572 1.0 63.24 ? 67 A 2 +ATOM 1018 H HG3 . GLN A1 1 67 ? -9.805 15.597 -11.329 1.0 63.02 ? 67 A 2 +ATOM 1019 H HE21 . GLN A1 1 67 ? -9.601 18.64 -12.258 1.0 0.12 ? 67 A 2 +ATOM 1020 H HE22 . GLN A1 1 67 ? -9.647 19.46 -10.739 1.0 72.41 ? 67 A 2 +ATOM 1021 N N . LYS A1 1 68 ? -8.319 13.127 -9.945 1.0 63.33 ? 68 A 2 +ATOM 1022 C CA . LYS A1 1 68 ? -9.136 12.217 -9.151 1.0 34.0 ? 68 A 2 +ATOM 1023 C C . LYS A1 1 68 ? -10.621 12.496 -9.358 1.0 33.21 ? 68 A 2 +ATOM 1024 O O . LYS A1 1 68 ? -11.45 11.591 -9.267 1.0 33.01 ? 68 A 2 +ATOM 1025 C CB . LYS A1 1 68 ? -8.784 12.346 -7.667 1.0 41.41 ? 68 A 2 +ATOM 1026 C CG . LYS A1 1 68 ? -9.449 11.298 -6.791 1.0 61.44 ? 68 A 2 +ATOM 1027 C CD . LYS A1 1 68 ? -8.88 9.913 -7.048 1.0 43.41 ? 68 A 2 +ATOM 1028 C CE . LYS A1 1 68 ? -7.652 9.647 -6.191 1.0 23.43 ? 68 A 2 +ATOM 1029 N NZ . LYS A1 1 68 ? -7.967 9.705 -4.737 1.0 52.05 ? 68 A 2 +ATOM 1030 H H . LYS A1 1 68 ? -7.627 13.659 -9.499 1.0 75.53 ? 68 A 2 +ATOM 1031 H HA . LYS A1 1 68 ? -8.922 11.21 -9.476 1.0 31.4 ? 68 A 2 +ATOM 1032 H HB2 . LYS A1 1 68 ? -7.714 12.254 -7.553 1.0 51.5 ? 68 A 2 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.092 13.322 -7.32 1.0 62.4 ? 68 A 2 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.288 11.554 -5.754 1.0 22.33 ? 68 A 2 +ATOM 1035 H HG3 . LYS A1 1 68 ? -10.509 11.287 -7.0 1.0 45.02 ? 68 A 2 +ATOM 1036 H HD2 . LYS A1 1 68 ? -9.633 9.175 -6.817 1.0 14.2 ? 68 A 2 +ATOM 1037 H HD3 . LYS A1 1 68 ? -8.605 9.835 -8.091 1.0 13.53 ? 68 A 2 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.269 8.666 -6.429 1.0 43.13 ? 68 A 2 +ATOM 1039 H HE3 . LYS A1 1 68 ? -6.902 10.391 -6.418 1.0 63.42 ? 68 A 2 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.059 10.694 -4.43 1.0 1.54 ? 68 A 2 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.208 9.252 -4.189 1.0 73.32 ? 68 A 2 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.861 9.209 -4.545 1.0 23.44 ? 68 A 2 +ATOM 1043 N N . GLU A1 1 69 ? -10.948 13.753 -9.639 1.0 51.1 ? 69 A 2 +ATOM 1044 C CA . GLU A1 1 69 ? -12.334 14.15 -9.86 1.0 15.41 ? 69 A 2 +ATOM 1045 C C . GLU A1 1 69 ? -12.411 15.373 -10.769 1.0 20.25 ? 69 A 2 +ATOM 1046 O O . GLU A1 1 69 ? -12.42 16.51 -10.298 1.0 55.15 ? 69 A 2 +ATOM 1047 C CB . GLU A1 1 69 ? -13.022 14.447 -8.526 1.0 42.14 ? 69 A 2 +ATOM 1048 C CG . GLU A1 1 69 ? -12.201 15.331 -7.602 1.0 32.44 ? 69 A 2 +ATOM 1049 C CD . GLU A1 1 69 ? -13.062 16.144 -6.656 1.0 60.3 ? 69 A 2 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.044 15.587 -6.121 1.0 52.11 ? 69 A 2 +ATOM 1051 O OE2 . GLU A1 1 69 ? -12.755 17.337 -6.449 1.0 33.22 ? 69 A 2 +ATOM 1052 H H . GLU A1 1 69 ? -10.242 14.43 -9.698 1.0 51.55 ? 69 A 2 +ATOM 1053 H HA . GLU A1 1 69 ? -12.842 13.327 -10.341 1.0 21.13 ? 69 A 2 +ATOM 1054 H HB2 . GLU A1 1 69 ? -13.962 14.941 -8.722 1.0 70.35 ? 69 A 2 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.215 13.514 -8.019 1.0 25.14 ? 69 A 2 +ATOM 1056 H HG2 . GLU A1 1 69 ? -11.543 14.705 -7.018 1.0 60.54 ? 69 A 2 +ATOM 1057 H HG3 . GLU A1 1 69 ? -11.612 16.009 -8.202 1.0 2.43 ? 69 A 2 +ATOM 1058 N N . SER A1 1 70 ? -12.466 15.131 -12.075 1.0 51.41 ? 70 A 2 +ATOM 1059 C CA . SER A1 1 70 ? -12.538 16.212 -13.051 1.0 50.24 ? 70 A 2 +ATOM 1060 C C . SER A1 1 70 ? -13.928 16.288 -13.675 1.0 72.1 ? 70 A 2 +ATOM 1061 O O . SER A1 1 70 ? -14.501 15.273 -14.072 1.0 13.02 ? 70 A 2 +ATOM 1062 C CB . SER A1 1 70 ? -11.486 16.013 -14.143 1.0 75.43 ? 70 A 2 +ATOM 1063 O OG . SER A1 1 70 ? -10.933 17.252 -14.551 1.0 45.33 ? 70 A 2 +ATOM 1064 H H . SER A1 1 70 ? -12.456 14.203 -12.389 1.0 42.55 ? 70 A 2 +ATOM 1065 H HA . SER A1 1 70 ? -12.337 17.139 -12.534 1.0 61.25 ? 70 A 2 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.693 15.386 -13.765 1.0 1.23 ? 70 A 2 +ATOM 1067 H HB3 . SER A1 1 70 ? -11.944 15.537 -14.998 1.0 50.33 ? 70 A 2 +ATOM 1068 H HG . SER A1 1 70 ? -11.254 17.472 -15.429 1.0 14.24 ? 70 A 2 +ATOM 1069 N N . THR A1 1 71 ? -14.467 17.501 -13.76 1.0 52.55 ? 71 A 2 +ATOM 1070 C CA . THR A1 1 71 ? -15.789 17.712 -14.335 1.0 43.33 ? 71 A 2 +ATOM 1071 C C . THR A1 1 71 ? -15.695 18.07 -15.813 1.0 63.44 ? 71 A 2 +ATOM 1072 O O . THR A1 1 71 ? -15.068 19.063 -16.184 1.0 13.52 ? 71 A 2 +ATOM 1073 C CB . THR A1 1 71 ? -16.552 18.827 -13.595 1.0 4.41 ? 71 A 2 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.639 19.844 -13.166 1.0 4.41 ? 71 A 2 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.297 18.268 -12.393 1.0 4.35 ? 71 A 2 +ATOM 1076 H H . THR A1 1 71 ? -13.961 18.271 -13.426 1.0 14.04 ? 71 A 2 +ATOM 1077 H HA . THR A1 1 71 ? -16.348 16.793 -14.232 1.0 24.13 ? 71 A 2 +ATOM 1078 H HB . THR A1 1 71 ? -17.27 19.263 -14.275 1.0 70.41 ? 71 A 2 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.115 20.512 -12.669 1.0 53.11 ? 71 A 2 +ATOM 1080 H HG21 . THR A1 1 71 ? -16.753 17.426 -11.993 1.0 12.42 ? 71 A 2 +ATOM 1081 H HG22 . THR A1 1 71 ? -18.283 17.948 -12.698 1.0 75.2 ? 71 A 2 +ATOM 1082 H HG23 . THR A1 1 71 ? -17.385 19.033 -11.636 1.0 31.12 ? 71 A 2 +ATOM 1083 N N . LEU A1 1 72 ? -16.323 17.256 -16.655 1.0 74.32 ? 72 A 2 +ATOM 1084 C CA . LEU A1 1 72 ? -16.311 17.488 -18.096 1.0 62.12 ? 72 A 2 +ATOM 1085 C C . LEU A1 1 72 ? -17.722 17.417 -18.67 1.0 14.1 ? 72 A 2 +ATOM 1086 O O . LEU A1 1 72 ? -18.591 16.735 -18.127 1.0 22.33 ? 72 A 2 +ATOM 1087 C CB . LEU A1 1 72 ? -15.413 16.462 -18.79 1.0 54.24 ? 72 A 2 +ATOM 1088 C CG . LEU A1 1 72 ? -16.105 15.194 -19.29 1.0 12.34 ? 72 A 2 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.437 15.316 -20.77 1.0 71.53 ? 72 A 2 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.232 13.974 -19.036 1.0 45.31 ? 72 A 2 +ATOM 1091 H H . LEU A1 1 72 ? -16.806 16.481 -16.301 1.0 40.44 ? 72 A 2 +ATOM 1092 H HA . LEU A1 1 72 ? -15.914 18.477 -18.269 1.0 22.23 ? 72 A 2 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.954 16.945 -19.639 1.0 24.33 ? 72 A 2 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.646 16.167 -18.088 1.0 64.44 ? 72 A 2 +ATOM 1095 H HG . LEU A1 1 72 ? -17.033 15.061 -18.751 1.0 60.22 ? 72 A 2 +ATOM 1096 H HD11 . LEU A1 1 72 ? -16.247 14.373 -21.259 1.0 22.12 ? 72 A 2 +ATOM 1097 H HD12 . LEU A1 1 72 ? -15.821 16.083 -21.215 1.0 11.12 ? 72 A 2 +ATOM 1098 H HD13 . LEU A1 1 72 ? -17.478 15.579 -20.885 1.0 74.11 ? 72 A 2 +ATOM 1099 H HD21 . LEU A1 1 72 ? -14.194 14.271 -19.018 1.0 45.11 ? 72 A 2 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.387 13.251 -19.823 1.0 64.51 ? 72 A 2 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.498 13.534 -18.085 1.0 15.53 ? 72 A 2 +ATOM 1102 N N . HIS A1 1 73 ? -17.942 18.125 -19.774 1.0 22.1 ? 73 A 2 +ATOM 1103 C CA . HIS A1 1 73 ? -19.247 18.14 -20.425 1.0 43.22 ? 73 A 2 +ATOM 1104 C C . HIS A1 1 73 ? -19.288 17.15 -21.584 1.0 1.12 ? 73 A 2 +ATOM 1105 O O . HIS A1 1 73 ? -18.504 17.252 -22.529 1.0 41.41 ? 73 A 2 +ATOM 1106 C CB . HIS A1 1 73 ? -19.573 19.547 -20.928 1.0 34.11 ? 73 A 2 +ATOM 1107 C CG . HIS A1 1 73 ? -21.032 19.768 -21.184 1.0 25.31 ? 73 A 2 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.879 18.772 -21.622 1.0 22.31 ? 73 A 2 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.794 20.88 -21.06 1.0 30.12 ? 73 A 2 +ATOM 1110 C CE1 . HIS A1 1 73 ? -23.098 19.261 -21.758 1.0 74.03 ? 73 A 2 +ATOM 1111 N NE2 . HIS A1 1 73 ? -23.074 20.539 -21.423 1.0 22.32 ? 73 A 2 +ATOM 1112 H H . HIS A1 1 73 ? -17.209 18.649 -20.16 1.0 41.1 ? 73 A 2 +ATOM 1113 H HA . HIS A1 1 73 ? -19.986 17.849 -19.693 1.0 23.25 ? 73 A 2 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.253 20.269 -20.191 1.0 51.13 ? 73 A 2 +ATOM 1115 H HB3 . HIS A1 1 73 ? -19.043 19.724 -21.852 1.0 64.13 ? 73 A 2 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.624 17.844 -21.807 1.0 63.31 ? 73 A 2 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.459 21.855 -20.737 1.0 71.43 ? 73 A 2 +ATOM 1118 H HE1 . HIS A1 1 73 ? -23.968 18.711 -22.086 1.0 3.34 ? 73 A 2 +ATOM 1119 N N . LEU A1 1 74 ? -20.205 16.192 -21.507 1.0 31.4 ? 74 A 2 +ATOM 1120 C CA . LEU A1 1 74 ? -20.347 15.183 -22.55 1.0 41.22 ? 74 A 2 +ATOM 1121 C C . LEU A1 1 74 ? -21.636 15.393 -23.339 1.0 21.0 ? 74 A 2 +ATOM 1122 O O . LEU A1 1 74 ? -22.734 15.309 -22.788 1.0 70.53 ? 74 A 2 +ATOM 1123 C CB . LEU A1 1 74 ? -20.335 13.782 -21.936 1.0 42.32 ? 74 A 2 +ATOM 1124 C CG . LEU A1 1 74 ? -20.901 12.661 -22.809 1.0 13.02 ? 74 A 2 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.095 12.525 -24.091 1.0 50.12 ? 74 A 2 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.916 11.345 -22.044 1.0 22.4 ? 74 A 2 +ATOM 1127 H H . LEU A1 1 74 ? -20.801 16.163 -20.73 1.0 53.04 ? 74 A 2 +ATOM 1128 H HA . LEU A1 1 74 ? -19.508 15.28 -23.222 1.0 65.43 ? 74 A 2 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.311 13.533 -21.701 1.0 22.02 ? 74 A 2 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.913 13.816 -21.023 1.0 20.31 ? 74 A 2 +ATOM 1131 H HG . LEU A1 1 74 ? -21.919 12.904 -23.079 1.0 34.12 ? 74 A 2 +ATOM 1132 H HD11 . LEU A1 1 74 ? -19.955 11.479 -24.319 1.0 33.01 ? 74 A 2 +ATOM 1133 H HD12 . LEU A1 1 74 ? -19.133 12.998 -23.964 1.0 1.34 ? 74 A 2 +ATOM 1134 H HD13 . LEU A1 1 74 ? -20.626 13.002 -24.902 1.0 63.14 ? 74 A 2 +ATOM 1135 H HD21 . LEU A1 1 74 ? -21.576 10.649 -22.539 1.0 12.32 ? 74 A 2 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.265 11.519 -21.037 1.0 54.43 ? 74 A 2 +ATOM 1137 H HD23 . LEU A1 1 74 ? -19.917 10.936 -22.013 1.0 14.02 ? 74 A 2 +ATOM 1138 N N . VAL A1 1 75 ? -21.494 15.664 -24.632 1.0 43.5 ? 75 A 2 +ATOM 1139 C CA . VAL A1 1 75 ? -22.646 15.882 -25.499 1.0 52.32 ? 75 A 2 +ATOM 1140 C C . VAL A1 1 75 ? -22.808 14.741 -26.496 1.0 61.15 ? 75 A 2 +ATOM 1141 O O . VAL A1 1 75 ? -21.834 14.282 -27.095 1.0 54.31 ? 75 A 2 +ATOM 1142 C CB . VAL A1 1 75 ? -22.525 17.21 -26.269 1.0 24.5 ? 75 A 2 +ATOM 1143 C CG1 . VAL A1 1 75 ? -22.527 18.388 -25.307 1.0 55.3 ? 75 A 2 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.269 17.215 -27.128 1.0 64.14 ? 75 A 2 +ATOM 1145 H H . VAL A1 1 75 ? -20.593 15.717 -25.013 1.0 70.11 ? 75 A 2 +ATOM 1146 H HA . VAL A1 1 75 ? -23.528 15.931 -24.876 1.0 60.52 ? 75 A 2 +ATOM 1147 H HB . VAL A1 1 75 ? -23.381 17.304 -26.921 1.0 44.41 ? 75 A 2 +ATOM 1148 H HG11 . VAL A1 1 75 ? -21.51 18.695 -25.111 1.0 31.54 ? 75 A 2 +ATOM 1149 H HG12 . VAL A1 1 75 ? -23.074 19.21 -25.745 1.0 61.34 ? 75 A 2 +ATOM 1150 H HG13 . VAL A1 1 75 ? -22.999 18.095 -24.381 1.0 54.52 ? 75 A 2 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.375 16.495 -27.925 1.0 5.24 ? 75 A 2 +ATOM 1152 H HG22 . VAL A1 1 75 ? -21.125 18.199 -27.547 1.0 61.35 ? 75 A 2 +ATOM 1153 H HG23 . VAL A1 1 75 ? -20.415 16.955 -26.519 1.0 24.43 ? 75 A 2 +ATOM 1154 N N . LEU A1 1 76 ? -24.044 14.287 -26.672 1.0 35.1 ? 76 A 2 +ATOM 1155 C CA . LEU A1 1 76 ? -24.334 13.198 -27.599 1.0 22.53 ? 76 A 2 +ATOM 1156 C C . LEU A1 1 76 ? -25.376 13.624 -28.629 1.0 2.14 ? 76 A 2 +ATOM 1157 O O . LEU A1 1 76 ? -26.364 14.278 -28.293 1.0 21.5 ? 76 A 2 +ATOM 1158 C CB . LEU A1 1 76 ? -24.829 11.969 -26.834 1.0 73.12 ? 76 A 2 +ATOM 1159 C CG . LEU A1 1 76 ? -24.552 11.958 -25.33 1.0 64.45 ? 76 A 2 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.678 12.648 -24.575 1.0 24.13 ? 76 A 2 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.369 10.532 -24.832 1.0 22.03 ? 76 A 2 +ATOM 1162 H H . LEU A1 1 76 ? -24.779 14.692 -26.167 1.0 44.32 ? 76 A 2 +ATOM 1163 H HA . LEU A1 1 76 ? -23.419 12.948 -28.113 1.0 53.04 ? 76 A 2 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.897 11.9 -26.974 1.0 71.31 ? 76 A 2 +ATOM 1165 H HB3 . LEU A1 1 76 ? -24.354 11.099 -27.265 1.0 62.14 ? 76 A 2 +ATOM 1166 H HG . LEU A1 1 76 ? -23.638 12.502 -25.135 1.0 42.11 ? 76 A 2 +ATOM 1167 H HD11 . LEU A1 1 76 ? -25.513 13.715 -24.578 1.0 12.14 ? 76 A 2 +ATOM 1168 H HD12 . LEU A1 1 76 ? -25.701 12.289 -23.557 1.0 23.21 ? 76 A 2 +ATOM 1169 H HD13 . LEU A1 1 76 ? -26.621 12.428 -25.056 1.0 40.2 ? 76 A 2 +ATOM 1170 H HD21 . LEU A1 1 76 ? -25.28 10.196 -24.361 1.0 53.24 ? 76 A 2 +ATOM 1171 H HD22 . LEU A1 1 76 ? -23.561 10.503 -24.116 1.0 72.02 ? 76 A 2 +ATOM 1172 H HD23 . LEU A1 1 76 ? -24.134 9.887 -25.666 1.0 63.4 ? 76 A 2 +ATOM 1173 N N . ARG A1 1 77 ? -25.15 13.246 -29.882 1.0 50.44 ? 77 A 2 +ATOM 1174 C CA . ARG A1 1 77 ? -26.069 13.587 -30.961 1.0 12.4 ? 77 A 2 +ATOM 1175 C C . ARG A1 1 77 ? -26.678 12.33 -31.575 1.0 10.32 ? 77 A 2 +ATOM 1176 O O . ARG A1 1 77 ? -26.558 12.092 -32.777 1.0 12.43 ? 77 A 2 +ATOM 1177 C CB . ARG A1 1 77 ? -25.346 14.395 -32.04 1.0 55.35 ? 77 A 2 +ATOM 1178 C CG . ARG A1 1 77 ? -24.049 13.758 -32.511 1.0 12.22 ? 77 A 2 +ATOM 1179 C CD . ARG A1 1 77 ? -22.836 14.527 -32.01 1.0 60.22 ? 77 A 2 +ATOM 1180 N NE . ARG A1 1 77 ? -22.513 15.661 -32.872 1.0 64.33 ? 77 A 2 +ATOM 1181 C CZ . ARG A1 1 77 ? -21.654 16.617 -32.536 1.0 13.31 ? 77 A 2 +ATOM 1182 N NH1 . ARG A1 1 77 ? -21.035 16.576 -31.364 1.0 63.3 ? 77 A 2 +ATOM 1183 N NH2 . ARG A1 1 77 ? -21.412 17.617 -33.374 1.0 70.54 ? 77 A 2 +ATOM 1184 H H . ARG A1 1 77 ? -24.345 12.726 -30.087 1.0 2.41 ? 77 A 2 +ATOM 1185 H HA . ARG A1 1 77 ? -26.862 14.19 -30.543 1.0 53.23 ? 77 A 2 +ATOM 1186 H HB2 . ARG A1 1 77 ? -25.999 14.501 -32.893 1.0 41.04 ? 77 A 2 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.118 15.375 -31.647 1.0 23.23 ? 77 A 2 +ATOM 1188 H HG2 . ARG A1 1 77 ? -23.999 12.746 -32.137 1.0 3.21 ? 77 A 2 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.036 13.746 -33.591 1.0 45.32 ? 77 A 2 +ATOM 1190 H HD2 . ARG A1 1 77 ? -23.044 14.891 -31.015 1.0 24.22 ? 77 A 2 +ATOM 1191 H HD3 . ARG A1 1 77 ? -21.99 13.857 -31.979 1.0 55.12 ? 77 A 2 +ATOM 1192 H HE . ARG A1 1 77 ? -22.959 15.711 -33.742 1.0 41.44 ? 77 A 2 +ATOM 1193 H HH11 . ARG A1 1 77 ? -21.215 15.823 -30.731 1.0 31.24 ? 77 A 2 +ATOM 1194 H HH12 . ARG A1 1 77 ? -20.388 17.297 -31.115 1.0 72.5 ? 77 A 2 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.876 17.651 -34.259 1.0 71.34 ? 77 A 2 +ATOM 1196 H HH22 . ARG A1 1 77 ? -20.766 18.336 -33.121 1.0 1.44 ? 77 A 2 +ATOM 1197 N N . LEU A1 1 78 ? -27.332 11.528 -30.741 1.0 31.03 ? 78 A 2 +ATOM 1198 C CA . LEU A1 1 78 ? -27.96 10.294 -31.201 1.0 51.32 ? 78 A 2 +ATOM 1199 C C . LEU A1 1 78 ? -29.003 10.582 -32.277 1.0 14.11 ? 78 A 2 +ATOM 1200 O O . LEU A1 1 78 ? -29.283 9.736 -33.125 1.0 12.31 ? 78 A 2 +ATOM 1201 C CB . LEU A1 1 78 ? -28.611 9.562 -30.027 1.0 42.51 ? 78 A 2 +ATOM 1202 C CG . LEU A1 1 78 ? -27.727 8.554 -29.291 1.0 51.45 ? 78 A 2 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.535 9.254 -28.656 1.0 14.44 ? 78 A 2 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.532 7.808 -28.238 1.0 25.32 ? 78 A 2 +ATOM 1205 H H . LEU A1 1 78 ? -27.395 11.771 -29.794 1.0 75.31 ? 78 A 2 +ATOM 1206 H HA . LEU A1 1 78 ? -27.189 9.668 -31.623 1.0 64.2 ? 78 A 2 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.932 10.303 -29.312 1.0 61.14 ? 78 A 2 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.473 9.032 -30.406 1.0 62.32 ? 78 A 2 +ATOM 1209 H HG . LEU A1 1 78 ? -27.35 7.831 -30.0 1.0 53.42 ? 78 A 2 +ATOM 1210 H HD11 . LEU A1 1 78 ? -26.412 8.906 -27.642 1.0 3.24 ? 78 A 2 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.703 10.321 -28.654 1.0 74.14 ? 78 A 2 +ATOM 1212 H HD13 . LEU A1 1 78 ? -25.643 9.032 -29.224 1.0 11.41 ? 78 A 2 +ATOM 1213 H HD21 . LEU A1 1 78 ? -28.513 8.361 -27.311 1.0 65.32 ? 78 A 2 +ATOM 1214 H HD22 . LEU A1 1 78 ? -28.101 6.83 -28.082 1.0 65.43 ? 78 A 2 +ATOM 1215 H HD23 . LEU A1 1 78 ? -29.553 7.701 -28.574 1.0 34.04 ? 78 A 2 +ATOM 1216 N N . ARG A1 1 79 ? -29.572 11.782 -32.236 1.0 44.5 ? 79 A 2 +ATOM 1217 C CA . ARG A1 1 79 ? -30.583 12.182 -33.207 1.0 54.44 ? 79 A 2 +ATOM 1218 C C . ARG A1 1 79 ? -29.991 12.245 -34.613 1.0 43.43 ? 79 A 2 +ATOM 1219 O O . ARG A1 1 79 ? -29.402 13.251 -35.005 1.0 24.23 ? 79 A 2 +ATOM 1220 C CB . ARG A1 1 79 ? -31.174 13.542 -32.83 1.0 53.1 ? 79 A 2 +ATOM 1221 C CG . ARG A1 1 79 ? -31.617 13.632 -31.379 1.0 62.42 ? 79 A 2 +ATOM 1222 C CD . ARG A1 1 79 ? -32.649 12.566 -31.045 1.0 15.2 ? 79 A 2 +ATOM 1223 N NE . ARG A1 1 79 ? -33.716 12.506 -32.04 1.0 22.21 ? 79 A 2 +ATOM 1224 C CZ . ARG A1 1 79 ? -34.568 11.492 -32.145 1.0 43.33 ? 79 A 2 +ATOM 1225 N NH1 . ARG A1 1 79 ? -34.479 10.459 -31.319 1.0 51.34 ? 79 A 2 +ATOM 1226 N NH2 . ARG A1 1 79 ? -35.513 11.511 -33.077 1.0 24.34 ? 79 A 2 +ATOM 1227 H H . ARG A1 1 79 ? -29.306 12.414 -31.535 1.0 30.43 ? 79 A 2 +ATOM 1228 H HA . ARG A1 1 79 ? -31.368 11.442 -33.193 1.0 75.12 ? 79 A 2 +ATOM 1229 H HB2 . ARG A1 1 79 ? -30.43 14.306 -33.004 1.0 72.51 ? 79 A 2 +ATOM 1230 H HB3 . ARG A1 1 79 ? -32.03 13.735 -33.458 1.0 62.3 ? 79 A 2 +ATOM 1231 H HG2 . ARG A1 1 79 ? -30.757 13.496 -30.74 1.0 34.21 ? 79 A 2 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.048 14.606 -31.204 1.0 51.44 ? 79 A 2 +ATOM 1233 H HD2 . ARG A1 1 79 ? -32.156 11.606 -31.003 1.0 21.42 ? 79 A 2 +ATOM 1234 H HD3 . ARG A1 1 79 ? -33.081 12.791 -30.081 1.0 24.22 ? 79 A 2 +ATOM 1235 H HE . ARG A1 1 79 ? -33.8 13.259 -32.661 1.0 63.2 ? 79 A 2 +ATOM 1236 H HH11 . ARG A1 1 79 ? -33.769 10.443 -30.615 1.0 0.03 ? 79 A 2 +ATOM 1237 H HH12 . ARG A1 1 79 ? -35.122 9.698 -31.398 1.0 54.33 ? 79 A 2 +ATOM 1238 H HH21 . ARG A1 1 79 ? -35.583 12.288 -33.701 1.0 72.3 ? 79 A 2 +ATOM 1239 H HH22 . ARG A1 1 79 ? -36.153 10.748 -33.154 1.0 2.44 ? 79 A 2 +ATOM 1240 N N . GLY A1 1 80 ? -30.152 11.161 -35.366 1.0 11.03 ? 80 A 2 +ATOM 1241 C CA . GLY A1 1 80 ? -29.629 11.114 -36.719 1.0 3.12 ? 80 A 2 +ATOM 1242 C C . GLY A1 1 80 ? -29.498 9.697 -37.241 1.0 52.34 ? 80 A 2 +ATOM 1243 O O . GLY A1 1 80 ? -29.919 9.398 -38.358 1.0 43.44 ? 80 A 2 +ATOM 1244 H H . GLY A1 1 80 ? -30.631 10.388 -35.001 1.0 0.24 ? 80 A 2 +ATOM 1245 H HA2 . GLY A1 1 80 ? -30.29 11.667 -37.369 1.0 71.24 ? 80 A 2 +ATOM 1246 H HA3 . GLY A1 1 80 ? -28.654 11.58 -36.732 1.0 43.14 ? 80 A 2 +ATOM 1247 N N . GLY A1 1 81 ? -28.912 8.82 -36.43 1.0 43.34 ? 81 A 2 +ATOM 1248 C CA . GLY A1 1 81 ? -28.737 7.438 -36.835 1.0 20.2 ? 81 A 2 +ATOM 1249 C C . GLY A1 1 81 ? -28.335 6.542 -35.68 1.0 63.23 ? 81 A 2 +ATOM 1250 O O . GLY A1 1 81 ? -28.272 6.986 -34.533 1.0 30.24 ? 81 A 2 +ATOM 1251 H H . GLY A1 1 81 ? -28.597 9.115 -35.55 1.0 11.33 ? 81 A 2 +ATOM 1252 H HA2 . GLY A1 1 81 ? -29.665 7.076 -37.252 1.0 30.51 ? 81 A 2 +ATOM 1253 H HA3 . GLY A1 1 81 ? -27.97 7.392 -37.594 1.0 55.14 ? 81 A 2 +ATOM 1254 N N . VAL A1 1 82 ? -28.064 5.276 -35.981 1.0 30.52 ? 82 A 2 +ATOM 1255 C CA . VAL A1 1 82 ? -27.666 4.315 -34.959 1.0 4.45 ? 82 A 2 +ATOM 1256 C C . VAL A1 1 82 ? -26.494 3.463 -35.432 1.0 63.52 ? 82 A 2 +ATOM 1257 O O . VAL A1 1 82 ? -25.348 3.699 -35.049 1.0 12.52 ? 82 A 2 +ATOM 1258 C CB . VAL A1 1 82 ? -28.836 3.391 -34.573 1.0 53.54 ? 82 A 2 +ATOM 1259 C CG1 . VAL A1 1 82 ? -30.004 4.203 -34.036 1.0 33.31 ? 82 A 2 +ATOM 1260 C CG2 . VAL A1 1 82 ? -29.265 2.549 -35.765 1.0 1.13 ? 82 A 2 +ATOM 1261 H H . VAL A1 1 82 ? -28.131 4.982 -36.913 1.0 42.11 ? 82 A 2 +ATOM 1262 H HA . VAL A1 1 82 ? -27.366 4.868 -34.08 1.0 65.12 ? 82 A 2 +ATOM 1263 H HB . VAL A1 1 82 ? -28.5 2.725 -33.791 1.0 3.02 ? 82 A 2 +ATOM 1264 H HG11 . VAL A1 1 82 ? -30.178 5.052 -34.68 1.0 71.54 ? 82 A 2 +ATOM 1265 H HG12 . VAL A1 1 82 ? -30.889 3.585 -34.005 1.0 43.52 ? 82 A 2 +ATOM 1266 H HG13 . VAL A1 1 82 ? -29.773 4.55 -33.039 1.0 60.31 ? 82 A 2 +ATOM 1267 H HG21 . VAL A1 1 82 ? -30.08 1.903 -35.476 1.0 51.1 ? 82 A 2 +ATOM 1268 H HG22 . VAL A1 1 82 ? -29.586 3.198 -36.566 1.0 43.42 ? 82 A 2 +ATOM 1269 H HG23 . VAL A1 1 82 ? -28.432 1.948 -36.101 1.0 61.21 ? 82 A 2 +ATOM 1 N N . GLY A1 1 1 ? -8.875 2.341 -1.267 1.0 13.0 ? 1 A 3 +ATOM 2 C CA . GLY A1 1 1 ? -7.892 3.405 -1.179 1.0 45.03 ? 1 A 3 +ATOM 3 C C . GLY A1 1 1 ? -6.752 3.223 -2.161 1.0 65.21 ? 1 A 3 +ATOM 4 O O . GLY A1 1 1 ? -5.629 2.885 -1.786 1.0 33.34 ? 1 A 3 +ATOM 5 H H1 . GLY A1 1 1 ? -9.512 2.325 -2.012 1.0 52.4 ? 1 A 3 +ATOM 6 H HA2 . GLY A1 1 1 ? -8.379 4.348 -1.38 1.0 14.15 ? 1 A 3 +ATOM 7 H HA3 . GLY A1 1 1 ? -7.489 3.426 -0.178 1.0 34.23 ? 1 A 3 +ATOM 8 N N . PRO A1 1 2 ? -7.036 3.448 -3.453 1.0 55.32 ? 2 A 3 +ATOM 9 C CA . PRO A1 1 2 ? -6.039 3.311 -4.518 1.0 21.43 ? 2 A 3 +ATOM 10 C C . PRO A1 1 2 ? -4.976 4.403 -4.461 1.0 41.45 ? 2 A 3 +ATOM 11 O O . PRO A1 1 2 ? -5.047 5.31 -3.631 1.0 62.42 ? 2 A 3 +ATOM 12 C CB . PRO A1 1 2 ? -6.868 3.439 -5.799 1.0 51.45 ? 2 A 3 +ATOM 13 C CG . PRO A1 1 2 ? -8.064 4.232 -5.398 1.0 43.11 ? 2 A 3 +ATOM 14 C CD . PRO A1 1 2 ? -8.353 3.853 -3.972 1.0 64.14 ? 2 A 3 +ATOM 15 H HA . PRO A1 1 2 ? -5.561 2.343 -4.492 1.0 31.54 ? 2 A 3 +ATOM 16 H HB2 . PRO A1 1 2 ? -6.29 3.949 -6.556 1.0 42.4 ? 2 A 3 +ATOM 17 H HB3 . PRO A1 1 2 ? -7.146 2.457 -6.152 1.0 62.54 ? 2 A 3 +ATOM 18 H HG2 . PRO A1 1 2 ? -7.845 5.287 -5.469 1.0 3.22 ? 2 A 3 +ATOM 19 H HG3 . PRO A1 1 2 ? -8.901 3.977 -6.031 1.0 51.14 ? 2 A 3 +ATOM 20 H HD2 . PRO A1 1 2 ? -8.738 4.702 -3.427 1.0 11.0 ? 2 A 3 +ATOM 21 H HD3 . PRO A1 1 2 ? -9.052 3.03 -3.935 1.0 24.12 ? 2 A 3 +ATOM 22 N N . LEU A1 1 3 ? -3.991 4.31 -5.348 1.0 34.12 ? 3 A 3 +ATOM 23 C CA . LEU A1 1 3 ? -2.913 5.291 -5.399 1.0 54.03 ? 3 A 3 +ATOM 24 C C . LEU A1 1 3 ? -2.895 6.012 -6.743 1.0 63.21 ? 3 A 3 +ATOM 25 O O . LEU A1 1 3 ? -3.255 7.185 -6.834 1.0 11.24 ? 3 A 3 +ATOM 26 C CB . LEU A1 1 3 ? -1.565 4.61 -5.155 1.0 60.12 ? 3 A 3 +ATOM 27 C CG . LEU A1 1 3 ? -0.919 4.867 -3.793 1.0 64.13 ? 3 A 3 +ATOM 28 C CD1 . LEU A1 1 3 ? -0.508 6.325 -3.665 1.0 62.25 ? 3 A 3 +ATOM 29 C CD2 . LEU A1 1 3 ? -1.87 4.478 -2.671 1.0 0.12 ? 3 A 3 +ATOM 30 H H . LEU A1 1 3 ? -3.989 3.565 -5.984 1.0 52.35 ? 3 A 3 +ATOM 31 H HA . LEU A1 1 3 ? -3.087 6.016 -4.617 1.0 43.13 ? 3 A 3 +ATOM 32 H HB2 . LEU A1 1 3 ? -1.71 3.545 -5.257 1.0 74.24 ? 3 A 3 +ATOM 33 H HB3 . LEU A1 1 3 ? -0.88 4.952 -5.918 1.0 72.41 ? 3 A 3 +ATOM 34 H HG . LEU A1 1 3 ? -0.029 4.26 -3.704 1.0 43.5 ? 3 A 3 +ATOM 35 H HD11 . LEU A1 1 3 ? -0.498 6.784 -4.641 1.0 50.45 ? 3 A 3 +ATOM 36 H HD12 . LEU A1 1 3 ? 0.479 6.383 -3.229 1.0 4.34 ? 3 A 3 +ATOM 37 H HD13 . LEU A1 1 3 ? -1.212 6.843 -3.03 1.0 54.42 ? 3 A 3 +ATOM 38 H HD21 . LEU A1 1 3 ? -2.087 3.422 -2.733 1.0 23.33 ? 3 A 3 +ATOM 39 H HD22 . LEU A1 1 3 ? -2.787 5.041 -2.764 1.0 1.01 ? 3 A 3 +ATOM 40 H HD23 . LEU A1 1 3 ? -1.41 4.696 -1.718 1.0 75.24 ? 3 A 3 +ATOM 41 N N . GLY A1 1 4 ? -2.476 5.301 -7.785 1.0 4.21 ? 4 A 3 +ATOM 42 C CA . GLY A1 1 4 ? -2.421 5.889 -9.111 1.0 43.34 ? 4 A 3 +ATOM 43 C C . GLY A1 1 4 ? -3.785 5.962 -9.769 1.0 32.24 ? 4 A 3 +ATOM 44 O O . GLY A1 1 4 ? -4.185 7.013 -10.268 1.0 73.31 ? 4 A 3 +ATOM 45 H H . GLY A1 1 4 ? -2.201 4.37 -7.653 1.0 2.13 ? 4 A 3 +ATOM 46 H HA2 . GLY A1 1 4 ? -2.016 6.887 -9.034 1.0 53.5 ? 4 A 3 +ATOM 47 H HA3 . GLY A1 1 4 ? -1.767 5.293 -9.73 1.0 61.41 ? 4 A 3 +ATOM 48 N N . SER A1 1 5 ? -4.5 4.841 -9.772 1.0 14.33 ? 5 A 3 +ATOM 49 C CA . SER A1 1 5 ? -5.824 4.781 -10.379 1.0 12.42 ? 5 A 3 +ATOM 50 C C . SER A1 1 5 ? -6.705 5.919 -9.874 1.0 43.22 ? 5 A 3 +ATOM 51 O O . SER A1 1 5 ? -6.554 6.382 -8.744 1.0 33.52 ? 5 A 3 +ATOM 52 C CB . SER A1 1 5 ? -6.486 3.435 -10.076 1.0 72.02 ? 5 A 3 +ATOM 53 O OG . SER A1 1 5 ? -5.703 2.36 -10.565 1.0 21.35 ? 5 A 3 +ATOM 54 H H . SER A1 1 5 ? -4.126 4.035 -9.358 1.0 31.12 ? 5 A 3 +ATOM 55 H HA . SER A1 1 5 ? -5.704 4.881 -11.447 1.0 12.32 ? 5 A 3 +ATOM 56 H HB2 . SER A1 1 5 ? -6.6 3.326 -9.008 1.0 41.01 ? 5 A 3 +ATOM 57 H HB3 . SER A1 1 5 ? -7.458 3.401 -10.547 1.0 74.13 ? 5 A 3 +ATOM 58 H HG . SER A1 1 5 ? -6.01 1.538 -10.175 1.0 33.45 ? 5 A 3 +ATOM 59 N N . MET A1 1 6 ? -7.626 6.366 -10.722 1.0 14.01 ? 6 A 3 +ATOM 60 C CA . MET A1 1 6 ? -8.533 7.45 -10.362 1.0 54.33 ? 6 A 3 +ATOM 61 C C . MET A1 1 6 ? -9.878 7.29 -11.065 1.0 31.44 ? 6 A 3 +ATOM 62 O O . MET A1 1 6 ? -10.128 6.279 -11.721 1.0 1.11 ? 6 A 3 +ATOM 63 C CB . MET A1 1 6 ? -7.915 8.802 -10.722 1.0 70.21 ? 6 A 3 +ATOM 64 C CG . MET A1 1 6 ? -7.324 8.847 -12.122 1.0 25.05 ? 6 A 3 +ATOM 65 S SD . MET A1 1 6 ? -5.539 9.103 -12.115 1.0 3.44 ? 6 A 3 +ATOM 66 C CE . MET A1 1 6 ? -5.077 8.311 -13.653 1.0 13.21 ? 6 A 3 +ATOM 67 H H . MET A1 1 6 ? -7.699 5.958 -11.61 1.0 2.32 ? 6 A 3 +ATOM 68 H HA . MET A1 1 6 ? -8.691 7.409 -9.295 1.0 5.22 ? 6 A 3 +ATOM 69 H HB2 . MET A1 1 6 ? -8.677 9.564 -10.652 1.0 62.43 ? 6 A 3 +ATOM 70 H HB3 . MET A1 1 6 ? -7.128 9.025 -10.016 1.0 63.34 ? 6 A 3 +ATOM 71 H HG2 . MET A1 1 6 ? -7.536 7.912 -12.618 1.0 33.13 ? 6 A 3 +ATOM 72 H HG3 . MET A1 1 6 ? -7.788 9.656 -12.667 1.0 12.41 ? 6 A 3 +ATOM 73 H HE1 . MET A1 1 6 ? -4.385 7.507 -13.45 1.0 12.23 ? 6 A 3 +ATOM 74 H HE2 . MET A1 1 6 ? -5.959 7.913 -14.133 1.0 52.54 ? 6 A 3 +ATOM 75 H HE3 . MET A1 1 6 ? -4.609 9.035 -14.304 1.0 2.41 ? 6 A 3 +ATOM 76 N N . GLN A1 1 7 ? -10.738 8.293 -10.923 1.0 13.12 ? 7 A 3 +ATOM 77 C CA . GLN A1 1 7 ? -12.057 8.261 -11.544 1.0 13.2 ? 7 A 3 +ATOM 78 C C . GLN A1 1 7 ? -12.416 9.623 -12.13 1.0 42.42 ? 7 A 3 +ATOM 79 O O . GLN A1 1 7 ? -11.892 10.651 -11.701 1.0 71.33 ? 7 A 3 +ATOM 80 C CB . GLN A1 1 7 ? -13.115 7.837 -10.524 1.0 42.01 ? 7 A 3 +ATOM 81 C CG . GLN A1 1 7 ? -12.694 6.653 -9.668 1.0 12.34 ? 7 A 3 +ATOM 82 C CD . GLN A1 1 7 ? -12.207 7.069 -8.294 1.0 44.31 ? 7 A 3 +ATOM 83 O OE1 . GLN A1 1 7 ? -12.018 8.255 -8.023 1.0 33.44 ? 7 A 3 +ATOM 84 N NE2 . GLN A1 1 7 ? -12.0 6.093 -7.418 1.0 73.32 ? 7 A 3 +ATOM 85 H H . GLN A1 1 7 ? -10.48 9.072 -10.388 1.0 71.21 ? 7 A 3 +ATOM 86 H HA . GLN A1 1 7 ? -12.03 7.536 -12.343 1.0 62.03 ? 7 A 3 +ATOM 87 H HB2 . GLN A1 1 7 ? -13.321 8.671 -9.87 1.0 13.25 ? 7 A 3 +ATOM 88 H HB3 . GLN A1 1 7 ? -14.019 7.57 -11.05 1.0 41.42 ? 7 A 3 +ATOM 89 H HG2 . GLN A1 1 7 ? -13.541 5.994 -9.548 1.0 43.33 ? 7 A 3 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.898 6.126 -10.173 1.0 33.21 ? 7 A 3 +ATOM 91 H HE21 . GLN A1 1 7 ? -12.171 5.171 -7.705 1.0 52.01 ? 7 A 3 +ATOM 92 H HE22 . GLN A1 1 7 ? -11.684 6.333 -6.523 1.0 55.43 ? 7 A 3 +ATOM 93 N N . ILE A1 1 8 ? -13.31 9.622 -13.113 1.0 12.12 ? 8 A 3 +ATOM 94 C CA . ILE A1 1 8 ? -13.739 10.857 -13.756 1.0 64.2 ? 8 A 3 +ATOM 95 C C . ILE A1 1 8 ? -15.26 10.945 -13.819 1.0 0.33 ? 8 A 3 +ATOM 96 O O . ILE A1 1 8 ? -15.954 9.931 -13.753 1.0 11.35 ? 8 A 3 +ATOM 97 C CB . ILE A1 1 8 ? -13.169 10.976 -15.183 1.0 65.34 ? 8 A 3 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.306 9.757 -15.513 1.0 72.33 ? 8 A 3 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.363 12.258 -15.326 1.0 55.24 ? 8 A 3 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.873 9.698 -16.961 1.0 11.02 ? 8 A 3 +ATOM 101 H H . ILE A1 1 8 ? -13.691 8.77 -13.411 1.0 43.45 ? 8 A 3 +ATOM 102 H HA . ILE A1 1 8 ? -13.364 11.685 -13.171 1.0 41.41 ? 8 A 3 +ATOM 103 H HB . ILE A1 1 8 ? -13.997 11.02 -15.874 1.0 13.24 ? 8 A 3 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.417 9.776 -14.902 1.0 4.11 ? 8 A 3 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.866 8.858 -15.297 1.0 33.41 ? 8 A 3 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.667 12.155 -16.146 1.0 12.11 ? 8 A 3 +ATOM 107 H HG22 . ILE A1 1 8 ? -13.031 13.082 -15.523 1.0 14.43 ? 8 A 3 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.818 12.445 -14.413 1.0 53.13 ? 8 A 3 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.456 8.951 -17.482 1.0 4.51 ? 8 A 3 +ATOM 110 H HD12 . ILE A1 1 8 ? -12.029 10.661 -17.424 1.0 22.53 ? 8 A 3 +ATOM 111 H HD13 . ILE A1 1 8 ? -10.826 9.438 -17.015 1.0 32.23 ? 8 A 3 +ATOM 112 N N . PHE A1 1 9 ? -15.771 12.165 -13.949 1.0 44.42 ? 9 A 3 +ATOM 113 C CA . PHE A1 1 9 ? -17.211 12.386 -14.023 1.0 45.42 ? 9 A 3 +ATOM 114 C C . PHE A1 1 9 ? -17.614 12.888 -15.406 1.0 62.05 ? 9 A 3 +ATOM 115 O O . PHE A1 1 9 ? -17.078 13.879 -15.9 1.0 33.13 ? 9 A 3 +ATOM 116 C CB . PHE A1 1 9 ? -17.648 13.392 -12.955 1.0 42.3 ? 9 A 3 +ATOM 117 C CG . PHE A1 1 9 ? -17.593 12.845 -11.558 1.0 44.44 ? 9 A 3 +ATOM 118 C CD1 . PHE A1 1 9 ? -16.376 12.561 -10.959 1.0 24.21 ? 9 A 3 +ATOM 119 C CD2 . PHE A1 1 9 ? -18.757 12.615 -10.843 1.0 24.11 ? 9 A 3 +ATOM 120 C CE1 . PHE A1 1 9 ? -16.323 12.057 -9.673 1.0 54.33 ? 9 A 3 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.71 12.112 -9.556 1.0 62.43 ? 9 A 3 +ATOM 122 C CZ . PHE A1 1 9 ? -17.491 11.833 -8.97 1.0 72.21 ? 9 A 3 +ATOM 123 H H . PHE A1 1 9 ? -15.166 12.935 -13.997 1.0 15.35 ? 9 A 3 +ATOM 124 H HA . PHE A1 1 9 ? -17.7 11.442 -13.838 1.0 72.15 ? 9 A 3 +ATOM 125 H HB2 . PHE A1 1 9 ? -17.002 14.256 -12.999 1.0 13.22 ? 9 A 3 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.665 13.697 -13.154 1.0 20.44 ? 9 A 3 +ATOM 127 H HD1 . PHE A1 1 9 ? -15.462 12.736 -11.506 1.0 63.23 ? 9 A 3 +ATOM 128 H HD2 . PHE A1 1 9 ? -19.712 12.833 -11.301 1.0 43.5 ? 9 A 3 +ATOM 129 H HE1 . PHE A1 1 9 ? -15.368 11.84 -9.217 1.0 53.21 ? 9 A 3 +ATOM 130 H HE2 . PHE A1 1 9 ? -19.625 11.938 -9.01 1.0 61.25 ? 9 A 3 +ATOM 131 H HZ . PHE A1 1 9 ? -17.452 11.439 -7.966 1.0 11.33 ? 9 A 3 +ATOM 132 N N . VAL A1 1 10 ? -18.564 12.195 -16.026 1.0 35.51 ? 10 A 3 +ATOM 133 C CA . VAL A1 1 10 ? -19.041 12.569 -17.352 1.0 51.35 ? 10 A 3 +ATOM 134 C C . VAL A1 1 10 ? -20.503 12.998 -17.31 1.0 20.3 ? 10 A 3 +ATOM 135 O O . VAL A1 1 10 ? -21.348 12.31 -16.736 1.0 33.54 ? 10 A 3 +ATOM 136 C CB . VAL A1 1 10 ? -18.888 11.407 -18.352 1.0 1.24 ? 10 A 3 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.647 11.939 -19.757 1.0 43.55 ? 10 A 3 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.76 10.481 -17.923 1.0 70.41 ? 10 A 3 +ATOM 139 H H . VAL A1 1 10 ? -18.954 11.413 -15.581 1.0 13.11 ? 10 A 3 +ATOM 140 H HA . VAL A1 1 10 ? -18.442 13.397 -17.701 1.0 52.2 ? 10 A 3 +ATOM 141 H HB . VAL A1 1 10 ? -19.807 10.841 -18.359 1.0 21.21 ? 10 A 3 +ATOM 142 H HG11 . VAL A1 1 10 ? -19.089 12.92 -19.85 1.0 75.22 ? 10 A 3 +ATOM 143 H HG12 . VAL A1 1 10 ? -17.584 12.003 -19.94 1.0 54.41 ? 10 A 3 +ATOM 144 H HG13 . VAL A1 1 10 ? -19.098 11.272 -20.476 1.0 61.31 ? 10 A 3 +ATOM 145 H HG21 . VAL A1 1 10 ? -16.947 11.065 -17.518 1.0 13.24 ? 10 A 3 +ATOM 146 H HG22 . VAL A1 1 10 ? -18.123 9.797 -17.17 1.0 62.44 ? 10 A 3 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.408 9.921 -18.778 1.0 2.35 ? 10 A 3 +ATOM 148 N N . LYS A1 1 11 ? -20.796 14.141 -17.921 1.0 23.3 ? 11 A 3 +ATOM 149 C CA . LYS A1 1 11 ? -22.157 14.663 -17.956 1.0 10.31 ? 11 A 3 +ATOM 150 C C . LYS A1 1 11 ? -22.75 14.544 -19.356 1.0 22.12 ? 11 A 3 +ATOM 151 O O . LYS A1 1 11 ? -22.28 15.183 -20.298 1.0 63.21 ? 11 A 3 +ATOM 152 C CB . LYS A1 1 11 ? -22.175 16.126 -17.506 1.0 34.41 ? 11 A 3 +ATOM 153 C CG . LYS A1 1 11 ? -23.485 16.837 -17.8 1.0 63.11 ? 11 A 3 +ATOM 154 C CD . LYS A1 1 11 ? -23.442 18.29 -17.358 1.0 3.15 ? 11 A 3 +ATOM 155 C CE . LYS A1 1 11 ? -23.025 19.207 -18.497 1.0 2.52 ? 11 A 3 +ATOM 156 N NZ . LYS A1 1 11 ? -23.057 20.641 -18.095 1.0 51.12 ? 11 A 3 +ATOM 157 H H . LYS A1 1 11 ? -20.079 14.645 -18.362 1.0 4.15 ? 11 A 3 +ATOM 158 H HA . LYS A1 1 11 ? -22.755 14.078 -17.274 1.0 44.21 ? 11 A 3 +ATOM 159 H HB2 . LYS A1 1 11 ? -22.0 16.164 -16.44 1.0 75.01 ? 11 A 3 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.381 16.656 -18.012 1.0 15.43 ? 11 A 3 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.673 16.801 -18.862 1.0 73.24 ? 11 A 3 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.283 16.333 -17.274 1.0 30.03 ? 11 A 3 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.424 18.583 -17.016 1.0 63.51 ? 11 A 3 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.733 18.39 -16.548 1.0 61.22 ? 11 A 3 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.021 18.95 -18.8 1.0 70.24 ? 11 A 3 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.7 19.059 -19.326 1.0 3.13 ? 11 A 3 +ATOM 167 H HZ1 . LYS A1 1 11 ? -22.109 21.058 -18.182 1.0 1.34 ? 11 A 3 +ATOM 168 H HZ2 . LYS A1 1 11 ? -23.374 20.728 -17.108 1.0 61.44 ? 11 A 3 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.713 21.168 -18.705 1.0 12.11 ? 11 A 3 +ATOM 170 N N . THR A1 1 12 ? -23.788 13.723 -19.486 1.0 60.33 ? 12 A 3 +ATOM 171 C CA . THR A1 1 12 ? -24.445 13.52 -20.771 1.0 63.11 ? 12 A 3 +ATOM 172 C C . THR A1 1 12 ? -25.282 14.734 -21.158 1.0 63.2 ? 12 A 3 +ATOM 173 O O . THR A1 1 12 ? -25.654 15.542 -20.305 1.0 23.14 ? 12 A 3 +ATOM 174 C CB . THR A1 1 12 ? -25.35 12.274 -20.749 1.0 13.53 ? 12 A 3 +ATOM 175 O OG1 . THR A1 1 12 ? -26.528 12.537 -19.979 1.0 44.22 ? 12 A 3 +ATOM 176 C CG2 . THR A1 1 12 ? -24.611 11.08 -20.163 1.0 44.25 ? 12 A 3 +ATOM 177 H H . THR A1 1 12 ? -24.117 13.241 -18.699 1.0 50.31 ? 12 A 3 +ATOM 178 H HA . THR A1 1 12 ? -23.679 13.371 -21.518 1.0 15.31 ? 12 A 3 +ATOM 179 H HB . THR A1 1 12 ? -25.637 12.038 -21.764 1.0 3.11 ? 12 A 3 +ATOM 180 H HG1 . THR A1 1 12 ? -27.293 12.171 -20.43 1.0 54.01 ? 12 A 3 +ATOM 181 H HG21 . THR A1 1 12 ? -25.26 10.217 -20.17 1.0 54.24 ? 12 A 3 +ATOM 182 H HG22 . THR A1 1 12 ? -24.318 11.301 -19.147 1.0 51.32 ? 12 A 3 +ATOM 183 H HG23 . THR A1 1 12 ? -23.732 10.874 -20.755 1.0 74.05 ? 12 A 3 +ATOM 184 N N . LEU A1 1 13 ? -25.576 14.858 -22.447 1.0 74.21 ? 13 A 3 +ATOM 185 C CA . LEU A1 1 13 ? -26.371 15.974 -22.947 1.0 74.52 ? 13 A 3 +ATOM 186 C C . LEU A1 1 13 ? -27.744 16.006 -22.282 1.0 25.21 ? 13 A 3 +ATOM 187 O O . LEU A1 1 13 ? -28.424 17.033 -22.285 1.0 11.35 ? 13 A 3 +ATOM 188 C CB . LEU A1 1 13 ? -26.529 15.874 -24.465 1.0 31.51 ? 13 A 3 +ATOM 189 C CG . LEU A1 1 13 ? -27.088 17.113 -25.165 1.0 30.32 ? 13 A 3 +ATOM 190 C CD1 . LEU A1 1 13 ? -25.993 18.148 -25.374 1.0 44.31 ? 13 A 3 +ATOM 191 C CD2 . LEU A1 1 13 ? -27.726 16.733 -26.494 1.0 64.01 ? 13 A 3 +ATOM 192 H H . LEU A1 1 13 ? -25.252 14.183 -23.079 1.0 42.02 ? 13 A 3 +ATOM 193 H HA . LEU A1 1 13 ? -25.847 16.888 -22.707 1.0 34.1 ? 13 A 3 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.557 15.667 -24.886 1.0 62.11 ? 13 A 3 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.193 15.047 -24.674 1.0 43.21 ? 13 A 3 +ATOM 196 H HG . LEU A1 1 13 ? -27.852 17.558 -24.542 1.0 45.4 ? 13 A 3 +ATOM 197 H HD11 . LEU A1 1 13 ? -26.34 19.112 -25.033 1.0 62.23 ? 13 A 3 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.747 18.204 -26.424 1.0 23.44 ? 13 A 3 +ATOM 199 H HD13 . LEU A1 1 13 ? -25.116 17.861 -24.813 1.0 25.55 ? 13 A 3 +ATOM 200 H HD21 . LEU A1 1 13 ? -27.155 15.94 -26.953 1.0 62.14 ? 13 A 3 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.737 17.594 -27.146 1.0 41.34 ? 13 A 3 +ATOM 202 H HD23 . LEU A1 1 13 ? -28.739 16.398 -26.324 1.0 51.42 ? 13 A 3 +ATOM 203 N N . THR A1 1 14 ? -28.145 14.875 -21.711 1.0 31.41 ? 14 A 3 +ATOM 204 C CA . THR A1 1 14 ? -29.436 14.773 -21.041 1.0 30.33 ? 14 A 3 +ATOM 205 C C . THR A1 1 14 ? -29.319 15.133 -19.564 1.0 22.13 ? 14 A 3 +ATOM 206 O O . THR A1 1 14 ? -30.271 14.981 -18.801 1.0 5.31 ? 14 A 3 +ATOM 207 C CB . THR A1 1 14 ? -30.024 13.355 -21.168 1.0 34.54 ? 14 A 3 +ATOM 208 O OG1 . THR A1 1 14 ? -29.213 12.422 -20.445 1.0 3.22 ? 14 A 3 +ATOM 209 C CG2 . THR A1 1 14 ? -30.113 12.935 -22.627 1.0 34.11 ? 14 A 3 +ATOM 210 H H . THR A1 1 14 ? -27.559 14.091 -21.741 1.0 2.31 ? 14 A 3 +ATOM 211 H HA . THR A1 1 14 ? -30.114 15.466 -21.517 1.0 25.44 ? 14 A 3 +ATOM 212 H HB . THR A1 1 14 ? -31.02 13.356 -20.747 1.0 55.24 ? 14 A 3 +ATOM 213 H HG1 . THR A1 1 14 ? -29.368 12.526 -19.503 1.0 24.42 ? 14 A 3 +ATOM 214 H HG21 . THR A1 1 14 ? -30.121 13.813 -23.254 1.0 1.02 ? 14 A 3 +ATOM 215 H HG22 . THR A1 1 14 ? -31.021 12.372 -22.785 1.0 12.23 ? 14 A 3 +ATOM 216 H HG23 . THR A1 1 14 ? -29.26 12.321 -22.877 1.0 12.42 ? 14 A 3 +ATOM 217 N N . GLY A1 1 15 ? -28.143 15.611 -19.167 1.0 61.2 ? 15 A 3 +ATOM 218 C CA . GLY A1 1 15 ? -27.924 15.985 -17.782 1.0 25.44 ? 15 A 3 +ATOM 219 C C . GLY A1 1 15 ? -27.82 14.782 -16.866 1.0 2.34 ? 15 A 3 +ATOM 220 O O . GLY A1 1 15 ? -28.571 14.662 -15.898 1.0 24.03 ? 15 A 3 +ATOM 221 H H . GLY A1 1 15 ? -27.419 15.71 -19.82 1.0 73.22 ? 15 A 3 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.009 16.555 -17.716 1.0 10.15 ? 15 A 3 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.746 16.603 -17.454 1.0 23.53 ? 15 A 3 +ATOM 224 N N . LYS A1 1 16 ? -26.888 13.886 -17.172 1.0 11.21 ? 16 A 3 +ATOM 225 C CA . LYS A1 1 16 ? -26.688 12.685 -16.37 1.0 34.13 ? 16 A 3 +ATOM 226 C C . LYS A1 1 16 ? -25.243 12.586 -15.89 1.0 15.24 ? 16 A 3 +ATOM 227 O O . LYS A1 1 16 ? -24.314 12.512 -16.694 1.0 50.04 ? 16 A 3 +ATOM 228 C CB . LYS A1 1 16 ? -27.053 11.439 -17.18 1.0 31.42 ? 16 A 3 +ATOM 229 C CG . LYS A1 1 16 ? -27.658 10.325 -16.343 1.0 73.35 ? 16 A 3 +ATOM 230 C CD . LYS A1 1 16 ? -26.585 9.413 -15.771 1.0 50.3 ? 16 A 3 +ATOM 231 C CE . LYS A1 1 16 ? -25.896 8.61 -16.863 1.0 52.44 ? 16 A 3 +ATOM 232 N NZ . LYS A1 1 16 ? -26.284 7.173 -16.823 1.0 2.53 ? 16 A 3 +ATOM 233 H H . LYS A1 1 16 ? -26.319 14.037 -17.957 1.0 52.54 ? 16 A 3 +ATOM 234 H HA . LYS A1 1 16 ? -27.337 12.748 -15.51 1.0 34.34 ? 16 A 3 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.767 11.716 -17.942 1.0 44.24 ? 16 A 3 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.161 11.059 -17.656 1.0 12.13 ? 16 A 3 +ATOM 237 H HG2 . LYS A1 1 16 ? -28.216 10.761 -15.528 1.0 3.41 ? 16 A 3 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.321 9.74 -16.964 1.0 74.14 ? 16 A 3 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.847 10.015 -15.262 1.0 63.23 ? 16 A 3 +ATOM 240 H HD3 . LYS A1 1 16 ? -27.043 8.731 -15.068 1.0 14.51 ? 16 A 3 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.169 9.022 -17.822 1.0 44.12 ? 16 A 3 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.827 8.689 -16.729 1.0 75.31 ? 16 A 3 +ATOM 243 H HZ1 . LYS A1 1 16 ? -26.977 7.01 -16.065 1.0 61.55 ? 16 A 3 +ATOM 244 H HZ2 . LYS A1 1 16 ? -25.447 6.581 -16.646 1.0 23.15 ? 16 A 3 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.706 6.892 -17.731 1.0 43.23 ? 16 A 3 +ATOM 246 N N . THR A1 1 17 ? -25.061 12.584 -14.573 1.0 33.03 ? 17 A 3 +ATOM 247 C CA . THR A1 1 17 ? -23.731 12.493 -13.985 1.0 61.21 ? 17 A 3 +ATOM 248 C C . THR A1 1 17 ? -23.31 11.04 -13.798 1.0 13.11 ? 17 A 3 +ATOM 249 O O . THR A1 1 17 ? -23.954 10.287 -13.067 1.0 32.24 ? 17 A 3 +ATOM 250 C CB . THR A1 1 17 ? -23.667 13.214 -12.625 1.0 22.54 ? 17 A 3 +ATOM 251 O OG1 . THR A1 1 17 ? -24.959 13.21 -12.008 1.0 24.32 ? 17 A 3 +ATOM 252 C CG2 . THR A1 1 17 ? -23.184 14.647 -12.794 1.0 72.42 ? 17 A 3 +ATOM 253 H H . THR A1 1 17 ? -25.842 12.645 -13.983 1.0 63.53 ? 17 A 3 +ATOM 254 H HA . THR A1 1 17 ? -23.036 12.975 -14.658 1.0 15.15 ? 17 A 3 +ATOM 255 H HB . THR A1 1 17 ? -22.97 12.688 -11.989 1.0 61.22 ? 17 A 3 +ATOM 256 H HG1 . THR A1 1 17 ? -24.873 12.949 -11.088 1.0 54.0 ? 17 A 3 +ATOM 257 H HG21 . THR A1 1 17 ? -22.689 14.749 -13.748 1.0 31.34 ? 17 A 3 +ATOM 258 H HG22 . THR A1 1 17 ? -22.492 14.889 -12.002 1.0 12.24 ? 17 A 3 +ATOM 259 H HG23 . THR A1 1 17 ? -24.029 15.318 -12.753 1.0 74.01 ? 17 A 3 +ATOM 260 N N . ILE A1 1 18 ? -22.226 10.653 -14.461 1.0 21.15 ? 18 A 3 +ATOM 261 C CA . ILE A1 1 18 ? -21.719 9.289 -14.365 1.0 42.23 ? 18 A 3 +ATOM 262 C C . ILE A1 1 18 ? -20.256 9.276 -13.934 1.0 2.02 ? 18 A 3 +ATOM 263 O O . ILE A1 1 18 ? -19.463 10.114 -14.363 1.0 34.24 ? 18 A 3 +ATOM 264 C CB . ILE A1 1 18 ? -21.854 8.543 -15.705 1.0 20.13 ? 18 A 3 +ATOM 265 C CG1 . ILE A1 1 18 ? -21.079 7.225 -15.66 1.0 0.43 ? 18 A 3 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.361 9.415 -16.85 1.0 34.34 ? 18 A 3 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.335 6.332 -16.854 1.0 41.12 ? 18 A 3 +ATOM 268 H H . ILE A1 1 18 ? -21.756 11.299 -15.028 1.0 72.35 ? 18 A 3 +ATOM 269 H HA . ILE A1 1 18 ? -22.306 8.767 -13.624 1.0 33.1 ? 18 A 3 +ATOM 270 H HB . ILE A1 1 18 ? -22.9 8.332 -15.87 1.0 55.23 ? 18 A 3 +ATOM 271 H HG12 . ILE A1 1 18 ? -20.022 7.437 -15.627 1.0 35.45 ? 18 A 3 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.361 6.68 -14.771 1.0 15.51 ? 18 A 3 +ATOM 273 H HG21 . ILE A1 1 18 ? -21.199 8.803 -17.725 1.0 31.24 ? 18 A 3 +ATOM 274 H HG22 . ILE A1 1 18 ? -22.1 10.17 -17.071 1.0 60.32 ? 18 A 3 +ATOM 275 H HG23 . ILE A1 1 18 ? -20.434 9.891 -16.567 1.0 71.44 ? 18 A 3 +ATOM 276 H HD11 . ILE A1 1 18 ? -20.396 5.935 -17.215 1.0 32.31 ? 18 A 3 +ATOM 277 H HD12 . ILE A1 1 18 ? -21.981 5.517 -16.563 1.0 60.24 ? 18 A 3 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.807 6.904 -17.638 1.0 25.35 ? 18 A 3 +ATOM 279 N N . THR A1 1 19 ? -19.904 8.317 -13.083 1.0 42.32 ? 19 A 3 +ATOM 280 C CA . THR A1 1 19 ? -18.537 8.193 -12.594 1.0 41.24 ? 19 A 3 +ATOM 281 C C . THR A1 1 19 ? -17.882 6.917 -13.11 1.0 70.21 ? 19 A 3 +ATOM 282 O O . THR A1 1 19 ? -18.51 5.858 -13.15 1.0 44.42 ? 19 A 3 +ATOM 283 C CB . THR A1 1 19 ? -18.489 8.195 -11.055 1.0 2.4 ? 19 A 3 +ATOM 284 O OG1 . THR A1 1 19 ? -19.681 8.787 -10.528 1.0 22.32 ? 19 A 3 +ATOM 285 C CG2 . THR A1 1 19 ? -17.273 8.958 -10.552 1.0 13.14 ? 19 A 3 +ATOM 286 H H . THR A1 1 19 ? -20.582 7.678 -12.778 1.0 1.15 ? 19 A 3 +ATOM 287 H HA . THR A1 1 19 ? -17.976 9.044 -12.952 1.0 65.43 ? 19 A 3 +ATOM 288 H HB . THR A1 1 19 ? -18.421 7.173 -10.71 1.0 44.24 ? 19 A 3 +ATOM 289 H HG1 . THR A1 1 19 ? -19.899 9.573 -11.035 1.0 60.25 ? 19 A 3 +ATOM 290 H HG21 . THR A1 1 19 ? -16.381 8.38 -10.744 1.0 73.33 ? 19 A 3 +ATOM 291 H HG22 . THR A1 1 19 ? -17.369 9.13 -9.49 1.0 23.45 ? 19 A 3 +ATOM 292 H HG23 . THR A1 1 19 ? -17.205 9.906 -11.066 1.0 51.03 ? 19 A 3 +ATOM 293 N N . ILE A1 1 20 ? -16.617 7.023 -13.503 1.0 2.13 ? 20 A 3 +ATOM 294 C CA . ILE A1 1 20 ? -15.878 5.876 -14.015 1.0 23.24 ? 20 A 3 +ATOM 295 C C . ILE A1 1 20 ? -14.422 5.914 -13.561 1.0 21.51 ? 20 A 3 +ATOM 296 O O . ILE A1 1 20 ? -13.753 6.942 -13.674 1.0 3.54 ? 20 A 3 +ATOM 297 C CB . ILE A1 1 20 ? -15.923 5.818 -15.553 1.0 55.55 ? 20 A 3 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.886 7.23 -16.14 1.0 1.5 ? 20 A 3 +ATOM 299 C CG2 . ILE A1 1 20 ? -17.168 5.078 -16.019 1.0 1.32 ? 20 A 3 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.143 7.319 -17.455 1.0 2.4 ? 20 A 3 +ATOM 301 H H . ILE A1 1 20 ? -16.171 7.894 -13.447 1.0 32.52 ? 20 A 3 +ATOM 302 H HA . ILE A1 1 20 ? -16.341 4.981 -13.627 1.0 40.32 ? 20 A 3 +ATOM 303 H HB . ILE A1 1 20 ? -15.058 5.27 -15.896 1.0 75.22 ? 20 A 3 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.895 7.571 -16.307 1.0 4.24 ? 20 A 3 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.398 7.891 -15.438 1.0 20.02 ? 20 A 3 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.984 5.777 -16.123 1.0 41.11 ? 20 A 3 +ATOM 307 H HG22 . ILE A1 1 20 ? -16.972 4.61 -16.972 1.0 51.34 ? 20 A 3 +ATOM 308 H HG23 . ILE A1 1 20 ? -17.43 4.323 -15.293 1.0 74.34 ? 20 A 3 +ATOM 309 H HD11 . ILE A1 1 20 ? -14.079 7.313 -17.268 1.0 44.23 ? 20 A 3 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.403 6.472 -18.074 1.0 43.31 ? 20 A 3 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.414 8.232 -17.962 1.0 23.14 ? 20 A 3 +ATOM 312 N N . ASP A1 1 21 ? -13.938 4.788 -13.051 1.0 44.41 ? 21 A 3 +ATOM 313 C CA . ASP A1 1 21 ? -12.56 4.69 -12.583 1.0 13.43 ? 21 A 3 +ATOM 314 C C . ASP A1 1 21 ? -11.613 4.393 -13.741 1.0 74.52 ? 21 A 3 +ATOM 315 O O . ASP A1 1 21 ? -11.738 3.368 -14.411 1.0 3.25 ? 21 A 3 +ATOM 316 C CB . ASP A1 1 21 ? -12.438 3.603 -11.514 1.0 40.32 ? 21 A 3 +ATOM 317 C CG . ASP A1 1 21 ? -12.884 2.244 -12.018 1.0 70.32 ? 21 A 3 +ATOM 318 O OD1 . ASP A1 1 21 ? -14.108 2.008 -12.082 1.0 34.41 ? 21 A 3 +ATOM 319 O OD2 . ASP A1 1 21 ? -12.008 1.416 -12.347 1.0 4.34 ? 21 A 3 +ATOM 320 H H . ASP A1 1 21 ? -14.521 4.002 -12.988 1.0 61.24 ? 21 A 3 +ATOM 321 H HA . ASP A1 1 21 ? -12.29 5.641 -12.148 1.0 0.1 ? 21 A 3 +ATOM 322 H HB2 . ASP A1 1 21 ? -11.406 3.529 -11.202 1.0 73.15 ? 21 A 3 +ATOM 323 H HB3 . ASP A1 1 21 ? -13.049 3.871 -10.665 1.0 61.23 ? 21 A 3 +ATOM 324 N N . VAL A1 1 22 ? -10.665 5.296 -13.971 1.0 30.34 ? 22 A 3 +ATOM 325 C CA . VAL A1 1 22 ? -9.696 5.131 -15.047 1.0 1.34 ? 22 A 3 +ATOM 326 C C . VAL A1 1 22 ? -8.27 5.287 -14.532 1.0 61.2 ? 22 A 3 +ATOM 327 O O . VAL A1 1 22 ? -8.045 5.844 -13.457 1.0 34.03 ? 22 A 3 +ATOM 328 C CB . VAL A1 1 22 ? -9.936 6.147 -16.179 1.0 60.13 ? 22 A 3 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.384 6.613 -16.181 1.0 14.0 ? 22 A 3 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.987 7.329 -16.043 1.0 61.12 ? 22 A 3 +ATOM 331 H H . VAL A1 1 22 ? -10.616 6.093 -13.402 1.0 71.0 ? 22 A 3 +ATOM 332 H HA . VAL A1 1 22 ? -9.815 4.137 -15.454 1.0 41.13 ? 22 A 3 +ATOM 333 H HB . VAL A1 1 22 ? -9.737 5.659 -17.122 1.0 23.42 ? 22 A 3 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.548 7.28 -15.348 1.0 3.13 ? 22 A 3 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.595 7.131 -17.106 1.0 11.12 ? 22 A 3 +ATOM 336 H HG13 . VAL A1 1 22 ? -12.037 5.757 -16.091 1.0 2.3 ? 22 A 3 +ATOM 337 H HG21 . VAL A1 1 22 ? -8.944 7.639 -15.01 1.0 43.3 ? 22 A 3 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.002 7.038 -16.374 1.0 71.52 ? 22 A 3 +ATOM 339 H HG23 . VAL A1 1 22 ? -9.343 8.148 -16.651 1.0 24.41 ? 22 A 3 +ATOM 340 N N . ASP A1 1 23 ? -7.31 4.793 -15.306 1.0 73.14 ? 23 A 3 +ATOM 341 C CA . ASP A1 1 23 ? -5.904 4.879 -14.929 1.0 0.33 ? 23 A 3 +ATOM 342 C C . ASP A1 1 23 ? -5.122 5.719 -15.934 1.0 62.12 ? 23 A 3 +ATOM 343 O O . ASP A1 1 23 ? -5.577 5.946 -17.056 1.0 35.34 ? 23 A 3 +ATOM 344 C CB . ASP A1 1 23 ? -5.294 3.48 -14.83 1.0 24.44 ? 23 A 3 +ATOM 345 C CG . ASP A1 1 23 ? -4.363 3.336 -13.642 1.0 11.25 ? 23 A 3 +ATOM 346 O OD1 . ASP A1 1 23 ? -3.876 4.372 -13.142 1.0 71.52 ? 23 A 3 +ATOM 347 O OD2 . ASP A1 1 23 ? -4.122 2.189 -13.212 1.0 54.12 ? 23 A 3 +ATOM 348 H H . ASP A1 1 23 ? -7.553 4.36 -16.151 1.0 71.31 ? 23 A 3 +ATOM 349 H HA . ASP A1 1 23 ? -5.848 5.354 -13.961 1.0 62.03 ? 23 A 3 +ATOM 350 H HB2 . ASP A1 1 23 ? -6.088 2.754 -14.732 1.0 75.32 ? 23 A 3 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.733 3.274 -15.731 1.0 32.1 ? 23 A 3 +ATOM 352 N N . HIS A1 1 24 ? -3.944 6.178 -15.525 1.0 3.42 ? 24 A 3 +ATOM 353 C CA . HIS A1 1 24 ? -3.098 6.993 -16.389 1.0 64.1 ? 24 A 3 +ATOM 354 C C . HIS A1 1 24 ? -2.731 6.235 -17.662 1.0 13.22 ? 24 A 3 +ATOM 355 O O . HIS A1 1 24 ? -2.305 6.832 -18.65 1.0 40.32 ? 24 A 3 +ATOM 356 C CB . HIS A1 1 24 ? -1.829 7.414 -15.648 1.0 43.52 ? 24 A 3 +ATOM 357 C CG . HIS A1 1 24 ? -0.854 6.295 -15.447 1.0 63.23 ? 24 A 3 +ATOM 358 N ND1 . HIS A1 1 24 ? 0.433 6.321 -15.939 1.0 33.23 ? 24 A 3 +ATOM 359 C CD2 . HIS A1 1 24 ? -0.985 5.112 -14.801 1.0 70.35 ? 24 A 3 +ATOM 360 C CE1 . HIS A1 1 24 ? 1.052 5.202 -15.606 1.0 52.22 ? 24 A 3 +ATOM 361 N NE2 . HIS A1 1 24 ? 0.214 4.452 -14.914 1.0 51.1 ? 24 A 3 +ATOM 362 H H . HIS A1 1 24 ? -3.635 5.963 -14.62 1.0 35.01 ? 24 A 3 +ATOM 363 H HA . HIS A1 1 24 ? -3.656 7.877 -16.66 1.0 52.33 ? 24 A 3 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.331 8.189 -16.211 1.0 74.33 ? 24 A 3 +ATOM 365 H HB3 . HIS A1 1 24 ? -2.099 7.799 -14.675 1.0 2.24 ? 24 A 3 +ATOM 366 H HD1 . HIS A1 1 24 ? 0.833 7.05 -16.457 1.0 61.24 ? 24 A 3 +ATOM 367 H HD2 . HIS A1 1 24 ? -1.868 4.754 -14.291 1.0 14.35 ? 24 A 3 +ATOM 368 H HE1 . HIS A1 1 24 ? 2.071 4.944 -15.855 1.0 73.24 ? 24 A 3 +ATOM 369 N N . ALA A1 1 25 ? -2.899 4.917 -17.629 1.0 63.43 ? 25 A 3 +ATOM 370 C CA . ALA A1 1 25 ? -2.587 4.078 -18.779 1.0 43.32 ? 25 A 3 +ATOM 371 C C . ALA A1 1 25 ? -3.812 3.883 -19.665 1.0 33.54 ? 25 A 3 +ATOM 372 O O . ALA A1 1 25 ? -3.779 3.113 -20.625 1.0 12.23 ? 25 A 3 +ATOM 373 C CB . ALA A1 1 25 ? -2.046 2.733 -18.319 1.0 51.34 ? 25 A 3 +ATOM 374 H H . ALA A1 1 25 ? -3.243 4.5 -16.812 1.0 55.41 ? 25 A 3 +ATOM 375 H HA . ALA A1 1 25 ? -1.815 4.572 -19.352 1.0 23.12 ? 25 A 3 +ATOM 376 H HB1 . ALA A1 1 25 ? -2.759 2.267 -17.654 1.0 42.21 ? 25 A 3 +ATOM 377 H HB2 . ALA A1 1 25 ? -1.885 2.097 -19.178 1.0 3.14 ? 25 A 3 +ATOM 378 H HB3 . ALA A1 1 25 ? -1.111 2.879 -17.8 1.0 44.44 ? 25 A 3 +ATOM 379 N N . ASP A1 1 26 ? -4.891 4.585 -19.337 1.0 53.31 ? 26 A 3 +ATOM 380 C CA . ASP A1 1 26 ? -6.128 4.489 -20.104 1.0 71.32 ? 26 A 3 +ATOM 381 C C . ASP A1 1 26 ? -6.412 5.793 -20.843 1.0 31.24 ? 26 A 3 +ATOM 382 O O . ASP A1 1 26 ? -6.595 6.843 -20.225 1.0 53.43 ? 26 A 3 +ATOM 383 C CB . ASP A1 1 26 ? -7.299 4.145 -19.183 1.0 21.1 ? 26 A 3 +ATOM 384 C CG . ASP A1 1 26 ? -7.126 2.801 -18.503 1.0 73.54 ? 26 A 3 +ATOM 385 O OD1 . ASP A1 1 26 ? -7.359 1.768 -19.165 1.0 73.22 ? 26 A 3 +ATOM 386 O OD2 . ASP A1 1 26 ? -6.758 2.782 -17.31 1.0 2.02 ? 26 A 3 +ATOM 387 H H . ASP A1 1 26 ? -4.855 5.182 -18.561 1.0 73.33 ? 26 A 3 +ATOM 388 H HA . ASP A1 1 26 ? -6.008 3.698 -20.829 1.0 35.3 ? 26 A 3 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.383 4.905 -18.419 1.0 71.15 ? 26 A 3 +ATOM 390 H HB3 . ASP A1 1 26 ? -8.21 4.121 -19.763 1.0 51.4 ? 26 A 3 +ATOM 391 N N . THR A1 1 27 ? -6.446 5.721 -22.17 1.0 11.22 ? 27 A 3 +ATOM 392 C CA . THR A1 1 27 ? -6.705 6.895 -22.993 1.0 12.11 ? 27 A 3 +ATOM 393 C C . THR A1 1 27 ? -8.199 7.178 -23.093 1.0 24.55 ? 27 A 3 +ATOM 394 O O . THR A1 1 27 ? -9.025 6.355 -22.696 1.0 14.34 ? 27 A 3 +ATOM 395 C CB . THR A1 1 27 ? -6.131 6.724 -24.412 1.0 24.42 ? 27 A 3 +ATOM 396 O OG1 . THR A1 1 27 ? -6.188 5.347 -24.801 1.0 51.41 ? 27 A 3 +ATOM 397 C CG2 . THR A1 1 27 ? -4.692 7.215 -24.477 1.0 72.22 ? 27 A 3 +ATOM 398 H H . THR A1 1 27 ? -6.292 4.856 -22.604 1.0 1.33 ? 27 A 3 +ATOM 399 H HA . THR A1 1 27 ? -6.218 7.741 -22.53 1.0 54.42 ? 27 A 3 +ATOM 400 H HB . THR A1 1 27 ? -6.726 7.31 -25.098 1.0 51.23 ? 27 A 3 +ATOM 401 H HG1 . THR A1 1 27 ? -7.069 5.143 -25.125 1.0 23.44 ? 27 A 3 +ATOM 402 H HG21 . THR A1 1 27 ? -4.641 8.229 -24.111 1.0 20.21 ? 27 A 3 +ATOM 403 H HG22 . THR A1 1 27 ? -4.346 7.183 -25.499 1.0 40.31 ? 27 A 3 +ATOM 404 H HG23 . THR A1 1 27 ? -4.068 6.58 -23.866 1.0 53.14 ? 27 A 3 +ATOM 405 N N . VAL A1 1 28 ? -8.541 8.347 -23.625 1.0 70.04 ? 28 A 3 +ATOM 406 C CA . VAL A1 1 28 ? -9.938 8.738 -23.779 1.0 40.12 ? 28 A 3 +ATOM 407 C C . VAL A1 1 28 ? -10.735 7.656 -24.499 1.0 43.3 ? 28 A 3 +ATOM 408 O O . VAL A1 1 28 ? -11.825 7.283 -24.068 1.0 51.44 ? 28 A 3 +ATOM 409 C CB . VAL A1 1 28 ? -10.068 10.061 -24.557 1.0 70.14 ? 28 A 3 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.457 10.653 -24.374 1.0 13.41 ? 28 A 3 +ATOM 411 C CG2 . VAL A1 1 28 ? -8.997 11.046 -24.114 1.0 73.55 ? 28 A 3 +ATOM 412 H H . VAL A1 1 28 ? -7.838 8.961 -23.923 1.0 50.23 ? 28 A 3 +ATOM 413 H HA . VAL A1 1 28 ? -10.355 8.882 -22.792 1.0 62.42 ? 28 A 3 +ATOM 414 H HB . VAL A1 1 28 ? -9.925 9.853 -25.607 1.0 52.41 ? 28 A 3 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.525 11.119 -23.402 1.0 72.32 ? 28 A 3 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.638 11.391 -25.142 1.0 75.12 ? 28 A 3 +ATOM 417 H HG13 . VAL A1 1 28 ? -12.195 9.868 -24.448 1.0 43.12 ? 28 A 3 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.91 11.024 -23.038 1.0 22.23 ? 28 A 3 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.052 10.773 -24.558 1.0 21.24 ? 28 A 3 +ATOM 420 H HG23 . VAL A1 1 28 ? -9.27 12.042 -24.433 1.0 51.43 ? 28 A 3 +ATOM 421 N N . GLY A1 1 29 ? -10.183 7.156 -25.601 1.0 51.02 ? 29 A 3 +ATOM 422 C CA . GLY A1 1 29 ? -10.856 6.122 -26.364 1.0 24.21 ? 29 A 3 +ATOM 423 C C . GLY A1 1 29 ? -11.404 5.016 -25.484 1.0 62.32 ? 29 A 3 +ATOM 424 O O . GLY A1 1 29 ? -12.575 4.653 -25.589 1.0 1.41 ? 29 A 3 +ATOM 425 H H . GLY A1 1 29 ? -9.311 7.493 -25.897 1.0 25.44 ? 29 A 3 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.672 6.568 -26.913 1.0 33.14 ? 29 A 3 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.155 5.694 -27.065 1.0 61.11 ? 29 A 3 +ATOM 428 N N . ALA A1 1 30 ? -10.554 4.477 -24.616 1.0 0.3 ? 30 A 3 +ATOM 429 C CA . ALA A1 1 30 ? -10.959 3.406 -23.715 1.0 24.42 ? 30 A 3 +ATOM 430 C C . ALA A1 1 30 ? -12.072 3.867 -22.779 1.0 23.15 ? 30 A 3 +ATOM 431 O O . ALA A1 1 30 ? -12.967 3.095 -22.434 1.0 23.32 ? 30 A 3 +ATOM 432 C CB . ALA A1 1 30 ? -9.765 2.91 -22.913 1.0 4.23 ? 30 A 3 +ATOM 433 H H . ALA A1 1 30 ? -9.633 4.809 -24.58 1.0 13.0 ? 30 A 3 +ATOM 434 H HA . ALA A1 1 30 ? -11.325 2.585 -24.315 1.0 42.35 ? 30 A 3 +ATOM 435 H HB1 . ALA A1 1 30 ? -10.052 2.037 -22.344 1.0 24.3 ? 30 A 3 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.961 2.652 -23.587 1.0 15.25 ? 30 A 3 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.436 3.687 -22.24 1.0 54.13 ? 30 A 3 +ATOM 438 N N . VAL A1 1 31 ? -12.009 5.13 -22.371 1.0 44.02 ? 31 A 3 +ATOM 439 C CA . VAL A1 1 31 ? -13.012 5.695 -21.475 1.0 44.43 ? 31 A 3 +ATOM 440 C C . VAL A1 1 31 ? -14.381 5.741 -22.143 1.0 22.33 ? 31 A 3 +ATOM 441 O O . VAL A1 1 31 ? -15.39 5.371 -21.543 1.0 41.34 ? 31 A 3 +ATOM 442 C CB . VAL A1 1 31 ? -12.625 7.115 -21.023 1.0 42.01 ? 31 A 3 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.765 7.76 -20.25 1.0 61.22 ? 31 A 3 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.355 7.08 -20.186 1.0 34.2 ? 31 A 3 +ATOM 445 H H . VAL A1 1 31 ? -11.272 5.697 -22.68 1.0 33.11 ? 31 A 3 +ATOM 446 H HA . VAL A1 1 31 ? -13.07 5.065 -20.6 1.0 53.53 ? 31 A 3 +ATOM 447 H HB . VAL A1 1 31 ? -12.434 7.712 -21.903 1.0 34.14 ? 31 A 3 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.47 6.999 -19.949 1.0 24.43 ? 31 A 3 +ATOM 449 H HG12 . VAL A1 1 31 ? -13.372 8.256 -19.375 1.0 62.24 ? 31 A 3 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.264 8.481 -20.88 1.0 4.44 ? 31 A 3 +ATOM 451 H HG21 . VAL A1 1 31 ? -11.219 6.089 -19.779 1.0 32.4 ? 31 A 3 +ATOM 452 H HG22 . VAL A1 1 31 ? -10.509 7.334 -20.806 1.0 31.51 ? 31 A 3 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.436 7.793 -19.378 1.0 2.41 ? 31 A 3 +ATOM 454 N N . LYS A1 1 32 ? -14.41 6.199 -23.39 1.0 44.33 ? 32 A 3 +ATOM 455 C CA . LYS A1 1 32 ? -15.656 6.294 -24.143 1.0 33.41 ? 32 A 3 +ATOM 456 C C . LYS A1 1 32 ? -16.363 4.943 -24.195 1.0 33.52 ? 32 A 3 +ATOM 457 O O . LYS A1 1 32 ? -17.582 4.864 -24.041 1.0 55.22 ? 32 A 3 +ATOM 458 C CB . LYS A1 1 32 ? -15.381 6.792 -25.563 1.0 21.43 ? 32 A 3 +ATOM 459 C CG . LYS A1 1 32 ? -16.03 8.13 -25.874 1.0 62.04 ? 32 A 3 +ATOM 460 C CD . LYS A1 1 32 ? -15.025 9.267 -25.802 1.0 13.3 ? 32 A 3 +ATOM 461 C CE . LYS A1 1 32 ? -14.634 9.754 -27.189 1.0 61.02 ? 32 A 3 +ATOM 462 N NZ . LYS A1 1 32 ? -15.773 10.409 -27.889 1.0 10.13 ? 32 A 3 +ATOM 463 H H . LYS A1 1 32 ? -13.572 6.48 -23.815 1.0 0.43 ? 32 A 3 +ATOM 464 H HA . LYS A1 1 32 ? -16.295 7.002 -23.639 1.0 20.21 ? 32 A 3 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.314 6.894 -25.696 1.0 31.13 ? 32 A 3 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.755 6.062 -26.267 1.0 51.43 ? 32 A 3 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.446 8.095 -26.87 1.0 34.55 ? 32 A 3 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.818 8.312 -25.158 1.0 75.31 ? 32 A 3 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.462 10.089 -25.255 1.0 62.53 ? 32 A 3 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.139 8.922 -25.288 1.0 34.24 ? 32 A 3 +ATOM 471 H HE2 . LYS A1 1 32 ? -13.826 10.464 -27.092 1.0 32.35 ? 32 A 3 +ATOM 472 H HE3 . LYS A1 1 32 ? -14.302 8.909 -27.773 1.0 31.14 ? 32 A 3 +ATOM 473 H HZ1 . LYS A1 1 32 ? -16.226 9.738 -28.541 1.0 3.34 ? 32 A 3 +ATOM 474 H HZ2 . LYS A1 1 32 ? -15.435 11.229 -28.432 1.0 11.13 ? 32 A 3 +ATOM 475 H HZ3 . LYS A1 1 32 ? -16.478 10.734 -27.197 1.0 13.55 ? 32 A 3 +ATOM 476 N N . ALA A1 1 33 ? -15.591 3.884 -24.411 1.0 34.21 ? 33 A 3 +ATOM 477 C CA . ALA A1 1 33 ? -16.144 2.537 -24.48 1.0 60.31 ? 33 A 3 +ATOM 478 C C . ALA A1 1 33 ? -16.764 2.129 -23.147 1.0 31.03 ? 33 A 3 +ATOM 479 O O . ALA A1 1 33 ? -17.83 1.514 -23.109 1.0 31.32 ? 33 A 3 +ATOM 480 C CB . ALA A1 1 33 ? -15.066 1.544 -24.888 1.0 54.24 ? 33 A 3 +ATOM 481 H H . ALA A1 1 33 ? -14.626 4.011 -24.526 1.0 43.1 ? 33 A 3 +ATOM 482 H HA . ALA A1 1 33 ? -16.912 2.529 -25.24 1.0 53.01 ? 33 A 3 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.17 1.731 -24.315 1.0 2.33 ? 33 A 3 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.412 0.539 -24.698 1.0 61.23 ? 33 A 3 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.851 1.658 -25.94 1.0 53.23 ? 33 A 3 +ATOM 486 N N . LYS A1 1 34 ? -16.09 2.475 -22.056 1.0 30.14 ? 34 A 3 +ATOM 487 C CA . LYS A1 1 34 ? -16.574 2.147 -20.72 1.0 3.41 ? 34 A 3 +ATOM 488 C C . LYS A1 1 34 ? -17.935 2.784 -20.463 1.0 51.04 ? 34 A 3 +ATOM 489 O O . LYS A1 1 34 ? -18.841 2.142 -19.929 1.0 30.3 ? 34 A 3 +ATOM 490 C CB . LYS A1 1 34 ? -15.572 2.614 -19.663 1.0 63.02 ? 34 A 3 +ATOM 491 C CG . LYS A1 1 34 ? -15.963 2.237 -18.245 1.0 24.43 ? 34 A 3 +ATOM 492 C CD . LYS A1 1 34 ? -15.881 0.736 -18.024 1.0 44.42 ? 34 A 3 +ATOM 493 C CE . LYS A1 1 34 ? -14.45 0.233 -18.143 1.0 34.12 ? 34 A 3 +ATOM 494 N NZ . LYS A1 1 34 ? -14.285 -1.117 -17.537 1.0 13.0 ? 34 A 3 +ATOM 495 H H . LYS A1 1 34 ? -15.246 2.965 -22.151 1.0 65.25 ? 34 A 3 +ATOM 496 H HA . LYS A1 1 34 ? -16.675 1.074 -20.659 1.0 3.22 ? 34 A 3 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.609 2.175 -19.877 1.0 71.03 ? 34 A 3 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.486 3.69 -19.716 1.0 71.12 ? 34 A 3 +ATOM 499 H HG2 . LYS A1 1 34 ? -15.296 2.729 -17.553 1.0 24.23 ? 34 A 3 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.978 2.564 -18.062 1.0 22.21 ? 34 A 3 +ATOM 501 H HD2 . LYS A1 1 34 ? -16.25 0.506 -17.035 1.0 63.43 ? 34 A 3 +ATOM 502 H HD3 . LYS A1 1 34 ? -16.492 0.238 -18.763 1.0 75.33 ? 34 A 3 +ATOM 503 H HE2 . LYS A1 1 34 ? -14.186 0.184 -19.189 1.0 34.14 ? 34 A 3 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.795 0.928 -17.639 1.0 0.12 ? 34 A 3 +ATOM 505 H HZ1 . LYS A1 1 34 ? -15.139 -1.377 -17.005 1.0 62.42 ? 34 A 3 +ATOM 506 H HZ2 . LYS A1 1 34 ? -13.471 -1.12 -16.89 1.0 14.2 ? 34 A 3 +ATOM 507 H HZ3 . LYS A1 1 34 ? -14.124 -1.825 -18.281 1.0 65.2 ? 34 A 3 +ATOM 508 N N . ILE A1 1 35 ? -18.073 4.049 -20.847 1.0 14.42 ? 35 A 3 +ATOM 509 C CA . ILE A1 1 35 ? -19.325 4.771 -20.659 1.0 22.32 ? 35 A 3 +ATOM 510 C C . ILE A1 1 35 ? -20.441 4.166 -21.504 1.0 74.31 ? 35 A 3 +ATOM 511 O O . ILE A1 1 35 ? -21.592 4.094 -21.073 1.0 33.23 ? 35 A 3 +ATOM 512 C CB . ILE A1 1 35 ? -19.175 6.261 -21.019 1.0 42.5 ? 35 A 3 +ATOM 513 C CG1 . ILE A1 1 35 ? -18.031 6.888 -20.219 1.0 22.04 ? 35 A 3 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.478 7.003 -20.76 1.0 45.14 ? 35 A 3 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.219 6.795 -18.721 1.0 11.1 ? 35 A 3 +ATOM 516 H H . ILE A1 1 35 ? -17.316 4.507 -21.266 1.0 54.44 ? 35 A 3 +ATOM 517 H HA . ILE A1 1 35 ? -19.599 4.699 -19.616 1.0 30.01 ? 35 A 3 +ATOM 518 H HB . ILE A1 1 35 ? -18.951 6.334 -22.072 1.0 2.44 ? 35 A 3 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.109 6.388 -20.469 1.0 3.24 ? 35 A 3 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.951 7.934 -20.48 1.0 0.11 ? 35 A 3 +ATOM 521 H HG21 . ILE A1 1 35 ? -21.237 6.299 -20.45 1.0 65.32 ? 35 A 3 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.327 7.734 -19.981 1.0 43.1 ? 35 A 3 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.796 7.499 -21.664 1.0 75.41 ? 35 A 3 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.597 7.533 -18.234 1.0 43.52 ? 35 A 3 +ATOM 525 H HD12 . ILE A1 1 35 ? -19.254 6.979 -18.475 1.0 71.15 ? 35 A 3 +ATOM 526 H HD13 . ILE A1 1 35 ? -17.937 5.809 -18.383 1.0 74.3 ? 35 A 3 +ATOM 527 N N . TYR A1 1 36 ? -20.092 3.73 -22.71 1.0 62.53 ? 36 A 3 +ATOM 528 C CA . TYR A1 1 36 ? -21.064 3.131 -23.616 1.0 64.44 ? 36 A 3 +ATOM 529 C C . TYR A1 1 36 ? -21.758 1.94 -22.962 1.0 53.42 ? 36 A 3 +ATOM 530 O O . TYR A1 1 36 ? -22.979 1.801 -23.036 1.0 34.33 ? 36 A 3 +ATOM 531 C CB . TYR A1 1 36 ? -20.38 2.689 -24.911 1.0 74.42 ? 36 A 3 +ATOM 532 C CG . TYR A1 1 36 ? -20.765 1.295 -25.353 1.0 43.51 ? 36 A 3 +ATOM 533 C CD1 . TYR A1 1 36 ? -22.021 1.036 -25.889 1.0 62.31 ? 36 A 3 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.872 0.237 -25.237 1.0 22.21 ? 36 A 3 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.377 -0.236 -26.293 1.0 25.24 ? 36 A 3 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.219 -1.038 -25.64 1.0 24.41 ? 36 A 3 +ATOM 537 C CZ . TYR A1 1 36 ? -21.472 -1.27 -26.167 1.0 51.0 ? 36 A 3 +ATOM 538 O OH . TYR A1 1 36 ? -21.822 -2.538 -26.57 1.0 31.41 ? 36 A 3 +ATOM 539 H H . TYR A1 1 36 ? -19.16 3.815 -22.998 1.0 42.53 ? 36 A 3 +ATOM 540 H HA . TYR A1 1 36 ? -21.806 3.881 -23.851 1.0 45.34 ? 36 A 3 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.646 3.372 -25.702 1.0 32.41 ? 36 A 3 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.31 2.708 -24.769 1.0 73.31 ? 36 A 3 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.727 1.848 -25.986 1.0 14.41 ? 36 A 3 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.891 0.421 -24.824 1.0 73.43 ? 36 A 3 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.358 -0.417 -26.706 1.0 30.0 ? 36 A 3 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.511 -1.848 -25.542 1.0 11.1 ? 36 A 3 +ATOM 547 H HH . TYR A1 1 36 ? -21.032 -3.024 -26.819 1.0 20.21 ? 36 A 3 +ATOM 548 N N . ASP A1 1 37 ? -20.97 1.085 -22.321 1.0 31.31 ? 37 A 3 +ATOM 549 C CA . ASP A1 1 37 ? -21.507 -0.094 -21.65 1.0 4.3 ? 37 A 3 +ATOM 550 C C . ASP A1 1 37 ? -22.2 0.29 -20.347 1.0 30.32 ? 37 A 3 +ATOM 551 O O . ASP A1 1 37 ? -23.153 -0.363 -19.921 1.0 62.0 ? 37 A 3 +ATOM 552 C CB . ASP A1 1 37 ? -20.391 -1.102 -21.372 1.0 35.43 ? 37 A 3 +ATOM 553 C CG . ASP A1 1 37 ? -20.909 -2.521 -21.249 1.0 34.32 ? 37 A 3 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.504 -3.023 -22.226 1.0 31.12 ? 37 A 3 +ATOM 555 O OD2 . ASP A1 1 37 ? -20.719 -3.131 -20.176 1.0 3.2 ? 37 A 3 +ATOM 556 H H . ASP A1 1 37 ? -20.004 1.25 -22.296 1.0 51.42 ? 37 A 3 +ATOM 557 H HA . ASP A1 1 37 ? -22.233 -0.548 -22.308 1.0 32.24 ? 37 A 3 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.675 -1.069 -22.18 1.0 43.14 ? 37 A 3 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.897 -0.836 -20.449 1.0 34.23 ? 37 A 3 +ATOM 560 N N . LYS A1 1 38 ? -21.713 1.353 -19.715 1.0 33.03 ? 38 A 3 +ATOM 561 C CA . LYS A1 1 38 ? -22.284 1.826 -18.459 1.0 33.5 ? 38 A 3 +ATOM 562 C C . LYS A1 1 38 ? -23.784 2.065 -18.6 1.0 62.1 ? 38 A 3 +ATOM 563 O O . LYS A1 1 38 ? -24.569 1.649 -17.749 1.0 13.24 ? 38 A 3 +ATOM 564 C CB . LYS A1 1 38 ? -21.59 3.115 -18.013 1.0 32.13 ? 38 A 3 +ATOM 565 C CG . LYS A1 1 38 ? -20.811 2.97 -16.718 1.0 11.13 ? 38 A 3 +ATOM 566 C CD . LYS A1 1 38 ? -19.346 2.661 -16.98 1.0 55.11 ? 38 A 3 +ATOM 567 C CE . LYS A1 1 38 ? -19.108 1.166 -17.12 1.0 12.13 ? 38 A 3 +ATOM 568 N NZ . LYS A1 1 38 ? -18.473 0.588 -15.904 1.0 62.42 ? 38 A 3 +ATOM 569 H H . LYS A1 1 38 ? -20.951 1.832 -20.104 1.0 40.1 ? 38 A 3 +ATOM 570 H HA . LYS A1 1 38 ? -22.121 1.063 -17.713 1.0 13.43 ? 38 A 3 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.906 3.428 -18.788 1.0 53.44 ? 38 A 3 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.339 3.882 -17.875 1.0 74.35 ? 38 A 3 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.88 3.893 -16.162 1.0 72.35 ? 38 A 3 +ATOM 574 H HG3 . LYS A1 1 38 ? -21.241 2.165 -16.138 1.0 65.33 ? 38 A 3 +ATOM 575 H HD2 . LYS A1 1 38 ? -19.042 3.15 -17.893 1.0 31.44 ? 38 A 3 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.756 3.035 -16.155 1.0 51.13 ? 38 A 3 +ATOM 577 H HE2 . LYS A1 1 38 ? -20.056 0.678 -17.288 1.0 72.24 ? 38 A 3 +ATOM 578 H HE3 . LYS A1 1 38 ? -18.461 0.996 -17.969 1.0 52.14 ? 38 A 3 +ATOM 579 H HZ1 . LYS A1 1 38 ? -19.198 0.372 -15.19 1.0 12.21 ? 38 A 3 +ATOM 580 H HZ2 . LYS A1 1 38 ? -17.795 1.266 -15.499 1.0 31.3 ? 38 A 3 +ATOM 581 H HZ3 . LYS A1 1 38 ? -17.968 -0.288 -16.146 1.0 72.13 ? 38 A 3 +ATOM 582 N N . GLU A1 1 39 ? -24.173 2.736 -19.679 1.0 74.33 ? 39 A 3 +ATOM 583 C CA . GLU A1 1 39 ? -25.579 3.029 -19.929 1.0 31.43 ? 39 A 3 +ATOM 584 C C . GLU A1 1 39 ? -26.073 2.302 -21.178 1.0 55.55 ? 39 A 3 +ATOM 585 O O . GLU A1 1 39 ? -27.069 1.581 -21.137 1.0 44.25 ? 39 A 3 +ATOM 586 C CB . GLU A1 1 39 ? -25.789 4.536 -20.087 1.0 31.12 ? 39 A 3 +ATOM 587 C CG . GLU A1 1 39 ? -24.713 5.217 -20.916 1.0 22.34 ? 39 A 3 +ATOM 588 C CD . GLU A1 1 39 ? -24.791 6.73 -20.844 1.0 34.02 ? 39 A 3 +ATOM 589 O OE1 . GLU A1 1 39 ? -25.874 7.253 -20.506 1.0 60.52 ? 39 A 3 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.769 7.39 -21.126 1.0 24.54 ? 39 A 3 +ATOM 591 H H . GLU A1 1 39 ? -23.499 3.041 -20.321 1.0 53.12 ? 39 A 3 +ATOM 592 H HA . GLU A1 1 39 ? -26.147 2.683 -19.079 1.0 24.23 ? 39 A 3 +ATOM 593 H HB2 . GLU A1 1 39 ? -26.744 4.707 -20.563 1.0 13.32 ? 39 A 3 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.8 4.99 -19.107 1.0 53.15 ? 39 A 3 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.745 4.905 -20.553 1.0 73.51 ? 39 A 3 +ATOM 596 H HG3 . GLU A1 1 39 ? -24.824 4.914 -21.946 1.0 55.55 ? 39 A 3 +ATOM 597 N N . GLY A1 1 40 ? -25.367 2.499 -22.288 1.0 41.31 ? 40 A 3 +ATOM 598 C CA . GLY A1 1 40 ? -25.748 1.858 -23.532 1.0 23.2 ? 40 A 3 +ATOM 599 C C . GLY A1 1 40 ? -25.929 2.849 -24.664 1.0 54.31 ? 40 A 3 +ATOM 600 O O . GLY A1 1 40 ? -26.94 2.822 -25.367 1.0 62.35 ? 40 A 3 +ATOM 601 H H . GLY A1 1 40 ? -24.582 3.085 -22.261 1.0 1.31 ? 40 A 3 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.982 1.148 -23.808 1.0 42.33 ? 40 A 3 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.678 1.328 -23.381 1.0 42.25 ? 40 A 3 +ATOM 604 N N . ILE A1 1 41 ? -24.948 3.729 -24.84 1.0 11.45 ? 41 A 3 +ATOM 605 C CA . ILE A1 1 41 ? -25.005 4.734 -25.895 1.0 13.21 ? 41 A 3 +ATOM 606 C C . ILE A1 1 41 ? -23.827 4.591 -26.853 1.0 73.14 ? 41 A 3 +ATOM 607 O O . ILE A1 1 41 ? -22.771 4.063 -26.505 1.0 54.03 ? 41 A 3 +ATOM 608 C CB . ILE A1 1 41 ? -25.009 6.16 -25.313 1.0 13.54 ? 41 A 3 +ATOM 609 C CG1 . ILE A1 1 41 ? -23.926 6.301 -24.242 1.0 35.25 ? 41 A 3 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.378 6.492 -24.737 1.0 15.54 ? 41 A 3 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.074 7.541 -24.404 1.0 51.21 ? 41 A 3 +ATOM 612 H H . ILE A1 1 41 ? -24.169 3.7 -24.248 1.0 10.31 ? 41 A 3 +ATOM 613 H HA . ILE A1 1 41 ? -25.923 4.588 -26.445 1.0 22.4 ? 41 A 3 +ATOM 614 H HB . ILE A1 1 41 ? -24.805 6.852 -26.115 1.0 2.22 ? 41 A 3 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.392 6.344 -23.271 1.0 53.25 ? 41 A 3 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.273 5.441 -24.286 1.0 73.21 ? 41 A 3 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.369 6.325 -23.67 1.0 41.34 ? 41 A 3 +ATOM 618 H HG22 . ILE A1 1 41 ? -26.61 7.528 -24.936 1.0 35.01 ? 41 A 3 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.124 5.861 -25.194 1.0 24.24 ? 41 A 3 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.362 8.274 -23.663 1.0 13.35 ? 41 A 3 +ATOM 621 H HD12 . ILE A1 1 41 ? -22.034 7.284 -24.269 1.0 5.02 ? 41 A 3 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.22 7.952 -25.391 1.0 73.01 ? 41 A 3 +ATOM 623 N N . PRO A1 1 42 ? -24.01 5.076 -28.091 1.0 42.01 ? 42 A 3 +ATOM 624 C CA . PRO A1 1 42 ? -22.973 5.016 -29.125 1.0 63.34 ? 42 A 3 +ATOM 625 C C . PRO A1 1 42 ? -21.803 5.948 -28.827 1.0 4.23 ? 42 A 3 +ATOM 626 O O . PRO A1 1 42 ? -21.939 7.172 -28.822 1.0 21.54 ? 42 A 3 +ATOM 627 C CB . PRO A1 1 42 ? -23.707 5.467 -30.39 1.0 63.45 ? 42 A 3 +ATOM 628 C CG . PRO A1 1 42 ? -24.832 6.31 -29.895 1.0 31.23 ? 42 A 3 +ATOM 629 C CD . PRO A1 1 42 ? -25.243 5.719 -28.575 1.0 52.22 ? 42 A 3 +ATOM 630 H HA . PRO A1 1 42 ? -22.604 4.01 -29.26 1.0 60.32 ? 42 A 3 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.034 6.034 -31.017 1.0 50.23 ? 42 A 3 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.068 4.604 -30.928 1.0 64.01 ? 42 A 3 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.497 7.328 -29.762 1.0 0.11 ? 42 A 3 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.653 6.273 -30.595 1.0 1.1 ? 42 A 3 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.565 6.495 -27.897 1.0 11.32 ? 42 A 3 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.027 4.99 -28.716 1.0 34.03 ? 42 A 3 +ATOM 637 N N . PRO A1 1 43 ? -20.626 5.359 -28.572 1.0 1.41 ? 43 A 3 +ATOM 638 C CA . PRO A1 1 43 ? -19.409 6.119 -28.27 1.0 62.53 ? 43 A 3 +ATOM 639 C C . PRO A1 1 43 ? -18.88 6.873 -29.485 1.0 21.35 ? 43 A 3 +ATOM 640 O O . PRO A1 1 43 ? -18.226 7.908 -29.348 1.0 73.42 ? 43 A 3 +ATOM 641 C CB . PRO A1 1 43 ? -18.415 5.039 -27.837 1.0 74.43 ? 43 A 3 +ATOM 642 C CG . PRO A1 1 43 ? -18.892 3.795 -28.503 1.0 42.11 ? 43 A 3 +ATOM 643 C CD . PRO A1 1 43 ? -20.391 3.905 -28.561 1.0 32.53 ? 43 A 3 +ATOM 644 H HA . PRO A1 1 43 ? -19.566 6.813 -27.457 1.0 3.1 ? 43 A 3 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.421 5.308 -28.166 1.0 1.2 ? 43 A 3 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.43 4.941 -26.762 1.0 52.2 ? 43 A 3 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.482 3.731 -29.499 1.0 21.5 ? 43 A 3 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.603 2.932 -27.921 1.0 41.32 ? 43 A 3 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.769 3.447 -29.463 1.0 55.24 ? 43 A 3 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.837 3.45 -27.689 1.0 31.14 ? 43 A 3 +ATOM 651 N N . ASP A1 1 44 ? -19.167 6.35 -30.671 1.0 54.12 ? 44 A 3 +ATOM 652 C CA . ASP A1 1 44 ? -18.721 6.976 -31.911 1.0 51.34 ? 44 A 3 +ATOM 653 C C . ASP A1 1 44 ? -19.593 8.178 -32.257 1.0 65.34 ? 44 A 3 +ATOM 654 O O . ASP A1 1 44 ? -19.22 9.009 -33.085 1.0 41.23 ? 44 A 3 +ATOM 655 C CB . ASP A1 1 44 ? -18.748 5.963 -33.057 1.0 23.35 ? 44 A 3 +ATOM 656 C CG . ASP A1 1 44 ? -17.963 6.435 -34.265 1.0 52.14 ? 44 A 3 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.892 7.049 -34.074 1.0 70.43 ? 44 A 3 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.418 6.188 -35.401 1.0 15.14 ? 44 A 3 +ATOM 659 H H . ASP A1 1 44 ? -19.692 5.523 -30.715 1.0 64.31 ? 44 A 3 +ATOM 660 H HA . ASP A1 1 44 ? -17.706 7.313 -31.765 1.0 72.42 ? 44 A 3 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.322 5.031 -32.715 1.0 64.21 ? 44 A 3 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.772 5.798 -33.358 1.0 74.33 ? 44 A 3 +ATOM 663 N N . GLN A1 1 45 ? -20.756 8.263 -31.619 1.0 24.51 ? 45 A 3 +ATOM 664 C CA . GLN A1 1 45 ? -21.682 9.363 -31.861 1.0 55.1 ? 45 A 3 +ATOM 665 C C . GLN A1 1 45 ? -21.584 10.41 -30.757 1.0 65.33 ? 45 A 3 +ATOM 666 O O . GLN A1 1 45 ? -22.113 11.514 -30.887 1.0 0.12 ? 45 A 3 +ATOM 667 C CB . GLN A1 1 45 ? -23.115 8.839 -31.957 1.0 3.33 ? 45 A 3 +ATOM 668 C CG . GLN A1 1 45 ? -23.515 8.413 -33.361 1.0 71.05 ? 45 A 3 +ATOM 669 C CD . GLN A1 1 45 ? -24.592 7.347 -33.363 1.0 50.21 ? 45 A 3 +ATOM 670 O OE1 . GLN A1 1 45 ? -25.745 7.612 -33.023 1.0 30.33 ? 45 A 3 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.221 6.131 -33.749 1.0 54.11 ? 45 A 3 +ATOM 672 H H . GLN A1 1 45 ? -20.997 7.569 -30.97 1.0 33.14 ? 45 A 3 +ATOM 673 H HA . GLN A1 1 45 ? -21.412 9.822 -32.8 1.0 54.13 ? 45 A 3 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.219 7.987 -31.303 1.0 72.22 ? 45 A 3 +ATOM 675 H HB3 . GLN A1 1 45 ? -23.792 9.616 -31.634 1.0 51.24 ? 45 A 3 +ATOM 676 H HG2 . GLN A1 1 45 ? -23.884 9.277 -33.894 1.0 11.31 ? 45 A 3 +ATOM 677 H HG3 . GLN A1 1 45 ? -22.643 8.025 -33.867 1.0 33.23 ? 45 A 3 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.285 5.993 -34.005 1.0 35.4 ? 45 A 3 +ATOM 679 H HE22 . GLN A1 1 45 ? -24.897 5.423 -33.759 1.0 53.4 ? 45 A 3 +ATOM 680 N N . GLN A1 1 46 ? -20.904 10.057 -29.671 1.0 5.34 ? 46 A 3 +ATOM 681 C CA . GLN A1 1 46 ? -20.738 10.967 -28.544 1.0 54.21 ? 46 A 3 +ATOM 682 C C . GLN A1 1 46 ? -19.317 11.52 -28.496 1.0 23.33 ? 46 A 3 +ATOM 683 O O . GLN A1 1 46 ? -18.389 10.924 -29.042 1.0 42.0 ? 46 A 3 +ATOM 684 C CB . GLN A1 1 46 ? -21.064 10.252 -27.232 1.0 54.1 ? 46 A 3 +ATOM 685 C CG . GLN A1 1 46 ? -20.028 9.213 -26.831 1.0 63.33 ? 46 A 3 +ATOM 686 C CD . GLN A1 1 46 ? -19.19 9.652 -25.647 1.0 73.34 ? 46 A 3 +ATOM 687 O OE1 . GLN A1 1 46 ? -18.213 10.386 -25.802 1.0 62.34 ? 46 A 3 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.567 9.205 -24.455 1.0 52.51 ? 46 A 3 +ATOM 689 H H . GLN A1 1 46 ? -20.505 9.163 -29.627 1.0 61.13 ? 46 A 3 +ATOM 690 H HA . GLN A1 1 46 ? -21.426 11.787 -28.677 1.0 1.54 ? 46 A 3 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.131 10.985 -26.443 1.0 70.34 ? 46 A 3 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.018 9.756 -27.333 1.0 24.41 ? 46 A 3 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.538 8.297 -26.571 1.0 71.34 ? 46 A 3 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.374 9.034 -27.671 1.0 12.44 ? 46 A 3 +ATOM 695 H HE21 . GLN A1 1 46 ? -20.355 8.623 -24.408 1.0 61.21 ? 46 A 3 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.043 9.472 -23.673 1.0 54.41 ? 46 A 3 +ATOM 697 N N . ARG A1 1 47 ? -19.155 12.664 -27.839 1.0 11.31 ? 47 A 3 +ATOM 698 C CA . ARG A1 1 47 ? -17.848 13.299 -27.721 1.0 74.42 ? 47 A 3 +ATOM 699 C C . ARG A1 1 47 ? -17.712 14.019 -26.383 1.0 0.05 ? 47 A 3 +ATOM 700 O O . ARG A1 1 47 ? -18.707 14.297 -25.711 1.0 62.43 ? 47 A 3 +ATOM 701 C CB . ARG A1 1 47 ? -17.633 14.288 -28.868 1.0 53.24 ? 47 A 3 +ATOM 702 C CG . ARG A1 1 47 ? -17.167 13.633 -30.158 1.0 25.13 ? 47 A 3 +ATOM 703 C CD . ARG A1 1 47 ? -18.297 13.531 -31.171 1.0 74.31 ? 47 A 3 +ATOM 704 N NE . ARG A1 1 47 ? -17.842 12.987 -32.447 1.0 72.02 ? 47 A 3 +ATOM 705 C CZ . ARG A1 1 47 ? -18.523 13.104 -33.581 1.0 4.33 ? 47 A 3 +ATOM 706 N NH1 . ARG A1 1 47 ? -19.685 13.743 -33.598 1.0 22.33 ? 47 A 3 +ATOM 707 N NH2 . ARG A1 1 47 ? -18.042 12.582 -34.703 1.0 24.44 ? 47 A 3 +ATOM 708 H H . ARG A1 1 47 ? -19.934 13.092 -27.425 1.0 14.32 ? 47 A 3 +ATOM 709 H HA . ARG A1 1 47 ? -17.097 12.526 -27.779 1.0 52.1 ? 47 A 3 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.563 14.801 -29.066 1.0 12.43 ? 47 A 3 +ATOM 711 H HB3 . ARG A1 1 47 ? -16.889 15.011 -28.569 1.0 31.22 ? 47 A 3 +ATOM 712 H HG2 . ARG A1 1 47 ? -16.37 14.223 -30.584 1.0 2.15 ? 47 A 3 +ATOM 713 H HG3 . ARG A1 1 47 ? -16.804 12.64 -29.936 1.0 3.22 ? 47 A 3 +ATOM 714 H HD2 . ARG A1 1 47 ? -19.065 12.886 -30.77 1.0 62.34 ? 47 A 3 +ATOM 715 H HD3 . ARG A1 1 47 ? -18.705 14.517 -31.335 1.0 4.32 ? 47 A 3 +ATOM 716 H HE . ARG A1 1 47 ? -16.986 12.511 -32.458 1.0 51.12 ? 47 A 3 +ATOM 717 H HH11 . ARG A1 1 47 ? -20.049 14.138 -32.754 1.0 35.02 ? 47 A 3 +ATOM 718 H HH12 . ARG A1 1 47 ? -20.195 13.831 -34.453 1.0 42.25 ? 47 A 3 +ATOM 719 H HH21 . ARG A1 1 47 ? -17.167 12.1 -34.694 1.0 32.54 ? 47 A 3 +ATOM 720 H HH22 . ARG A1 1 47 ? -18.556 12.671 -35.555 1.0 51.04 ? 47 A 3 +ATOM 721 N N . LEU A1 1 48 ? -16.475 14.317 -26.0 1.0 13.42 ? 48 A 3 +ATOM 722 C CA . LEU A1 1 48 ? -16.208 15.004 -24.742 1.0 63.04 ? 48 A 3 +ATOM 723 C C . LEU A1 1 48 ? -15.834 16.463 -24.986 1.0 70.54 ? 48 A 3 +ATOM 724 O O . LEU A1 1 48 ? -15.233 16.796 -26.007 1.0 13.22 ? 48 A 3 +ATOM 725 C CB . LEU A1 1 48 ? -15.085 14.298 -23.981 1.0 73.22 ? 48 A 3 +ATOM 726 C CG . LEU A1 1 48 ? -15.03 12.777 -24.125 1.0 23.01 ? 48 A 3 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.431 12.186 -24.088 1.0 2.23 ? 48 A 3 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.319 12.388 -25.413 1.0 62.5 ? 48 A 3 +ATOM 729 H H . LEU A1 1 48 ? -15.724 14.07 -26.578 1.0 13.1 ? 48 A 3 +ATOM 730 H HA . LEU A1 1 48 ? -17.11 14.971 -24.148 1.0 5.14 ? 48 A 3 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.146 14.697 -24.332 1.0 14.35 ? 48 A 3 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.202 14.528 -22.931 1.0 62.22 ? 48 A 3 +ATOM 733 H HG . LEU A1 1 48 ? -14.472 12.363 -23.296 1.0 74.12 ? 48 A 3 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.088 12.851 -23.548 1.0 72.12 ? 48 A 3 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.404 11.226 -23.593 1.0 51.52 ? 48 A 3 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.795 12.06 -25.097 1.0 50.13 ? 48 A 3 +ATOM 737 H HD21 . LEU A1 1 48 ? -15.047 12.243 -26.196 1.0 32.51 ? 48 A 3 +ATOM 738 H HD22 . LEU A1 1 48 ? -13.769 11.472 -25.257 1.0 4.35 ? 48 A 3 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.635 13.174 -25.697 1.0 44.23 ? 48 A 3 +ATOM 740 N N . ILE A1 1 49 ? -16.192 17.326 -24.041 1.0 13.31 ? 49 A 3 +ATOM 741 C CA . ILE A1 1 49 ? -15.891 18.748 -24.153 1.0 13.25 ? 49 A 3 +ATOM 742 C C . ILE A1 1 49 ? -15.462 19.326 -22.808 1.0 73.24 ? 49 A 3 +ATOM 743 O O . ILE A1 1 49 ? -16.151 19.16 -21.801 1.0 20.41 ? 49 A 3 +ATOM 744 C CB . ILE A1 1 49 ? -17.102 19.541 -24.678 1.0 42.12 ? 49 A 3 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.232 19.373 -26.193 1.0 21.4 ? 49 A 3 +ATOM 746 C CG2 . ILE A1 1 49 ? -16.972 21.011 -24.311 1.0 44.11 ? 49 A 3 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.548 18.764 -26.623 1.0 30.32 ? 49 A 3 +ATOM 748 H H . ILE A1 1 49 ? -16.669 16.999 -23.251 1.0 11.12 ? 49 A 3 +ATOM 749 H HA . ILE A1 1 49 ? -15.079 18.862 -24.857 1.0 31.54 ? 49 A 3 +ATOM 750 H HB . ILE A1 1 49 ? -17.991 19.154 -24.202 1.0 10.22 ? 49 A 3 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.144 20.339 -26.665 1.0 52.53 ? 49 A 3 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.437 18.731 -26.545 1.0 23.14 ? 49 A 3 +ATOM 753 H HG21 . ILE A1 1 49 ? -15.927 21.287 -24.295 1.0 54.41 ? 49 A 3 +ATOM 754 H HG22 . ILE A1 1 49 ? -17.49 21.612 -25.044 1.0 2.4 ? 49 A 3 +ATOM 755 H HG23 . ILE A1 1 49 ? -17.403 21.18 -23.336 1.0 53.42 ? 49 A 3 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.209 19.545 -26.971 1.0 43.14 ? 49 A 3 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.374 18.059 -27.422 1.0 61.33 ? 49 A 3 +ATOM 758 H HD13 . ILE A1 1 49 ? -19.001 18.256 -25.785 1.0 3.14 ? 49 A 3 +ATOM 759 N N . PHE A1 1 50 ? -14.322 20.007 -22.8 1.0 0.44 ? 50 A 3 +ATOM 760 C CA . PHE A1 1 50 ? -13.801 20.612 -21.579 1.0 63.4 ? 50 A 3 +ATOM 761 C C . PHE A1 1 50 ? -13.689 22.127 -21.727 1.0 34.31 ? 50 A 3 +ATOM 762 O O . PHE A1 1 50 ? -12.837 22.628 -22.459 1.0 24.03 ? 50 A 3 +ATOM 763 C CB . PHE A1 1 50 ? -12.433 20.019 -21.234 1.0 1.31 ? 50 A 3 +ATOM 764 C CG . PHE A1 1 50 ? -11.946 20.393 -19.864 1.0 63.44 ? 50 A 3 +ATOM 765 C CD1 . PHE A1 1 50 ? -11.226 21.56 -19.664 1.0 63.22 ? 50 A 3 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.209 19.578 -18.774 1.0 31.12 ? 50 A 3 +ATOM 767 C CE1 . PHE A1 1 50 ? -10.776 21.906 -18.404 1.0 44.05 ? 50 A 3 +ATOM 768 C CE2 . PHE A1 1 50 ? -11.762 19.919 -17.512 1.0 53.14 ? 50 A 3 +ATOM 769 C CZ . PHE A1 1 50 ? -11.046 21.085 -17.326 1.0 64.24 ? 50 A 3 +ATOM 770 H H . PHE A1 1 50 ? -13.817 20.106 -23.635 1.0 32.43 ? 50 A 3 +ATOM 771 H HA . PHE A1 1 50 ? -14.492 20.391 -20.78 1.0 55.42 ? 50 A 3 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.493 18.942 -21.282 1.0 72.21 ? 50 A 3 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.707 20.368 -21.953 1.0 52.42 ? 50 A 3 +ATOM 774 H HD1 . PHE A1 1 50 ? -11.016 22.203 -20.506 1.0 64.41 ? 50 A 3 +ATOM 775 H HD2 . PHE A1 1 50 ? -12.77 18.665 -18.919 1.0 25.0 ? 50 A 3 +ATOM 776 H HE1 . PHE A1 1 50 ? -10.217 22.818 -18.261 1.0 33.34 ? 50 A 3 +ATOM 777 H HE2 . PHE A1 1 50 ? -11.975 19.275 -16.671 1.0 34.14 ? 50 A 3 +ATOM 778 H HZ . PHE A1 1 50 ? -10.695 21.353 -16.341 1.0 42.2 ? 50 A 3 +ATOM 779 N N . GLY A1 1 51 ? -14.557 22.85 -21.026 1.0 53.44 ? 51 A 3 +ATOM 780 C CA . GLY A1 1 51 ? -14.54 24.299 -21.094 1.0 33.5 ? 51 A 3 +ATOM 781 C C . GLY A1 1 51 ? -15.101 24.826 -22.4 1.0 34.32 ? 51 A 3 +ATOM 782 O O . GLY A1 1 51 ? -15.214 26.036 -22.592 1.0 0.02 ? 51 A 3 +ATOM 783 H H . GLY A1 1 51 ? -15.215 22.395 -20.459 1.0 14.34 ? 51 A 3 +ATOM 784 H HA2 . GLY A1 1 51 ? -15.126 24.694 -20.277 1.0 71.3 ? 51 A 3 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.521 24.641 -20.99 1.0 2.33 ? 51 A 3 +ATOM 786 N N . GLY A1 1 52 ? -15.453 23.914 -23.301 1.0 51.33 ? 52 A 3 +ATOM 787 C CA . GLY A1 1 52 ? -16.0 24.313 -24.585 1.0 70.11 ? 52 A 3 +ATOM 788 C C . GLY A1 1 52 ? -15.309 23.627 -25.748 1.0 64.35 ? 52 A 3 +ATOM 789 O O . GLY A1 1 52 ? -15.89 23.473 -26.822 1.0 21.12 ? 52 A 3 +ATOM 790 H H . GLY A1 1 52 ? -15.34 22.963 -23.093 1.0 52.33 ? 52 A 3 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.051 24.067 -24.609 1.0 34.31 ? 52 A 3 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.888 25.382 -24.695 1.0 33.12 ? 52 A 3 +ATOM 793 N N . LYS A1 1 53 ? -14.063 23.217 -25.535 1.0 4.12 ? 53 A 3 +ATOM 794 C CA . LYS A1 1 53 ? -13.291 22.544 -26.572 1.0 20.15 ? 53 A 3 +ATOM 795 C C . LYS A1 1 53 ? -13.431 21.029 -26.459 1.0 12.34 ? 53 A 3 +ATOM 796 O O . LYS A1 1 53 ? -13.539 20.488 -25.36 1.0 53.3 ? 53 A 3 +ATOM 797 C CB . LYS A1 1 53 ? -11.816 22.939 -26.476 1.0 12.13 ? 53 A 3 +ATOM 798 C CG . LYS A1 1 53 ? -11.189 22.626 -25.128 1.0 34.42 ? 53 A 3 +ATOM 799 C CD . LYS A1 1 53 ? -10.53 21.257 -25.124 1.0 44.0 ? 53 A 3 +ATOM 800 C CE . LYS A1 1 53 ? -9.364 21.197 -26.098 1.0 75.53 ? 53 A 3 +ATOM 801 N NZ . LYS A1 1 53 ? -8.083 20.874 -25.41 1.0 61.53 ? 53 A 3 +ATOM 802 H H . LYS A1 1 53 ? -13.654 23.369 -24.657 1.0 32.12 ? 53 A 3 +ATOM 803 H HA . LYS A1 1 53 ? -13.677 22.859 -27.53 1.0 74.23 ? 53 A 3 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.263 22.41 -27.238 1.0 34.02 ? 53 A 3 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.728 24.002 -26.652 1.0 32.22 ? 53 A 3 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.442 23.374 -24.906 1.0 24.24 ? 53 A 3 +ATOM 807 H HG3 . LYS A1 1 53 ? -11.959 22.648 -24.37 1.0 53.0 ? 53 A 3 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.166 21.045 -24.13 1.0 22.42 ? 53 A 3 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.263 20.514 -25.407 1.0 0.05 ? 53 A 3 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.567 20.437 -26.837 1.0 25.2 ? 53 A 3 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.269 22.156 -26.585 1.0 75.24 ? 53 A 3 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.379 21.615 -25.598 1.0 1.33 ? 53 A 3 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.713 19.964 -25.754 1.0 14.14 ? 53 A 3 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.235 20.807 -24.384 1.0 31.25 ? 53 A 3 +ATOM 815 N N . GLN A1 1 54 ? -13.425 20.352 -27.603 1.0 32.1 ? 54 A 3 +ATOM 816 C CA . GLN A1 1 54 ? -13.551 18.9 -27.631 1.0 3.14 ? 54 A 3 +ATOM 817 C C . GLN A1 1 54 ? -12.284 18.234 -27.103 1.0 14.5 ? 54 A 3 +ATOM 818 O O . GLN A1 1 54 ? -11.233 18.868 -27.0 1.0 22.04 ? 54 A 3 +ATOM 819 C CB . GLN A1 1 54 ? -13.839 18.419 -29.054 1.0 14.03 ? 54 A 3 +ATOM 820 C CG . GLN A1 1 54 ? -15.311 18.145 -29.317 1.0 52.41 ? 54 A 3 +ATOM 821 C CD . GLN A1 1 54 ? -16.086 19.401 -29.664 1.0 44.23 ? 54 A 3 +ATOM 822 O OE1 . GLN A1 1 54 ? -15.742 20.497 -29.222 1.0 25.33 ? 54 A 3 +ATOM 823 N NE2 . GLN A1 1 54 ? -17.138 19.247 -30.459 1.0 63.1 ? 54 A 3 +ATOM 824 H H . GLN A1 1 54 ? -13.335 20.84 -28.447 1.0 52.11 ? 54 A 3 +ATOM 825 H HA . GLN A1 1 54 ? -14.378 18.626 -26.994 1.0 62.04 ? 54 A 3 +ATOM 826 H HB2 . GLN A1 1 54 ? -13.505 19.173 -29.751 1.0 31.24 ? 54 A 3 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.288 17.507 -29.231 1.0 25.42 ? 54 A 3 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.393 17.451 -30.141 1.0 52.11 ? 54 A 3 +ATOM 829 H HG3 . GLN A1 1 54 ? -15.745 17.704 -28.432 1.0 53.52 ? 54 A 3 +ATOM 830 H HE21 . GLN A1 1 54 ? -17.353 18.343 -30.772 1.0 45.55 ? 54 A 3 +ATOM 831 H HE22 . GLN A1 1 54 ? -17.657 20.042 -30.698 1.0 62.42 ? 54 A 3 +ATOM 832 N N . LEU A1 1 55 ? -12.391 16.952 -26.77 1.0 51.34 ? 55 A 3 +ATOM 833 C CA . LEU A1 1 55 ? -11.253 16.199 -26.252 1.0 40.45 ? 55 A 3 +ATOM 834 C C . LEU A1 1 55 ? -10.889 15.051 -27.187 1.0 63.5 ? 55 A 3 +ATOM 835 O O . LEU A1 1 55 ? -11.736 14.228 -27.534 1.0 52.11 ? 55 A 3 +ATOM 836 C CB . LEU A1 1 55 ? -11.569 15.656 -24.857 1.0 25.03 ? 55 A 3 +ATOM 837 C CG . LEU A1 1 55 ? -12.143 16.662 -23.859 1.0 41.33 ? 55 A 3 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.258 16.037 -22.478 1.0 33.24 ? 55 A 3 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.282 17.916 -23.81 1.0 52.23 ? 55 A 3 +ATOM 840 H H . LEU A1 1 55 ? -13.253 16.501 -26.875 1.0 12.34 ? 55 A 3 +ATOM 841 H HA . LEU A1 1 55 ? -10.412 16.874 -26.186 1.0 22.21 ? 55 A 3 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.284 14.856 -24.968 1.0 55.1 ? 55 A 3 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.652 15.263 -24.442 1.0 51.11 ? 55 A 3 +ATOM 844 H HG . LEU A1 1 55 ? -13.135 16.95 -24.178 1.0 72.12 ? 55 A 3 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.487 15.292 -22.355 1.0 32.04 ? 55 A 3 +ATOM 846 H HD12 . LEU A1 1 55 ? -13.227 15.573 -22.372 1.0 44.35 ? 55 A 3 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.142 16.804 -21.725 1.0 32.21 ? 55 A 3 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.149 18.221 -22.783 1.0 33.14 ? 55 A 3 +ATOM 849 H HD22 . LEU A1 1 55 ? -11.766 18.707 -24.362 1.0 72.01 ? 55 A 3 +ATOM 850 H HD23 . LEU A1 1 55 ? -10.318 17.707 -24.251 1.0 74.33 ? 55 A 3 +ATOM 851 N N . GLU A1 1 56 ? -9.624 15.001 -27.591 1.0 12.02 ? 56 A 3 +ATOM 852 C CA . GLU A1 1 56 ? -9.148 13.952 -28.485 1.0 31.33 ? 56 A 3 +ATOM 853 C C . GLU A1 1 56 ? -9.199 12.589 -27.8 1.0 62.51 ? 56 A 3 +ATOM 854 O O . GLU A1 1 56 ? -9.637 12.474 -26.655 1.0 51.02 ? 56 A 3 +ATOM 855 C CB . GLU A1 1 56 ? -7.719 14.251 -28.944 1.0 62.01 ? 56 A 3 +ATOM 856 C CG . GLU A1 1 56 ? -7.495 14.017 -30.428 1.0 21.02 ? 56 A 3 +ATOM 857 C CD . GLU A1 1 56 ? -7.252 15.304 -31.191 1.0 1.0 ? 56 A 3 +ATOM 858 O OE1 . GLU A1 1 56 ? -8.238 16.006 -31.502 1.0 61.34 ? 56 A 3 +ATOM 859 O OE2 . GLU A1 1 56 ? -6.076 15.611 -31.477 1.0 22.01 ? 56 A 3 +ATOM 860 H H . GLU A1 1 56 ? -8.995 15.686 -27.28 1.0 72.43 ? 56 A 3 +ATOM 861 H HA . GLU A1 1 56 ? -9.797 13.932 -29.347 1.0 4.21 ? 56 A 3 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.492 15.284 -28.724 1.0 41.11 ? 56 A 3 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.038 13.617 -28.394 1.0 51.02 ? 56 A 3 +ATOM 864 H HG2 . GLU A1 1 56 ? -6.636 13.375 -30.553 1.0 71.31 ? 56 A 3 +ATOM 865 H HG3 . GLU A1 1 56 ? -8.369 13.531 -30.839 1.0 60.44 ? 56 A 3 +ATOM 866 N N . ASP A1 1 57 ? -8.749 11.56 -28.509 1.0 71.03 ? 57 A 3 +ATOM 867 C CA . ASP A1 1 57 ? -8.743 10.205 -27.971 1.0 63.41 ? 57 A 3 +ATOM 868 C C . ASP A1 1 57 ? -7.662 10.048 -26.905 1.0 21.4 ? 57 A 3 +ATOM 869 O O . ASP A1 1 57 ? -7.703 9.121 -26.097 1.0 43.31 ? 57 A 3 +ATOM 870 C CB . ASP A1 1 57 ? -8.521 9.189 -29.092 1.0 45.31 ? 57 A 3 +ATOM 871 C CG . ASP A1 1 57 ? -9.358 9.49 -30.32 1.0 55.43 ? 57 A 3 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.462 10.052 -30.162 1.0 72.35 ? 57 A 3 +ATOM 873 O OD2 . ASP A1 1 57 ? -8.909 9.164 -31.439 1.0 15.11 ? 57 A 3 +ATOM 874 H H . ASP A1 1 57 ? -8.412 11.716 -29.417 1.0 23.12 ? 57 A 3 +ATOM 875 H HA . ASP A1 1 57 ? -9.706 10.023 -27.518 1.0 62.14 ? 57 A 3 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.479 9.199 -29.378 1.0 24.44 ? 57 A 3 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.782 8.204 -28.734 1.0 64.03 ? 57 A 3 +ATOM 878 N N . SER A1 1 58 ? -6.696 10.961 -26.911 1.0 32.51 ? 58 A 3 +ATOM 879 C CA . SER A1 1 58 ? -5.602 10.922 -25.948 1.0 62.24 ? 58 A 3 +ATOM 880 C C . SER A1 1 58 ? -5.72 12.064 -24.944 1.0 2.12 ? 58 A 3 +ATOM 881 O O . SER A1 1 58 ? -4.85 12.251 -24.095 1.0 12.21 ? 58 A 3 +ATOM 882 C CB . SER A1 1 58 ? -4.255 11.0 -26.671 1.0 65.11 ? 58 A 3 +ATOM 883 O OG . SER A1 1 58 ? -3.179 10.86 -25.76 1.0 34.21 ? 58 A 3 +ATOM 884 H H . SER A1 1 58 ? -6.719 11.676 -27.581 1.0 21.03 ? 58 A 3 +ATOM 885 H HA . SER A1 1 58 ? -5.661 9.983 -25.417 1.0 33.55 ? 58 A 3 +ATOM 886 H HB2 . SER A1 1 58 ? -4.196 10.21 -27.404 1.0 31.42 ? 58 A 3 +ATOM 887 H HB3 . SER A1 1 58 ? -4.171 11.957 -27.165 1.0 40.4 ? 58 A 3 +ATOM 888 H HG . SER A1 1 58 ? -2.676 11.677 -25.73 1.0 10.23 ? 58 A 3 +ATOM 889 N N . ASN A1 1 59 ? -6.804 12.826 -25.05 1.0 35.41 ? 59 A 3 +ATOM 890 C CA . ASN A1 1 59 ? -7.038 13.951 -24.152 1.0 52.34 ? 59 A 3 +ATOM 891 C C . ASN A1 1 59 ? -7.588 13.472 -22.811 1.0 4.01 ? 59 A 3 +ATOM 892 O O . ASN A1 1 59 ? -8.797 13.492 -22.582 1.0 42.21 ? 59 A 3 +ATOM 893 C CB . ASN A1 1 59 ? -8.011 14.945 -24.789 1.0 21.1 ? 59 A 3 +ATOM 894 C CG . ASN A1 1 59 ? -7.298 16.029 -25.575 1.0 14.54 ? 59 A 3 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.49 15.74 -26.459 1.0 24.42 ? 59 A 3 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.593 17.283 -25.256 1.0 14.44 ? 59 A 3 +ATOM 897 H H . ASN A1 1 59 ? -7.463 12.627 -25.748 1.0 5.51 ? 59 A 3 +ATOM 898 H HA . ASN A1 1 59 ? -6.092 14.443 -23.984 1.0 74.51 ? 59 A 3 +ATOM 899 H HB2 . ASN A1 1 59 ? -8.67 14.415 -25.461 1.0 43.43 ? 59 A 3 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.596 15.415 -24.013 1.0 11.21 ? 59 A 3 +ATOM 901 H HD21 . ASN A1 1 59 ? -8.246 17.438 -24.541 1.0 21.33 ? 59 A 3 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.147 18.003 -25.749 1.0 12.0 ? 59 A 3 +ATOM 903 N N . ALA A1 1 60 ? -6.691 13.044 -21.929 1.0 13.11 ? 60 A 3 +ATOM 904 C CA . ALA A1 1 60 ? -7.086 12.563 -20.611 1.0 35.51 ? 60 A 3 +ATOM 905 C C . ALA A1 1 60 ? -5.865 12.232 -19.759 1.0 74.01 ? 60 A 3 +ATOM 906 O O . ALA A1 1 60 ? -5.367 13.077 -19.016 1.0 74.24 ? 60 A 3 +ATOM 907 C CB . ALA A1 1 60 ? -7.986 11.343 -20.742 1.0 64.13 ? 60 A 3 +ATOM 908 H H . ALA A1 1 60 ? -5.741 13.052 -22.17 1.0 31.12 ? 60 A 3 +ATOM 909 H HA . ALA A1 1 60 ? -7.65 13.346 -20.125 1.0 20.01 ? 60 A 3 +ATOM 910 H HB1 . ALA A1 1 60 ? -7.531 10.632 -21.416 1.0 72.33 ? 60 A 3 +ATOM 911 H HB2 . ALA A1 1 60 ? -8.119 10.888 -19.772 1.0 25.02 ? 60 A 3 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.947 11.646 -21.132 1.0 51.02 ? 60 A 3 +ATOM 913 N N . MET A1 1 61 ? -5.388 10.996 -19.871 1.0 21.52 ? 61 A 3 +ATOM 914 C CA . MET A1 1 61 ? -4.224 10.555 -19.111 1.0 32.03 ? 61 A 3 +ATOM 915 C C . MET A1 1 61 ? -3.029 11.468 -19.367 1.0 55.14 ? 61 A 3 +ATOM 916 O O . MET A1 1 61 ? -2.378 11.93 -18.431 1.0 73.23 ? 61 A 3 +ATOM 917 C CB . MET A1 1 61 ? -3.867 9.113 -19.476 1.0 33.12 ? 61 A 3 +ATOM 918 C CG . MET A1 1 61 ? -4.115 8.777 -20.938 1.0 10.31 ? 61 A 3 +ATOM 919 S SD . MET A1 1 61 ? -2.845 7.699 -21.628 1.0 3.45 ? 61 A 3 +ATOM 920 C CE . MET A1 1 61 ? -1.969 8.845 -22.691 1.0 11.34 ? 61 A 3 +ATOM 921 H H . MET A1 1 61 ? -5.828 10.367 -20.48 1.0 44.35 ? 61 A 3 +ATOM 922 H HA . MET A1 1 61 ? -4.478 10.599 -18.063 1.0 14.21 ? 61 A 3 +ATOM 923 H HB2 . MET A1 1 61 ? -2.821 8.949 -19.264 1.0 14.23 ? 61 A 3 +ATOM 924 H HB3 . MET A1 1 61 ? -4.459 8.443 -18.871 1.0 0.24 ? 61 A 3 +ATOM 925 H HG2 . MET A1 1 61 ? -5.071 8.282 -21.023 1.0 62.14 ? 61 A 3 +ATOM 926 H HG3 . MET A1 1 61 ? -4.136 9.696 -21.505 1.0 32.0 ? 61 A 3 +ATOM 927 H HE1 . MET A1 1 61 ? -1.303 8.296 -23.34 1.0 54.23 ? 61 A 3 +ATOM 928 H HE2 . MET A1 1 61 ? -2.68 9.397 -23.288 1.0 64.31 ? 61 A 3 +ATOM 929 H HE3 . MET A1 1 61 ? -1.397 9.532 -22.085 1.0 24.11 ? 61 A 3 +ATOM 930 N N . SER A1 1 62 ? -2.747 11.723 -20.641 1.0 73.15 ? 62 A 3 +ATOM 931 C CA . SER A1 1 62 ? -1.628 12.577 -21.019 1.0 12.22 ? 62 A 3 +ATOM 932 C C . SER A1 1 62 ? -1.967 14.048 -20.797 1.0 13.52 ? 62 A 3 +ATOM 933 O O . SER A1 1 62 ? -1.098 14.854 -20.467 1.0 42.51 ? 62 A 3 +ATOM 934 C CB . SER A1 1 62 ? -1.253 12.344 -22.484 1.0 62.33 ? 62 A 3 +ATOM 935 O OG . SER A1 1 62 ? -0.843 13.551 -23.104 1.0 14.13 ? 62 A 3 +ATOM 936 H H . SER A1 1 62 ? -3.304 11.325 -21.342 1.0 74.25 ? 62 A 3 +ATOM 937 H HA . SER A1 1 62 ? -0.786 12.316 -20.395 1.0 74.15 ? 62 A 3 +ATOM 938 H HB2 . SER A1 1 62 ? -0.444 11.633 -22.537 1.0 54.41 ? 62 A 3 +ATOM 939 H HB3 . SER A1 1 62 ? -2.111 11.955 -23.014 1.0 23.45 ? 62 A 3 +ATOM 940 H HG . SER A1 1 62 ? -1.36 13.694 -23.9 1.0 1.23 ? 62 A 3 +ATOM 941 N N . ASP A1 1 63 ? -3.238 14.389 -20.981 1.0 34.33 ? 63 A 3 +ATOM 942 C CA . ASP A1 1 63 ? -3.695 15.762 -20.8 1.0 10.21 ? 63 A 3 +ATOM 943 C C . ASP A1 1 63 ? -3.372 16.262 -19.395 1.0 63.54 ? 63 A 3 +ATOM 944 O O . ASP A1 1 63 ? -3.23 17.464 -19.17 1.0 31.33 ? 63 A 3 +ATOM 945 C CB . ASP A1 1 63 ? -5.199 15.86 -21.056 1.0 21.1 ? 63 A 3 +ATOM 946 C CG . ASP A1 1 63 ? -5.647 17.28 -21.344 1.0 12.2 ? 63 A 3 +ATOM 947 O OD1 . ASP A1 1 63 ? -5.963 18.009 -20.381 1.0 53.24 ? 63 A 3 +ATOM 948 O OD2 . ASP A1 1 63 ? -5.679 17.661 -22.532 1.0 3.13 ? 63 A 3 +ATOM 949 H H . ASP A1 1 63 ? -3.885 13.701 -21.244 1.0 14.4 ? 63 A 3 +ATOM 950 H HA . ASP A1 1 63 ? -3.176 16.381 -21.516 1.0 72.42 ? 63 A 3 +ATOM 951 H HB2 . ASP A1 1 63 ? -5.454 15.243 -21.906 1.0 63.34 ? 63 A 3 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.73 15.503 -20.186 1.0 44.51 ? 63 A 3 +ATOM 953 N N . TYR A1 1 64 ? -3.26 15.331 -18.453 1.0 43.15 ? 64 A 3 +ATOM 954 C CA . TYR A1 1 64 ? -2.957 15.677 -17.069 1.0 74.44 ? 64 A 3 +ATOM 955 C C . TYR A1 1 64 ? -4.176 16.283 -16.381 1.0 35.31 ? 64 A 3 +ATOM 956 O O . TYR A1 1 64 ? -4.058 16.931 -15.342 1.0 63.11 ? 64 A 3 +ATOM 957 C CB . TYR A1 1 64 ? -1.785 16.657 -17.011 1.0 41.31 ? 64 A 3 +ATOM 958 C CG . TYR A1 1 64 ? -0.67 16.213 -16.091 1.0 35.31 ? 64 A 3 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.306 15.326 -16.528 1.0 10.21 ? 64 A 3 +ATOM 960 C CD2 . TYR A1 1 64 ? -0.592 16.682 -14.785 1.0 61.0 ? 64 A 3 +ATOM 961 C CE1 . TYR A1 1 64 ? 1.326 14.917 -15.69 1.0 31.32 ? 64 A 3 +ATOM 962 C CE2 . TYR A1 1 64 ? 0.425 16.279 -13.941 1.0 3.01 ? 64 A 3 +ATOM 963 C CZ . TYR A1 1 64 ? 1.381 15.396 -14.398 1.0 35.43 ? 64 A 3 +ATOM 964 O OH . TYR A1 1 64 ? 2.396 14.993 -13.562 1.0 23.32 ? 64 A 3 +ATOM 965 H H . TYR A1 1 64 ? -3.384 14.39 -18.694 1.0 10.22 ? 64 A 3 +ATOM 966 H HA . TYR A1 1 64 ? -2.681 14.769 -16.554 1.0 40.51 ? 64 A 3 +ATOM 967 H HB2 . TYR A1 1 64 ? -1.371 16.772 -18.001 1.0 75.32 ? 64 A 3 +ATOM 968 H HB3 . TYR A1 1 64 ? -2.142 17.615 -16.662 1.0 32.34 ? 64 A 3 +ATOM 969 H HD1 . TYR A1 1 64 ? 0.26 14.952 -17.541 1.0 1.35 ? 64 A 3 +ATOM 970 H HD2 . TYR A1 1 64 ? -1.342 17.373 -14.43 1.0 32.41 ? 64 A 3 +ATOM 971 H HE1 . TYR A1 1 64 ? 2.075 14.226 -16.048 1.0 52.21 ? 64 A 3 +ATOM 972 H HE2 . TYR A1 1 64 ? 0.469 16.654 -12.929 1.0 43.14 ? 64 A 3 +ATOM 973 H HH . TYR A1 1 64 ? 2.538 15.659 -12.885 1.0 23.33 ? 64 A 3 +ATOM 974 N N . ASN A1 1 65 ? -5.348 16.068 -16.969 1.0 61.21 ? 65 A 3 +ATOM 975 C CA . ASN A1 1 65 ? -6.591 16.593 -16.414 1.0 70.22 ? 65 A 3 +ATOM 976 C C . ASN A1 1 65 ? -7.461 15.465 -15.867 1.0 21.44 ? 65 A 3 +ATOM 977 O O . ASN A1 1 65 ? -8.652 15.651 -15.617 1.0 22.24 ? 65 A 3 +ATOM 978 C CB . ASN A1 1 65 ? -7.36 17.375 -17.48 1.0 30.31 ? 65 A 3 +ATOM 979 C CG . ASN A1 1 65 ? -8.171 16.471 -18.388 1.0 75.23 ? 65 A 3 +ATOM 980 O OD1 . ASN A1 1 65 ? -7.685 15.438 -18.848 1.0 74.2 ? 65 A 3 +ATOM 981 N ND2 . ASN A1 1 65 ? -9.414 16.857 -18.651 1.0 12.4 ? 65 A 3 +ATOM 982 H H . ASN A1 1 65 ? -5.379 15.544 -17.797 1.0 72.01 ? 65 A 3 +ATOM 983 H HA . ASN A1 1 65 ? -6.336 17.26 -15.604 1.0 43.44 ? 65 A 3 +ATOM 984 H HB2 . ASN A1 1 65 ? -8.036 18.064 -16.994 1.0 12.24 ? 65 A 3 +ATOM 985 H HB3 . ASN A1 1 65 ? -6.66 17.93 -18.086 1.0 73.02 ? 65 A 3 +ATOM 986 H HD21 . ASN A1 1 65 ? -9.734 17.692 -18.249 1.0 23.44 ? 65 A 3 +ATOM 987 H HD22 . ASN A1 1 65 ? -9.96 16.291 -19.235 1.0 32.24 ? 65 A 3 +ATOM 988 N N . VAL A1 1 66 ? -6.858 14.295 -15.683 1.0 11.4 ? 66 A 3 +ATOM 989 C CA . VAL A1 1 66 ? -7.577 13.137 -15.165 1.0 70.45 ? 66 A 3 +ATOM 990 C C . VAL A1 1 66 ? -7.33 12.961 -13.671 1.0 73.11 ? 66 A 3 +ATOM 991 O O . VAL A1 1 66 ? -6.44 12.215 -13.263 1.0 33.12 ? 66 A 3 +ATOM 992 C CB . VAL A1 1 66 ? -7.165 11.846 -15.898 1.0 40.11 ? 66 A 3 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.65 11.716 -15.939 1.0 32.21 ? 66 A 3 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.795 10.632 -15.232 1.0 25.13 ? 66 A 3 +ATOM 995 H H . VAL A1 1 66 ? -5.906 14.208 -15.901 1.0 25.31 ? 66 A 3 +ATOM 996 H HA . VAL A1 1 66 ? -8.632 13.298 -15.329 1.0 44.24 ? 66 A 3 +ATOM 997 H HB . VAL A1 1 66 ? -7.527 11.902 -16.914 1.0 65.05 ? 66 A 3 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.29 12.005 -16.915 1.0 62.5 ? 66 A 3 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.212 12.357 -15.188 1.0 4.5 ? 66 A 3 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.372 10.69 -15.744 1.0 12.32 ? 66 A 3 +ATOM 1001 H HG21 . VAL A1 1 66 ? -7.932 9.851 -15.964 1.0 23.4 ? 66 A 3 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.148 10.279 -14.444 1.0 64.2 ? 66 A 3 +ATOM 1003 H HG23 . VAL A1 1 66 ? -8.754 10.907 -14.816 1.0 74.31 ? 66 A 3 +ATOM 1004 N N . GLN A1 1 67 ? -8.124 13.652 -12.86 1.0 5.43 ? 67 A 3 +ATOM 1005 C CA . GLN A1 1 67 ? -7.992 13.572 -11.41 1.0 15.5 ? 67 A 3 +ATOM 1006 C C . GLN A1 1 67 ? -8.951 12.536 -10.832 1.0 62.54 ? 67 A 3 +ATOM 1007 O O . GLN A1 1 67 ? -9.67 11.862 -11.569 1.0 44.01 ? 67 A 3 +ATOM 1008 C CB . GLN A1 1 67 ? -8.256 14.939 -10.776 1.0 35.11 ? 67 A 3 +ATOM 1009 C CG . GLN A1 1 67 ? -9.615 15.521 -11.129 1.0 11.21 ? 67 A 3 +ATOM 1010 C CD . GLN A1 1 67 ? -9.904 16.816 -10.396 1.0 34.44 ? 67 A 3 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.28 17.817 -11.005 1.0 41.54 ? 67 A 3 +ATOM 1012 N NE2 . GLN A1 1 67 ? -9.729 16.802 -9.079 1.0 50.51 ? 67 A 3 +ATOM 1013 H H . GLN A1 1 67 ? -8.815 14.23 -13.246 1.0 54.23 ? 67 A 3 +ATOM 1014 H HA . GLN A1 1 67 ? -6.979 13.271 -11.186 1.0 21.13 ? 67 A 3 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.197 14.842 -9.702 1.0 61.05 ? 67 A 3 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.495 15.63 -11.109 1.0 21.05 ? 67 A 3 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.645 15.713 -12.192 1.0 63.24 ? 67 A 3 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.378 14.801 -10.873 1.0 63.02 ? 67 A 3 +ATOM 1019 H HE21 . GLN A1 1 67 ? -9.427 15.968 -8.662 1.0 0.12 ? 67 A 3 +ATOM 1020 H HE22 . GLN A1 1 67 ? -9.908 17.625 -8.58 1.0 72.41 ? 67 A 3 +ATOM 1021 N N . LYS A1 1 68 ? -8.955 12.415 -9.509 1.0 63.33 ? 68 A 3 +ATOM 1022 C CA . LYS A1 1 68 ? -9.826 11.463 -8.831 1.0 34.0 ? 68 A 3 +ATOM 1023 C C . LYS A1 1 68 ? -11.292 11.754 -9.134 1.0 33.21 ? 68 A 3 +ATOM 1024 O O . LYS A1 1 68 ? -12.119 10.844 -9.173 1.0 33.01 ? 68 A 3 +ATOM 1025 C CB . LYS A1 1 68 ? -9.588 11.51 -7.32 1.0 41.41 ? 68 A 3 +ATOM 1026 C CG . LYS A1 1 68 ? -10.178 10.325 -6.574 1.0 61.44 ? 68 A 3 +ATOM 1027 C CD . LYS A1 1 68 ? -9.453 9.034 -6.916 1.0 43.41 ? 68 A 3 +ATOM 1028 C CE . LYS A1 1 68 ? -8.151 8.903 -6.14 1.0 23.43 ? 68 A 3 +ATOM 1029 N NZ . LYS A1 1 68 ? -8.381 8.898 -4.668 1.0 52.05 ? 68 A 3 +ATOM 1030 H H . LYS A1 1 68 ? -8.358 12.982 -8.975 1.0 75.53 ? 68 A 3 +ATOM 1031 H HA . LYS A1 1 68 ? -9.585 10.475 -9.194 1.0 31.4 ? 68 A 3 +ATOM 1032 H HB2 . LYS A1 1 68 ? -8.524 11.531 -7.135 1.0 51.5 ? 68 A 3 +ATOM 1033 H HB3 . LYS A1 1 68 ? -10.031 12.413 -6.925 1.0 62.4 ? 68 A 3 +ATOM 1034 H HG2 . LYS A1 1 68 ? -10.094 10.501 -5.512 1.0 22.33 ? 68 A 3 +ATOM 1035 H HG3 . LYS A1 1 68 ? -11.22 10.224 -6.843 1.0 45.02 ? 68 A 3 +ATOM 1036 H HD2 . LYS A1 1 68 ? -10.09 8.197 -6.671 1.0 14.2 ? 68 A 3 +ATOM 1037 H HD3 . LYS A1 1 68 ? -9.233 9.024 -7.974 1.0 13.53 ? 68 A 3 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.669 7.981 -6.424 1.0 43.13 ? 68 A 3 +ATOM 1039 H HE3 . LYS A1 1 68 ? -7.512 9.736 -6.392 1.0 63.42 ? 68 A 3 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.578 9.862 -4.333 1.0 1.54 ? 68 A 3 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.538 8.537 -4.177 1.0 73.32 ? 68 A 3 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.191 8.288 -4.436 1.0 23.44 ? 68 A 3 +ATOM 1043 N N . GLU A1 1 69 ? -11.606 13.027 -9.351 1.0 51.1 ? 69 A 3 +ATOM 1044 C CA . GLU A1 1 69 ? -12.972 13.437 -9.652 1.0 15.41 ? 69 A 3 +ATOM 1045 C C . GLU A1 1 69 ? -12.986 14.658 -10.566 1.0 20.25 ? 69 A 3 +ATOM 1046 O O . GLU A1 1 69 ? -13.171 15.786 -10.11 1.0 55.15 ? 69 A 3 +ATOM 1047 C CB . GLU A1 1 69 ? -13.733 13.744 -8.36 1.0 42.14 ? 69 A 3 +ATOM 1048 C CG . GLU A1 1 69 ? -12.961 14.63 -7.396 1.0 32.44 ? 69 A 3 +ATOM 1049 C CD . GLU A1 1 69 ? -13.788 15.794 -6.884 1.0 60.3 ? 69 A 3 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.201 16.636 -7.708 1.0 52.11 ? 69 A 3 +ATOM 1051 O OE2 . GLU A1 1 69 ? -14.021 15.862 -5.659 1.0 33.22 ? 69 A 3 +ATOM 1052 H H . GLU A1 1 69 ? -10.902 13.708 -9.306 1.0 51.55 ? 69 A 3 +ATOM 1053 H HA . GLU A1 1 69 ? -13.46 12.618 -10.159 1.0 21.13 ? 69 A 3 +ATOM 1054 H HB2 . GLU A1 1 69 ? -14.659 14.24 -8.611 1.0 70.35 ? 69 A 3 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.958 12.814 -7.859 1.0 25.14 ? 69 A 3 +ATOM 1056 H HG2 . GLU A1 1 69 ? -12.647 14.034 -6.553 1.0 60.54 ? 69 A 3 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.092 15.021 -7.904 1.0 2.43 ? 69 A 3 +ATOM 1058 N N . SER A1 1 70 ? -12.787 14.425 -11.859 1.0 51.41 ? 70 A 3 +ATOM 1059 C CA . SER A1 1 70 ? -12.771 15.506 -12.838 1.0 50.24 ? 70 A 3 +ATOM 1060 C C . SER A1 1 70 ? -14.134 15.652 -13.507 1.0 72.1 ? 70 A 3 +ATOM 1061 O O . SER A1 1 70 ? -14.718 14.674 -13.976 1.0 13.02 ? 70 A 3 +ATOM 1062 C CB . SER A1 1 70 ? -11.696 15.249 -13.895 1.0 75.43 ? 70 A 3 +ATOM 1063 O OG . SER A1 1 70 ? -11.015 16.446 -14.231 1.0 45.33 ? 70 A 3 +ATOM 1064 H H . SER A1 1 70 ? -12.645 13.503 -12.162 1.0 42.55 ? 70 A 3 +ATOM 1065 H HA . SER A1 1 70 ? -12.539 16.422 -12.316 1.0 61.25 ? 70 A 3 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.981 14.537 -13.513 1.0 1.23 ? 70 A 3 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.159 14.85 -14.786 1.0 50.33 ? 70 A 3 +ATOM 1068 H HG . SER A1 1 70 ? -11.623 17.187 -14.175 1.0 14.24 ? 70 A 3 +ATOM 1069 N N . THR A1 1 71 ? -14.637 16.882 -13.549 1.0 52.55 ? 71 A 3 +ATOM 1070 C CA . THR A1 1 71 ? -15.932 17.158 -14.159 1.0 43.33 ? 71 A 3 +ATOM 1071 C C . THR A1 1 71 ? -15.774 17.583 -15.614 1.0 63.44 ? 71 A 3 +ATOM 1072 O O . THR A1 1 71 ? -15.094 18.565 -15.915 1.0 13.52 ? 71 A 3 +ATOM 1073 C CB . THR A1 1 71 ? -16.69 18.259 -13.394 1.0 4.41 ? 71 A 3 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.775 19.27 -12.955 1.0 4.41 ? 71 A 3 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.424 17.678 -12.195 1.0 4.35 ? 71 A 3 +ATOM 1076 H H . THR A1 1 71 ? -14.125 17.62 -13.158 1.0 14.04 ? 71 A 3 +ATOM 1077 H HA . THR A1 1 71 ? -16.519 16.252 -14.12 1.0 24.13 ? 71 A 3 +ATOM 1078 H HB . THR A1 1 71 ? -17.415 18.705 -14.06 1.0 70.41 ? 71 A 3 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.264 20.059 -12.71 1.0 53.11 ? 71 A 3 +ATOM 1080 H HG21 . THR A1 1 71 ? -17.503 18.428 -11.423 1.0 12.42 ? 71 A 3 +ATOM 1081 H HG22 . THR A1 1 71 ? -16.878 16.827 -11.816 1.0 75.2 ? 71 A 3 +ATOM 1082 H HG23 . THR A1 1 71 ? -18.413 17.365 -12.496 1.0 31.12 ? 71 A 3 +ATOM 1083 N N . LEU A1 1 72 ? -16.406 16.838 -16.515 1.0 74.32 ? 72 A 3 +ATOM 1084 C CA . LEU A1 1 72 ? -16.337 17.139 -17.941 1.0 62.12 ? 72 A 3 +ATOM 1085 C C . LEU A1 1 72 ? -17.723 17.096 -18.574 1.0 14.1 ? 72 A 3 +ATOM 1086 O O . LEU A1 1 72 ? -18.616 16.396 -18.094 1.0 22.33 ? 72 A 3 +ATOM 1087 C CB . LEU A1 1 72 ? -15.41 16.147 -18.646 1.0 54.24 ? 72 A 3 +ATOM 1088 C CG . LEU A1 1 72 ? -16.077 14.894 -19.215 1.0 12.34 ? 72 A 3 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.369 15.07 -20.697 1.0 71.53 ? 72 A 3 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.199 13.672 -18.984 1.0 45.31 ? 72 A 3 +ATOM 1091 H H . LEU A1 1 72 ? -16.932 16.068 -16.215 1.0 40.44 ? 72 A 3 +ATOM 1092 H HA . LEU A1 1 72 ? -15.935 18.135 -18.05 1.0 22.23 ? 72 A 3 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.931 16.665 -19.462 1.0 24.33 ? 72 A 3 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.662 15.831 -17.934 1.0 64.44 ? 72 A 3 +ATOM 1095 H HG . LEU A1 1 72 ? -17.017 14.732 -18.707 1.0 60.22 ? 72 A 3 +ATOM 1096 H HD11 . LEU A1 1 72 ? -15.746 15.857 -21.095 1.0 22.12 ? 72 A 3 +ATOM 1097 H HD12 . LEU A1 1 72 ? -17.408 15.332 -20.83 1.0 11.12 ? 72 A 3 +ATOM 1098 H HD13 . LEU A1 1 72 ? -16.161 14.147 -21.217 1.0 74.11 ? 72 A 3 +ATOM 1099 H HD21 . LEU A1 1 72 ? -15.342 13.311 -17.977 1.0 45.11 ? 72 A 3 +ATOM 1100 H HD22 . LEU A1 1 72 ? -14.163 13.941 -19.127 1.0 64.51 ? 72 A 3 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.47 12.897 -19.687 1.0 15.53 ? 72 A 3 +ATOM 1102 N N . HIS A1 1 73 ? -17.897 17.848 -19.657 1.0 22.1 ? 73 A 3 +ATOM 1103 C CA . HIS A1 1 73 ? -19.175 17.893 -20.359 1.0 43.22 ? 73 A 3 +ATOM 1104 C C . HIS A1 1 73 ? -19.176 16.939 -21.549 1.0 1.12 ? 73 A 3 +ATOM 1105 O O . HIS A1 1 73 ? -18.354 17.062 -22.458 1.0 41.41 ? 73 A 3 +ATOM 1106 C CB . HIS A1 1 73 ? -19.47 19.317 -20.832 1.0 34.11 ? 73 A 3 +ATOM 1107 C CG . HIS A1 1 73 ? -20.916 19.559 -21.136 1.0 25.31 ? 73 A 3 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.751 18.589 -21.649 1.0 22.31 ? 73 A 3 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.677 20.67 -20.995 1.0 30.12 ? 73 A 3 +ATOM 1110 C CE1 . HIS A1 1 73 ? -22.961 19.092 -21.812 1.0 74.03 ? 73 A 3 +ATOM 1111 N NE2 . HIS A1 1 73 ? -22.943 20.354 -21.422 1.0 22.32 ? 73 A 3 +ATOM 1112 H H . HIS A1 1 73 ? -17.148 18.384 -19.992 1.0 41.1 ? 73 A 3 +ATOM 1113 H HA . HIS A1 1 73 ? -19.944 17.587 -19.667 1.0 23.25 ? 73 A 3 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.172 20.014 -20.063 1.0 51.13 ? 73 A 3 +ATOM 1115 H HB3 . HIS A1 1 73 ? -18.904 19.516 -21.731 1.0 64.13 ? 73 A 3 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.493 17.668 -21.864 1.0 63.31 ? 73 A 3 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.349 21.629 -20.617 1.0 71.43 ? 73 A 3 +ATOM 1118 H HE1 . HIS A1 1 73 ? -23.82 18.563 -22.197 1.0 3.34 ? 73 A 3 +ATOM 1119 N N . LEU A1 1 74 ? -20.102 15.987 -21.537 1.0 31.4 ? 74 A 3 +ATOM 1120 C CA . LEU A1 1 74 ? -20.209 15.01 -22.615 1.0 41.22 ? 74 A 3 +ATOM 1121 C C . LEU A1 1 74 ? -21.433 15.288 -23.482 1.0 21.0 ? 74 A 3 +ATOM 1122 O O . LEU A1 1 74 ? -22.568 15.231 -23.009 1.0 70.53 ? 74 A 3 +ATOM 1123 C CB . LEU A1 1 74 ? -20.289 13.594 -22.04 1.0 42.32 ? 74 A 3 +ATOM 1124 C CG . LEU A1 1 74 ? -21.025 12.563 -22.896 1.0 13.02 ? 74 A 3 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.399 12.473 -24.279 1.0 50.12 ? 74 A 3 +ATOM 1126 C CD2 . LEU A1 1 74 ? -21.018 11.202 -22.216 1.0 22.4 ? 74 A 3 +ATOM 1127 H H . LEU A1 1 74 ? -20.729 15.939 -20.785 1.0 53.04 ? 74 A 3 +ATOM 1128 H HA . LEU A1 1 74 ? -19.323 15.092 -23.226 1.0 65.43 ? 74 A 3 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.28 13.24 -21.892 1.0 22.02 ? 74 A 3 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.792 13.653 -21.086 1.0 20.31 ? 74 A 3 +ATOM 1131 H HG . LEU A1 1 74 ? -22.054 12.872 -23.016 1.0 34.12 ? 74 A 3 +ATOM 1132 H HD11 . LEU A1 1 74 ? -19.348 12.709 -24.215 1.0 33.01 ? 74 A 3 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.886 13.174 -24.941 1.0 1.34 ? 74 A 3 +ATOM 1134 H HD13 . LEU A1 1 74 ? -20.521 11.471 -24.665 1.0 63.14 ? 74 A 3 +ATOM 1135 H HD21 . LEU A1 1 74 ? -20.009 10.818 -22.189 1.0 12.32 ? 74 A 3 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.648 10.52 -22.768 1.0 54.43 ? 74 A 3 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.392 11.302 -21.207 1.0 14.02 ? 74 A 3 +ATOM 1138 N N . VAL A1 1 75 ? -21.194 15.587 -24.755 1.0 43.5 ? 75 A 3 +ATOM 1139 C CA . VAL A1 1 75 ? -22.276 15.871 -25.69 1.0 52.32 ? 75 A 3 +ATOM 1140 C C . VAL A1 1 75 ? -22.401 14.77 -26.736 1.0 61.15 ? 75 A 3 +ATOM 1141 O O . VAL A1 1 75 ? -21.421 14.397 -27.382 1.0 54.31 ? 75 A 3 +ATOM 1142 C CB . VAL A1 1 75 ? -22.062 17.22 -26.403 1.0 24.5 ? 75 A 3 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.245 17.54 -27.304 1.0 55.3 ? 75 A 3 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.84 18.33 -25.387 1.0 64.14 ? 75 A 3 +ATOM 1145 H H . VAL A1 1 75 ? -20.267 15.617 -25.073 1.0 70.11 ? 75 A 3 +ATOM 1146 H HA . VAL A1 1 75 ? -23.197 15.927 -25.128 1.0 60.52 ? 75 A 3 +ATOM 1147 H HB . VAL A1 1 75 ? -21.179 17.142 -27.019 1.0 44.41 ? 75 A 3 +ATOM 1148 H HG11 . VAL A1 1 75 ? -24.059 16.866 -27.083 1.0 31.54 ? 75 A 3 +ATOM 1149 H HG12 . VAL A1 1 75 ? -23.562 18.559 -27.135 1.0 61.34 ? 75 A 3 +ATOM 1150 H HG13 . VAL A1 1 75 ? -22.952 17.422 -28.337 1.0 54.52 ? 75 A 3 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.619 19.252 -25.903 1.0 5.24 ? 75 A 3 +ATOM 1152 H HG22 . VAL A1 1 75 ? -22.731 18.455 -24.791 1.0 61.35 ? 75 A 3 +ATOM 1153 H HG23 . VAL A1 1 75 ? -21.011 18.069 -24.744 1.0 24.43 ? 75 A 3 +ATOM 1154 N N . LEU A1 1 76 ? -23.614 14.252 -26.9 1.0 35.1 ? 76 A 3 +ATOM 1155 C CA . LEU A1 1 76 ? -23.869 13.193 -27.87 1.0 22.53 ? 76 A 3 +ATOM 1156 C C . LEU A1 1 76 ? -24.972 13.598 -28.842 1.0 2.14 ? 76 A 3 +ATOM 1157 O O . LEU A1 1 76 ? -25.989 14.165 -28.442 1.0 21.5 ? 76 A 3 +ATOM 1158 C CB . LEU A1 1 76 ? -24.257 11.899 -27.151 1.0 73.12 ? 76 A 3 +ATOM 1159 C CG . LEU A1 1 76 ? -24.193 11.935 -25.624 1.0 64.45 ? 76 A 3 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.435 12.602 -25.053 1.0 24.13 ? 76 A 3 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.036 10.529 -25.064 1.0 22.03 ? 76 A 3 +ATOM 1162 H H . LEU A1 1 76 ? -24.356 14.59 -26.357 1.0 44.32 ? 76 A 3 +ATOM 1163 H HA . LEU A1 1 76 ? -22.958 13.027 -28.426 1.0 53.04 ? 76 A 3 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.269 11.655 -27.434 1.0 71.31 ? 76 A 3 +ATOM 1165 H HB3 . LEU A1 1 76 ? -23.592 11.119 -27.493 1.0 62.14 ? 76 A 3 +ATOM 1166 H HG . LEU A1 1 76 ? -23.333 12.516 -25.319 1.0 42.11 ? 76 A 3 +ATOM 1167 H HD11 . LEU A1 1 76 ? -26.266 12.452 -25.726 1.0 12.14 ? 76 A 3 +ATOM 1168 H HD12 . LEU A1 1 76 ? -25.254 13.66 -24.936 1.0 23.21 ? 76 A 3 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.667 12.168 -24.091 1.0 40.2 ? 76 A 3 +ATOM 1170 H HD21 . LEU A1 1 76 ? -24.93 10.254 -24.525 1.0 53.24 ? 76 A 3 +ATOM 1171 H HD22 . LEU A1 1 76 ? -23.189 10.502 -24.394 1.0 72.02 ? 76 A 3 +ATOM 1172 H HD23 . LEU A1 1 76 ? -23.875 9.834 -25.875 1.0 63.4 ? 76 A 3 +ATOM 1173 N N . ARG A1 1 77 ? -24.764 13.303 -30.121 1.0 50.44 ? 77 A 3 +ATOM 1174 C CA . ARG A1 1 77 ? -25.741 13.636 -31.151 1.0 12.4 ? 77 A 3 +ATOM 1175 C C . ARG A1 1 77 ? -26.295 12.373 -31.803 1.0 10.32 ? 77 A 3 +ATOM 1176 O O . ARG A1 1 77 ? -26.109 12.146 -33.0 1.0 12.43 ? 77 A 3 +ATOM 1177 C CB . ARG A1 1 77 ? -25.107 14.536 -32.214 1.0 55.35 ? 77 A 3 +ATOM 1178 C CG . ARG A1 1 77 ? -24.351 15.721 -31.636 1.0 12.22 ? 77 A 3 +ATOM 1179 C CD . ARG A1 1 77 ? -22.847 15.53 -31.748 1.0 60.22 ? 77 A 3 +ATOM 1180 N NE . ARG A1 1 77 ? -22.252 16.432 -32.731 1.0 64.33 ? 77 A 3 +ATOM 1181 C CZ . ARG A1 1 77 ? -22.141 17.743 -32.552 1.0 13.31 ? 77 A 3 +ATOM 1182 N NH1 . ARG A1 1 77 ? -22.58 18.303 -31.434 1.0 63.3 ? 77 A 3 +ATOM 1183 N NH2 . ARG A1 1 77 ? -21.588 18.498 -33.494 1.0 70.54 ? 77 A 3 +ATOM 1184 H H . ARG A1 1 77 ? -23.933 12.851 -30.379 1.0 2.41 ? 77 A 3 +ATOM 1185 H HA . ARG A1 1 77 ? -26.553 14.169 -30.678 1.0 53.23 ? 77 A 3 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.417 13.948 -32.801 1.0 41.04 ? 77 A 3 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.886 14.913 -32.859 1.0 23.23 ? 77 A 3 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.631 16.613 -32.177 1.0 3.21 ? 77 A 3 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.615 15.831 -30.595 1.0 45.32 ? 77 A 3 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.4 15.72 -30.784 1.0 24.22 ? 77 A 3 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.648 14.51 -32.042 1.0 55.12 ? 77 A 3 +ATOM 1192 H HE . ARG A1 1 77 ? -21.921 16.039 -33.565 1.0 41.44 ? 77 A 3 +ATOM 1193 H HH11 . ARG A1 1 77 ? -22.996 17.737 -30.722 1.0 31.24 ? 77 A 3 +ATOM 1194 H HH12 . ARG A1 1 77 ? -22.494 19.291 -31.301 1.0 72.5 ? 77 A 3 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.255 18.08 -34.338 1.0 71.34 ? 77 A 3 +ATOM 1196 H HH22 . ARG A1 1 77 ? -21.505 19.485 -33.358 1.0 1.44 ? 77 A 3 +ATOM 1197 N N . LEU A1 1 78 ? -26.976 11.554 -31.01 1.0 31.03 ? 78 A 3 +ATOM 1198 C CA . LEU A1 1 78 ? -27.558 10.313 -31.51 1.0 51.32 ? 78 A 3 +ATOM 1199 C C . LEU A1 1 78 ? -28.547 10.59 -32.638 1.0 14.11 ? 78 A 3 +ATOM 1200 O O . LEU A1 1 78 ? -28.465 9.99 -33.709 1.0 12.31 ? 78 A 3 +ATOM 1201 C CB . LEU A1 1 78 ? -28.258 9.561 -30.376 1.0 42.51 ? 78 A 3 +ATOM 1202 C CG . LEU A1 1 78 ? -27.379 8.621 -29.55 1.0 51.45 ? 78 A 3 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.298 9.404 -28.821 1.0 14.44 ? 78 A 3 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.224 7.829 -28.563 1.0 25.32 ? 78 A 3 +ATOM 1205 H H . LEU A1 1 78 ? -27.092 11.788 -30.066 1.0 75.31 ? 78 A 3 +ATOM 1206 H HA . LEU A1 1 78 ? -26.755 9.701 -31.893 1.0 64.2 ? 78 A 3 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.679 10.294 -29.705 1.0 61.14 ? 78 A 3 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.054 8.974 -30.811 1.0 62.32 ? 78 A 3 +ATOM 1209 H HG . LEU A1 1 78 ? -26.892 7.919 -30.213 1.0 53.42 ? 78 A 3 +ATOM 1210 H HD11 . LEU A1 1 78 ? -25.407 9.441 -29.429 1.0 3.24 ? 78 A 3 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.074 8.919 -27.882 1.0 74.14 ? 78 A 3 +ATOM 1212 H HD13 . LEU A1 1 78 ? -26.647 10.409 -28.631 1.0 11.41 ? 78 A 3 +ATOM 1213 H HD21 . LEU A1 1 78 ? -29.179 8.318 -28.435 1.0 65.32 ? 78 A 3 +ATOM 1214 H HD22 . LEU A1 1 78 ? -27.714 7.779 -27.613 1.0 65.43 ? 78 A 3 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.379 6.83 -28.943 1.0 34.04 ? 78 A 3 +ATOM 1216 N N . ARG A1 1 79 ? -29.479 11.504 -32.389 1.0 44.5 ? 79 A 3 +ATOM 1217 C CA . ARG A1 1 79 ? -30.482 11.861 -33.384 1.0 54.44 ? 79 A 3 +ATOM 1218 C C . ARG A1 1 79 ? -31.251 10.628 -33.849 1.0 43.43 ? 79 A 3 +ATOM 1219 O O . ARG A1 1 79 ? -31.105 9.544 -33.285 1.0 24.23 ? 79 A 3 +ATOM 1220 C CB . ARG A1 1 79 ? -29.822 12.546 -34.582 1.0 53.1 ? 79 A 3 +ATOM 1221 C CG . ARG A1 1 79 ? -30.393 13.921 -34.889 1.0 62.42 ? 79 A 3 +ATOM 1222 C CD . ARG A1 1 79 ? -29.419 15.026 -34.511 1.0 15.2 ? 79 A 3 +ATOM 1223 N NE . ARG A1 1 79 ? -29.671 16.256 -35.256 1.0 22.21 ? 79 A 3 +ATOM 1224 C CZ . ARG A1 1 79 ? -30.714 17.048 -35.035 1.0 43.33 ? 79 A 3 +ATOM 1225 N NH1 . ARG A1 1 79 ? -31.597 16.74 -34.095 1.0 51.34 ? 79 A 3 +ATOM 1226 N NH2 . ARG A1 1 79 ? -30.875 18.152 -35.754 1.0 24.34 ? 79 A 3 +ATOM 1227 H H . ARG A1 1 79 ? -29.492 11.948 -31.516 1.0 30.43 ? 79 A 3 +ATOM 1228 H HA . ARG A1 1 79 ? -31.175 12.55 -32.924 1.0 75.12 ? 79 A 3 +ATOM 1229 H HB2 . ARG A1 1 79 ? -28.766 12.655 -34.383 1.0 72.51 ? 79 A 3 +ATOM 1230 H HB3 . ARG A1 1 79 ? -29.953 11.923 -35.454 1.0 62.3 ? 79 A 3 +ATOM 1231 H HG2 . ARG A1 1 79 ? -30.601 13.987 -35.947 1.0 34.21 ? 79 A 3 +ATOM 1232 H HG3 . ARG A1 1 79 ? -31.308 14.053 -34.331 1.0 51.44 ? 79 A 3 +ATOM 1233 H HD2 . ARG A1 1 79 ? -29.517 15.229 -33.455 1.0 21.42 ? 79 A 3 +ATOM 1234 H HD3 . ARG A1 1 79 ? -28.414 14.688 -34.72 1.0 24.22 ? 79 A 3 +ATOM 1235 H HE . ARG A1 1 79 ? -29.03 16.503 -35.955 1.0 63.2 ? 79 A 3 +ATOM 1236 H HH11 . ARG A1 1 79 ? -31.478 15.91 -33.551 1.0 0.03 ? 79 A 3 +ATOM 1237 H HH12 . ARG A1 1 79 ? -32.381 17.339 -33.93 1.0 54.33 ? 79 A 3 +ATOM 1238 H HH21 . ARG A1 1 79 ? -30.211 18.387 -36.463 1.0 72.3 ? 79 A 3 +ATOM 1239 H HH22 . ARG A1 1 79 ? -31.66 18.747 -35.587 1.0 2.44 ? 79 A 3 +ATOM 1240 N N . GLY A1 1 80 ? -32.07 10.802 -34.882 1.0 11.03 ? 80 A 3 +ATOM 1241 C CA . GLY A1 1 80 ? -32.85 9.695 -35.405 1.0 3.12 ? 80 A 3 +ATOM 1242 C C . GLY A1 1 80 ? -34.29 10.079 -35.681 1.0 52.34 ? 80 A 3 +ATOM 1243 O O . GLY A1 1 80 ? -34.583 10.737 -36.678 1.0 43.44 ? 80 A 3 +ATOM 1244 H H . GLY A1 1 80 ? -32.146 11.689 -35.292 1.0 0.24 ? 80 A 3 +ATOM 1245 H HA2 . GLY A1 1 80 ? -32.397 9.352 -36.323 1.0 71.24 ? 80 A 3 +ATOM 1246 H HA3 . GLY A1 1 80 ? -32.837 8.889 -34.685 1.0 43.14 ? 80 A 3 +ATOM 1247 N N . GLY A1 1 81 ? -35.192 9.666 -34.796 1.0 43.34 ? 81 A 3 +ATOM 1248 C CA . GLY A1 1 81 ? -36.598 9.979 -34.969 1.0 20.2 ? 81 A 3 +ATOM 1249 C C . GLY A1 1 81 ? -37.332 8.926 -35.776 1.0 63.23 ? 81 A 3 +ATOM 1250 O O . GLY A1 1 81 ? -36.826 8.447 -36.791 1.0 30.24 ? 81 A 3 +ATOM 1251 H H . GLY A1 1 81 ? -34.9 9.144 -34.019 1.0 11.33 ? 81 A 3 +ATOM 1252 H HA2 . GLY A1 1 81 ? -37.06 10.059 -33.996 1.0 30.51 ? 81 A 3 +ATOM 1253 H HA3 . GLY A1 1 81 ? -36.684 10.929 -35.476 1.0 55.14 ? 81 A 3 +ATOM 1254 N N . VAL A1 1 82 ? -38.528 8.563 -35.323 1.0 30.52 ? 82 A 3 +ATOM 1255 C CA . VAL A1 1 82 ? -39.332 7.559 -36.01 1.0 4.45 ? 82 A 3 +ATOM 1256 C C . VAL A1 1 82 ? -40.078 8.167 -37.193 1.0 63.52 ? 82 A 3 +ATOM 1257 O O . VAL A1 1 82 ? -39.728 7.931 -38.349 1.0 12.52 ? 82 A 3 +ATOM 1258 C CB . VAL A1 1 82 ? -40.35 6.907 -35.056 1.0 53.54 ? 82 A 3 +ATOM 1259 C CG1 . VAL A1 1 82 ? -41.052 5.743 -35.738 1.0 33.31 ? 82 A 3 +ATOM 1260 C CG2 . VAL A1 1 82 ? -39.665 6.452 -33.776 1.0 1.13 ? 82 A 3 +ATOM 1261 H H . VAL A1 1 82 ? -38.878 8.981 -34.509 1.0 42.11 ? 82 A 3 +ATOM 1262 H HA . VAL A1 1 82 ? -38.667 6.79 -36.374 1.0 65.12 ? 82 A 3 +ATOM 1263 H HB . VAL A1 1 82 ? -41.095 7.645 -34.797 1.0 3.02 ? 82 A 3 +ATOM 1264 H HG11 . VAL A1 1 82 ? -41.945 5.488 -35.186 1.0 71.54 ? 82 A 3 +ATOM 1265 H HG12 . VAL A1 1 82 ? -41.318 6.023 -36.747 1.0 43.52 ? 82 A 3 +ATOM 1266 H HG13 . VAL A1 1 82 ? -40.39 4.889 -35.764 1.0 60.31 ? 82 A 3 +ATOM 1267 H HG21 . VAL A1 1 82 ? -40.367 5.902 -33.167 1.0 51.1 ? 82 A 3 +ATOM 1268 H HG22 . VAL A1 1 82 ? -38.828 5.816 -34.024 1.0 43.42 ? 82 A 3 +ATOM 1269 H HG23 . VAL A1 1 82 ? -39.312 7.314 -33.23 1.0 61.21 ? 82 A 3 +ATOM 1 N N . GLY A1 1 1 ? -15.13 -4.109 -7.524 1.0 13.0 ? 1 A 4 +ATOM 2 C CA . GLY A1 1 1 ? -14.03 -3.547 -6.762 1.0 45.03 ? 1 A 4 +ATOM 3 C C . GLY A1 1 1 ? -13.407 -2.345 -7.444 1.0 65.21 ? 1 A 4 +ATOM 4 O O . GLY A1 1 1 ? -12.323 -2.425 -8.023 1.0 33.34 ? 1 A 4 +ATOM 5 H H1 . GLY A1 1 1 ? -15.976 -3.618 -7.594 1.0 52.4 ? 1 A 4 +ATOM 6 H HA2 . GLY A1 1 1 ? -14.395 -3.248 -5.791 1.0 14.15 ? 1 A 4 +ATOM 7 H HA3 . GLY A1 1 1 ? -13.272 -4.306 -6.633 1.0 34.23 ? 1 A 4 +ATOM 8 N N . PRO A1 1 2 ? -14.102 -1.199 -7.382 1.0 55.32 ? 2 A 4 +ATOM 9 C CA . PRO A1 1 2 ? -13.63 0.047 -7.995 1.0 21.43 ? 2 A 4 +ATOM 10 C C . PRO A1 1 2 ? -12.42 0.626 -7.27 1.0 41.45 ? 2 A 4 +ATOM 11 O O . PRO A1 1 2 ? -12.521 1.064 -6.123 1.0 62.42 ? 2 A 4 +ATOM 12 C CB . PRO A1 1 2 ? -14.832 0.985 -7.863 1.0 51.45 ? 2 A 4 +ATOM 13 C CG . PRO A1 1 2 ? -15.595 0.46 -6.696 1.0 43.11 ? 2 A 4 +ATOM 14 C CD . PRO A1 1 2 ? -15.401 -1.031 -6.71 1.0 64.14 ? 2 A 4 +ATOM 15 H HA . PRO A1 1 2 ? -13.391 -0.09 -9.039 1.0 31.54 ? 2 A 4 +ATOM 16 H HB2 . PRO A1 1 2 ? -14.487 1.994 -7.689 1.0 42.4 ? 2 A 4 +ATOM 17 H HB3 . PRO A1 1 2 ? -15.421 0.95 -8.767 1.0 62.54 ? 2 A 4 +ATOM 18 H HG2 . PRO A1 1 2 ? -15.204 0.881 -5.782 1.0 3.22 ? 2 A 4 +ATOM 19 H HG3 . PRO A1 1 2 ? -16.642 0.702 -6.804 1.0 51.14 ? 2 A 4 +ATOM 20 H HD2 . PRO A1 1 2 ? -15.366 -1.416 -5.702 1.0 11.0 ? 2 A 4 +ATOM 21 H HD3 . PRO A1 1 2 ? -16.19 -1.509 -7.272 1.0 24.12 ? 2 A 4 +ATOM 22 N N . LEU A1 1 3 ? -11.276 0.628 -7.946 1.0 34.12 ? 3 A 4 +ATOM 23 C CA . LEU A1 1 3 ? -10.045 1.155 -7.366 1.0 54.03 ? 3 A 4 +ATOM 24 C C . LEU A1 1 3 ? -8.94 1.236 -8.415 1.0 63.21 ? 3 A 4 +ATOM 25 O O . LEU A1 1 3 ? -8.731 0.299 -9.184 1.0 11.24 ? 3 A 4 +ATOM 26 C CB . LEU A1 1 3 ? -9.592 0.278 -6.198 1.0 60.12 ? 3 A 4 +ATOM 27 C CG . LEU A1 1 3 ? -9.307 -1.188 -6.529 1.0 64.13 ? 3 A 4 +ATOM 28 C CD1 . LEU A1 1 3 ? -7.859 -1.366 -6.959 1.0 62.25 ? 3 A 4 +ATOM 29 C CD2 . LEU A1 1 3 ? -9.625 -2.076 -5.336 1.0 0.12 ? 3 A 4 +ATOM 30 H H . LEU A1 1 3 ? -11.257 0.266 -8.856 1.0 52.35 ? 3 A 4 +ATOM 31 H HA . LEU A1 1 3 ? -10.251 2.15 -7.0 1.0 43.13 ? 3 A 4 +ATOM 32 H HB2 . LEU A1 1 3 ? -8.688 0.707 -5.794 1.0 74.24 ? 3 A 4 +ATOM 33 H HB3 . LEU A1 1 3 ? -10.368 0.303 -5.446 1.0 72.41 ? 3 A 4 +ATOM 34 H HG . LEU A1 1 3 ? -9.939 -1.493 -7.352 1.0 43.5 ? 3 A 4 +ATOM 35 H HD11 . LEU A1 1 3 ? -7.391 -0.398 -7.058 1.0 50.45 ? 3 A 4 +ATOM 36 H HD12 . LEU A1 1 3 ? -7.826 -1.881 -7.907 1.0 4.34 ? 3 A 4 +ATOM 37 H HD13 . LEU A1 1 3 ? -7.333 -1.947 -6.215 1.0 54.42 ? 3 A 4 +ATOM 38 H HD21 . LEU A1 1 3 ? -9.144 -1.68 -4.454 1.0 23.33 ? 3 A 4 +ATOM 39 H HD22 . LEU A1 1 3 ? -9.263 -3.076 -5.525 1.0 1.01 ? 3 A 4 +ATOM 40 H HD23 . LEU A1 1 3 ? -10.694 -2.104 -5.182 1.0 75.24 ? 3 A 4 +ATOM 41 N N . GLY A1 1 4 ? -8.234 2.362 -8.438 1.0 4.21 ? 4 A 4 +ATOM 42 C CA . GLY A1 1 4 ? -7.158 2.543 -9.394 1.0 43.34 ? 4 A 4 +ATOM 43 C C . GLY A1 1 4 ? -6.348 3.796 -9.124 1.0 32.24 ? 4 A 4 +ATOM 44 O O . GLY A1 1 4 ? -5.897 4.022 -8.001 1.0 73.31 ? 4 A 4 +ATOM 45 H H . GLY A1 1 4 ? -8.446 3.076 -7.8 1.0 2.13 ? 4 A 4 +ATOM 46 H HA2 . GLY A1 1 4 ? -6.503 1.686 -9.349 1.0 53.5 ? 4 A 4 +ATOM 47 H HA3 . GLY A1 1 4 ? -7.58 2.609 -10.386 1.0 61.41 ? 4 A 4 +ATOM 48 N N . SER A1 1 5 ? -6.161 4.612 -10.157 1.0 14.33 ? 5 A 4 +ATOM 49 C CA . SER A1 1 5 ? -5.394 5.846 -10.027 1.0 12.42 ? 5 A 4 +ATOM 50 C C . SER A1 1 5 ? -6.297 7.005 -9.618 1.0 43.22 ? 5 A 4 +ATOM 51 O O . SER A1 1 5 ? -6.175 7.543 -8.518 1.0 33.52 ? 5 A 4 +ATOM 52 C CB . SER A1 1 5 ? -4.689 6.174 -11.344 1.0 72.02 ? 5 A 4 +ATOM 53 O OG . SER A1 1 5 ? -3.513 6.932 -11.119 1.0 21.35 ? 5 A 4 +ATOM 54 H H . SER A1 1 5 ? -6.546 4.377 -11.027 1.0 31.12 ? 5 A 4 +ATOM 55 H HA . SER A1 1 5 ? -4.651 5.695 -9.258 1.0 12.32 ? 5 A 4 +ATOM 56 H HB2 . SER A1 1 5 ? -4.42 5.255 -11.844 1.0 41.01 ? 5 A 4 +ATOM 57 H HB3 . SER A1 1 5 ? -5.356 6.744 -11.974 1.0 74.13 ? 5 A 4 +ATOM 58 H HG . SER A1 1 5 ? -2.827 6.361 -10.767 1.0 33.45 ? 5 A 4 +ATOM 59 N N . MET A1 1 6 ? -7.204 7.385 -10.512 1.0 14.01 ? 6 A 4 +ATOM 60 C CA . MET A1 1 6 ? -8.129 8.481 -10.244 1.0 54.33 ? 6 A 4 +ATOM 61 C C . MET A1 1 6 ? -9.472 8.237 -10.926 1.0 31.44 ? 6 A 4 +ATOM 62 O O . MET A1 1 6 ? -9.698 7.177 -11.508 1.0 1.11 ? 6 A 4 +ATOM 63 C CB . MET A1 1 6 ? -7.534 9.807 -10.723 1.0 70.21 ? 6 A 4 +ATOM 64 C CG . MET A1 1 6 ? -6.818 9.705 -12.059 1.0 25.05 ? 6 A 4 +ATOM 65 S SD . MET A1 1 6 ? -5.033 9.519 -11.878 1.0 3.44 ? 6 A 4 +ATOM 66 C CE . MET A1 1 6 ? -4.505 11.229 -11.958 1.0 13.21 ? 6 A 4 +ATOM 67 H H . MET A1 1 6 ? -7.254 6.918 -11.372 1.0 2.32 ? 6 A 4 +ATOM 68 H HA . MET A1 1 6 ? -8.283 8.53 -9.177 1.0 5.22 ? 6 A 4 +ATOM 69 H HB2 . MET A1 1 6 ? -8.33 10.53 -10.819 1.0 62.43 ? 6 A 4 +ATOM 70 H HB3 . MET A1 1 6 ? -6.827 10.157 -9.986 1.0 63.34 ? 6 A 4 +ATOM 71 H HG2 . MET A1 1 6 ? -7.201 8.849 -12.594 1.0 33.13 ? 6 A 4 +ATOM 72 H HG3 . MET A1 1 6 ? -7.017 10.601 -12.628 1.0 12.41 ? 6 A 4 +ATOM 73 H HE1 . MET A1 1 6 ? -5.323 11.842 -12.309 1.0 12.23 ? 6 A 4 +ATOM 74 H HE2 . MET A1 1 6 ? -4.205 11.559 -10.974 1.0 52.54 ? 6 A 4 +ATOM 75 H HE3 . MET A1 1 6 ? -3.671 11.316 -12.637 1.0 2.41 ? 6 A 4 +ATOM 76 N N . GLN A1 1 7 ? -10.358 9.225 -10.847 1.0 13.12 ? 7 A 4 +ATOM 77 C CA . GLN A1 1 7 ? -11.678 9.115 -11.456 1.0 13.2 ? 7 A 4 +ATOM 78 C C . GLN A1 1 7 ? -12.079 10.426 -12.126 1.0 42.42 ? 7 A 4 +ATOM 79 O O . GLN A1 1 7 ? -11.556 11.49 -11.792 1.0 71.33 ? 7 A 4 +ATOM 80 C CB . GLN A1 1 7 ? -12.718 8.729 -10.403 1.0 42.01 ? 7 A 4 +ATOM 81 C CG . GLN A1 1 7 ? -12.232 7.668 -9.428 1.0 12.34 ? 7 A 4 +ATOM 82 C CD . GLN A1 1 7 ? -13.196 7.444 -8.28 1.0 44.31 ? 7 A 4 +ATOM 83 O OE1 . GLN A1 1 7 ? -14.345 7.885 -8.325 1.0 33.44 ? 7 A 4 +ATOM 84 N NE2 . GLN A1 1 7 ? -12.734 6.755 -7.244 1.0 73.32 ? 7 A 4 +ATOM 85 H H . GLN A1 1 7 ? -10.118 10.045 -10.369 1.0 71.21 ? 7 A 4 +ATOM 86 H HA . GLN A1 1 7 ? -11.634 8.341 -12.206 1.0 62.03 ? 7 A 4 +ATOM 87 H HB2 . GLN A1 1 7 ? -12.986 9.61 -9.838 1.0 13.25 ? 7 A 4 +ATOM 88 H HB3 . GLN A1 1 7 ? -13.597 8.351 -10.904 1.0 41.42 ? 7 A 4 +ATOM 89 H HG2 . GLN A1 1 7 ? -12.109 6.737 -9.962 1.0 43.33 ? 7 A 4 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.28 7.978 -9.024 1.0 33.21 ? 7 A 4 +ATOM 91 H HE21 . GLN A1 1 7 ? -11.807 6.436 -7.277 1.0 52.01 ? 7 A 4 +ATOM 92 H HE22 . GLN A1 1 7 ? -13.335 6.597 -6.488 1.0 55.43 ? 7 A 4 +ATOM 93 N N . ILE A1 1 8 ? -13.008 10.341 -13.072 1.0 12.12 ? 8 A 4 +ATOM 94 C CA . ILE A1 1 8 ? -13.478 11.52 -13.788 1.0 64.2 ? 8 A 4 +ATOM 95 C C . ILE A1 1 8 ? -15.001 11.591 -13.79 1.0 0.33 ? 8 A 4 +ATOM 96 O O . ILE A1 1 8 ? -15.681 10.571 -13.671 1.0 11.35 ? 8 A 4 +ATOM 97 C CB . ILE A1 1 8 ? -12.973 11.533 -15.243 1.0 65.34 ? 8 A 4 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.115 10.297 -15.52 1.0 72.33 ? 8 A 4 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.185 12.805 -15.519 1.0 55.24 ? 8 A 4 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.73 10.142 -16.975 1.0 11.02 ? 8 A 4 +ATOM 101 H H . ILE A1 1 8 ? -13.386 9.464 -13.293 1.0 43.45 ? 8 A 4 +ATOM 102 H HA . ILE A1 1 8 ? -13.088 12.393 -13.285 1.0 41.41 ? 8 A 4 +ATOM 103 H HB . ILE A1 1 8 ? -13.831 11.521 -15.898 1.0 13.24 ? 8 A 4 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.206 10.362 -14.942 1.0 4.11 ? 8 A 4 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.663 9.414 -15.224 1.0 33.41 ? 8 A 4 +ATOM 106 H HG21 . ILE A1 1 8 ? -12.87 13.617 -15.714 1.0 12.11 ? 8 A 4 +ATOM 107 H HG22 . ILE A1 1 8 ? -11.579 13.046 -14.658 1.0 14.43 ? 8 A 4 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.549 12.656 -16.378 1.0 53.13 ? 8 A 4 +ATOM 109 H HD11 . ILE A1 1 8 ? -10.668 9.956 -17.048 1.0 4.51 ? 8 A 4 +ATOM 110 H HD12 . ILE A1 1 8 ? -12.27 9.31 -17.403 1.0 22.53 ? 8 A 4 +ATOM 111 H HD13 . ILE A1 1 8 ? -11.975 11.046 -17.511 1.0 32.23 ? 8 A 4 +ATOM 112 N N . PHE A1 1 9 ? -15.532 12.802 -13.927 1.0 44.42 ? 9 A 4 +ATOM 113 C CA . PHE A1 1 9 ? -16.975 13.006 -13.945 1.0 45.42 ? 9 A 4 +ATOM 114 C C . PHE A1 1 9 ? -17.451 13.401 -15.34 1.0 62.05 ? 9 A 4 +ATOM 115 O O . PHE A1 1 9 ? -16.954 14.36 -15.93 1.0 33.13 ? 9 A 4 +ATOM 116 C CB . PHE A1 1 9 ? -17.371 14.085 -12.935 1.0 42.3 ? 9 A 4 +ATOM 117 C CG . PHE A1 1 9 ? -18.024 13.538 -11.698 1.0 44.44 ? 9 A 4 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.246 12.889 -11.773 1.0 24.21 ? 9 A 4 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.416 13.673 -10.46 1.0 24.11 ? 9 A 4 +ATOM 120 C CE1 . PHE A1 1 9 ? -19.849 12.384 -10.636 1.0 54.33 ? 9 A 4 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.014 13.169 -9.321 1.0 62.43 ? 9 A 4 +ATOM 122 C CZ . PHE A1 1 9 ? -19.233 12.525 -9.409 1.0 72.21 ? 9 A 4 +ATOM 123 H H . PHE A1 1 9 ? -14.937 13.576 -14.018 1.0 15.35 ? 9 A 4 +ATOM 124 H HA . PHE A1 1 9 ? -17.445 12.076 -13.667 1.0 72.15 ? 9 A 4 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.488 14.626 -12.632 1.0 13.22 ? 9 A 4 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.064 14.769 -13.403 1.0 20.44 ? 9 A 4 +ATOM 127 H HD1 . PHE A1 1 9 ? -19.73 12.778 -12.733 1.0 63.23 ? 9 A 4 +ATOM 128 H HD2 . PHE A1 1 9 ? -16.463 14.177 -10.39 1.0 43.5 ? 9 A 4 +ATOM 129 H HE1 . PHE A1 1 9 ? -20.802 11.881 -10.709 1.0 53.21 ? 9 A 4 +ATOM 130 H HE2 . PHE A1 1 9 ? -17.53 13.281 -8.362 1.0 61.25 ? 9 A 4 +ATOM 131 H HZ . PHE A1 1 9 ? -19.702 12.131 -8.52 1.0 11.33 ? 9 A 4 +ATOM 132 N N . VAL A1 1 10 ? -18.417 12.652 -15.863 1.0 35.51 ? 10 A 4 +ATOM 133 C CA . VAL A1 1 10 ? -18.962 12.922 -17.188 1.0 51.35 ? 10 A 4 +ATOM 134 C C . VAL A1 1 10 ? -20.435 13.308 -17.109 1.0 20.3 ? 10 A 4 +ATOM 135 O O . VAL A1 1 10 ? -21.242 12.599 -16.507 1.0 33.54 ? 10 A 4 +ATOM 136 C CB . VAL A1 1 10 ? -18.811 11.702 -18.116 1.0 1.24 ? 10 A 4 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.829 12.135 -19.574 1.0 43.55 ? 10 A 4 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.534 10.942 -17.793 1.0 70.41 ? 10 A 4 +ATOM 139 H H . VAL A1 1 10 ? -18.773 11.9 -15.344 1.0 13.11 ? 10 A 4 +ATOM 140 H HA . VAL A1 1 10 ? -18.407 13.744 -17.616 1.0 52.2 ? 10 A 4 +ATOM 141 H HB . VAL A1 1 10 ? -19.65 11.043 -17.949 1.0 21.21 ? 10 A 4 +ATOM 142 H HG11 . VAL A1 1 10 ? -18.296 11.409 -20.171 1.0 75.22 ? 10 A 4 +ATOM 143 H HG12 . VAL A1 1 10 ? -19.851 12.206 -19.917 1.0 54.41 ? 10 A 4 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.349 13.099 -19.669 1.0 61.31 ? 10 A 4 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.65 10.426 -16.851 1.0 13.24 ? 10 A 4 +ATOM 146 H HG22 . VAL A1 1 10 ? -17.335 10.225 -18.575 1.0 62.44 ? 10 A 4 +ATOM 147 H HG23 . VAL A1 1 10 ? -16.709 11.636 -17.722 1.0 2.35 ? 10 A 4 +ATOM 148 N N . LYS A1 1 11 ? -20.779 14.436 -17.721 1.0 23.3 ? 11 A 4 +ATOM 149 C CA . LYS A1 1 11 ? -22.155 14.917 -17.723 1.0 10.31 ? 11 A 4 +ATOM 150 C C . LYS A1 1 11 ? -22.798 14.722 -19.092 1.0 22.12 ? 11 A 4 +ATOM 151 O O . LYS A1 1 11 ? -22.395 15.346 -20.074 1.0 63.21 ? 11 A 4 +ATOM 152 C CB . LYS A1 1 11 ? -22.201 16.396 -17.332 1.0 34.41 ? 11 A 4 +ATOM 153 C CG . LYS A1 1 11 ? -23.536 17.06 -17.621 1.0 63.11 ? 11 A 4 +ATOM 154 C CD . LYS A1 1 11 ? -23.524 18.528 -17.229 1.0 3.15 ? 11 A 4 +ATOM 155 C CE . LYS A1 1 11 ? -23.214 19.421 -18.421 1.0 2.52 ? 11 A 4 +ATOM 156 N NZ . LYS A1 1 11 ? -23.396 20.863 -18.096 1.0 51.12 ? 11 A 4 +ATOM 157 H H . LYS A1 1 11 ? -20.09 14.958 -18.184 1.0 4.15 ? 11 A 4 +ATOM 158 H HA . LYS A1 1 11 ? -22.708 14.343 -16.994 1.0 44.21 ? 11 A 4 +ATOM 159 H HB2 . LYS A1 1 11 ? -22.001 16.482 -16.274 1.0 75.01 ? 11 A 4 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.434 16.924 -17.879 1.0 15.43 ? 11 A 4 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.745 16.983 -18.678 1.0 73.24 ? 11 A 4 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.309 16.553 -17.061 1.0 30.03 ? 11 A 4 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.495 18.795 -16.837 1.0 63.51 ? 11 A 4 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.772 18.683 -16.468 1.0 61.22 ? 11 A 4 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.19 19.255 -18.721 1.0 70.24 ? 11 A 4 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.874 19.157 -19.233 1.0 3.13 ? 11 A 4 +ATOM 167 H HZ1 . LYS A1 1 11 ? -22.64 21.426 -18.534 1.0 1.34 ? 11 A 4 +ATOM 168 H HZ2 . LYS A1 1 11 ? -23.366 21.003 -17.066 1.0 61.44 ? 11 A 4 +ATOM 169 H HZ3 . LYS A1 1 11 ? -24.314 21.196 -18.453 1.0 12.11 ? 11 A 4 +ATOM 170 N N . THR A1 1 12 ? -23.803 13.853 -19.151 1.0 60.33 ? 12 A 4 +ATOM 171 C CA . THR A1 1 12 ? -24.501 13.576 -20.4 1.0 63.11 ? 12 A 4 +ATOM 172 C C . THR A1 1 12 ? -25.407 14.738 -20.792 1.0 63.2 ? 12 A 4 +ATOM 173 O O . THR A1 1 12 ? -25.77 15.565 -19.955 1.0 23.14 ? 12 A 4 +ATOM 174 C CB . THR A1 1 12 ? -25.347 12.293 -20.298 1.0 13.53 ? 12 A 4 +ATOM 175 O OG1 . THR A1 1 12 ? -26.496 12.527 -19.477 1.0 44.22 ? 12 A 4 +ATOM 176 C CG2 . THR A1 1 12 ? -24.528 11.149 -19.718 1.0 44.25 ? 12 A 4 +ATOM 177 H H . THR A1 1 12 ? -24.078 13.386 -18.335 1.0 50.31 ? 12 A 4 +ATOM 178 H HA . THR A1 1 12 ? -23.76 13.433 -21.173 1.0 15.31 ? 12 A 4 +ATOM 179 H HB . THR A1 1 12 ? -25.673 12.015 -21.29 1.0 3.11 ? 12 A 4 +ATOM 180 H HG1 . THR A1 1 12 ? -27.139 11.828 -19.619 1.0 54.01 ? 12 A 4 +ATOM 181 H HG21 . THR A1 1 12 ? -23.677 10.959 -20.354 1.0 54.24 ? 12 A 4 +ATOM 182 H HG22 . THR A1 1 12 ? -25.14 10.261 -19.66 1.0 51.32 ? 12 A 4 +ATOM 183 H HG23 . THR A1 1 12 ? -24.186 11.417 -18.73 1.0 74.05 ? 12 A 4 +ATOM 184 N N . LEU A1 1 13 ? -25.769 14.795 -22.069 1.0 74.21 ? 13 A 4 +ATOM 185 C CA . LEU A1 1 13 ? -26.634 15.856 -22.573 1.0 74.52 ? 13 A 4 +ATOM 186 C C . LEU A1 1 13 ? -27.972 15.861 -21.841 1.0 25.21 ? 13 A 4 +ATOM 187 O O . LEU A1 1 13 ? -28.697 16.857 -21.854 1.0 11.35 ? 13 A 4 +ATOM 188 C CB . LEU A1 1 13 ? -26.862 15.685 -24.075 1.0 31.51 ? 13 A 4 +ATOM 189 C CG . LEU A1 1 13 ? -27.507 16.87 -24.796 1.0 30.32 ? 13 A 4 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.454 17.899 -25.178 1.0 44.31 ? 13 A 4 +ATOM 191 C CD2 . LEU A1 1 13 ? -28.265 16.397 -26.027 1.0 64.01 ? 13 A 4 +ATOM 192 H H . LEU A1 1 13 ? -25.448 14.107 -22.689 1.0 42.02 ? 13 A 4 +ATOM 193 H HA . LEU A1 1 13 ? -26.138 16.799 -22.397 1.0 34.1 ? 13 A 4 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.904 15.5 -24.536 1.0 62.11 ? 13 A 4 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.5 14.824 -24.217 1.0 43.21 ? 13 A 4 +ATOM 196 H HG . LEU A1 1 13 ? -28.213 17.347 -24.13 1.0 45.4 ? 13 A 4 +ATOM 197 H HD11 . LEU A1 1 13 ? -26.699 18.849 -24.727 1.0 62.23 ? 13 A 4 +ATOM 198 H HD12 . LEU A1 1 13 ? -26.429 18.006 -26.252 1.0 23.44 ? 13 A 4 +ATOM 199 H HD13 . LEU A1 1 13 ? -25.487 17.572 -24.826 1.0 25.55 ? 13 A 4 +ATOM 200 H HD21 . LEU A1 1 13 ? -29.16 15.877 -25.721 1.0 62.14 ? 13 A 4 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.639 15.73 -26.601 1.0 41.34 ? 13 A 4 +ATOM 202 H HD23 . LEU A1 1 13 ? -28.533 17.25 -26.634 1.0 51.42 ? 13 A 4 +ATOM 203 N N . THR A1 1 14 ? -28.295 14.741 -21.2 1.0 31.41 ? 14 A 4 +ATOM 204 C CA . THR A1 1 14 ? -29.545 14.616 -20.462 1.0 30.33 ? 14 A 4 +ATOM 205 C C . THR A1 1 14 ? -29.377 15.067 -19.016 1.0 22.13 ? 14 A 4 +ATOM 206 O O . THR A1 1 14 ? -30.284 14.916 -18.198 1.0 5.31 ? 14 A 4 +ATOM 207 C CB . THR A1 1 14 ? -30.065 13.166 -20.478 1.0 34.54 ? 14 A 4 +ATOM 208 O OG1 . THR A1 1 14 ? -29.242 12.341 -19.646 1.0 3.22 ? 14 A 4 +ATOM 209 C CG2 . THR A1 1 14 ? -30.079 12.613 -21.895 1.0 34.11 ? 14 A 4 +ATOM 210 H H . THR A1 1 14 ? -27.676 13.982 -21.226 1.0 2.31 ? 14 A 4 +ATOM 211 H HA . THR A1 1 14 ? -30.281 15.246 -20.942 1.0 25.44 ? 14 A 4 +ATOM 212 H HB . THR A1 1 14 ? -31.075 13.158 -20.094 1.0 55.24 ? 14 A 4 +ATOM 213 H HG1 . THR A1 1 14 ? -29.792 11.71 -19.177 1.0 24.42 ? 14 A 4 +ATOM 214 H HG21 . THR A1 1 14 ? -29.926 13.418 -22.597 1.0 1.02 ? 14 A 4 +ATOM 215 H HG22 . THR A1 1 14 ? -31.032 12.143 -22.089 1.0 12.23 ? 14 A 4 +ATOM 216 H HG23 . THR A1 1 14 ? -29.29 11.884 -22.005 1.0 12.42 ? 14 A 4 +ATOM 217 N N . GLY A1 1 15 ? -28.21 15.623 -18.705 1.0 61.2 ? 15 A 4 +ATOM 218 C CA . GLY A1 1 15 ? -27.944 16.088 -17.357 1.0 25.44 ? 15 A 4 +ATOM 219 C C . GLY A1 1 15 ? -27.766 14.948 -16.374 1.0 2.34 ? 15 A 4 +ATOM 220 O O . GLY A1 1 15 ? -28.458 14.879 -15.359 1.0 24.03 ? 15 A 4 +ATOM 221 H H . GLY A1 1 15 ? -27.523 15.718 -19.398 1.0 73.22 ? 15 A 4 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.046 16.687 -17.364 1.0 10.15 ? 15 A 4 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.771 16.702 -17.031 1.0 23.53 ? 15 A 4 +ATOM 224 N N . LYS A1 1 16 ? -26.836 14.049 -16.677 1.0 11.21 ? 16 A 4 +ATOM 225 C CA . LYS A1 1 16 ? -26.568 12.904 -15.814 1.0 34.13 ? 16 A 4 +ATOM 226 C C . LYS A1 1 16 ? -25.103 12.874 -15.391 1.0 15.24 ? 16 A 4 +ATOM 227 O O . LYS A1 1 16 ? -24.204 12.801 -16.23 1.0 50.04 ? 16 A 4 +ATOM 228 C CB . LYS A1 1 16 ? -26.929 11.602 -16.532 1.0 31.42 ? 16 A 4 +ATOM 229 C CG . LYS A1 1 16 ? -27.442 10.517 -15.602 1.0 73.35 ? 16 A 4 +ATOM 230 C CD . LYS A1 1 16 ? -26.31 9.643 -15.087 1.0 50.3 ? 16 A 4 +ATOM 231 C CE . LYS A1 1 16 ? -25.706 8.8 -16.199 1.0 52.44 ? 16 A 4 +ATOM 232 N NZ . LYS A1 1 16 ? -26.063 7.361 -16.06 1.0 2.53 ? 16 A 4 +ATOM 233 H H . LYS A1 1 16 ? -26.316 14.158 -17.501 1.0 52.54 ? 16 A 4 +ATOM 234 H HA . LYS A1 1 16 ? -27.183 13.002 -14.933 1.0 34.34 ? 16 A 4 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.695 11.81 -17.265 1.0 44.24 ? 16 A 4 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.051 11.228 -17.038 1.0 12.13 ? 16 A 4 +ATOM 237 H HG2 . LYS A1 1 16 ? -27.936 10.98 -14.76 1.0 3.41 ? 16 A 4 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.146 9.897 -16.139 1.0 74.14 ? 16 A 4 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.539 10.276 -14.671 1.0 63.23 ? 16 A 4 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.693 8.988 -14.318 1.0 14.51 ? 16 A 4 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.072 9.163 -17.147 1.0 44.12 ? 16 A 4 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.631 8.9 -16.166 1.0 75.31 ? 16 A 4 +ATOM 243 H HZ1 . LYS A1 1 16 ? -25.929 7.053 -15.076 1.0 61.55 ? 16 A 4 +ATOM 244 H HZ2 . LYS A1 1 16 ? -25.46 6.782 -16.679 1.0 23.15 ? 16 A 4 +ATOM 245 H HZ3 . LYS A1 1 16 ? -27.057 7.212 -16.326 1.0 43.23 ? 16 A 4 +ATOM 246 N N . THR A1 1 17 ? -24.868 12.929 -14.083 1.0 33.03 ? 17 A 4 +ATOM 247 C CA . THR A1 1 17 ? -23.512 12.907 -13.549 1.0 61.21 ? 17 A 4 +ATOM 248 C C . THR A1 1 17 ? -23.043 11.478 -13.296 1.0 13.11 ? 17 A 4 +ATOM 249 O O . THR A1 1 17 ? -23.636 10.753 -12.497 1.0 32.24 ? 17 A 4 +ATOM 250 C CB . THR A1 1 17 ? -23.413 13.707 -12.236 1.0 22.54 ? 17 A 4 +ATOM 251 O OG1 . THR A1 1 17 ? -24.667 13.674 -11.546 1.0 24.32 ? 17 A 4 +ATOM 252 C CG2 . THR A1 1 17 ? -23.017 15.15 -12.511 1.0 72.42 ? 17 A 4 +ATOM 253 H H . THR A1 1 17 ? -25.626 12.986 -13.465 1.0 63.53 ? 17 A 4 +ATOM 254 H HA . THR A1 1 17 ? -22.859 13.366 -14.276 1.0 15.15 ? 17 A 4 +ATOM 255 H HB . THR A1 1 17 ? -22.655 13.254 -11.612 1.0 61.22 ? 17 A 4 +ATOM 256 H HG1 . THR A1 1 17 ? -24.703 14.394 -10.912 1.0 54.0 ? 17 A 4 +ATOM 257 H HG21 . THR A1 1 17 ? -23.893 15.779 -12.458 1.0 31.34 ? 17 A 4 +ATOM 258 H HG22 . THR A1 1 17 ? -22.582 15.223 -13.496 1.0 12.24 ? 17 A 4 +ATOM 259 H HG23 . THR A1 1 17 ? -22.297 15.472 -11.773 1.0 74.01 ? 17 A 4 +ATOM 260 N N . ILE A1 1 18 ? -21.977 11.081 -13.981 1.0 21.15 ? 18 A 4 +ATOM 261 C CA . ILE A1 1 18 ? -21.428 9.739 -13.829 1.0 42.23 ? 18 A 4 +ATOM 262 C C . ILE A1 1 18 ? -19.948 9.788 -13.466 1.0 2.02 ? 18 A 4 +ATOM 263 O O . ILE A1 1 18 ? -19.206 10.645 -13.948 1.0 34.24 ? 18 A 4 +ATOM 264 C CB . ILE A1 1 18 ? -21.602 8.911 -15.116 1.0 20.13 ? 18 A 4 +ATOM 265 C CG1 . ILE A1 1 18 ? -20.806 7.607 -15.02 1.0 0.43 ? 18 A 4 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.164 9.717 -16.329 1.0 34.34 ? 18 A 4 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.088 6.643 -16.151 1.0 41.12 ? 18 A 4 +ATOM 268 H H . ILE A1 1 18 ? -21.548 11.705 -14.603 1.0 72.35 ? 18 A 4 +ATOM 269 H HA . ILE A1 1 18 ? -21.967 9.247 -13.032 1.0 33.1 ? 18 A 4 +ATOM 270 H HB . ILE A1 1 18 ? -22.65 8.677 -15.228 1.0 55.23 ? 18 A 4 +ATOM 271 H HG12 . ILE A1 1 18 ? -19.752 7.834 -15.034 1.0 35.45 ? 18 A 4 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.052 7.112 -14.092 1.0 15.51 ? 18 A 4 +ATOM 273 H HG21 . ILE A1 1 18 ? -20.259 10.259 -16.093 1.0 31.24 ? 18 A 4 +ATOM 274 H HG22 . ILE A1 1 18 ? -20.976 9.05 -17.156 1.0 60.32 ? 18 A 4 +ATOM 275 H HG23 . ILE A1 1 18 ? -21.942 10.416 -16.597 1.0 71.44 ? 18 A 4 +ATOM 276 H HD11 . ILE A1 1 18 ? -21.599 7.163 -16.949 1.0 32.31 ? 18 A 4 +ATOM 277 H HD12 . ILE A1 1 18 ? -20.157 6.242 -16.524 1.0 60.24 ? 18 A 4 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.71 5.837 -15.792 1.0 25.35 ? 18 A 4 +ATOM 279 N N . THR A1 1 19 ? -19.522 8.862 -12.612 1.0 42.32 ? 19 A 4 +ATOM 280 C CA . THR A1 1 19 ? -18.131 8.799 -12.184 1.0 41.24 ? 19 A 4 +ATOM 281 C C . THR A1 1 19 ? -17.468 7.51 -12.657 1.0 70.21 ? 19 A 4 +ATOM 282 O O . THR A1 1 19 ? -18.069 6.436 -12.602 1.0 44.42 ? 19 A 4 +ATOM 283 C CB . THR A1 1 19 ? -18.009 8.893 -10.651 1.0 2.4 ? 19 A 4 +ATOM 284 O OG1 . THR A1 1 19 ? -19.274 9.249 -10.081 1.0 22.32 ? 19 A 4 +ATOM 285 C CG2 . THR A1 1 19 ? -16.96 9.92 -10.253 1.0 13.14 ? 19 A 4 +ATOM 286 H H . THR A1 1 19 ? -20.161 8.207 -12.262 1.0 1.15 ? 19 A 4 +ATOM 287 H HA . THR A1 1 19 ? -17.61 9.64 -12.618 1.0 65.43 ? 19 A 4 +ATOM 288 H HB . THR A1 1 19 ? -17.71 7.927 -10.269 1.0 44.24 ? 19 A 4 +ATOM 289 H HG1 . THR A1 1 19 ? -19.487 8.64 -9.369 1.0 60.25 ? 19 A 4 +ATOM 290 H HG21 . THR A1 1 19 ? -15.987 9.454 -10.244 1.0 73.33 ? 19 A 4 +ATOM 291 H HG22 . THR A1 1 19 ? -17.186 10.302 -9.269 1.0 23.45 ? 19 A 4 +ATOM 292 H HG23 . THR A1 1 19 ? -16.964 10.732 -10.965 1.0 51.03 ? 19 A 4 +ATOM 293 N N . ILE A1 1 20 ? -16.228 7.623 -13.119 1.0 2.13 ? 20 A 4 +ATOM 294 C CA . ILE A1 1 20 ? -15.484 6.465 -13.6 1.0 23.24 ? 20 A 4 +ATOM 295 C C . ILE A1 1 20 ? -14.011 6.561 -13.218 1.0 21.51 ? 20 A 4 +ATOM 296 O O . ILE A1 1 20 ? -13.374 7.596 -13.415 1.0 3.54 ? 20 A 4 +ATOM 297 C CB . ILE A1 1 20 ? -15.597 6.317 -15.128 1.0 55.55 ? 20 A 4 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.636 7.695 -15.794 1.0 1.5 ? 20 A 4 +ATOM 299 C CG2 . ILE A1 1 20 ? -16.836 5.513 -15.492 1.0 1.32 ? 20 A 4 +ATOM 300 C CD1 . ILE A1 1 20 ? -14.951 7.733 -17.142 1.0 2.4 ? 20 A 4 +ATOM 301 H H . ILE A1 1 20 ? -15.803 8.505 -13.137 1.0 32.52 ? 20 A 4 +ATOM 302 H HA . ILE A1 1 20 ? -15.907 5.583 -13.14 1.0 40.32 ? 20 A 4 +ATOM 303 H HB . ILE A1 1 20 ? -14.731 5.779 -15.481 1.0 75.22 ? 20 A 4 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.663 7.991 -15.936 1.0 4.24 ? 20 A 4 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.145 8.411 -15.151 1.0 20.02 ? 20 A 4 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.002 4.75 -14.746 1.0 41.11 ? 20 A 4 +ATOM 307 H HG22 . ILE A1 1 20 ? -17.693 6.169 -15.531 1.0 51.34 ? 20 A 4 +ATOM 308 H HG23 . ILE A1 1 20 ? -16.694 5.048 -16.456 1.0 74.34 ? 20 A 4 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.089 6.786 -17.643 1.0 44.23 ? 20 A 4 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.38 8.522 -17.742 1.0 43.31 ? 20 A 4 +ATOM 311 H HD13 . ILE A1 1 20 ? -13.896 7.916 -17.006 1.0 23.14 ? 20 A 4 +ATOM 312 N N . ASP A1 1 21 ? -13.475 5.475 -12.672 1.0 44.41 ? 21 A 4 +ATOM 313 C CA . ASP A1 1 21 ? -12.075 5.435 -12.265 1.0 13.43 ? 21 A 4 +ATOM 314 C C . ASP A1 1 21 ? -11.171 5.124 -13.454 1.0 74.52 ? 21 A 4 +ATOM 315 O O . ASP A1 1 21 ? -11.327 4.096 -14.113 1.0 3.25 ? 21 A 4 +ATOM 316 C CB . ASP A1 1 21 ? -11.871 4.391 -11.166 1.0 40.32 ? 21 A 4 +ATOM 317 C CG . ASP A1 1 21 ? -12.204 2.987 -11.633 1.0 70.32 ? 21 A 4 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.365 2.754 -12.031 1.0 34.41 ? 21 A 4 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.305 2.122 -11.601 1.0 4.34 ? 21 A 4 +ATOM 320 H H . ASP A1 1 21 ? -14.034 4.681 -12.541 1.0 61.24 ? 21 A 4 +ATOM 321 H HA . ASP A1 1 21 ? -11.815 6.408 -11.876 1.0 0.1 ? 21 A 4 +ATOM 322 H HB2 . ASP A1 1 21 ? -10.838 4.408 -10.849 1.0 73.15 ? 21 A 4 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.505 4.632 -10.327 1.0 61.23 ? 21 A 4 +ATOM 324 N N . VAL A1 1 22 ? -10.227 6.02 -13.724 1.0 30.34 ? 22 A 4 +ATOM 325 C CA . VAL A1 1 22 ? -9.298 5.842 -14.833 1.0 1.34 ? 22 A 4 +ATOM 326 C C . VAL A1 1 22 ? -7.868 6.154 -14.409 1.0 61.2 ? 22 A 4 +ATOM 327 O O . VAL A1 1 22 ? -7.64 6.78 -13.373 1.0 34.03 ? 22 A 4 +ATOM 328 C CB . VAL A1 1 22 ? -9.675 6.737 -16.029 1.0 60.13 ? 22 A 4 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.14 7.137 -15.957 1.0 14.0 ? 22 A 4 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.779 7.966 -16.077 1.0 61.12 ? 22 A 4 +ATOM 331 H H . VAL A1 1 22 ? -10.153 6.82 -13.162 1.0 71.0 ? 22 A 4 +ATOM 332 H HA . VAL A1 1 22 ? -9.352 4.811 -15.151 1.0 41.13 ? 22 A 4 +ATOM 333 H HB . VAL A1 1 22 ? -9.523 6.172 -16.937 1.0 23.42 ? 22 A 4 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.742 6.263 -15.758 1.0 3.13 ? 22 A 4 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.278 7.859 -15.164 1.0 11.12 ? 22 A 4 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.441 7.574 -16.898 1.0 2.3 ? 22 A 4 +ATOM 337 H HG21 . VAL A1 1 22 ? -7.786 7.676 -16.387 1.0 43.3 ? 22 A 4 +ATOM 338 H HG22 . VAL A1 1 22 ? -9.184 8.678 -16.781 1.0 71.52 ? 22 A 4 +ATOM 339 H HG23 . VAL A1 1 22 ? -8.733 8.416 -15.096 1.0 24.41 ? 22 A 4 +ATOM 340 N N . ASP A1 1 23 ? -6.908 5.715 -15.216 1.0 73.14 ? 23 A 4 +ATOM 341 C CA . ASP A1 1 23 ? -5.498 5.95 -14.925 1.0 0.33 ? 23 A 4 +ATOM 342 C C . ASP A1 1 23 ? -4.864 6.838 -15.99 1.0 62.12 ? 23 A 4 +ATOM 343 O O . ASP A1 1 23 ? -5.309 6.863 -17.138 1.0 35.34 ? 23 A 4 +ATOM 344 C CB . ASP A1 1 23 ? -4.746 4.621 -14.837 1.0 24.44 ? 23 A 4 +ATOM 345 C CG . ASP A1 1 23 ? -5.61 3.502 -14.287 1.0 11.25 ? 23 A 4 +ATOM 346 O OD1 . ASP A1 1 23 ? -6.152 3.664 -13.174 1.0 71.52 ? 23 A 4 +ATOM 347 O OD2 . ASP A1 1 23 ? -5.742 2.465 -14.97 1.0 54.12 ? 23 A 4 +ATOM 348 H H . ASP A1 1 23 ? -7.154 5.223 -16.027 1.0 71.31 ? 23 A 4 +ATOM 349 H HA . ASP A1 1 23 ? -5.436 6.452 -13.971 1.0 62.03 ? 23 A 4 +ATOM 350 H HB2 . ASP A1 1 23 ? -4.41 4.339 -15.824 1.0 75.32 ? 23 A 4 +ATOM 351 H HB3 . ASP A1 1 23 ? -3.89 4.742 -14.19 1.0 32.1 ? 23 A 4 +ATOM 352 N N . HIS A1 1 24 ? -3.822 7.567 -15.603 1.0 3.42 ? 24 A 4 +ATOM 353 C CA . HIS A1 1 24 ? -3.127 8.457 -16.525 1.0 64.1 ? 24 A 4 +ATOM 354 C C . HIS A1 1 24 ? -2.55 7.677 -17.702 1.0 13.22 ? 24 A 4 +ATOM 355 O O . HIS A1 1 24 ? -2.192 8.257 -18.727 1.0 40.32 ? 24 A 4 +ATOM 356 C CB . HIS A1 1 24 ? -2.009 9.207 -15.798 1.0 43.52 ? 24 A 4 +ATOM 357 C CG . HIS A1 1 24 ? -1.103 8.313 -15.009 1.0 63.23 ? 24 A 4 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.088 7.575 -15.581 1.0 33.23 ? 24 A 4 +ATOM 359 C CD2 . HIS A1 1 24 ? -1.063 8.041 -13.684 1.0 70.35 ? 24 A 4 +ATOM 360 C CE1 . HIS A1 1 24 ? 0.536 6.887 -14.642 1.0 52.22 ? 24 A 4 +ATOM 361 N NE2 . HIS A1 1 24 ? -0.035 7.152 -13.482 1.0 51.1 ? 24 A 4 +ATOM 362 H H . HIS A1 1 24 ? -3.514 7.504 -14.675 1.0 35.01 ? 24 A 4 +ATOM 363 H HA . HIS A1 1 24 ? -3.843 9.172 -16.899 1.0 52.33 ? 24 A 4 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.406 9.732 -16.524 1.0 74.33 ? 24 A 4 +ATOM 365 H HB3 . HIS A1 1 24 ? -2.448 9.921 -15.117 1.0 2.24 ? 24 A 4 +ATOM 366 H HD1 . HIS A1 1 24 ? 0.139 7.558 -16.534 1.0 61.24 ? 24 A 4 +ATOM 367 H HD2 . HIS A1 1 24 ? -1.717 8.447 -12.925 1.0 14.35 ? 24 A 4 +ATOM 368 H HE1 . HIS A1 1 24 ? 1.372 6.221 -14.797 1.0 73.24 ? 24 A 4 +ATOM 369 N N . ALA A1 1 25 ? -2.462 6.36 -17.547 1.0 63.43 ? 25 A 4 +ATOM 370 C CA . ALA A1 1 25 ? -1.931 5.501 -18.598 1.0 43.32 ? 25 A 4 +ATOM 371 C C . ALA A1 1 25 ? -3.023 5.098 -19.583 1.0 33.54 ? 25 A 4 +ATOM 372 O O . ALA A1 1 25 ? -2.8 4.269 -20.466 1.0 12.23 ? 25 A 4 +ATOM 373 C CB . ALA A1 1 25 ? -1.282 4.266 -17.992 1.0 51.34 ? 25 A 4 +ATOM 374 H H . ALA A1 1 25 ? -2.764 5.957 -16.707 1.0 55.41 ? 25 A 4 +ATOM 375 H HA . ALA A1 1 25 ? -1.168 6.055 -19.128 1.0 23.12 ? 25 A 4 +ATOM 376 H HB1 . ALA A1 1 25 ? -1.008 3.58 -18.78 1.0 42.21 ? 25 A 4 +ATOM 377 H HB2 . ALA A1 1 25 ? -0.398 4.556 -17.443 1.0 3.14 ? 25 A 4 +ATOM 378 H HB3 . ALA A1 1 25 ? -1.98 3.785 -17.323 1.0 44.44 ? 25 A 4 +ATOM 379 N N . ASP A1 1 26 ? -4.202 5.689 -19.425 1.0 53.31 ? 26 A 4 +ATOM 380 C CA . ASP A1 1 26 ? -5.329 5.391 -20.301 1.0 71.32 ? 26 A 4 +ATOM 381 C C . ASP A1 1 26 ? -5.487 6.47 -21.369 1.0 31.24 ? 26 A 4 +ATOM 382 O O . ASP A1 1 26 ? -4.614 7.321 -21.541 1.0 53.43 ? 26 A 4 +ATOM 383 C CB . ASP A1 1 26 ? -6.618 5.27 -19.487 1.0 21.1 ? 26 A 4 +ATOM 384 C CG . ASP A1 1 26 ? -6.574 4.118 -18.501 1.0 73.54 ? 26 A 4 +ATOM 385 O OD1 . ASP A1 1 26 ? -5.57 4.004 -17.766 1.0 73.22 ? 26 A 4 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.543 3.332 -18.465 1.0 2.02 ? 26 A 4 +ATOM 387 H H . ASP A1 1 26 ? -4.317 6.341 -18.703 1.0 73.33 ? 26 A 4 +ATOM 388 H HA . ASP A1 1 26 ? -5.132 4.448 -20.788 1.0 35.3 ? 26 A 4 +ATOM 389 H HB2 . ASP A1 1 26 ? -6.775 6.185 -18.935 1.0 71.15 ? 26 A 4 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.448 5.113 -20.159 1.0 51.4 ? 26 A 4 +ATOM 391 N N . THR A1 1 27 ? -6.607 6.427 -22.084 1.0 11.22 ? 27 A 4 +ATOM 392 C CA . THR A1 1 27 ? -6.879 7.399 -23.136 1.0 12.11 ? 27 A 4 +ATOM 393 C C . THR A1 1 27 ? -8.37 7.698 -23.236 1.0 24.55 ? 27 A 4 +ATOM 394 O O . THR A1 1 27 ? -9.2 6.948 -22.723 1.0 14.34 ? 27 A 4 +ATOM 395 C CB . THR A1 1 27 ? -6.374 6.902 -24.504 1.0 24.42 ? 27 A 4 +ATOM 396 O OG1 . THR A1 1 27 ? -6.34 5.47 -24.523 1.0 51.41 ? 27 A 4 +ATOM 397 C CG2 . THR A1 1 27 ? -4.987 7.451 -24.801 1.0 72.22 ? 27 A 4 +ATOM 398 H H . THR A1 1 27 ? -7.265 5.725 -21.899 1.0 1.33 ? 27 A 4 +ATOM 399 H HA . THR A1 1 27 ? -6.354 8.311 -22.892 1.0 54.42 ? 27 A 4 +ATOM 400 H HB . THR A1 1 27 ? -7.054 7.248 -25.269 1.0 51.23 ? 27 A 4 +ATOM 401 H HG1 . THR A1 1 27 ? -5.595 5.161 -24.002 1.0 23.44 ? 27 A 4 +ATOM 402 H HG21 . THR A1 1 27 ? -4.641 7.061 -25.746 1.0 20.21 ? 27 A 4 +ATOM 403 H HG22 . THR A1 1 27 ? -4.306 7.154 -24.017 1.0 40.31 ? 27 A 4 +ATOM 404 H HG23 . THR A1 1 27 ? -5.03 8.529 -24.851 1.0 53.14 ? 27 A 4 +ATOM 405 N N . VAL A1 1 28 ? -8.705 8.8 -23.9 1.0 70.04 ? 28 A 4 +ATOM 406 C CA . VAL A1 1 28 ? -10.098 9.198 -24.069 1.0 40.12 ? 28 A 4 +ATOM 407 C C . VAL A1 1 28 ? -10.922 8.069 -24.678 1.0 43.3 ? 28 A 4 +ATOM 408 O O . VAL A1 1 28 ? -11.996 7.733 -24.182 1.0 51.44 ? 28 A 4 +ATOM 409 C CB . VAL A1 1 28 ? -10.22 10.448 -24.961 1.0 70.14 ? 28 A 4 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.641 10.99 -24.927 1.0 13.41 ? 28 A 4 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.223 11.512 -24.526 1.0 73.55 ? 28 A 4 +ATOM 412 H H . VAL A1 1 28 ? -7.998 9.358 -24.287 1.0 50.23 ? 28 A 4 +ATOM 413 H HA . VAL A1 1 28 ? -10.497 9.437 -23.094 1.0 62.42 ? 28 A 4 +ATOM 414 H HB . VAL A1 1 28 ? -9.991 10.163 -25.977 1.0 52.41 ? 28 A 4 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.796 11.533 -24.006 1.0 72.32 ? 28 A 4 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.793 11.652 -25.767 1.0 75.12 ? 28 A 4 +ATOM 417 H HG13 . VAL A1 1 28 ? -12.341 10.17 -24.983 1.0 43.12 ? 28 A 4 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.618 11.804 -25.371 1.0 22.23 ? 28 A 4 +ATOM 419 H HG22 . VAL A1 1 28 ? -9.757 12.371 -24.15 1.0 21.24 ? 28 A 4 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.588 11.114 -23.748 1.0 51.43 ? 28 A 4 +ATOM 421 N N . GLY A1 1 29 ? -10.41 7.486 -25.758 1.0 51.02 ? 29 A 4 +ATOM 422 C CA . GLY A1 1 29 ? -11.111 6.401 -26.418 1.0 24.21 ? 29 A 4 +ATOM 423 C C . GLY A1 1 29 ? -11.527 5.308 -25.453 1.0 62.32 ? 29 A 4 +ATOM 424 O O . GLY A1 1 29 ? -12.684 4.887 -25.443 1.0 1.41 ? 29 A 4 +ATOM 425 H H . GLY A1 1 29 ? -9.549 7.796 -26.11 1.0 25.44 ? 29 A 4 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.993 6.797 -26.9 1.0 33.14 ? 29 A 4 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.464 5.974 -27.17 1.0 61.11 ? 29 A 4 +ATOM 428 N N . ALA A1 1 30 ? -10.582 4.847 -24.641 1.0 0.3 ? 30 A 4 +ATOM 429 C CA . ALA A1 1 30 ? -10.857 3.797 -23.668 1.0 24.42 ? 30 A 4 +ATOM 430 C C . ALA A1 1 30 ? -11.939 4.229 -22.684 1.0 23.15 ? 30 A 4 +ATOM 431 O O . ALA A1 1 30 ? -12.821 3.446 -22.332 1.0 23.32 ? 30 A 4 +ATOM 432 C CB . ALA A1 1 30 ? -9.584 3.421 -22.924 1.0 4.23 ? 30 A 4 +ATOM 433 H H . ALA A1 1 30 ? -9.679 5.223 -24.696 1.0 13.0 ? 30 A 4 +ATOM 434 H HA . ALA A1 1 30 ? -11.201 2.925 -24.206 1.0 42.35 ? 30 A 4 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.352 2.382 -23.111 1.0 24.3 ? 30 A 4 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.77 4.04 -23.269 1.0 15.25 ? 30 A 4 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.729 3.572 -21.865 1.0 54.13 ? 30 A 4 +ATOM 438 N N . VAL A1 1 31 ? -11.865 5.481 -22.243 1.0 44.02 ? 31 A 4 +ATOM 439 C CA . VAL A1 1 31 ? -12.838 6.018 -21.3 1.0 44.43 ? 31 A 4 +ATOM 440 C C . VAL A1 1 31 ? -14.244 6.0 -21.89 1.0 22.33 ? 31 A 4 +ATOM 441 O O . VAL A1 1 31 ? -15.209 5.644 -21.215 1.0 41.34 ? 31 A 4 +ATOM 442 C CB . VAL A1 1 31 ? -12.485 7.459 -20.887 1.0 42.01 ? 31 A 4 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.566 8.038 -19.988 1.0 61.22 ? 31 A 4 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.129 7.498 -20.198 1.0 34.2 ? 31 A 4 +ATOM 445 H H . VAL A1 1 31 ? -11.139 6.057 -22.56 1.0 33.11 ? 31 A 4 +ATOM 446 H HA . VAL A1 1 31 ? -12.823 5.399 -20.415 1.0 53.53 ? 31 A 4 +ATOM 447 H HB . VAL A1 1 31 ? -12.429 8.064 -21.78 1.0 34.14 ? 31 A 4 +ATOM 448 H HG11 . VAL A1 1 31 ? -13.106 8.605 -19.192 1.0 24.43 ? 31 A 4 +ATOM 449 H HG12 . VAL A1 1 31 ? -14.209 8.684 -20.567 1.0 62.24 ? 31 A 4 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.15 7.234 -19.564 1.0 4.44 ? 31 A 4 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.881 6.513 -19.834 1.0 32.4 ? 31 A 4 +ATOM 452 H HG22 . VAL A1 1 31 ? -10.377 7.822 -20.903 1.0 31.51 ? 31 A 4 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.166 8.19 -19.369 1.0 2.41 ? 31 A 4 +ATOM 454 N N . LYS A1 1 32 ? -14.352 6.387 -23.157 1.0 44.33 ? 32 A 4 +ATOM 455 C CA . LYS A1 1 32 ? -15.639 6.415 -23.842 1.0 33.41 ? 32 A 4 +ATOM 456 C C . LYS A1 1 32 ? -16.316 5.049 -23.783 1.0 33.52 ? 32 A 4 +ATOM 457 O O . LYS A1 1 32 ? -17.521 4.953 -23.553 1.0 55.22 ? 32 A 4 +ATOM 458 C CB . LYS A1 1 32 ? -15.455 6.842 -25.3 1.0 21.43 ? 32 A 4 +ATOM 459 C CG . LYS A1 1 32 ? -16.161 8.141 -25.647 1.0 62.04 ? 32 A 4 +ATOM 460 C CD . LYS A1 1 32 ? -15.201 9.319 -25.634 1.0 13.3 ? 32 A 4 +ATOM 461 C CE . LYS A1 1 32 ? -14.724 9.664 -27.036 1.0 61.02 ? 32 A 4 +ATOM 462 N NZ . LYS A1 1 32 ? -14.215 8.467 -27.759 1.0 10.13 ? 32 A 4 +ATOM 463 H H . LYS A1 1 32 ? -13.545 6.66 -23.644 1.0 0.43 ? 32 A 4 +ATOM 464 H HA . LYS A1 1 32 ? -16.266 7.136 -23.341 1.0 20.21 ? 32 A 4 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.4 6.967 -25.495 1.0 31.13 ? 32 A 4 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.842 6.064 -25.942 1.0 51.43 ? 32 A 4 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.593 8.053 -26.633 1.0 34.55 ? 32 A 4 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.945 8.318 -24.924 1.0 75.31 ? 32 A 4 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.704 10.178 -25.215 1.0 62.53 ? 32 A 4 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.345 9.067 -25.023 1.0 34.24 ? 32 A 4 +ATOM 471 H HE2 . LYS A1 1 32 ? -15.549 10.085 -27.59 1.0 32.35 ? 32 A 4 +ATOM 472 H HE3 . LYS A1 1 32 ? -13.931 10.394 -26.962 1.0 31.14 ? 32 A 4 +ATOM 473 H HZ1 . LYS A1 1 32 ? -13.661 7.868 -27.114 1.0 3.34 ? 32 A 4 +ATOM 474 H HZ2 . LYS A1 1 32 ? -13.606 8.76 -28.551 1.0 11.13 ? 32 A 4 +ATOM 475 H HZ3 . LYS A1 1 32 ? -15.009 7.912 -28.135 1.0 13.55 ? 32 A 4 +ATOM 476 N N . ALA A1 1 33 ? -15.533 3.996 -23.99 1.0 34.21 ? 33 A 4 +ATOM 477 C CA . ALA A1 1 33 ? -16.056 2.636 -23.956 1.0 60.31 ? 33 A 4 +ATOM 478 C C . ALA A1 1 33 ? -16.579 2.283 -22.568 1.0 31.03 ? 33 A 4 +ATOM 479 O O . ALA A1 1 33 ? -17.616 1.634 -22.43 1.0 31.32 ? 33 A 4 +ATOM 480 C CB . ALA A1 1 33 ? -14.984 1.647 -24.386 1.0 54.24 ? 33 A 4 +ATOM 481 H H . ALA A1 1 33 ? -14.58 4.137 -24.168 1.0 43.1 ? 33 A 4 +ATOM 482 H HA . ALA A1 1 33 ? -16.872 2.575 -24.663 1.0 53.01 ? 33 A 4 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.07 1.85 -23.847 1.0 2.33 ? 33 A 4 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.314 0.642 -24.17 1.0 61.23 ? 33 A 4 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.806 1.747 -25.447 1.0 53.23 ? 33 A 4 +ATOM 486 N N . LYS A1 1 34 ? -15.854 2.714 -21.541 1.0 30.14 ? 34 A 4 +ATOM 487 C CA . LYS A1 1 34 ? -16.243 2.444 -20.162 1.0 3.41 ? 34 A 4 +ATOM 488 C C . LYS A1 1 34 ? -17.611 3.046 -19.856 1.0 51.04 ? 34 A 4 +ATOM 489 O O . LYS A1 1 34 ? -18.462 2.398 -19.245 1.0 30.3 ? 34 A 4 +ATOM 490 C CB . LYS A1 1 34 ? -15.199 3.007 -19.196 1.0 63.02 ? 34 A 4 +ATOM 491 C CG . LYS A1 1 34 ? -15.478 2.679 -17.739 1.0 24.43 ? 34 A 4 +ATOM 492 C CD . LYS A1 1 34 ? -15.405 1.183 -17.481 1.0 44.42 ? 34 A 4 +ATOM 493 C CE . LYS A1 1 34 ? -14.015 0.635 -17.763 1.0 34.12 ? 34 A 4 +ATOM 494 N NZ . LYS A1 1 34 ? -13.881 -0.785 -17.337 1.0 13.0 ? 34 A 4 +ATOM 495 H H . LYS A1 1 34 ? -15.037 3.227 -21.715 1.0 65.25 ? 34 A 4 +ATOM 496 H HA . LYS A1 1 34 ? -16.298 1.374 -20.036 1.0 3.22 ? 34 A 4 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.231 2.603 -19.455 1.0 71.03 ? 34 A 4 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.17 4.082 -19.302 1.0 71.12 ? 34 A 4 +ATOM 499 H HG2 . LYS A1 1 34 ? -14.746 3.176 -17.121 1.0 24.23 ? 34 A 4 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.467 3.032 -17.484 1.0 22.21 ? 34 A 4 +ATOM 501 H HD2 . LYS A1 1 34 ? -15.652 0.992 -16.447 1.0 63.43 ? 34 A 4 +ATOM 502 H HD3 . LYS A1 1 34 ? -16.117 0.681 -18.121 1.0 75.33 ? 34 A 4 +ATOM 503 H HE2 . LYS A1 1 34 ? -13.823 0.704 -18.822 1.0 34.14 ? 34 A 4 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.292 1.233 -17.227 1.0 0.12 ? 34 A 4 +ATOM 505 H HZ1 . LYS A1 1 34 ? -14.136 -0.884 -16.334 1.0 62.42 ? 34 A 4 +ATOM 506 H HZ2 . LYS A1 1 34 ? -12.9 -1.106 -17.468 1.0 14.2 ? 34 A 4 +ATOM 507 H HZ3 . LYS A1 1 34 ? -14.51 -1.389 -17.905 1.0 65.2 ? 34 A 4 +ATOM 508 N N . ILE A1 1 35 ? -17.816 4.287 -20.284 1.0 14.42 ? 35 A 4 +ATOM 509 C CA . ILE A1 1 35 ? -19.081 4.974 -20.057 1.0 22.32 ? 35 A 4 +ATOM 510 C C . ILE A1 1 35 ? -20.213 4.314 -20.838 1.0 74.31 ? 35 A 4 +ATOM 511 O O . ILE A1 1 35 ? -21.347 4.238 -20.364 1.0 33.23 ? 35 A 4 +ATOM 512 C CB . ILE A1 1 35 ? -18.995 6.459 -20.456 1.0 42.5 ? 35 A 4 +ATOM 513 C CG1 . ILE A1 1 35 ? -17.817 7.132 -19.749 1.0 22.04 ? 35 A 4 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.297 7.173 -20.125 1.0 45.14 ? 35 A 4 +ATOM 515 C CD1 . ILE A1 1 35 ? -17.859 6.996 -18.243 1.0 11.1 ? 35 A 4 +ATOM 516 H H . ILE A1 1 35 ? -17.099 4.751 -20.765 1.0 54.44 ? 35 A 4 +ATOM 517 H HA . ILE A1 1 35 ? -19.306 4.918 -19.002 1.0 30.01 ? 35 A 4 +ATOM 518 H HB . ILE A1 1 35 ? -18.844 6.514 -21.523 1.0 2.44 ? 35 A 4 +ATOM 519 H HG12 . ILE A1 1 35 ? -16.897 6.69 -20.095 1.0 3.24 ? 35 A 4 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.819 8.186 -19.988 1.0 0.11 ? 35 A 4 +ATOM 521 H HG21 . ILE A1 1 35 ? -21.127 6.616 -20.535 1.0 65.32 ? 35 A 4 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.406 7.243 -19.053 1.0 43.1 ? 35 A 4 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.283 8.164 -20.552 1.0 75.41 ? 35 A 4 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.033 6.382 -17.914 1.0 43.52 ? 35 A 4 +ATOM 525 H HD12 . ILE A1 1 35 ? -17.783 7.974 -17.79 1.0 71.15 ? 35 A 4 +ATOM 526 H HD13 . ILE A1 1 35 ? -18.789 6.534 -17.948 1.0 74.3 ? 35 A 4 +ATOM 527 N N . TYR A1 1 36 ? -19.897 3.836 -22.036 1.0 62.53 ? 36 A 4 +ATOM 528 C CA . TYR A1 1 36 ? -20.887 3.182 -22.884 1.0 64.44 ? 36 A 4 +ATOM 529 C C . TYR A1 1 36 ? -21.531 2.004 -22.16 1.0 53.42 ? 36 A 4 +ATOM 530 O O . TYR A1 1 36 ? -22.75 1.836 -22.187 1.0 34.33 ? 36 A 4 +ATOM 531 C CB . TYR A1 1 36 ? -20.239 2.704 -24.185 1.0 74.42 ? 36 A 4 +ATOM 532 C CG . TYR A1 1 36 ? -20.606 1.285 -24.557 1.0 43.51 ? 36 A 4 +ATOM 533 C CD1 . TYR A1 1 36 ? -21.879 0.974 -25.019 1.0 62.31 ? 36 A 4 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.68 0.255 -24.447 1.0 22.21 ? 36 A 4 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.219 -0.321 -25.36 1.0 25.24 ? 36 A 4 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.01 -1.042 -24.787 1.0 24.41 ? 36 A 4 +ATOM 537 C CZ . TYR A1 1 36 ? -21.281 -1.325 -25.243 1.0 51.0 ? 36 A 4 +ATOM 538 O OH . TYR A1 1 36 ? -21.614 -2.617 -25.581 1.0 31.41 ? 36 A 4 +ATOM 539 H H . TYR A1 1 36 ? -18.976 3.926 -22.36 1.0 42.53 ? 36 A 4 +ATOM 540 H HA . TYR A1 1 36 ? -21.652 3.907 -23.12 1.0 45.34 ? 36 A 4 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.55 3.349 -24.992 1.0 32.41 ? 36 A 4 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.165 2.754 -24.083 1.0 73.31 ? 36 A 4 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.612 1.763 -25.11 1.0 14.41 ? 36 A 4 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.685 0.481 -24.089 1.0 73.43 ? 36 A 4 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.213 -0.543 -25.717 1.0 30.0 ? 36 A 4 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.276 -1.829 -24.694 1.0 11.1 ? 36 A 4 +ATOM 547 H HH . TYR A1 1 36 ? -20.841 -3.066 -25.93 1.0 20.21 ? 36 A 4 +ATOM 548 N N . ASP A1 1 37 ? -20.703 1.192 -21.513 1.0 31.31 ? 37 A 4 +ATOM 549 C CA . ASP A1 1 37 ? -21.19 0.029 -20.779 1.0 4.3 ? 37 A 4 +ATOM 550 C C . ASP A1 1 37 ? -21.845 0.45 -19.467 1.0 30.32 ? 37 A 4 +ATOM 551 O O . ASP A1 1 37 ? -22.77 -0.203 -18.984 1.0 62.0 ? 37 A 4 +ATOM 552 C CB . ASP A1 1 37 ? -20.043 -0.943 -20.502 1.0 35.43 ? 37 A 4 +ATOM 553 C CG . ASP A1 1 37 ? -20.524 -2.369 -20.32 1.0 34.32 ? 37 A 4 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.733 -2.561 -20.071 1.0 31.12 ? 37 A 4 +ATOM 555 O OD2 . ASP A1 1 37 ? -19.691 -3.294 -20.427 1.0 3.2 ? 37 A 4 +ATOM 556 H H . ASP A1 1 37 ? -19.741 1.379 -21.528 1.0 51.42 ? 37 A 4 +ATOM 557 H HA . ASP A1 1 37 ? -21.928 -0.465 -21.393 1.0 32.24 ? 37 A 4 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.351 -0.92 -21.331 1.0 43.14 ? 37 A 4 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.53 -0.637 -19.602 1.0 34.23 ? 37 A 4 +ATOM 560 N N . LYS A1 1 38 ? -21.358 1.546 -18.893 1.0 33.03 ? 38 A 4 +ATOM 561 C CA . LYS A1 1 38 ? -21.895 2.055 -17.637 1.0 33.5 ? 38 A 4 +ATOM 562 C C . LYS A1 1 38 ? -23.404 2.258 -17.733 1.0 62.1 ? 38 A 4 +ATOM 563 O O . LYS A1 1 38 ? -24.15 1.863 -16.837 1.0 13.24 ? 38 A 4 +ATOM 564 C CB . LYS A1 1 38 ? -21.215 3.375 -17.266 1.0 32.13 ? 38 A 4 +ATOM 565 C CG . LYS A1 1 38 ? -20.384 3.295 -15.997 1.0 11.13 ? 38 A 4 +ATOM 566 C CD . LYS A1 1 38 ? -18.926 2.995 -16.304 1.0 55.11 ? 38 A 4 +ATOM 567 C CE . LYS A1 1 38 ? -18.678 1.499 -16.426 1.0 12.13 ? 38 A 4 +ATOM 568 N NZ . LYS A1 1 38 ? -18.087 0.932 -15.182 1.0 62.42 ? 38 A 4 +ATOM 569 H H . LYS A1 1 38 ? -20.62 2.024 -19.327 1.0 40.1 ? 38 A 4 +ATOM 570 H HA . LYS A1 1 38 ? -21.69 1.325 -16.869 1.0 13.43 ? 38 A 4 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.568 3.673 -18.078 1.0 53.44 ? 38 A 4 +ATOM 572 H HB3 . LYS A1 1 38 ? -21.975 4.13 -17.126 1.0 74.35 ? 38 A 4 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.444 4.24 -15.478 1.0 72.35 ? 38 A 4 +ATOM 574 H HG3 . LYS A1 1 38 ? -20.778 2.51 -15.368 1.0 65.33 ? 38 A 4 +ATOM 575 H HD2 . LYS A1 1 38 ? -18.658 3.47 -17.236 1.0 31.44 ? 38 A 4 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.311 3.39 -15.508 1.0 51.13 ? 38 A 4 +ATOM 577 H HE2 . LYS A1 1 38 ? -19.617 1.007 -16.625 1.0 72.24 ? 38 A 4 +ATOM 578 H HE3 . LYS A1 1 38 ? -18.0 1.326 -17.248 1.0 52.14 ? 38 A 4 +ATOM 579 H HZ1 . LYS A1 1 38 ? -17.541 0.075 -15.404 1.0 12.21 ? 38 A 4 +ATOM 580 H HZ2 . LYS A1 1 38 ? -18.841 0.686 -14.509 1.0 31.3 ? 38 A 4 +ATOM 581 H HZ3 . LYS A1 1 38 ? -17.455 1.628 -14.737 1.0 72.13 ? 38 A 4 +ATOM 582 N N . GLU A1 1 39 ? -23.846 2.874 -18.825 1.0 74.33 ? 39 A 4 +ATOM 583 C CA . GLU A1 1 39 ? -25.266 3.128 -19.036 1.0 31.43 ? 39 A 4 +ATOM 584 C C . GLU A1 1 39 ? -25.788 2.335 -20.231 1.0 55.55 ? 39 A 4 +ATOM 585 O O . GLU A1 1 39 ? -26.766 1.597 -20.121 1.0 44.25 ? 39 A 4 +ATOM 586 C CB . GLU A1 1 39 ? -25.513 4.622 -19.253 1.0 31.12 ? 39 A 4 +ATOM 587 C CG . GLU A1 1 39 ? -24.469 5.29 -20.132 1.0 22.34 ? 39 A 4 +ATOM 588 C CD . GLU A1 1 39 ? -24.592 6.801 -20.138 1.0 34.02 ? 39 A 4 +ATOM 589 O OE1 . GLU A1 1 39 ? -25.691 7.308 -19.825 1.0 60.52 ? 39 A 4 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.592 7.478 -20.455 1.0 24.54 ? 39 A 4 +ATOM 591 H H . GLU A1 1 39 ? -23.202 3.165 -19.503 1.0 53.12 ? 39 A 4 +ATOM 592 H HA . GLU A1 1 39 ? -25.795 2.81 -18.15 1.0 24.23 ? 39 A 4 +ATOM 593 H HB2 . GLU A1 1 39 ? -26.48 4.751 -19.717 1.0 13.32 ? 39 A 4 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.516 5.117 -18.293 1.0 53.15 ? 39 A 4 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.488 5.026 -19.767 1.0 73.51 ? 39 A 4 +ATOM 596 H HG3 . GLU A1 1 39 ? -24.584 4.93 -21.143 1.0 55.55 ? 39 A 4 +ATOM 597 N N . GLY A1 1 40 ? -25.128 2.496 -21.374 1.0 41.31 ? 40 A 4 +ATOM 598 C CA . GLY A1 1 40 ? -25.54 1.791 -22.574 1.0 23.2 ? 40 A 4 +ATOM 599 C C . GLY A1 1 40 ? -25.79 2.727 -23.74 1.0 54.31 ? 40 A 4 +ATOM 600 O O . GLY A1 1 40 ? -26.825 2.641 -24.402 1.0 62.35 ? 40 A 4 +ATOM 601 H H . GLY A1 1 40 ? -24.356 3.098 -21.403 1.0 1.31 ? 40 A 4 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.768 1.088 -22.849 1.0 42.33 ? 40 A 4 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.449 1.246 -22.363 1.0 42.25 ? 40 A 4 +ATOM 604 N N . ILE A1 1 41 ? -24.842 3.623 -23.99 1.0 11.45 ? 41 A 4 +ATOM 605 C CA . ILE A1 1 41 ? -24.966 4.58 -25.083 1.0 13.21 ? 41 A 4 +ATOM 606 C C . ILE A1 1 41 ? -23.827 4.419 -26.085 1.0 73.14 ? 41 A 4 +ATOM 607 O O . ILE A1 1 41 ? -22.744 3.932 -25.759 1.0 54.03 ? 41 A 4 +ATOM 608 C CB . ILE A1 1 41 ? -24.978 6.03 -24.565 1.0 13.54 ? 41 A 4 +ATOM 609 C CG1 . ILE A1 1 41 ? -23.849 6.242 -23.553 1.0 35.25 ? 41 A 4 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.325 6.357 -23.939 1.0 15.54 ? 41 A 4 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.048 7.501 -23.798 1.0 51.21 ? 41 A 4 +ATOM 612 H H . ILE A1 1 41 ? -24.041 3.642 -23.427 1.0 10.31 ? 41 A 4 +ATOM 613 H HA . ILE A1 1 41 ? -25.903 4.391 -25.587 1.0 22.4 ? 41 A 4 +ATOM 614 H HB . ILE A1 1 41 ? -24.827 6.69 -25.405 1.0 2.22 ? 41 A 4 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.269 6.304 -22.562 1.0 53.25 ? 41 A 4 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.171 5.402 -23.6 1.0 73.21 ? 41 A 4 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.313 7.372 -23.569 1.0 41.34 ? 41 A 4 +ATOM 618 H HG22 . ILE A1 1 41 ? -27.101 6.256 -24.683 1.0 35.01 ? 41 A 4 +ATOM 619 H HG23 . ILE A1 1 41 ? -26.518 5.678 -23.123 1.0 24.24 ? 41 A 4 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.372 8.272 -23.114 1.0 13.35 ? 41 A 4 +ATOM 621 H HD12 . ILE A1 1 41 ? -21.999 7.298 -23.638 1.0 5.02 ? 41 A 4 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.2 7.834 -24.813 1.0 73.01 ? 41 A 4 +ATOM 623 N N . PRO A1 1 42 ? -24.074 4.84 -27.334 1.0 42.01 ? 42 A 4 +ATOM 624 C CA . PRO A1 1 42 ? -23.081 4.756 -28.409 1.0 63.34 ? 42 A 4 +ATOM 625 C C . PRO A1 1 42 ? -21.923 5.727 -28.206 1.0 4.23 ? 42 A 4 +ATOM 626 O O . PRO A1 1 42 ? -22.096 6.946 -28.209 1.0 21.54 ? 42 A 4 +ATOM 627 C CB . PRO A1 1 42 ? -23.88 5.13 -29.66 1.0 63.45 ? 42 A 4 +ATOM 628 C CG . PRO A1 1 42 ? -25.002 5.969 -29.156 1.0 31.23 ? 42 A 4 +ATOM 629 C CD . PRO A1 1 42 ? -25.342 5.431 -27.794 1.0 52.22 ? 42 A 4 +ATOM 630 H HA . PRO A1 1 42 ? -22.694 3.753 -28.514 1.0 60.32 ? 42 A 4 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.248 5.682 -30.342 1.0 50.23 ? 42 A 4 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.242 4.234 -30.142 1.0 64.01 ? 42 A 4 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.688 6.999 -29.085 1.0 0.11 ? 42 A 4 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.852 5.88 -29.817 1.0 1.1 ? 42 A 4 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.654 6.232 -27.139 1.0 11.32 ? 42 A 4 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.114 4.679 -27.867 1.0 34.03 ? 42 A 4 +ATOM 637 N N . PRO A1 1 43 ? -20.713 5.177 -28.026 1.0 1.41 ? 43 A 4 +ATOM 638 C CA . PRO A1 1 43 ? -19.503 5.978 -27.819 1.0 62.53 ? 43 A 4 +ATOM 639 C C . PRO A1 1 43 ? -19.083 6.729 -29.078 1.0 21.35 ? 43 A 4 +ATOM 640 O O . PRO A1 1 43 ? -18.474 7.797 -29.001 1.0 73.42 ? 43 A 4 +ATOM 641 C CB . PRO A1 1 43 ? -18.448 4.935 -27.442 1.0 74.43 ? 43 A 4 +ATOM 642 C CG . PRO A1 1 43 ? -18.931 3.667 -28.057 1.0 42.11 ? 43 A 4 +ATOM 643 C CD . PRO A1 1 43 ? -20.433 3.732 -28.011 1.0 32.53 ? 43 A 4 +ATOM 644 H HA . PRO A1 1 43 ? -19.625 6.68 -27.007 1.0 3.1 ? 43 A 4 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.488 5.229 -27.843 1.0 1.2 ? 43 A 4 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.385 4.854 -26.367 1.0 52.2 ? 43 A 4 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.59 3.601 -29.078 1.0 21.5 ? 43 A 4 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.576 2.823 -27.484 1.0 41.32 ? 43 A 4 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.858 3.248 -28.878 1.0 55.24 ? 43 A 4 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.803 3.278 -27.104 1.0 31.14 ? 43 A 4 +ATOM 651 N N . ASP A1 1 44 ? -19.411 6.166 -30.235 1.0 54.12 ? 44 A 4 +ATOM 652 C CA . ASP A1 1 44 ? -19.069 6.783 -31.511 1.0 51.34 ? 44 A 4 +ATOM 653 C C . ASP A1 1 44 ? -20.02 7.932 -31.831 1.0 65.34 ? 44 A 4 +ATOM 654 O O . ASP A1 1 44 ? -19.737 8.762 -32.695 1.0 41.23 ? 44 A 4 +ATOM 655 C CB . ASP A1 1 44 ? -19.109 5.744 -32.632 1.0 23.35 ? 44 A 4 +ATOM 656 C CG . ASP A1 1 44 ? -18.421 6.226 -33.894 1.0 52.14 ? 44 A 4 +ATOM 657 O OD1 . ASP A1 1 44 ? -17.204 6.498 -33.839 1.0 70.43 ? 44 A 4 +ATOM 658 O OD2 . ASP A1 1 44 ? -19.1 6.333 -34.937 1.0 15.14 ? 44 A 4 +ATOM 659 H H . ASP A1 1 44 ? -19.896 5.314 -30.231 1.0 64.31 ? 44 A 4 +ATOM 660 H HA . ASP A1 1 44 ? -18.066 7.175 -31.432 1.0 72.42 ? 44 A 4 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.616 4.843 -32.298 1.0 64.21 ? 44 A 4 +ATOM 662 H HB3 . ASP A1 1 44 ? -20.139 5.519 -32.869 1.0 74.33 ? 44 A 4 +ATOM 663 N N . GLN A1 1 45 ? -21.149 7.972 -31.13 1.0 24.51 ? 45 A 4 +ATOM 664 C CA . GLN A1 1 45 ? -22.142 9.018 -31.341 1.0 55.1 ? 45 A 4 +ATOM 665 C C . GLN A1 1 45 ? -22.03 10.1 -30.272 1.0 65.33 ? 45 A 4 +ATOM 666 O O . GLN A1 1 45 ? -22.618 11.174 -30.399 1.0 0.12 ? 45 A 4 +ATOM 667 C CB . GLN A1 1 45 ? -23.551 8.422 -31.334 1.0 3.33 ? 45 A 4 +ATOM 668 C CG . GLN A1 1 45 ? -23.995 7.895 -32.689 1.0 71.05 ? 45 A 4 +ATOM 669 C CD . GLN A1 1 45 ? -24.896 6.68 -32.576 1.0 50.21 ? 45 A 4 +ATOM 670 O OE1 . GLN A1 1 45 ? -25.997 6.759 -32.03 1.0 30.33 ? 45 A 4 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.432 5.549 -33.093 1.0 54.11 ? 45 A 4 +ATOM 672 H H . GLN A1 1 45 ? -21.317 7.282 -30.456 1.0 33.14 ? 45 A 4 +ATOM 673 H HA . GLN A1 1 45 ? -21.955 9.463 -32.307 1.0 54.13 ? 45 A 4 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.58 7.607 -30.627 1.0 72.22 ? 45 A 4 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.25 9.184 -31.023 1.0 51.24 ? 45 A 4 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.533 8.675 -33.207 1.0 11.31 ? 45 A 4 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.119 7.623 -33.26 1.0 33.23 ? 45 A 4 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.545 5.561 -33.512 1.0 35.4 ? 45 A 4 +ATOM 679 H HE22 . GLN A1 1 45 ? -24.993 4.748 -33.033 1.0 53.4 ? 45 A 4 +ATOM 680 N N . GLN A1 1 46 ? -21.272 9.808 -29.22 1.0 5.34 ? 46 A 4 +ATOM 681 C CA . GLN A1 1 46 ? -21.084 10.757 -28.128 1.0 54.21 ? 46 A 4 +ATOM 682 C C . GLN A1 1 46 ? -19.697 11.387 -28.188 1.0 23.33 ? 46 A 4 +ATOM 683 O O . GLN A1 1 46 ? -18.749 10.781 -28.688 1.0 42.0 ? 46 A 4 +ATOM 684 C CB . GLN A1 1 46 ? -21.284 10.061 -26.781 1.0 54.1 ? 46 A 4 +ATOM 685 C CG . GLN A1 1 46 ? -20.185 9.067 -26.44 1.0 63.33 ? 46 A 4 +ATOM 686 C CD . GLN A1 1 46 ? -19.279 9.557 -25.328 1.0 73.34 ? 46 A 4 +ATOM 687 O OE1 . GLN A1 1 46 ? -18.297 10.258 -25.575 1.0 62.34 ? 46 A 4 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.604 9.189 -24.094 1.0 52.51 ? 46 A 4 +ATOM 689 H H . GLN A1 1 46 ? -20.829 8.936 -29.177 1.0 61.13 ? 46 A 4 +ATOM 690 H HA . GLN A1 1 46 ? -21.824 11.535 -28.235 1.0 1.54 ? 46 A 4 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.315 10.81 -26.004 1.0 70.34 ? 46 A 4 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.225 9.532 -26.798 1.0 24.41 ? 46 A 4 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.641 8.139 -26.129 1.0 71.34 ? 46 A 4 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.587 8.895 -27.323 1.0 12.44 ? 46 A 4 +ATOM 695 H HE21 . GLN A1 1 46 ? -20.399 8.629 -23.973 1.0 61.21 ? 46 A 4 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.035 9.491 -23.356 1.0 54.41 ? 46 A 4 +ATOM 697 N N . ARG A1 1 47 ? -19.584 12.608 -27.675 1.0 11.31 ? 47 A 4 +ATOM 698 C CA . ARG A1 1 47 ? -18.313 13.321 -27.671 1.0 74.42 ? 47 A 4 +ATOM 699 C C . ARG A1 1 47 ? -18.119 14.081 -26.362 1.0 0.05 ? 47 A 4 +ATOM 700 O O . ARG A1 1 47 ? -19.084 14.379 -25.656 1.0 62.43 ? 47 A 4 +ATOM 701 C CB . ARG A1 1 47 ? -18.245 14.292 -28.851 1.0 53.24 ? 47 A 4 +ATOM 702 C CG . ARG A1 1 47 ? -18.208 13.603 -30.205 1.0 25.13 ? 47 A 4 +ATOM 703 C CD . ARG A1 1 47 ? -16.788 13.233 -30.604 1.0 74.31 ? 47 A 4 +ATOM 704 N NE . ARG A1 1 47 ? -16.318 14.014 -31.744 1.0 72.02 ? 47 A 4 +ATOM 705 C CZ . ARG A1 1 47 ? -15.255 13.687 -32.471 1.0 4.33 ? 47 A 4 +ATOM 706 N NH1 . ARG A1 1 47 ? -14.556 12.6 -32.178 1.0 22.33 ? 47 A 4 +ATOM 707 N NH2 . ARG A1 1 47 ? -14.89 14.449 -33.495 1.0 24.44 ? 47 A 4 +ATOM 708 H H . ARG A1 1 47 ? -20.376 13.04 -27.29 1.0 14.32 ? 47 A 4 +ATOM 709 H HA . ARG A1 1 47 ? -17.523 12.592 -27.77 1.0 52.1 ? 47 A 4 +ATOM 710 H HB2 . ARG A1 1 47 ? -19.112 14.936 -28.823 1.0 12.43 ? 47 A 4 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.355 14.896 -28.754 1.0 31.22 ? 47 A 4 +ATOM 712 H HG2 . ARG A1 1 47 ? -18.803 12.703 -30.157 1.0 2.15 ? 47 A 4 +ATOM 713 H HG3 . ARG A1 1 47 ? -18.62 14.269 -30.949 1.0 3.22 ? 47 A 4 +ATOM 714 H HD2 . ARG A1 1 47 ? -16.134 13.412 -29.763 1.0 62.34 ? 47 A 4 +ATOM 715 H HD3 . ARG A1 1 47 ? -16.763 12.185 -30.862 1.0 4.32 ? 47 A 4 +ATOM 716 H HE . ARG A1 1 47 ? -16.82 14.822 -31.979 1.0 51.12 ? 47 A 4 +ATOM 717 H HH11 . ARG A1 1 47 ? -14.83 12.023 -31.408 1.0 35.02 ? 47 A 4 +ATOM 718 H HH12 . ARG A1 1 47 ? -13.757 12.355 -32.728 1.0 42.25 ? 47 A 4 +ATOM 719 H HH21 . ARG A1 1 47 ? -15.415 15.27 -33.719 1.0 32.54 ? 47 A 4 +ATOM 720 H HH22 . ARG A1 1 47 ? -14.091 14.203 -34.041 1.0 51.04 ? 47 A 4 +ATOM 721 N N . LEU A1 1 48 ? -16.868 14.391 -26.043 1.0 13.42 ? 48 A 4 +ATOM 722 C CA . LEU A1 1 48 ? -16.547 15.115 -24.818 1.0 63.04 ? 48 A 4 +ATOM 723 C C . LEU A1 1 48 ? -16.193 16.568 -25.122 1.0 70.54 ? 48 A 4 +ATOM 724 O O . LEU A1 1 48 ? -15.644 16.875 -26.18 1.0 13.22 ? 48 A 4 +ATOM 725 C CB . LEU A1 1 48 ? -15.385 14.437 -24.09 1.0 73.22 ? 48 A 4 +ATOM 726 C CG . LEU A1 1 48 ? -15.312 12.915 -24.215 1.0 23.01 ? 48 A 4 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.7 12.303 -24.105 1.0 2.23 ? 48 A 4 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.655 12.519 -25.53 1.0 62.5 ? 48 A 4 +ATOM 729 H H . LEU A1 1 48 ? -16.141 14.127 -26.645 1.0 13.1 ? 48 A 4 +ATOM 730 H HA . LEU A1 1 48 ? -17.42 15.095 -24.183 1.0 5.14 ? 48 A 4 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.466 14.845 -24.482 1.0 14.35 ? 48 A 4 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.467 14.68 -23.04 1.0 62.22 ? 48 A 4 +ATOM 733 H HG . LEU A1 1 48 ? -14.71 12.522 -23.408 1.0 74.12 ? 48 A 4 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.107 12.153 -25.094 1.0 72.12 ? 48 A 4 +ATOM 735 H HD12 . LEU A1 1 48 ? -17.343 12.968 -23.548 1.0 51.52 ? 48 A 4 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.635 11.353 -23.594 1.0 50.13 ? 48 A 4 +ATOM 737 H HD21 . LEU A1 1 48 ? -14.084 11.613 -25.388 1.0 32.51 ? 48 A 4 +ATOM 738 H HD22 . LEU A1 1 48 ? -13.998 13.311 -25.856 1.0 4.35 ? 48 A 4 +ATOM 739 H HD23 . LEU A1 1 48 ? -15.417 12.352 -26.277 1.0 44.23 ? 48 A 4 +ATOM 740 N N . ILE A1 1 49 ? -16.509 17.456 -24.186 1.0 13.31 ? 49 A 4 +ATOM 741 C CA . ILE A1 1 49 ? -16.222 18.876 -24.352 1.0 13.25 ? 49 A 4 +ATOM 742 C C . ILE A1 1 49 ? -15.733 19.494 -23.047 1.0 73.24 ? 49 A 4 +ATOM 743 O O . ILE A1 1 49 ? -16.38 19.369 -22.007 1.0 20.41 ? 49 A 4 +ATOM 744 C CB . ILE A1 1 49 ? -17.461 19.648 -24.84 1.0 42.12 ? 49 A 4 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.645 19.461 -26.348 1.0 21.4 ? 49 A 4 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.335 21.124 -24.496 1.0 44.11 ? 49 A 4 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.961 18.816 -26.721 1.0 30.32 ? 49 A 4 +ATOM 748 H H . ILE A1 1 49 ? -16.946 17.15 -23.364 1.0 11.12 ? 49 A 4 +ATOM 749 H HA . ILE A1 1 49 ? -15.445 18.973 -25.097 1.0 31.54 ? 49 A 4 +ATOM 750 H HB . ILE A1 1 49 ? -18.327 19.256 -24.328 1.0 10.22 ? 49 A 4 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.599 20.423 -26.832 1.0 52.53 ? 49 A 4 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.849 18.834 -26.724 1.0 23.14 ? 49 A 4 +ATOM 753 H HG21 . ILE A1 1 49 ? -16.297 21.417 -24.543 1.0 54.41 ? 49 A 4 +ATOM 754 H HG22 . ILE A1 1 49 ? -17.905 21.708 -25.203 1.0 2.4 ? 49 A 4 +ATOM 755 H HG23 . ILE A1 1 49 ? -17.713 21.295 -23.499 1.0 53.42 ? 49 A 4 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.666 19.58 -27.016 1.0 43.14 ? 49 A 4 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.808 18.133 -27.543 1.0 61.33 ? 49 A 4 +ATOM 758 H HD13 . ILE A1 1 49 ? -19.352 18.276 -25.871 1.0 3.14 ? 49 A 4 +ATOM 759 N N . PHE A1 1 50 ? -14.586 20.164 -23.109 1.0 0.44 ? 50 A 4 +ATOM 760 C CA . PHE A1 1 50 ? -14.01 20.803 -21.931 1.0 63.4 ? 50 A 4 +ATOM 761 C C . PHE A1 1 50 ? -13.897 22.311 -22.133 1.0 34.31 ? 50 A 4 +ATOM 762 O O . PHE A1 1 50 ? -13.071 22.784 -22.912 1.0 24.03 ? 50 A 4 +ATOM 763 C CB . PHE A1 1 50 ? -12.632 20.213 -21.627 1.0 1.31 ? 50 A 4 +ATOM 764 C CG . PHE A1 1 50 ? -11.931 20.886 -20.482 1.0 63.44 ? 50 A 4 +ATOM 765 C CD1 . PHE A1 1 50 ? -12.125 20.45 -19.181 1.0 63.22 ? 50 A 4 +ATOM 766 C CD2 . PHE A1 1 50 ? -11.077 21.954 -20.706 1.0 31.12 ? 50 A 4 +ATOM 767 C CE1 . PHE A1 1 50 ? -11.482 21.068 -18.126 1.0 44.05 ? 50 A 4 +ATOM 768 C CE2 . PHE A1 1 50 ? -10.431 22.576 -19.655 1.0 53.14 ? 50 A 4 +ATOM 769 C CZ . PHE A1 1 50 ? -10.633 22.132 -18.363 1.0 64.24 ? 50 A 4 +ATOM 770 H H . PHE A1 1 50 ? -14.116 20.229 -23.966 1.0 32.43 ? 50 A 4 +ATOM 771 H HA . PHE A1 1 50 ? -14.667 20.612 -21.097 1.0 55.42 ? 50 A 4 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.742 19.168 -21.38 1.0 72.21 ? 50 A 4 +ATOM 773 H HB3 . PHE A1 1 50 ? -12.007 20.307 -22.502 1.0 52.42 ? 50 A 4 +ATOM 774 H HD1 . PHE A1 1 50 ? -12.788 19.618 -18.994 1.0 64.41 ? 50 A 4 +ATOM 775 H HD2 . PHE A1 1 50 ? -10.918 22.302 -21.717 1.0 25.0 ? 50 A 4 +ATOM 776 H HE1 . PHE A1 1 50 ? -11.642 20.719 -17.116 1.0 33.34 ? 50 A 4 +ATOM 777 H HE2 . PHE A1 1 50 ? -9.768 23.407 -19.844 1.0 34.14 ? 50 A 4 +ATOM 778 H HZ . PHE A1 1 50 ? -10.13 22.616 -17.54 1.0 42.2 ? 50 A 4 +ATOM 779 N N . GLY A1 1 51 ? -14.735 23.062 -21.423 1.0 53.44 ? 51 A 4 +ATOM 780 C CA . GLY A1 1 51 ? -14.713 24.509 -21.538 1.0 33.5 ? 51 A 4 +ATOM 781 C C . GLY A1 1 51 ? -15.317 24.996 -22.84 1.0 34.32 ? 51 A 4 +ATOM 782 O O . GLY A1 1 51 ? -15.428 26.199 -23.07 1.0 0.02 ? 51 A 4 +ATOM 783 H H . GLY A1 1 51 ? -15.372 22.63 -20.817 1.0 14.34 ? 51 A 4 +ATOM 784 H HA2 . GLY A1 1 51 ? -15.269 24.932 -20.715 1.0 71.3 ? 51 A 4 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.689 24.848 -21.481 1.0 2.33 ? 51 A 4 +ATOM 786 N N . GLY A1 1 52 ? -15.708 24.057 -23.698 1.0 51.33 ? 52 A 4 +ATOM 787 C CA . GLY A1 1 52 ? -16.298 24.417 -24.974 1.0 70.11 ? 52 A 4 +ATOM 788 C C . GLY A1 1 52 ? -15.65 23.692 -26.137 1.0 64.35 ? 52 A 4 +ATOM 789 O O . GLY A1 1 52 ? -16.268 23.508 -27.186 1.0 21.12 ? 52 A 4 +ATOM 790 H H . GLY A1 1 52 ? -15.596 23.113 -23.461 1.0 52.33 ? 52 A 4 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.35 24.176 -24.953 1.0 34.31 ? 52 A 4 +ATOM 792 H HA3 . GLY A1 1 52 ? -16.186 25.481 -25.122 1.0 33.12 ? 52 A 4 +ATOM 793 N N . LYS A1 1 53 ? -14.401 23.279 -25.953 1.0 4.12 ? 53 A 4 +ATOM 794 C CA . LYS A1 1 53 ? -13.667 22.57 -26.994 1.0 20.15 ? 53 A 4 +ATOM 795 C C . LYS A1 1 53 ? -13.81 21.06 -26.828 1.0 12.34 ? 53 A 4 +ATOM 796 O O . LYS A1 1 53 ? -13.89 20.556 -25.709 1.0 53.3 ? 53 A 4 +ATOM 797 C CB . LYS A1 1 53 ? -12.188 22.96 -26.961 1.0 12.13 ? 53 A 4 +ATOM 798 C CG . LYS A1 1 53 ? -11.511 22.667 -25.634 1.0 34.42 ? 53 A 4 +ATOM 799 C CD . LYS A1 1 53 ? -10.866 21.292 -25.629 1.0 44.0 ? 53 A 4 +ATOM 800 C CE . LYS A1 1 53 ? -9.75 21.196 -26.658 1.0 75.53 ? 53 A 4 +ATOM 801 N NZ . LYS A1 1 53 ? -8.517 20.588 -26.084 1.0 61.53 ? 53 A 4 +ATOM 802 H H . LYS A1 1 53 ? -13.961 23.455 -25.094 1.0 32.12 ? 53 A 4 +ATOM 803 H HA . LYS A1 1 53 ? -14.085 22.856 -27.948 1.0 74.23 ? 53 A 4 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.667 22.416 -27.735 1.0 34.02 ? 53 A 4 +ATOM 805 H HB3 . LYS A1 1 53 ? -12.103 24.019 -27.159 1.0 32.22 ? 53 A 4 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.749 23.411 -25.456 1.0 24.24 ? 53 A 4 +ATOM 807 H HG3 . LYS A1 1 53 ? -12.25 22.711 -24.846 1.0 53.0 ? 53 A 4 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.454 21.1 -24.649 1.0 22.42 ? 53 A 4 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.618 20.549 -25.856 1.0 0.05 ? 53 A 4 +ATOM 810 H HE2 . LYS A1 1 53 ? -10.089 20.589 -27.483 1.0 25.2 ? 53 A 4 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.519 22.189 -27.013 1.0 75.24 ? 53 A 4 +ATOM 812 H HZ1 . LYS A1 1 53 ? -8.493 20.733 -25.055 1.0 1.33 ? 53 A 4 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.673 21.027 -26.505 1.0 14.14 ? 53 A 4 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.497 19.567 -26.281 1.0 31.25 ? 53 A 4 +ATOM 815 N N . GLN A1 1 54 ? -13.839 20.346 -27.949 1.0 32.1 ? 54 A 4 +ATOM 816 C CA . GLN A1 1 54 ? -13.971 18.894 -27.925 1.0 3.14 ? 54 A 4 +ATOM 817 C C . GLN A1 1 54 ? -12.681 18.238 -27.442 1.0 14.5 ? 54 A 4 +ATOM 818 O O . GLN A1 1 54 ? -11.621 18.865 -27.427 1.0 22.04 ? 54 A 4 +ATOM 819 C CB . GLN A1 1 54 ? -14.332 18.371 -29.317 1.0 14.03 ? 54 A 4 +ATOM 820 C CG . GLN A1 1 54 ? -15.818 18.111 -29.502 1.0 52.41 ? 54 A 4 +ATOM 821 C CD . GLN A1 1 54 ? -16.553 19.307 -30.075 1.0 44.23 ? 54 A 4 +ATOM 822 O OE1 . GLN A1 1 54 ? -16.332 20.444 -29.658 1.0 25.33 ? 54 A 4 +ATOM 823 N NE2 . GLN A1 1 54 ? -17.434 19.056 -31.036 1.0 63.1 ? 54 A 4 +ATOM 824 H H . GLN A1 1 54 ? -13.771 20.806 -28.811 1.0 52.11 ? 54 A 4 +ATOM 825 H HA . GLN A1 1 54 ? -14.766 18.645 -27.239 1.0 62.04 ? 54 A 4 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.021 19.097 -30.053 1.0 31.24 ? 54 A 4 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.803 17.446 -29.489 1.0 25.42 ? 54 A 4 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.944 17.276 -30.174 1.0 52.11 ? 54 A 4 +ATOM 829 H HG3 . GLN A1 1 54 ? -16.25 17.868 -28.542 1.0 53.52 ? 54 A 4 +ATOM 830 H HE21 . GLN A1 1 54 ? -17.56 18.125 -31.316 1.0 45.55 ? 54 A 4 +ATOM 831 H HE22 . GLN A1 1 54 ? -17.924 19.81 -31.423 1.0 62.42 ? 54 A 4 +ATOM 832 N N . LEU A1 1 55 ? -12.779 16.974 -27.047 1.0 51.34 ? 55 A 4 +ATOM 833 C CA . LEU A1 1 55 ? -11.62 16.232 -26.562 1.0 40.45 ? 55 A 4 +ATOM 834 C C . LEU A1 1 55 ? -11.259 15.1 -27.519 1.0 63.5 ? 55 A 4 +ATOM 835 O O . LEU A1 1 55 ? -12.096 14.259 -27.843 1.0 52.11 ? 55 A 4 +ATOM 836 C CB . LEU A1 1 55 ? -11.897 15.668 -25.168 1.0 25.03 ? 55 A 4 +ATOM 837 C CG . LEU A1 1 55 ? -12.366 16.676 -24.117 1.0 41.33 ? 55 A 4 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.451 16.019 -22.748 1.0 33.24 ? 55 A 4 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.434 17.878 -24.077 1.0 52.23 ? 55 A 4 +ATOM 840 H H . LEU A1 1 55 ? -13.65 16.527 -27.082 1.0 12.34 ? 55 A 4 +ATOM 841 H HA . LEU A1 1 55 ? -10.788 16.918 -26.505 1.0 22.21 ? 55 A 4 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.66 14.911 -25.263 1.0 55.1 ? 55 A 4 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.985 15.214 -24.808 1.0 51.11 ? 55 A 4 +ATOM 844 H HG . LEU A1 1 55 ? -13.355 17.027 -24.381 1.0 72.12 ? 55 A 4 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.695 15.253 -22.669 1.0 32.04 ? 55 A 4 +ATOM 846 H HD12 . LEU A1 1 55 ? -13.428 15.575 -22.622 1.0 44.35 ? 55 A 4 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.293 16.763 -21.982 1.0 32.21 ? 55 A 4 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.918 18.724 -24.541 1.0 33.14 ? 55 A 4 +ATOM 849 H HD22 . LEU A1 1 55 ? -10.525 17.645 -24.612 1.0 72.01 ? 55 A 4 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.197 18.115 -23.05 1.0 74.33 ? 55 A 4 +ATOM 851 N N . GLU A1 1 56 ? -10.007 15.085 -27.965 1.0 12.02 ? 56 A 4 +ATOM 852 C CA . GLU A1 1 56 ? -9.536 14.055 -28.883 1.0 31.33 ? 56 A 4 +ATOM 853 C C . GLU A1 1 56 ? -9.518 12.688 -28.204 1.0 62.51 ? 56 A 4 +ATOM 854 O O . GLU A1 1 56 ? -9.964 12.543 -27.066 1.0 51.02 ? 56 A 4 +ATOM 855 C CB . GLU A1 1 56 ? -8.136 14.399 -29.396 1.0 62.01 ? 56 A 4 +ATOM 856 C CG . GLU A1 1 56 ? -8.036 14.439 -30.912 1.0 21.02 ? 56 A 4 +ATOM 857 C CD . GLU A1 1 56 ? -8.877 15.542 -31.523 1.0 1.0 ? 56 A 4 +ATOM 858 O OE1 . GLU A1 1 56 ? -9.288 16.457 -30.778 1.0 61.34 ? 56 A 4 +ATOM 859 O OE2 . GLU A1 1 56 ? -9.125 15.492 -32.746 1.0 22.01 ? 56 A 4 +ATOM 860 H H . GLU A1 1 56 ? -9.386 15.784 -27.67 1.0 72.43 ? 56 A 4 +ATOM 861 H HA . GLU A1 1 56 ? -10.217 14.019 -29.719 1.0 4.21 ? 56 A 4 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.853 15.368 -29.011 1.0 41.11 ? 56 A 4 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.44 13.659 -29.03 1.0 51.02 ? 56 A 4 +ATOM 864 H HG2 . GLU A1 1 56 ? -7.005 14.599 -31.188 1.0 71.31 ? 56 A 4 +ATOM 865 H HG3 . GLU A1 1 56 ? -8.37 13.491 -31.307 1.0 60.44 ? 56 A 4 +ATOM 866 N N . ASP A1 1 57 ? -9.002 11.69 -28.912 1.0 71.03 ? 57 A 4 +ATOM 867 C CA . ASP A1 1 57 ? -8.926 10.334 -28.379 1.0 63.41 ? 57 A 4 +ATOM 868 C C . ASP A1 1 57 ? -7.828 10.225 -27.326 1.0 21.4 ? 57 A 4 +ATOM 869 O O . ASP A1 1 57 ? -7.9 9.391 -26.424 1.0 43.31 ? 57 A 4 +ATOM 870 C CB . ASP A1 1 57 ? -8.67 9.334 -29.507 1.0 45.31 ? 57 A 4 +ATOM 871 C CG . ASP A1 1 57 ? -9.776 9.334 -30.544 1.0 55.43 ? 57 A 4 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.958 9.239 -30.151 1.0 72.35 ? 57 A 4 +ATOM 873 O OD2 . ASP A1 1 57 ? -9.46 9.43 -31.748 1.0 15.11 ? 57 A 4 +ATOM 874 H H . ASP A1 1 57 ? -8.663 11.868 -29.814 1.0 23.12 ? 57 A 4 +ATOM 875 H HA . ASP A1 1 57 ? -9.874 10.106 -27.916 1.0 62.14 ? 57 A 4 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.741 9.585 -29.999 1.0 24.44 ? 57 A 4 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.593 8.341 -29.088 1.0 64.03 ? 57 A 4 +ATOM 878 N N . SER A1 1 58 ? -6.811 11.073 -27.449 1.0 32.51 ? 58 A 4 +ATOM 879 C CA . SER A1 1 58 ? -5.695 11.068 -26.511 1.0 62.24 ? 58 A 4 +ATOM 880 C C . SER A1 1 58 ? -5.707 12.325 -25.646 1.0 2.12 ? 58 A 4 +ATOM 881 O O . SER A1 1 58 ? -4.804 12.546 -24.841 1.0 12.21 ? 58 A 4 +ATOM 882 C CB . SER A1 1 58 ? -4.367 10.967 -27.265 1.0 65.11 ? 58 A 4 +ATOM 883 O OG . SER A1 1 58 ? -3.281 10.818 -26.368 1.0 34.21 ? 58 A 4 +ATOM 884 H H . SER A1 1 58 ? -6.811 11.714 -28.19 1.0 21.03 ? 58 A 4 +ATOM 885 H HA . SER A1 1 58 ? -5.802 10.205 -25.872 1.0 33.55 ? 58 A 4 +ATOM 886 H HB2 . SER A1 1 58 ? -4.395 10.112 -27.924 1.0 31.42 ? 58 A 4 +ATOM 887 H HB3 . SER A1 1 58 ? -4.218 11.865 -27.847 1.0 40.4 ? 58 A 4 +ATOM 888 H HG . SER A1 1 58 ? -3.516 10.189 -25.682 1.0 10.23 ? 58 A 4 +ATOM 889 N N . ASN A1 1 59 ? -6.738 13.146 -25.82 1.0 35.41 ? 59 A 4 +ATOM 890 C CA . ASN A1 1 59 ? -6.868 14.381 -25.057 1.0 52.34 ? 59 A 4 +ATOM 891 C C . ASN A1 1 59 ? -7.548 14.123 -23.716 1.0 4.01 ? 59 A 4 +ATOM 892 O O . ASN A1 1 59 ? -8.748 14.349 -23.562 1.0 42.21 ? 59 A 4 +ATOM 893 C CB . ASN A1 1 59 ? -7.665 15.416 -25.854 1.0 21.1 ? 59 A 4 +ATOM 894 C CG . ASN A1 1 59 ? -7.339 16.839 -25.443 1.0 14.54 ? 59 A 4 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.786 17.611 -26.226 1.0 24.42 ? 59 A 4 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.682 17.191 -24.21 1.0 14.44 ? 59 A 4 +ATOM 897 H H . ASN A1 1 59 ? -7.427 12.915 -26.478 1.0 5.51 ? 59 A 4 +ATOM 898 H HA . ASN A1 1 59 ? -5.876 14.766 -24.877 1.0 74.51 ? 59 A 4 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.439 15.304 -26.905 1.0 43.43 ? 59 A 4 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.72 15.248 -25.698 1.0 11.21 ? 59 A 4 +ATOM 901 H HD21 . ASN A1 1 59 ? -8.119 16.523 -23.641 1.0 21.33 ? 59 A 4 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.483 18.106 -23.918 1.0 12.0 ? 59 A 4 +ATOM 903 N N . ALA A1 1 60 ? -6.771 13.648 -22.747 1.0 13.11 ? 60 A 4 +ATOM 904 C CA . ALA A1 1 60 ? -7.297 13.361 -21.418 1.0 35.51 ? 60 A 4 +ATOM 905 C C . ALA A1 1 60 ? -6.182 12.949 -20.464 1.0 74.01 ? 60 A 4 +ATOM 906 O O . ALA A1 1 60 ? -5.681 13.764 -19.69 1.0 74.24 ? 60 A 4 +ATOM 907 C CB . ALA A1 1 60 ? -8.359 12.274 -21.494 1.0 64.13 ? 60 A 4 +ATOM 908 H H . ALA A1 1 60 ? -5.822 13.488 -22.931 1.0 31.12 ? 60 A 4 +ATOM 909 H HA . ALA A1 1 60 ? -7.764 14.26 -21.043 1.0 20.01 ? 60 A 4 +ATOM 910 H HB1 . ALA A1 1 60 ? -9.179 12.615 -22.109 1.0 72.33 ? 60 A 4 +ATOM 911 H HB2 . ALA A1 1 60 ? -7.93 11.382 -21.926 1.0 25.02 ? 60 A 4 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.721 12.055 -20.501 1.0 51.02 ? 60 A 4 +ATOM 913 N N . MET A1 1 61 ? -5.798 11.678 -20.524 1.0 21.52 ? 61 A 4 +ATOM 914 C CA . MET A1 1 61 ? -4.74 11.158 -19.665 1.0 32.03 ? 61 A 4 +ATOM 915 C C . MET A1 1 61 ? -3.378 11.691 -20.095 1.0 55.14 ? 61 A 4 +ATOM 916 O O . MET A1 1 61 ? -2.695 12.369 -19.327 1.0 73.23 ? 61 A 4 +ATOM 917 C CB . MET A1 1 61 ? -4.735 9.628 -19.695 1.0 33.12 ? 61 A 4 +ATOM 918 C CG . MET A1 1 61 ? -6.126 9.015 -19.686 1.0 10.31 ? 61 A 4 +ATOM 919 S SD . MET A1 1 61 ? -7.191 9.729 -18.418 1.0 3.45 ? 61 A 4 +ATOM 920 C CE . MET A1 1 61 ? -8.774 9.71 -19.256 1.0 11.34 ? 61 A 4 +ATOM 921 H H . MET A1 1 61 ? -6.235 11.075 -21.162 1.0 44.35 ? 61 A 4 +ATOM 922 H HA . MET A1 1 61 ? -4.941 11.488 -18.657 1.0 14.21 ? 61 A 4 +ATOM 923 H HB2 . MET A1 1 61 ? -4.226 9.3 -20.589 1.0 14.23 ? 61 A 4 +ATOM 924 H HB3 . MET A1 1 61 ? -4.199 9.264 -18.831 1.0 0.24 ? 61 A 4 +ATOM 925 H HG2 . MET A1 1 61 ? -6.583 9.176 -20.651 1.0 62.14 ? 61 A 4 +ATOM 926 H HG3 . MET A1 1 61 ? -6.035 7.954 -19.506 1.0 32.0 ? 61 A 4 +ATOM 927 H HE1 . MET A1 1 61 ? -9.248 10.675 -19.149 1.0 54.23 ? 61 A 4 +ATOM 928 H HE2 . MET A1 1 61 ? -8.624 9.496 -20.304 1.0 64.31 ? 61 A 4 +ATOM 929 H HE3 . MET A1 1 61 ? -9.403 8.949 -18.819 1.0 24.11 ? 61 A 4 +ATOM 930 N N . SER A1 1 62 ? -2.988 11.381 -21.328 1.0 73.15 ? 62 A 4 +ATOM 931 C CA . SER A1 1 62 ? -1.705 11.826 -21.859 1.0 12.22 ? 62 A 4 +ATOM 932 C C . SER A1 1 62 ? -1.6 13.348 -21.821 1.0 13.52 ? 62 A 4 +ATOM 933 O O . SER A1 1 62 ? -0.521 13.902 -21.612 1.0 42.51 ? 62 A 4 +ATOM 934 C CB . SER A1 1 62 ? -1.522 11.327 -23.293 1.0 62.33 ? 62 A 4 +ATOM 935 O OG . SER A1 1 62 ? -0.896 12.31 -24.099 1.0 14.13 ? 62 A 4 +ATOM 936 H H . SER A1 1 62 ? -3.577 10.838 -21.892 1.0 74.25 ? 62 A 4 +ATOM 937 H HA . SER A1 1 62 ? -0.927 11.408 -21.239 1.0 74.15 ? 62 A 4 +ATOM 938 H HB2 . SER A1 1 62 ? -0.908 10.439 -23.287 1.0 54.41 ? 62 A 4 +ATOM 939 H HB3 . SER A1 1 62 ? -2.489 11.094 -23.716 1.0 23.45 ? 62 A 4 +ATOM 940 H HG . SER A1 1 62 ? -1.533 12.989 -24.33 1.0 1.23 ? 62 A 4 +ATOM 941 N N . ASP A1 1 63 ? -2.729 14.018 -22.024 1.0 34.33 ? 63 A 4 +ATOM 942 C CA . ASP A1 1 63 ? -2.766 15.476 -22.012 1.0 10.21 ? 63 A 4 +ATOM 943 C C . ASP A1 1 63 ? -2.285 16.021 -20.671 1.0 63.54 ? 63 A 4 +ATOM 944 O O . ASP A1 1 63 ? -1.845 17.167 -20.577 1.0 31.33 ? 63 A 4 +ATOM 945 C CB . ASP A1 1 63 ? -4.184 15.974 -22.3 1.0 21.1 ? 63 A 4 +ATOM 946 C CG . ASP A1 1 63 ? -4.204 17.406 -22.795 1.0 12.2 ? 63 A 4 +ATOM 947 O OD1 . ASP A1 1 63 ? -3.887 17.628 -23.982 1.0 53.24 ? 63 A 4 +ATOM 948 O OD2 . ASP A1 1 63 ? -4.538 18.306 -21.995 1.0 3.13 ? 63 A 4 +ATOM 949 H H . ASP A1 1 63 ? -3.558 13.52 -22.185 1.0 14.4 ? 63 A 4 +ATOM 950 H HA . ASP A1 1 63 ? -2.106 15.83 -22.789 1.0 72.42 ? 63 A 4 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.633 15.345 -23.055 1.0 63.34 ? 63 A 4 +ATOM 952 H HB3 . ASP A1 1 63 ? -4.769 15.916 -21.394 1.0 44.51 ? 63 A 4 +ATOM 953 N N . TYR A1 1 64 ? -2.372 15.192 -19.636 1.0 43.15 ? 64 A 4 +ATOM 954 C CA . TYR A1 1 64 ? -1.949 15.592 -18.3 1.0 74.44 ? 64 A 4 +ATOM 955 C C . TYR A1 1 64 ? -2.97 16.53 -17.662 1.0 35.31 ? 64 A 4 +ATOM 956 O O . TYR A1 1 64 ? -2.61 17.541 -17.061 1.0 63.11 ? 64 A 4 +ATOM 957 C CB . TYR A1 1 64 ? -0.581 16.274 -18.358 1.0 41.31 ? 64 A 4 +ATOM 958 C CG . TYR A1 1 64 ? 0.408 15.572 -19.261 1.0 35.31 ? 64 A 4 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.833 14.278 -18.986 1.0 10.21 ? 64 A 4 +ATOM 960 C CD2 . TYR A1 1 64 ? 0.917 16.203 -20.39 1.0 61.0 ? 64 A 4 +ATOM 961 C CE1 . TYR A1 1 64 ? 1.737 13.634 -19.808 1.0 31.32 ? 64 A 4 +ATOM 962 C CE2 . TYR A1 1 64 ? 1.82 15.565 -21.218 1.0 3.01 ? 64 A 4 +ATOM 963 C CZ . TYR A1 1 64 ? 2.227 14.281 -20.923 1.0 35.43 ? 64 A 4 +ATOM 964 O OH . TYR A1 1 64 ? 3.126 13.641 -21.745 1.0 23.32 ? 64 A 4 +ATOM 965 H H . TYR A1 1 64 ? -2.731 14.291 -19.774 1.0 10.22 ? 64 A 4 +ATOM 966 H HA . TYR A1 1 64 ? -1.87 14.7 -17.696 1.0 40.51 ? 64 A 4 +ATOM 967 H HB2 . TYR A1 1 64 ? -0.704 17.283 -18.722 1.0 75.32 ? 64 A 4 +ATOM 968 H HB3 . TYR A1 1 64 ? -0.159 16.305 -17.364 1.0 32.34 ? 64 A 4 +ATOM 969 H HD1 . TYR A1 1 64 ? 0.446 13.774 -18.112 1.0 1.35 ? 64 A 4 +ATOM 970 H HD2 . TYR A1 1 64 ? 0.596 17.209 -20.618 1.0 32.41 ? 64 A 4 +ATOM 971 H HE1 . TYR A1 1 64 ? 2.055 12.628 -19.577 1.0 52.21 ? 64 A 4 +ATOM 972 H HE2 . TYR A1 1 64 ? 2.204 16.072 -22.091 1.0 43.14 ? 64 A 4 +ATOM 973 H HH . TYR A1 1 64 ? 2.695 12.899 -22.175 1.0 23.33 ? 64 A 4 +ATOM 974 N N . ASN A1 1 65 ? -4.246 16.184 -17.799 1.0 61.21 ? 65 A 4 +ATOM 975 C CA . ASN A1 1 65 ? -5.321 16.994 -17.237 1.0 70.22 ? 65 A 4 +ATOM 976 C C . ASN A1 1 65 ? -6.33 16.12 -16.497 1.0 21.44 ? 65 A 4 +ATOM 977 O O . ASN A1 1 65 ? -7.447 16.55 -16.21 1.0 22.24 ? 65 A 4 +ATOM 978 C CB . ASN A1 1 65 ? -6.026 17.782 -18.343 1.0 30.31 ? 65 A 4 +ATOM 979 C CG . ASN A1 1 65 ? -6.896 18.896 -17.794 1.0 75.23 ? 65 A 4 +ATOM 980 O OD1 . ASN A1 1 65 ? -6.487 19.633 -16.896 1.0 74.2 ? 65 A 4 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.103 19.025 -18.333 1.0 12.4 ? 65 A 4 +ATOM 982 H H . ASN A1 1 65 ? -4.47 15.366 -18.29 1.0 72.01 ? 65 A 4 +ATOM 983 H HA . ASN A1 1 65 ? -4.882 17.688 -16.536 1.0 43.44 ? 65 A 4 +ATOM 984 H HB2 . ASN A1 1 65 ? -5.283 18.219 -18.994 1.0 12.24 ? 65 A 4 +ATOM 985 H HB3 . ASN A1 1 65 ? -6.65 17.111 -18.914 1.0 73.02 ? 65 A 4 +ATOM 986 H HD21 . ASN A1 1 65 ? -8.361 18.402 -19.045 1.0 23.44 ? 65 A 4 +ATOM 987 H HD22 . ASN A1 1 65 ? -8.685 19.738 -17.998 1.0 32.24 ? 65 A 4 +ATOM 988 N N . VAL A1 1 66 ? -5.928 14.891 -16.191 1.0 11.4 ? 66 A 4 +ATOM 989 C CA . VAL A1 1 66 ? -6.795 13.957 -15.483 1.0 70.45 ? 66 A 4 +ATOM 990 C C . VAL A1 1 66 ? -6.627 14.086 -13.973 1.0 73.11 ? 66 A 4 +ATOM 991 O O . VAL A1 1 66 ? -5.513 14.008 -13.455 1.0 33.12 ? 66 A 4 +ATOM 992 C CB . VAL A1 1 66 ? -6.509 12.501 -15.897 1.0 40.11 ? 66 A 4 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.108 12.09 -15.471 1.0 32.21 ? 66 A 4 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.552 11.565 -15.307 1.0 25.13 ? 66 A 4 +ATOM 995 H H . VAL A1 1 66 ? -5.026 14.606 -16.446 1.0 25.31 ? 66 A 4 +ATOM 996 H HA . VAL A1 1 66 ? -7.818 14.189 -15.743 1.0 44.24 ? 66 A 4 +ATOM 997 H HB . VAL A1 1 66 ? -6.567 12.437 -16.974 1.0 65.05 ? 66 A 4 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.167 11.496 -14.57 1.0 62.5 ? 66 A 4 +ATOM 999 H HG12 . VAL A1 1 66 ? -4.648 11.509 -16.257 1.0 4.5 ? 66 A 4 +ATOM 1000 H HG13 . VAL A1 1 66 ? -4.516 12.973 -15.281 1.0 12.32 ? 66 A 4 +ATOM 1001 H HG21 . VAL A1 1 66 ? -7.319 10.547 -15.581 1.0 23.4 ? 66 A 4 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.55 11.658 -14.231 1.0 64.2 ? 66 A 4 +ATOM 1003 H HG23 . VAL A1 1 66 ? -8.529 11.826 -15.688 1.0 74.31 ? 66 A 4 +ATOM 1004 N N . GLN A1 1 67 ? -7.739 14.285 -13.274 1.0 5.43 ? 67 A 4 +ATOM 1005 C CA . GLN A1 1 67 ? -7.714 14.425 -11.823 1.0 15.5 ? 67 A 4 +ATOM 1006 C C . GLN A1 1 67 ? -8.608 13.383 -11.16 1.0 62.54 ? 67 A 4 +ATOM 1007 O O . GLN A1 1 67 ? -9.201 12.539 -11.832 1.0 44.01 ? 67 A 4 +ATOM 1008 C CB . GLN A1 1 67 ? -8.162 15.831 -11.418 1.0 35.11 ? 67 A 4 +ATOM 1009 C CG . GLN A1 1 67 ? -9.602 16.142 -11.793 1.0 11.21 ? 67 A 4 +ATOM 1010 C CD . GLN A1 1 67 ? -10.257 17.117 -10.835 1.0 34.44 ? 67 A 4 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.421 16.826 -9.65 1.0 41.54 ? 67 A 4 +ATOM 1012 N NE2 . GLN A1 1 67 ? -10.636 18.284 -11.344 1.0 50.51 ? 67 A 4 +ATOM 1013 H H . GLN A1 1 67 ? -8.597 14.338 -13.745 1.0 54.23 ? 67 A 4 +ATOM 1014 H HA . GLN A1 1 67 ? -6.698 14.272 -11.493 1.0 21.13 ? 67 A 4 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.061 15.933 -10.348 1.0 61.05 ? 67 A 4 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.523 16.553 -11.903 1.0 21.05 ? 67 A 4 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.618 16.57 -12.784 1.0 63.24 ? 67 A 4 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.168 15.222 -11.791 1.0 63.02 ? 67 A 4 +ATOM 1019 H HE21 . GLN A1 1 67 ? -10.475 18.446 -12.297 1.0 0.12 ? 67 A 4 +ATOM 1020 H HE22 . GLN A1 1 67 ? -11.063 18.932 -10.747 1.0 72.41 ? 67 A 4 +ATOM 1021 N N . LYS A1 1 68 ? -8.701 13.447 -9.836 1.0 63.33 ? 68 A 4 +ATOM 1022 C CA . LYS A1 1 68 ? -9.523 12.509 -9.08 1.0 34.0 ? 68 A 4 +ATOM 1023 C C . LYS A1 1 68 ? -11.006 12.756 -9.337 1.0 33.21 ? 68 A 4 +ATOM 1024 O O . LYS A1 1 68 ? -11.814 11.829 -9.299 1.0 33.01 ? 68 A 4 +ATOM 1025 C CB . LYS A1 1 68 ? -9.227 12.631 -7.583 1.0 41.41 ? 68 A 4 +ATOM 1026 C CG . LYS A1 1 68 ? -9.689 11.433 -6.772 1.0 61.44 ? 68 A 4 +ATOM 1027 C CD . LYS A1 1 68 ? -8.867 10.195 -7.087 1.0 43.41 ? 68 A 4 +ATOM 1028 C CE . LYS A1 1 68 ? -7.57 10.17 -6.292 1.0 23.43 ? 68 A 4 +ATOM 1029 N NZ . LYS A1 1 68 ? -7.82 10.152 -4.824 1.0 52.05 ? 68 A 4 +ATOM 1030 H H . LYS A1 1 68 ? -8.204 14.142 -9.355 1.0 75.53 ? 68 A 4 +ATOM 1031 H HA . LYS A1 1 68 ? -9.274 11.511 -9.407 1.0 31.4 ? 68 A 4 +ATOM 1032 H HB2 . LYS A1 1 68 ? -8.161 12.742 -7.447 1.0 51.5 ? 68 A 4 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.723 13.512 -7.201 1.0 62.4 ? 68 A 4 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.589 11.661 -5.721 1.0 22.33 ? 68 A 4 +ATOM 1035 H HG3 . LYS A1 1 68 ? -10.726 11.233 -7.002 1.0 45.02 ? 68 A 4 +ATOM 1036 H HD2 . LYS A1 1 68 ? -9.444 9.317 -6.84 1.0 14.2 ? 68 A 4 +ATOM 1037 H HD3 . LYS A1 1 68 ? -8.632 10.189 -8.142 1.0 13.53 ? 68 A 4 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.013 9.287 -6.565 1.0 43.13 ? 68 A 4 +ATOM 1039 H HE3 . LYS A1 1 68 ? -6.995 11.05 -6.54 1.0 63.42 ? 68 A 4 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.233 9.423 -4.37 1.0 1.54 ? 68 A 4 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -8.822 9.943 -4.635 1.0 73.32 ? 68 A 4 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -7.587 11.077 -4.41 1.0 23.44 ? 68 A 4 +ATOM 1043 N N . GLU A1 1 69 ? -11.356 14.011 -9.6 1.0 51.1 ? 69 A 4 +ATOM 1044 C CA . GLU A1 1 69 ? -12.742 14.378 -9.864 1.0 15.41 ? 69 A 4 +ATOM 1045 C C . GLU A1 1 69 ? -12.819 15.535 -10.857 1.0 20.25 ? 69 A 4 +ATOM 1046 O O . GLU A1 1 69 ? -13.054 16.681 -10.474 1.0 55.15 ? 69 A 4 +ATOM 1047 C CB . GLU A1 1 69 ? -13.448 14.761 -8.562 1.0 42.14 ? 69 A 4 +ATOM 1048 C CG . GLU A1 1 69 ? -13.647 13.593 -7.611 1.0 32.44 ? 69 A 4 +ATOM 1049 C CD . GLU A1 1 69 ? -14.052 14.037 -6.218 1.0 60.3 ? 69 A 4 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.196 15.259 -6.004 1.0 52.11 ? 69 A 4 +ATOM 1051 O OE2 . GLU A1 1 69 ? -14.225 13.163 -5.343 1.0 33.22 ? 69 A 4 +ATOM 1052 H H . GLU A1 1 69 ? -10.665 14.707 -9.616 1.0 51.55 ? 69 A 4 +ATOM 1053 H HA . GLU A1 1 69 ? -13.237 13.519 -10.291 1.0 21.13 ? 69 A 4 +ATOM 1054 H HB2 . GLU A1 1 69 ? -12.862 15.515 -8.057 1.0 70.35 ? 69 A 4 +ATOM 1055 H HB3 . GLU A1 1 69 ? -14.418 15.173 -8.801 1.0 25.14 ? 69 A 4 +ATOM 1056 H HG2 . GLU A1 1 69 ? -14.42 12.951 -8.006 1.0 60.54 ? 69 A 4 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.722 13.04 -7.542 1.0 2.43 ? 69 A 4 +ATOM 1058 N N . SER A1 1 70 ? -12.619 15.225 -12.134 1.0 51.41 ? 70 A 4 +ATOM 1059 C CA . SER A1 1 70 ? -12.661 16.238 -13.182 1.0 50.24 ? 70 A 4 +ATOM 1060 C C . SER A1 1 70 ? -14.067 16.362 -13.761 1.0 72.1 ? 70 A 4 +ATOM 1061 O O . SER A1 1 70 ? -14.678 15.37 -14.159 1.0 13.02 ? 70 A 4 +ATOM 1062 C CB . SER A1 1 70 ? -11.668 15.894 -14.293 1.0 75.43 ? 70 A 4 +ATOM 1063 O OG . SER A1 1 70 ? -12.31 15.851 -15.556 1.0 45.33 ? 70 A 4 +ATOM 1064 H H . SER A1 1 70 ? -12.436 14.293 -12.376 1.0 42.55 ? 70 A 4 +ATOM 1065 H HA . SER A1 1 70 ? -12.382 17.183 -12.741 1.0 61.25 ? 70 A 4 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.891 16.643 -14.323 1.0 1.23 ? 70 A 4 +ATOM 1067 H HB3 . SER A1 1 70 ? -11.229 14.927 -14.093 1.0 50.33 ? 70 A 4 +ATOM 1068 H HG . SER A1 1 70 ? -12.385 16.741 -15.907 1.0 14.24 ? 70 A 4 +ATOM 1069 N N . THR A1 1 71 ? -14.576 17.589 -13.805 1.0 52.55 ? 71 A 4 +ATOM 1070 C CA . THR A1 1 71 ? -15.91 17.845 -14.333 1.0 43.33 ? 71 A 4 +ATOM 1071 C C . THR A1 1 71 ? -15.854 18.222 -15.809 1.0 63.44 ? 71 A 4 +ATOM 1072 O O . THR A1 1 71 ? -15.308 19.264 -16.175 1.0 13.52 ? 71 A 4 +ATOM 1073 C CB . THR A1 1 71 ? -16.617 18.971 -13.555 1.0 4.41 ? 71 A 4 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.681 20.007 -13.235 1.0 4.41 ? 71 A 4 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.244 18.434 -12.277 1.0 4.35 ? 71 A 4 +ATOM 1076 H H . THR A1 1 71 ? -14.041 18.34 -13.472 1.0 14.04 ? 71 A 4 +ATOM 1077 H HA . THR A1 1 71 ? -16.491 16.941 -14.224 1.0 24.13 ? 71 A 4 +ATOM 1078 H HB . THR A1 1 71 ? -17.398 19.383 -14.177 1.0 70.41 ? 71 A 4 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.148 20.752 -12.848 1.0 53.11 ? 71 A 4 +ATOM 1080 H HG21 . THR A1 1 71 ? -18.249 18.099 -12.484 1.0 12.42 ? 71 A 4 +ATOM 1081 H HG22 . THR A1 1 71 ? -17.272 19.217 -11.534 1.0 75.2 ? 71 A 4 +ATOM 1082 H HG23 . THR A1 1 71 ? -16.656 17.607 -11.908 1.0 31.12 ? 71 A 4 +ATOM 1083 N N . LEU A1 1 72 ? -16.421 17.368 -16.655 1.0 74.32 ? 72 A 4 +ATOM 1084 C CA . LEU A1 1 72 ? -16.436 17.612 -18.093 1.0 62.12 ? 72 A 4 +ATOM 1085 C C . LEU A1 1 72 ? -17.848 17.479 -18.653 1.0 14.1 ? 72 A 4 +ATOM 1086 O O . LEU A1 1 72 ? -18.679 16.754 -18.105 1.0 22.33 ? 72 A 4 +ATOM 1087 C CB . LEU A1 1 72 ? -15.499 16.635 -18.805 1.0 54.24 ? 72 A 4 +ATOM 1088 C CG . LEU A1 1 72 ? -16.122 15.313 -19.255 1.0 12.34 ? 72 A 4 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.454 15.357 -20.739 1.0 71.53 ? 72 A 4 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.188 14.152 -18.95 1.0 45.31 ? 72 A 4 +ATOM 1091 H H . LEU A1 1 72 ? -16.84 16.555 -16.305 1.0 40.44 ? 72 A 4 +ATOM 1092 H HA . LEU A1 1 72 ? -16.088 18.62 -18.262 1.0 22.23 ? 72 A 4 +ATOM 1093 H HB2 . LEU A1 1 72 ? -15.108 17.131 -19.681 1.0 24.33 ? 72 A 4 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.686 16.406 -18.131 1.0 64.44 ? 72 A 4 +ATOM 1095 H HG . LEU A1 1 72 ? -17.044 15.154 -18.712 1.0 60.22 ? 72 A 4 +ATOM 1096 H HD11 . LEU A1 1 72 ? -16.578 14.351 -21.11 1.0 22.12 ? 72 A 4 +ATOM 1097 H HD12 . LEU A1 1 72 ? -15.65 15.842 -21.273 1.0 11.12 ? 72 A 4 +ATOM 1098 H HD13 . LEU A1 1 72 ? -17.37 15.911 -20.886 1.0 74.11 ? 72 A 4 +ATOM 1099 H HD21 . LEU A1 1 72 ? -15.725 13.221 -19.052 1.0 45.11 ? 72 A 4 +ATOM 1100 H HD22 . LEU A1 1 72 ? -14.816 14.245 -17.94 1.0 64.51 ? 72 A 4 +ATOM 1101 H HD23 . LEU A1 1 72 ? -14.357 14.167 -19.641 1.0 15.53 ? 72 A 4 +ATOM 1102 N N . HIS A1 1 73 ? -18.113 18.182 -19.75 1.0 22.1 ? 73 A 4 +ATOM 1103 C CA . HIS A1 1 73 ? -19.425 18.141 -20.386 1.0 43.22 ? 73 A 4 +ATOM 1104 C C . HIS A1 1 73 ? -19.433 17.154 -21.55 1.0 1.12 ? 73 A 4 +ATOM 1105 O O . HIS A1 1 73 ? -18.664 17.295 -22.502 1.0 41.41 ? 73 A 4 +ATOM 1106 C CB . HIS A1 1 73 ? -19.82 19.533 -20.88 1.0 34.11 ? 73 A 4 +ATOM 1107 C CG . HIS A1 1 73 ? -19.809 20.575 -19.805 1.0 25.31 ? 73 A 4 +ATOM 1108 N ND1 . HIS A1 1 73 ? -19.72 21.926 -20.067 1.0 22.31 ? 73 A 4 +ATOM 1109 C CD2 . HIS A1 1 73 ? -19.877 20.458 -18.458 1.0 30.12 ? 73 A 4 +ATOM 1110 C CE1 . HIS A1 1 73 ? -19.733 22.595 -18.928 1.0 74.03 ? 73 A 4 +ATOM 1111 N NE2 . HIS A1 1 73 ? -19.828 21.728 -17.936 1.0 22.32 ? 73 A 4 +ATOM 1112 H H . HIS A1 1 73 ? -17.41 18.742 -20.14 1.0 41.1 ? 73 A 4 +ATOM 1113 H HA . HIS A1 1 73 ? -20.141 17.813 -19.649 1.0 23.25 ? 73 A 4 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.129 19.844 -21.65 1.0 51.13 ? 73 A 4 +ATOM 1115 H HB3 . HIS A1 1 73 ? -20.818 19.492 -21.293 1.0 64.13 ? 73 A 4 +ATOM 1116 H HD1 . HIS A1 1 73 ? -19.656 22.333 -20.955 1.0 63.31 ? 73 A 4 +ATOM 1117 H HD2 . HIS A1 1 73 ? -19.955 19.538 -17.897 1.0 71.43 ? 73 A 4 +ATOM 1118 H HE1 . HIS A1 1 73 ? -19.676 23.668 -18.824 1.0 3.34 ? 73 A 4 +ATOM 1119 N N . LEU A1 1 74 ? -20.306 16.156 -21.467 1.0 31.4 ? 74 A 4 +ATOM 1120 C CA . LEU A1 1 74 ? -20.413 15.145 -22.513 1.0 41.22 ? 74 A 4 +ATOM 1121 C C . LEU A1 1 74 ? -21.662 15.369 -23.361 1.0 21.0 ? 74 A 4 +ATOM 1122 O O . LEU A1 1 74 ? -22.784 15.318 -22.858 1.0 70.53 ? 74 A 4 +ATOM 1123 C CB . LEU A1 1 74 ? -20.447 13.746 -21.896 1.0 42.32 ? 74 A 4 +ATOM 1124 C CG . LEU A1 1 74 ? -21.164 12.669 -22.712 1.0 13.02 ? 74 A 4 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.497 12.494 -24.067 1.0 50.12 ? 74 A 4 +ATOM 1126 C CD2 . LEU A1 1 74 ? -21.186 11.351 -21.952 1.0 22.4 ? 74 A 4 +ATOM 1127 H H . LEU A1 1 74 ? -20.892 16.097 -20.685 1.0 53.04 ? 74 A 4 +ATOM 1128 H HA . LEU A1 1 74 ? -19.543 15.23 -23.147 1.0 65.43 ? 74 A 4 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.427 13.425 -21.749 1.0 22.02 ? 74 A 4 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.941 13.82 -20.938 1.0 20.31 ? 74 A 4 +ATOM 1131 H HG . LEU A1 1 74 ? -22.187 12.976 -22.881 1.0 34.12 ? 74 A 4 +ATOM 1132 H HD11 . LEU A1 1 74 ? -20.505 11.45 -24.34 1.0 33.01 ? 74 A 4 +ATOM 1133 H HD12 . LEU A1 1 74 ? -19.477 12.844 -24.014 1.0 1.34 ? 74 A 4 +ATOM 1134 H HD13 . LEU A1 1 74 ? -21.035 13.065 -24.81 1.0 63.14 ? 74 A 4 +ATOM 1135 H HD21 . LEU A1 1 74 ? -20.179 11.078 -21.674 1.0 12.32 ? 74 A 4 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.608 10.581 -22.581 1.0 54.43 ? 74 A 4 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.789 11.459 -21.062 1.0 14.02 ? 74 A 4 +ATOM 1138 N N . VAL A1 1 75 ? -21.458 15.616 -24.651 1.0 43.5 ? 75 A 4 +ATOM 1139 C CA . VAL A1 1 75 ? -22.567 15.845 -25.57 1.0 52.32 ? 75 A 4 +ATOM 1140 C C . VAL A1 1 75 ? -22.713 14.689 -26.553 1.0 61.15 ? 75 A 4 +ATOM 1141 O O . VAL A1 1 75 ? -21.768 14.336 -27.259 1.0 54.31 ? 75 A 4 +ATOM 1142 C CB . VAL A1 1 75 ? -22.381 17.155 -26.359 1.0 24.5 ? 75 A 4 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.59 17.423 -27.242 1.0 55.3 ? 75 A 4 +ATOM 1144 C CG2 . VAL A1 1 75 ? -22.136 18.318 -25.409 1.0 64.14 ? 75 A 4 +ATOM 1145 H H . VAL A1 1 75 ? -20.54 15.644 -24.993 1.0 70.11 ? 75 A 4 +ATOM 1146 H HA . VAL A1 1 75 ? -23.473 15.926 -24.987 1.0 60.52 ? 75 A 4 +ATOM 1147 H HB . VAL A1 1 75 ? -21.515 17.048 -26.995 1.0 44.41 ? 75 A 4 +ATOM 1148 H HG11 . VAL A1 1 75 ? -23.292 17.39 -28.279 1.0 31.54 ? 75 A 4 +ATOM 1149 H HG12 . VAL A1 1 75 ? -24.344 16.671 -27.058 1.0 61.34 ? 75 A 4 +ATOM 1150 H HG13 . VAL A1 1 75 ? -23.992 18.399 -27.014 1.0 54.52 ? 75 A 4 +ATOM 1151 H HG21 . VAL A1 1 75 ? -22.002 19.225 -25.978 1.0 5.24 ? 75 A 4 +ATOM 1152 H HG22 . VAL A1 1 75 ? -22.983 18.427 -24.749 1.0 61.35 ? 75 A 4 +ATOM 1153 H HG23 . VAL A1 1 75 ? -21.247 18.125 -24.825 1.0 24.43 ? 75 A 4 +ATOM 1154 N N . LEU A1 1 76 ? -23.904 14.102 -26.594 1.0 35.1 ? 76 A 4 +ATOM 1155 C CA . LEU A1 1 76 ? -24.176 12.985 -27.492 1.0 22.53 ? 76 A 4 +ATOM 1156 C C . LEU A1 1 76 ? -25.374 13.284 -28.387 1.0 2.14 ? 76 A 4 +ATOM 1157 O O . LEU A1 1 76 ? -26.383 13.821 -27.931 1.0 21.5 ? 76 A 4 +ATOM 1158 C CB . LEU A1 1 76 ? -24.432 11.709 -26.688 1.0 73.12 ? 76 A 4 +ATOM 1159 C CG . LEU A1 1 76 ? -24.342 11.845 -25.167 1.0 64.45 ? 76 A 4 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.61 12.474 -24.612 1.0 24.13 ? 76 A 4 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.092 10.488 -24.524 1.0 22.03 ? 76 A 4 +ATOM 1162 H H . LEU A1 1 76 ? -24.618 14.427 -26.008 1.0 44.32 ? 76 A 4 +ATOM 1163 H HA . LEU A1 1 76 ? -23.305 12.84 -28.114 1.0 53.04 ? 76 A 4 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.424 11.359 -26.93 1.0 71.31 ? 76 A 4 +ATOM 1165 H HB3 . LEU A1 1 76 ? -23.706 10.971 -26.999 1.0 62.14 ? 76 A 4 +ATOM 1166 H HG . LEU A1 1 76 ? -23.512 12.492 -24.918 1.0 42.11 ? 76 A 4 +ATOM 1167 H HD11 . LEU A1 1 76 ? -26.437 12.261 -25.272 1.0 12.14 ? 76 A 4 +ATOM 1168 H HD12 . LEU A1 1 76 ? -25.477 13.543 -24.534 1.0 23.21 ? 76 A 4 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.815 12.066 -23.633 1.0 40.2 ? 76 A 4 +ATOM 1170 H HD21 . LEU A1 1 76 ? -24.053 9.729 -25.291 1.0 53.24 ? 76 A 4 +ATOM 1171 H HD22 . LEU A1 1 76 ? -24.893 10.264 -23.835 1.0 72.02 ? 76 A 4 +ATOM 1172 H HD23 . LEU A1 1 76 ? -23.153 10.511 -23.991 1.0 63.4 ? 76 A 4 +ATOM 1173 N N . ARG A1 1 77 ? -25.256 12.931 -29.663 1.0 50.44 ? 77 A 4 +ATOM 1174 C CA . ARG A1 1 77 ? -26.33 13.162 -30.622 1.0 12.4 ? 77 A 4 +ATOM 1175 C C . ARG A1 1 77 ? -26.916 11.84 -31.109 1.0 10.32 ? 77 A 4 +ATOM 1176 O O . ARG A1 1 77 ? -26.773 11.479 -32.278 1.0 12.43 ? 77 A 4 +ATOM 1177 C CB . ARG A1 1 77 ? -25.814 13.973 -31.812 1.0 55.35 ? 77 A 4 +ATOM 1178 C CG . ARG A1 1 77 ? -24.539 13.415 -32.423 1.0 12.22 ? 77 A 4 +ATOM 1179 C CD . ARG A1 1 77 ? -23.305 14.1 -31.857 1.0 60.22 ? 77 A 4 +ATOM 1180 N NE . ARG A1 1 77 ? -23.258 15.518 -32.205 1.0 64.33 ? 77 A 4 +ATOM 1181 C CZ . ARG A1 1 77 ? -22.183 16.28 -32.037 1.0 13.31 ? 77 A 4 +ATOM 1182 N NH1 . ARG A1 1 77 ? -21.072 15.763 -31.53 1.0 63.3 ? 77 A 4 +ATOM 1183 N NH2 . ARG A1 1 77 ? -22.217 17.562 -32.378 1.0 70.54 ? 77 A 4 +ATOM 1184 H H . ARG A1 1 77 ? -24.426 12.507 -29.967 1.0 2.41 ? 77 A 4 +ATOM 1185 H HA . ARG A1 1 77 ? -27.105 13.724 -30.123 1.0 53.23 ? 77 A 4 +ATOM 1186 H HB2 . ARG A1 1 77 ? -26.576 13.991 -32.578 1.0 41.04 ? 77 A 4 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.619 14.983 -31.486 1.0 23.23 ? 77 A 4 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.481 12.358 -32.209 1.0 3.21 ? 77 A 4 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.567 13.567 -33.492 1.0 45.32 ? 77 A 4 +ATOM 1190 H HD2 . ARG A1 1 77 ? -23.317 14.003 -30.782 1.0 24.22 ? 77 A 4 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.426 13.612 -32.253 1.0 55.12 ? 77 A 4 +ATOM 1192 H HE . ARG A1 1 77 ? -24.067 15.92 -32.581 1.0 41.44 ? 77 A 4 +ATOM 1193 H HH11 . ARG A1 1 77 ? -21.043 14.798 -31.273 1.0 31.24 ? 77 A 4 +ATOM 1194 H HH12 . ARG A1 1 77 ? -20.264 16.339 -31.406 1.0 72.5 ? 77 A 4 +ATOM 1195 H HH21 . ARG A1 1 77 ? -23.053 17.955 -32.761 1.0 71.34 ? 77 A 4 +ATOM 1196 H HH22 . ARG A1 1 77 ? -21.408 18.135 -32.251 1.0 1.44 ? 77 A 4 +ATOM 1197 N N . LEU A1 1 78 ? -27.575 11.122 -30.206 1.0 31.03 ? 78 A 4 +ATOM 1198 C CA . LEU A1 1 78 ? -28.183 9.84 -30.544 1.0 51.32 ? 78 A 4 +ATOM 1199 C C . LEU A1 1 78 ? -29.299 10.019 -31.567 1.0 14.11 ? 78 A 4 +ATOM 1200 O O . LEU A1 1 78 ? -29.531 9.148 -32.407 1.0 12.31 ? 78 A 4 +ATOM 1201 C CB . LEU A1 1 78 ? -28.732 9.166 -29.285 1.0 42.51 ? 78 A 4 +ATOM 1202 C CG . LEU A1 1 78 ? -27.753 8.277 -28.518 1.0 51.45 ? 78 A 4 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.593 9.1 -27.98 1.0 14.44 ? 78 A 4 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.466 7.553 -27.385 1.0 25.32 ? 78 A 4 +ATOM 1205 H H . LEU A1 1 78 ? -27.655 11.462 -29.291 1.0 75.31 ? 78 A 4 +ATOM 1206 H HA . LEU A1 1 78 ? -27.415 9.212 -30.972 1.0 64.2 ? 78 A 4 +ATOM 1207 H HB2 . LEU A1 1 78 ? -29.068 9.943 -28.615 1.0 61.14 ? 78 A 4 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.575 8.557 -29.578 1.0 62.32 ? 78 A 4 +ATOM 1209 H HG . LEU A1 1 78 ? -27.35 7.532 -29.19 1.0 53.42 ? 78 A 4 +ATOM 1210 H HD11 . LEU A1 1 78 ? -25.967 8.477 -27.359 1.0 3.24 ? 78 A 4 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.976 9.923 -27.395 1.0 74.14 ? 78 A 4 +ATOM 1212 H HD13 . LEU A1 1 78 ? -26.012 9.485 -28.806 1.0 11.41 ? 78 A 4 +ATOM 1213 H HD21 . LEU A1 1 78 ? -28.116 6.533 -27.333 1.0 65.32 ? 78 A 4 +ATOM 1214 H HD22 . LEU A1 1 78 ? -29.531 7.56 -27.567 1.0 65.43 ? 78 A 4 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.258 8.054 -26.45 1.0 34.04 ? 78 A 4 +ATOM 1216 N N . ARG A1 1 79 ? -29.987 11.153 -31.493 1.0 44.5 ? 79 A 4 +ATOM 1217 C CA . ARG A1 1 79 ? -31.079 11.447 -32.413 1.0 54.44 ? 79 A 4 +ATOM 1218 C C . ARG A1 1 79 ? -30.591 11.427 -33.859 1.0 43.43 ? 79 A 4 +ATOM 1219 O O . ARG A1 1 79 ? -31.355 11.136 -34.778 1.0 24.23 ? 79 A 4 +ATOM 1220 C CB . ARG A1 1 79 ? -31.693 12.81 -32.09 1.0 53.1 ? 79 A 4 +ATOM 1221 C CG . ARG A1 1 79 ? -33.179 12.749 -31.777 1.0 62.42 ? 79 A 4 +ATOM 1222 C CD . ARG A1 1 79 ? -33.464 11.824 -30.604 1.0 15.2 ? 79 A 4 +ATOM 1223 N NE . ARG A1 1 79 ? -34.776 12.074 -30.015 1.0 22.21 ? 79 A 4 +ATOM 1224 C CZ . ARG A1 1 79 ? -35.417 11.199 -29.248 1.0 43.33 ? 79 A 4 +ATOM 1225 N NH1 . ARG A1 1 79 ? -34.868 10.022 -28.979 1.0 51.34 ? 79 A 4 +ATOM 1226 N NH2 . ARG A1 1 79 ? -36.609 11.499 -28.749 1.0 24.34 ? 79 A 4 +ATOM 1227 H H . ARG A1 1 79 ? -29.755 11.809 -30.801 1.0 30.43 ? 79 A 4 +ATOM 1228 H HA . ARG A1 1 79 ? -31.832 10.684 -32.289 1.0 75.12 ? 79 A 4 +ATOM 1229 H HB2 . ARG A1 1 79 ? -31.184 13.228 -31.234 1.0 72.51 ? 79 A 4 +ATOM 1230 H HB3 . ARG A1 1 79 ? -31.553 13.464 -32.938 1.0 62.3 ? 79 A 4 +ATOM 1231 H HG2 . ARG A1 1 79 ? -33.527 13.742 -31.53 1.0 34.21 ? 79 A 4 +ATOM 1232 H HG3 . ARG A1 1 79 ? -33.707 12.386 -32.646 1.0 51.44 ? 79 A 4 +ATOM 1233 H HD2 . ARG A1 1 79 ? -33.424 10.802 -30.95 1.0 21.42 ? 79 A 4 +ATOM 1234 H HD3 . ARG A1 1 79 ? -32.706 11.978 -29.85 1.0 24.22 ? 79 A 4 +ATOM 1235 H HE . ARG A1 1 79 ? -35.2 12.937 -30.201 1.0 63.2 ? 79 A 4 +ATOM 1236 H HH11 . ARG A1 1 79 ? -33.969 9.793 -29.353 1.0 0.03 ? 79 A 4 +ATOM 1237 H HH12 . ARG A1 1 79 ? -35.352 9.365 -28.4 1.0 54.33 ? 79 A 4 +ATOM 1238 H HH21 . ARG A1 1 79 ? -37.026 12.385 -28.95 1.0 72.3 ? 79 A 4 +ATOM 1239 H HH22 . ARG A1 1 79 ? -37.09 10.84 -28.172 1.0 2.44 ? 79 A 4 +ATOM 1240 N N . GLY A1 1 80 ? -29.313 11.737 -34.052 1.0 11.03 ? 80 A 4 +ATOM 1241 C CA . GLY A1 1 80 ? -28.745 11.749 -35.387 1.0 3.12 ? 80 A 4 +ATOM 1242 C C . GLY A1 1 80 ? -28.493 10.354 -35.922 1.0 52.34 ? 80 A 4 +ATOM 1243 O O . GLY A1 1 80 ? -29.216 9.875 -36.795 1.0 43.44 ? 80 A 4 +ATOM 1244 H H . GLY A1 1 80 ? -28.75 11.96 -33.28 1.0 0.24 ? 80 A 4 +ATOM 1245 H HA2 . GLY A1 1 80 ? -29.426 12.26 -36.051 1.0 71.24 ? 80 A 4 +ATOM 1246 H HA3 . GLY A1 1 80 ? -27.809 12.288 -35.364 1.0 43.14 ? 80 A 4 +ATOM 1247 N N . GLY A1 1 81 ? -27.46 9.699 -35.399 1.0 43.34 ? 81 A 4 +ATOM 1248 C CA . GLY A1 1 81 ? -27.131 8.357 -35.844 1.0 20.2 ? 81 A 4 +ATOM 1249 C C . GLY A1 1 81 ? -26.628 8.326 -37.273 1.0 63.23 ? 81 A 4 +ATOM 1250 O O . GLY A1 1 81 ? -26.772 9.302 -38.01 1.0 30.24 ? 81 A 4 +ATOM 1251 H H . GLY A1 1 81 ? -26.918 10.13 -34.706 1.0 11.33 ? 81 A 4 +ATOM 1252 H HA2 . GLY A1 1 81 ? -26.368 7.952 -35.196 1.0 30.51 ? 81 A 4 +ATOM 1253 H HA3 . GLY A1 1 81 ? -28.015 7.74 -35.772 1.0 55.14 ? 81 A 4 +ATOM 1254 N N . VAL A1 1 82 ? -26.036 7.204 -37.667 1.0 30.52 ? 82 A 4 +ATOM 1255 C CA . VAL A1 1 82 ? -25.509 7.05 -39.018 1.0 4.45 ? 82 A 4 +ATOM 1256 C C . VAL A1 1 82 ? -26.263 5.967 -39.782 1.0 63.52 ? 82 A 4 +ATOM 1257 O O . VAL A1 1 82 ? -26.525 6.104 -40.977 1.0 12.52 ? 82 A 4 +ATOM 1258 C CB . VAL A1 1 82 ? -24.01 6.699 -38.999 1.0 53.54 ? 82 A 4 +ATOM 1259 C CG1 . VAL A1 1 82 ? -23.79 5.325 -38.385 1.0 33.31 ? 82 A 4 +ATOM 1260 C CG2 . VAL A1 1 82 ? -23.43 6.764 -40.404 1.0 1.13 ? 82 A 4 +ATOM 1261 H H . VAL A1 1 82 ? -25.952 6.46 -37.034 1.0 42.11 ? 82 A 4 +ATOM 1262 H HA . VAL A1 1 82 ? -25.631 7.992 -39.533 1.0 65.12 ? 82 A 4 +ATOM 1263 H HB . VAL A1 1 82 ? -23.498 7.428 -38.387 1.0 3.02 ? 82 A 4 +ATOM 1264 H HG11 . VAL A1 1 82 ? -24.437 5.206 -37.529 1.0 71.54 ? 82 A 4 +ATOM 1265 H HG12 . VAL A1 1 82 ? -24.016 4.563 -39.117 1.0 43.52 ? 82 A 4 +ATOM 1266 H HG13 . VAL A1 1 82 ? -22.76 5.231 -38.074 1.0 60.31 ? 82 A 4 +ATOM 1267 H HG21 . VAL A1 1 82 ? -23.442 7.786 -40.752 1.0 51.1 ? 82 A 4 +ATOM 1268 H HG22 . VAL A1 1 82 ? -22.414 6.399 -40.391 1.0 43.42 ? 82 A 4 +ATOM 1269 H HG23 . VAL A1 1 82 ? -24.024 6.152 -41.067 1.0 61.21 ? 82 A 4 +ATOM 1 N N . GLY A1 1 1 ? -7.895 -5.399 -4.914 1.0 13.0 ? 1 A 5 +ATOM 2 C CA . GLY A1 1 1 ? -7.708 -4.184 -4.141 1.0 45.03 ? 1 A 5 +ATOM 3 C C . GLY A1 1 1 ? -6.451 -3.434 -4.534 1.0 65.21 ? 1 A 5 +ATOM 4 O O . GLY A1 1 1 ? -5.48 -3.37 -3.78 1.0 33.34 ? 1 A 5 +ATOM 5 H H1 . GLY A1 1 1 ? -7.317 -6.174 -4.752 1.0 52.4 ? 1 A 5 +ATOM 6 H HA2 . GLY A1 1 1 ? -8.561 -3.54 -4.292 1.0 14.15 ? 1 A 5 +ATOM 7 H HA3 . GLY A1 1 1 ? -7.646 -4.443 -3.094 1.0 34.23 ? 1 A 5 +ATOM 8 N N . PRO A1 1 2 ? -6.458 -2.851 -5.742 1.0 55.32 ? 2 A 5 +ATOM 9 C CA . PRO A1 1 2 ? -5.316 -2.093 -6.262 1.0 21.43 ? 2 A 5 +ATOM 10 C C . PRO A1 1 2 ? -5.108 -0.777 -5.519 1.0 41.45 ? 2 A 5 +ATOM 11 O O . PRO A1 1 2 ? -5.823 -0.472 -4.564 1.0 62.42 ? 2 A 5 +ATOM 12 C CB . PRO A1 1 2 ? -5.7 -1.83 -7.72 1.0 51.45 ? 2 A 5 +ATOM 13 C CG . PRO A1 1 2 ? -7.189 -1.876 -7.735 1.0 43.11 ? 2 A 5 +ATOM 14 C CD . PRO A1 1 2 ? -7.581 -2.888 -6.693 1.0 64.14 ? 2 A 5 +ATOM 15 H HA . PRO A1 1 2 ? -4.406 -2.673 -6.226 1.0 31.54 ? 2 A 5 +ATOM 16 H HB2 . PRO A1 1 2 ? -5.331 -0.859 -8.022 1.0 42.4 ? 2 A 5 +ATOM 17 H HB3 . PRO A1 1 2 ? -5.275 -2.595 -8.352 1.0 62.54 ? 2 A 5 +ATOM 18 H HG2 . PRO A1 1 2 ? -7.589 -0.906 -7.485 1.0 3.22 ? 2 A 5 +ATOM 19 H HG3 . PRO A1 1 2 ? -7.536 -2.188 -8.709 1.0 51.14 ? 2 A 5 +ATOM 20 H HD2 . PRO A1 1 2 ? -8.503 -2.596 -6.213 1.0 11.0 ? 2 A 5 +ATOM 21 H HD3 . PRO A1 1 2 ? -7.679 -3.868 -7.137 1.0 24.12 ? 2 A 5 +ATOM 22 N N . LEU A1 1 3 ? -4.127 -0.001 -5.965 1.0 34.12 ? 3 A 5 +ATOM 23 C CA . LEU A1 1 3 ? -3.825 1.284 -5.343 1.0 54.03 ? 3 A 5 +ATOM 24 C C . LEU A1 1 3 ? -3.705 2.383 -6.394 1.0 63.21 ? 3 A 5 +ATOM 25 O O . LEU A1 1 3 ? -3.364 2.119 -7.546 1.0 11.24 ? 3 A 5 +ATOM 26 C CB . LEU A1 1 3 ? -2.529 1.19 -4.536 1.0 60.12 ? 3 A 5 +ATOM 27 C CG . LEU A1 1 3 ? -2.679 1.248 -3.015 1.0 64.13 ? 3 A 5 +ATOM 28 C CD1 . LEU A1 1 3 ? -2.66 -0.153 -2.424 1.0 62.25 ? 3 A 5 +ATOM 29 C CD2 . LEU A1 1 3 ? -1.579 2.102 -2.403 1.0 0.12 ? 3 A 5 +ATOM 30 H H . LEU A1 1 3 ? -3.592 -0.297 -6.73 1.0 52.35 ? 3 A 5 +ATOM 31 H HA . LEU A1 1 3 ? -4.638 1.528 -4.676 1.0 43.13 ? 3 A 5 +ATOM 32 H HB2 . LEU A1 1 3 ? -2.051 0.255 -4.786 1.0 74.24 ? 3 A 5 +ATOM 33 H HB3 . LEU A1 1 3 ? -1.892 2.01 -4.838 1.0 72.41 ? 3 A 5 +ATOM 34 H HG . LEU A1 1 3 ? -3.631 1.7 -2.771 1.0 43.5 ? 3 A 5 +ATOM 35 H HD11 . LEU A1 1 3 ? -3.389 -0.767 -2.93 1.0 50.45 ? 3 A 5 +ATOM 36 H HD12 . LEU A1 1 3 ? -2.9 -0.103 -1.372 1.0 4.34 ? 3 A 5 +ATOM 37 H HD13 . LEU A1 1 3 ? -1.677 -0.583 -2.548 1.0 54.42 ? 3 A 5 +ATOM 38 H HD21 . LEU A1 1 3 ? -0.633 1.59 -2.494 1.0 23.33 ? 3 A 5 +ATOM 39 H HD22 . LEU A1 1 3 ? -1.797 2.275 -1.359 1.0 1.01 ? 3 A 5 +ATOM 40 H HD23 . LEU A1 1 3 ? -1.529 3.049 -2.921 1.0 75.24 ? 3 A 5 +ATOM 41 N N . GLY A1 1 4 ? -3.985 3.617 -5.987 1.0 4.21 ? 4 A 5 +ATOM 42 C CA . GLY A1 1 4 ? -3.901 4.738 -6.905 1.0 43.34 ? 4 A 5 +ATOM 43 C C . GLY A1 1 4 ? -5.136 4.87 -7.774 1.0 32.24 ? 4 A 5 +ATOM 44 O O . GLY A1 1 4 ? -6.26 4.721 -7.295 1.0 73.31 ? 4 A 5 +ATOM 45 H H . GLY A1 1 4 ? -4.252 3.768 -5.056 1.0 2.13 ? 4 A 5 +ATOM 46 H HA2 . GLY A1 1 4 ? -3.776 5.647 -6.335 1.0 53.5 ? 4 A 5 +ATOM 47 H HA3 . GLY A1 1 4 ? -3.039 4.602 -7.542 1.0 61.41 ? 4 A 5 +ATOM 48 N N . SER A1 1 5 ? -4.928 5.151 -9.056 1.0 14.33 ? 5 A 5 +ATOM 49 C CA . SER A1 1 5 ? -6.033 5.309 -9.994 1.0 12.42 ? 5 A 5 +ATOM 50 C C . SER A1 1 5 ? -6.923 6.482 -9.593 1.0 43.22 ? 5 A 5 +ATOM 51 O O . SER A1 1 5 ? -6.816 7.004 -8.484 1.0 33.52 ? 5 A 5 +ATOM 52 C CB . SER A1 1 5 ? -6.862 4.024 -10.058 1.0 72.02 ? 5 A 5 +ATOM 53 O OG . SER A1 1 5 ? -6.824 3.457 -11.356 1.0 21.35 ? 5 A 5 +ATOM 54 H H . SER A1 1 5 ? -4.008 5.258 -9.379 1.0 31.12 ? 5 A 5 +ATOM 55 H HA . SER A1 1 5 ? -5.615 5.506 -10.97 1.0 12.32 ? 5 A 5 +ATOM 56 H HB2 . SER A1 1 5 ? -6.467 3.308 -9.354 1.0 41.01 ? 5 A 5 +ATOM 57 H HB3 . SER A1 1 5 ? -7.888 4.248 -9.806 1.0 74.13 ? 5 A 5 +ATOM 58 H HG . SER A1 1 5 ? -7.695 3.124 -11.586 1.0 33.45 ? 5 A 5 +ATOM 59 N N . MET A1 1 6 ? -7.8 6.89 -10.504 1.0 14.01 ? 6 A 5 +ATOM 60 C CA . MET A1 1 6 ? -8.709 8.0 -10.246 1.0 54.33 ? 6 A 5 +ATOM 61 C C . MET A1 1 6 ? -10.032 7.801 -10.978 1.0 31.44 ? 6 A 5 +ATOM 62 O O . MET A1 1 6 ? -10.26 6.76 -11.593 1.0 1.11 ? 6 A 5 +ATOM 63 C CB . MET A1 1 6 ? -8.069 9.322 -10.675 1.0 70.21 ? 6 A 5 +ATOM 64 C CG . MET A1 1 6 ? -7.267 9.219 -11.962 1.0 25.05 ? 6 A 5 +ATOM 65 S SD . MET A1 1 6 ? -5.524 8.865 -11.667 1.0 3.44 ? 6 A 5 +ATOM 66 C CE . MET A1 1 6 ? -4.759 10.328 -12.363 1.0 13.21 ? 6 A 5 +ATOM 67 H H . MET A1 1 6 ? -7.838 6.433 -11.371 1.0 2.32 ? 6 A 5 +ATOM 68 H HA . MET A1 1 6 ? -8.9 8.031 -9.183 1.0 5.22 ? 6 A 5 +ATOM 69 H HB2 . MET A1 1 6 ? -8.848 10.055 -10.819 1.0 62.43 ? 6 A 5 +ATOM 70 H HB3 . MET A1 1 6 ? -7.408 9.66 -9.891 1.0 63.34 ? 6 A 5 +ATOM 71 H HG2 . MET A1 1 6 ? -7.682 8.427 -12.567 1.0 33.13 ? 6 A 5 +ATOM 72 H HG3 . MET A1 1 6 ? -7.346 10.155 -12.494 1.0 12.41 ? 6 A 5 +ATOM 73 H HE1 . MET A1 1 6 ? -4.584 10.175 -13.418 1.0 12.23 ? 6 A 5 +ATOM 74 H HE2 . MET A1 1 6 ? -5.414 11.176 -12.226 1.0 52.54 ? 6 A 5 +ATOM 75 H HE3 . MET A1 1 6 ? -3.819 10.514 -11.865 1.0 2.41 ? 6 A 5 +ATOM 76 N N . GLN A1 1 7 ? -10.9 8.805 -10.906 1.0 13.12 ? 7 A 5 +ATOM 77 C CA . GLN A1 1 7 ? -12.201 8.738 -11.562 1.0 13.2 ? 7 A 5 +ATOM 78 C C . GLN A1 1 7 ? -12.551 10.072 -12.213 1.0 42.42 ? 7 A 5 +ATOM 79 O O . GLN A1 1 7 ? -12.021 11.116 -11.835 1.0 71.33 ? 7 A 5 +ATOM 80 C CB . GLN A1 1 7 ? -13.284 8.349 -10.554 1.0 42.01 ? 7 A 5 +ATOM 81 C CG . GLN A1 1 7 ? -12.85 7.264 -9.582 1.0 12.34 ? 7 A 5 +ATOM 82 C CD . GLN A1 1 7 ? -13.875 7.01 -8.494 1.0 44.31 ? 7 A 5 +ATOM 83 O OE1 . GLN A1 1 7 ? -15.08 7.103 -8.728 1.0 33.44 ? 7 A 5 +ATOM 84 N NE2 . GLN A1 1 7 ? -13.401 6.687 -7.297 1.0 73.32 ? 7 A 5 +ATOM 85 H H . GLN A1 1 7 ? -10.661 9.609 -10.4 1.0 71.21 ? 7 A 5 +ATOM 86 H HA . GLN A1 1 7 ? -12.147 7.98 -12.328 1.0 62.03 ? 7 A 5 +ATOM 87 H HB2 . GLN A1 1 7 ? -13.56 9.224 -9.984 1.0 13.25 ? 7 A 5 +ATOM 88 H HB3 . GLN A1 1 7 ? -14.149 7.993 -11.093 1.0 41.42 ? 7 A 5 +ATOM 89 H HG2 . GLN A1 1 7 ? -12.696 6.347 -10.131 1.0 43.33 ? 7 A 5 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.922 7.565 -9.118 1.0 33.21 ? 7 A 5 +ATOM 91 H HE21 . GLN A1 1 7 ? -12.428 6.634 -7.184 1.0 52.01 ? 7 A 5 +ATOM 92 H HE22 . GLN A1 1 7 ? -14.041 6.519 -6.576 1.0 55.43 ? 7 A 5 +ATOM 93 N N . ILE A1 1 8 ? -13.447 10.028 -13.194 1.0 12.12 ? 8 A 5 +ATOM 94 C CA . ILE A1 1 8 ? -13.868 11.233 -13.897 1.0 64.2 ? 8 A 5 +ATOM 95 C C . ILE A1 1 8 ? -15.388 11.334 -13.954 1.0 0.33 ? 8 A 5 +ATOM 96 O O . ILE A1 1 8 ? -16.093 10.334 -13.818 1.0 11.35 ? 8 A 5 +ATOM 97 C CB . ILE A1 1 8 ? -13.309 11.272 -15.332 1.0 65.34 ? 8 A 5 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.467 10.025 -15.609 1.0 72.33 ? 8 A 5 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.484 12.533 -15.545 1.0 55.24 ? 8 A 5 +ATOM 100 C CD1 . ILE A1 1 8 ? -12.044 9.889 -17.055 1.0 11.02 ? 8 A 5 +ATOM 101 H H . ILE A1 1 8 ? -13.834 9.165 -13.45 1.0 43.45 ? 8 A 5 +ATOM 102 H HA . ILE A1 1 8 ? -13.48 12.086 -13.358 1.0 41.41 ? 8 A 5 +ATOM 103 H HB . ILE A1 1 8 ? -14.141 11.295 -16.018 1.0 13.24 ? 8 A 5 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.573 10.06 -15.005 1.0 4.11 ? 8 A 5 +ATOM 105 H HG13 . ILE A1 1 8 ? -13.04 9.148 -15.346 1.0 33.41 ? 8 A 5 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.753 12.358 -16.321 1.0 12.11 ? 8 A 5 +ATOM 107 H HG22 . ILE A1 1 8 ? -13.134 13.342 -15.84 1.0 14.43 ? 8 A 5 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.979 12.793 -14.627 1.0 53.13 ? 8 A 5 +ATOM 109 H HD11 . ILE A1 1 8 ? -10.984 9.684 -17.102 1.0 4.51 ? 8 A 5 +ATOM 110 H HD12 . ILE A1 1 8 ? -12.588 9.077 -17.514 1.0 22.53 ? 8 A 5 +ATOM 111 H HD13 . ILE A1 1 8 ? -12.256 10.809 -17.58 1.0 32.23 ? 8 A 5 +ATOM 112 N N . PHE A1 1 9 ? -15.888 12.549 -14.155 1.0 44.42 ? 9 A 5 +ATOM 113 C CA . PHE A1 1 9 ? -17.326 12.781 -14.231 1.0 45.42 ? 9 A 5 +ATOM 114 C C . PHE A1 1 9 ? -17.737 13.193 -15.641 1.0 62.05 ? 9 A 5 +ATOM 115 O O . PHE A1 1 9 ? -17.195 14.144 -16.205 1.0 33.13 ? 9 A 5 +ATOM 116 C CB . PHE A1 1 9 ? -17.742 13.861 -13.23 1.0 42.3 ? 9 A 5 +ATOM 117 C CG . PHE A1 1 9 ? -18.346 13.31 -11.97 1.0 44.44 ? 9 A 5 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.615 12.753 -11.981 1.0 24.21 ? 9 A 5 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.646 13.349 -10.775 1.0 24.11 ? 9 A 5 +ATOM 120 C CE1 . PHE A1 1 9 ? -20.174 12.244 -10.823 1.0 54.33 ? 9 A 5 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.2 12.842 -9.615 1.0 62.43 ? 9 A 5 +ATOM 122 C CZ . PHE A1 1 9 ? -19.466 12.29 -9.639 1.0 72.21 ? 9 A 5 +ATOM 123 H H . PHE A1 1 9 ? -15.275 13.307 -14.256 1.0 15.35 ? 9 A 5 +ATOM 124 H HA . PHE A1 1 9 ? -17.823 11.858 -13.979 1.0 72.15 ? 9 A 5 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.874 14.441 -12.954 1.0 13.22 ? 9 A 5 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.471 14.509 -13.693 1.0 20.44 ? 9 A 5 +ATOM 127 H HD1 . PHE A1 1 9 ? -20.171 12.717 -12.907 1.0 63.23 ? 9 A 5 +ATOM 128 H HD2 . PHE A1 1 9 ? -16.656 13.781 -10.755 1.0 43.5 ? 9 A 5 +ATOM 129 H HE1 . PHE A1 1 9 ? -21.164 11.814 -10.846 1.0 53.21 ? 9 A 5 +ATOM 130 H HE2 . PHE A1 1 9 ? -17.644 12.879 -8.69 1.0 61.25 ? 9 A 5 +ATOM 131 H HZ . PHE A1 1 9 ? -19.9 11.892 -8.733 1.0 11.33 ? 9 A 5 +ATOM 132 N N . VAL A1 1 10 ? -18.7 12.471 -16.205 1.0 35.51 ? 10 A 5 +ATOM 133 C CA . VAL A1 1 10 ? -19.185 12.76 -17.549 1.0 51.35 ? 10 A 5 +ATOM 134 C C . VAL A1 1 10 ? -20.647 13.191 -17.524 1.0 20.3 ? 10 A 5 +ATOM 135 O O . VAL A1 1 10 ? -21.5 12.502 -16.964 1.0 33.54 ? 10 A 5 +ATOM 136 C CB . VAL A1 1 10 ? -19.037 11.538 -18.475 1.0 1.24 ? 10 A 5 +ATOM 137 C CG1 . VAL A1 1 10 ? -19.034 11.97 -19.933 1.0 43.55 ? 10 A 5 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.772 10.764 -18.136 1.0 70.41 ? 10 A 5 +ATOM 139 H H . VAL A1 1 10 ? -19.093 11.726 -15.705 1.0 13.11 ? 10 A 5 +ATOM 140 H HA . VAL A1 1 10 ? -18.589 13.566 -17.953 1.0 52.2 ? 10 A 5 +ATOM 141 H HB . VAL A1 1 10 ? -19.885 10.888 -18.317 1.0 21.21 ? 10 A 5 +ATOM 142 H HG11 . VAL A1 1 10 ? -20.023 12.3 -20.213 1.0 75.22 ? 10 A 5 +ATOM 143 H HG12 . VAL A1 1 10 ? -18.331 12.78 -20.068 1.0 54.41 ? 10 A 5 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.745 11.135 -20.555 1.0 61.31 ? 10 A 5 +ATOM 145 H HG21 . VAL A1 1 10 ? -16.936 11.446 -18.081 1.0 13.24 ? 10 A 5 +ATOM 146 H HG22 . VAL A1 1 10 ? -17.897 10.269 -17.185 1.0 62.44 ? 10 A 5 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.584 10.027 -18.904 1.0 2.35 ? 10 A 5 +ATOM 148 N N . LYS A1 1 11 ? -20.931 14.336 -18.136 1.0 23.3 ? 11 A 5 +ATOM 149 C CA . LYS A1 1 11 ? -22.291 14.86 -18.187 1.0 10.31 ? 11 A 5 +ATOM 150 C C . LYS A1 1 11 ? -22.886 14.695 -19.582 1.0 22.12 ? 11 A 5 +ATOM 151 O O . LYS A1 1 11 ? -22.432 15.322 -20.54 1.0 63.21 ? 11 A 5 +ATOM 152 C CB . LYS A1 1 11 ? -22.305 16.337 -17.786 1.0 34.41 ? 11 A 5 +ATOM 153 C CG . LYS A1 1 11 ? -23.622 17.035 -18.083 1.0 63.11 ? 11 A 5 +ATOM 154 C CD . LYS A1 1 11 ? -23.578 18.5 -17.684 1.0 3.15 ? 11 A 5 +ATOM 155 C CE . LYS A1 1 11 ? -23.18 19.385 -18.855 1.0 2.52 ? 11 A 5 +ATOM 156 N NZ . LYS A1 1 11 ? -23.337 20.831 -18.535 1.0 51.12 ? 11 A 5 +ATOM 157 H H . LYS A1 1 11 ? -20.208 14.841 -18.565 1.0 4.15 ? 11 A 5 +ATOM 158 H HA . LYS A1 1 11 ? -22.889 14.299 -17.485 1.0 44.21 ? 11 A 5 +ATOM 159 H HB2 . LYS A1 1 11 ? -22.113 16.412 -16.726 1.0 75.01 ? 11 A 5 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.521 16.851 -18.323 1.0 15.43 ? 11 A 5 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.824 16.967 -19.141 1.0 73.24 ? 11 A 5 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.411 16.544 -17.531 1.0 30.03 ? 11 A 5 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.557 18.799 -17.338 1.0 63.51 ? 11 A 5 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.859 18.626 -16.887 1.0 61.22 ? 11 A 5 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.148 19.19 -19.102 1.0 70.24 ? 11 A 5 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.805 19.142 -19.701 1.0 3.13 ? 11 A 5 +ATOM 167 H HZ1 . LYS A1 1 11 ? -23.966 21.284 -19.228 1.0 1.34 ? 11 A 5 +ATOM 168 H HZ2 . LYS A1 1 11 ? -22.411 21.305 -18.561 1.0 61.44 ? 11 A 5 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.745 20.945 -17.586 1.0 12.11 ? 11 A 5 +ATOM 170 N N . THR A1 1 12 ? -23.905 13.848 -19.689 1.0 60.33 ? 12 A 5 +ATOM 171 C CA . THR A1 1 12 ? -24.562 13.601 -20.967 1.0 63.11 ? 12 A 5 +ATOM 172 C C . THR A1 1 12 ? -25.429 14.786 -21.377 1.0 63.2 ? 12 A 5 +ATOM 173 O O . THR A1 1 12 ? -25.79 15.622 -20.547 1.0 23.14 ? 12 A 5 +ATOM 174 C CB . THR A1 1 12 ? -25.436 12.334 -20.913 1.0 13.53 ? 12 A 5 +ATOM 175 O OG1 . THR A1 1 12 ? -26.489 12.505 -19.957 1.0 44.22 ? 12 A 5 +ATOM 176 C CG2 . THR A1 1 12 ? -24.602 11.117 -20.544 1.0 44.25 ? 12 A 5 +ATOM 177 H H . THR A1 1 12 ? -24.221 13.379 -18.889 1.0 50.31 ? 12 A 5 +ATOM 178 H HA . THR A1 1 12 ? -23.796 13.453 -21.713 1.0 15.31 ? 12 A 5 +ATOM 179 H HB . THR A1 1 12 ? -25.87 12.173 -21.889 1.0 3.11 ? 12 A 5 +ATOM 180 H HG1 . THR A1 1 12 ? -27.121 11.787 -20.044 1.0 54.01 ? 12 A 5 +ATOM 181 H HG21 . THR A1 1 12 ? -23.687 11.438 -20.071 1.0 54.24 ? 12 A 5 +ATOM 182 H HG22 . THR A1 1 12 ? -24.369 10.556 -21.437 1.0 51.32 ? 12 A 5 +ATOM 183 H HG23 . THR A1 1 12 ? -25.16 10.492 -19.862 1.0 74.05 ? 12 A 5 +ATOM 184 N N . LEU A1 1 13 ? -25.763 14.852 -22.661 1.0 74.21 ? 13 A 5 +ATOM 185 C CA . LEU A1 1 13 ? -26.589 15.936 -23.182 1.0 74.52 ? 13 A 5 +ATOM 186 C C . LEU A1 1 13 ? -27.943 15.974 -22.479 1.0 25.21 ? 13 A 5 +ATOM 187 O O . LEU A1 1 13 ? -28.638 16.991 -22.501 1.0 11.35 ? 13 A 5 +ATOM 188 C CB . LEU A1 1 13 ? -26.789 15.771 -24.69 1.0 31.51 ? 13 A 5 +ATOM 189 C CG . LEU A1 1 13 ? -27.448 16.947 -25.411 1.0 30.32 ? 13 A 5 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.578 18.19 -25.312 1.0 44.31 ? 13 A 5 +ATOM 191 C CD2 . LEU A1 1 13 ? -27.716 16.597 -26.868 1.0 64.01 ? 13 A 5 +ATOM 192 H H . LEU A1 1 13 ? -25.446 14.157 -23.274 1.0 42.02 ? 13 A 5 +ATOM 193 H HA . LEU A1 1 13 ? -26.073 16.866 -22.995 1.0 34.1 ? 13 A 5 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.82 15.611 -25.136 1.0 62.11 ? 13 A 5 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.406 14.898 -24.847 1.0 43.21 ? 13 A 5 +ATOM 196 H HG . LEU A1 1 13 ? -28.396 17.166 -24.939 1.0 45.4 ? 13 A 5 +ATOM 197 H HD11 . LEU A1 1 13 ? -26.656 18.759 -26.226 1.0 62.23 ? 13 A 5 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.55 17.898 -25.156 1.0 23.44 ? 13 A 5 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.909 18.796 -24.481 1.0 25.55 ? 13 A 5 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.554 17.175 -27.229 1.0 62.14 ? 13 A 5 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.943 15.544 -26.948 1.0 41.34 ? 13 A 5 +ATOM 202 H HD23 . LEU A1 1 13 ? -26.84 16.822 -27.459 1.0 51.42 ? 13 A 5 +ATOM 203 N N . THR A1 1 14 ? -28.311 14.86 -21.853 1.0 31.41 ? 14 A 5 +ATOM 204 C CA . THR A1 1 14 ? -29.58 14.767 -21.143 1.0 30.33 ? 14 A 5 +ATOM 205 C C . THR A1 1 14 ? -29.427 15.189 -19.686 1.0 22.13 ? 14 A 5 +ATOM 206 O O . THR A1 1 14 ? -30.345 15.028 -18.883 1.0 5.31 ? 14 A 5 +ATOM 207 C CB . THR A1 1 14 ? -30.148 13.336 -21.194 1.0 34.54 ? 14 A 5 +ATOM 208 O OG1 . THR A1 1 14 ? -29.141 12.395 -20.803 1.0 3.22 ? 14 A 5 +ATOM 209 C CG2 . THR A1 1 14 ? -30.647 13.001 -22.591 1.0 34.11 ? 14 A 5 +ATOM 210 H H . THR A1 1 14 ? -27.714 14.084 -21.872 1.0 2.31 ? 14 A 5 +ATOM 211 H HA . THR A1 1 14 ? -30.283 15.428 -21.628 1.0 25.44 ? 14 A 5 +ATOM 212 H HB . THR A1 1 14 ? -30.978 13.27 -20.505 1.0 55.24 ? 14 A 5 +ATOM 213 H HG1 . THR A1 1 14 ? -29.257 12.168 -19.878 1.0 24.42 ? 14 A 5 +ATOM 214 H HG21 . THR A1 1 14 ? -31.192 13.844 -22.99 1.0 1.02 ? 14 A 5 +ATOM 215 H HG22 . THR A1 1 14 ? -31.299 12.141 -22.544 1.0 12.23 ? 14 A 5 +ATOM 216 H HG23 . THR A1 1 14 ? -29.806 12.781 -23.231 1.0 12.42 ? 14 A 5 +ATOM 217 N N . GLY A1 1 15 ? -28.26 15.732 -19.351 1.0 61.2 ? 15 A 5 +ATOM 218 C CA . GLY A1 1 15 ? -28.008 16.169 -17.991 1.0 25.44 ? 15 A 5 +ATOM 219 C C . GLY A1 1 15 ? -27.898 15.01 -17.02 1.0 2.34 ? 15 A 5 +ATOM 220 O O . GLY A1 1 15 ? -28.627 14.949 -16.029 1.0 24.03 ? 15 A 5 +ATOM 221 H H . GLY A1 1 15 ? -27.564 15.835 -20.034 1.0 73.22 ? 15 A 5 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.087 16.732 -17.97 1.0 10.15 ? 15 A 5 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.818 16.811 -17.676 1.0 23.53 ? 15 A 5 +ATOM 224 N N . LYS A1 1 16 ? -26.986 14.087 -17.304 1.0 11.21 ? 16 A 5 +ATOM 225 C CA . LYS A1 1 16 ? -26.782 12.923 -16.45 1.0 34.13 ? 16 A 5 +ATOM 226 C C . LYS A1 1 16 ? -25.337 12.848 -15.969 1.0 15.24 ? 16 A 5 +ATOM 227 O O . LYS A1 1 16 ? -24.408 12.755 -16.772 1.0 50.04 ? 16 A 5 +ATOM 228 C CB . LYS A1 1 16 ? -27.148 11.642 -17.202 1.0 31.42 ? 16 A 5 +ATOM 229 C CG . LYS A1 1 16 ? -27.723 10.556 -16.31 1.0 73.35 ? 16 A 5 +ATOM 230 C CD . LYS A1 1 16 ? -26.634 9.65 -15.762 1.0 50.3 ? 16 A 5 +ATOM 231 C CE . LYS A1 1 16 ? -26.005 8.807 -16.86 1.0 52.44 ? 16 A 5 +ATOM 232 N NZ . LYS A1 1 16 ? -26.393 7.373 -16.751 1.0 2.53 ? 16 A 5 +ATOM 233 H H . LYS A1 1 16 ? -26.435 14.191 -18.109 1.0 52.54 ? 16 A 5 +ATOM 234 H HA . LYS A1 1 16 ? -27.43 13.024 -15.592 1.0 34.34 ? 16 A 5 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.879 11.88 -17.961 1.0 44.24 ? 16 A 5 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.26 11.253 -17.68 1.0 12.13 ? 16 A 5 +ATOM 237 H HG2 . LYS A1 1 16 ? -28.242 11.018 -15.483 1.0 3.41 ? 16 A 5 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.418 9.96 -16.885 1.0 74.14 ? 16 A 5 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.866 10.258 -15.307 1.0 63.23 ? 16 A 5 +ATOM 240 H HD3 . LYS A1 1 16 ? -27.064 8.993 -15.018 1.0 14.51 ? 16 A 5 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.328 9.186 -17.817 1.0 44.12 ? 16 A 5 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.93 8.886 -16.786 1.0 75.31 ? 16 A 5 +ATOM 243 H HZ1 . LYS A1 1 16 ? -26.096 6.856 -17.603 1.0 61.55 ? 16 A 5 +ATOM 244 H HZ2 . LYS A1 1 16 ? -27.425 7.29 -16.65 1.0 23.15 ? 16 A 5 +ATOM 245 H HZ3 . LYS A1 1 16 ? -25.94 6.942 -15.92 1.0 43.23 ? 16 A 5 +ATOM 246 N N . THR A1 1 17 ? -25.153 12.887 -14.653 1.0 33.03 ? 17 A 5 +ATOM 247 C CA . THR A1 1 17 ? -23.821 12.823 -14.065 1.0 61.21 ? 17 A 5 +ATOM 248 C C . THR A1 1 17 ? -23.406 11.38 -13.798 1.0 13.11 ? 17 A 5 +ATOM 249 O O . THR A1 1 17 ? -24.052 10.672 -13.025 1.0 32.24 ? 17 A 5 +ATOM 250 C CB . THR A1 1 17 ? -23.749 13.617 -12.747 1.0 22.54 ? 17 A 5 +ATOM 251 O OG1 . THR A1 1 17 ? -25.058 13.743 -12.179 1.0 24.32 ? 17 A 5 +ATOM 252 C CG2 . THR A1 1 17 ? -23.157 14.999 -12.979 1.0 72.42 ? 17 A 5 +ATOM 253 H H . THR A1 1 17 ? -25.933 12.962 -14.064 1.0 63.53 ? 17 A 5 +ATOM 254 H HA . THR A1 1 17 ? -23.126 13.264 -14.765 1.0 15.15 ? 17 A 5 +ATOM 255 H HB . THR A1 1 17 ? -23.115 13.081 -12.055 1.0 61.22 ? 17 A 5 +ATOM 256 H HG1 . THR A1 1 17 ? -25.121 13.192 -11.395 1.0 54.0 ? 17 A 5 +ATOM 257 H HG21 . THR A1 1 17 ? -22.149 15.028 -12.592 1.0 31.34 ? 17 A 5 +ATOM 258 H HG22 . THR A1 1 17 ? -23.758 15.739 -12.472 1.0 12.24 ? 17 A 5 +ATOM 259 H HG23 . THR A1 1 17 ? -23.142 15.211 -14.038 1.0 74.01 ? 17 A 5 +ATOM 260 N N . ILE A1 1 18 ? -22.326 10.951 -14.443 1.0 21.15 ? 18 A 5 +ATOM 261 C CA . ILE A1 1 18 ? -21.826 9.593 -14.273 1.0 42.23 ? 18 A 5 +ATOM 262 C C . ILE A1 1 18 ? -20.361 9.596 -13.85 1.0 2.02 ? 18 A 5 +ATOM 263 O O . ILE A1 1 18 ? -19.573 10.428 -14.303 1.0 34.24 ? 18 A 5 +ATOM 264 C CB . ILE A1 1 18 ? -21.972 8.773 -15.569 1.0 20.13 ? 18 A 5 +ATOM 265 C CG1 . ILE A1 1 18 ? -21.212 7.451 -15.45 1.0 0.43 ? 18 A 5 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.471 9.573 -16.762 1.0 34.34 ? 18 A 5 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.452 6.51 -16.609 1.0 41.12 ? 18 A 5 +ATOM 268 H H . ILE A1 1 18 ? -21.855 11.563 -15.046 1.0 72.35 ? 18 A 5 +ATOM 269 H HA . ILE A1 1 18 ? -22.411 9.116 -13.501 1.0 33.1 ? 18 A 5 +ATOM 270 H HB . ILE A1 1 18 ? -23.02 8.565 -15.72 1.0 55.23 ? 18 A 5 +ATOM 271 H HG12 . ILE A1 1 18 ? -20.154 7.654 -15.402 1.0 35.45 ? 18 A 5 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.519 6.948 -14.544 1.0 15.51 ? 18 A 5 +ATOM 273 H HG21 . ILE A1 1 18 ? -22.204 10.322 -17.026 1.0 31.24 ? 18 A 5 +ATOM 274 H HG22 . ILE A1 1 18 ? -20.541 10.057 -16.505 1.0 60.32 ? 18 A 5 +ATOM 275 H HG23 . ILE A1 1 18 ? -21.314 8.911 -17.599 1.0 71.44 ? 18 A 5 +ATOM 276 H HD11 . ILE A1 1 18 ? -21.975 7.034 -17.396 1.0 32.31 ? 18 A 5 +ATOM 277 H HD12 . ILE A1 1 18 ? -20.505 6.151 -16.985 1.0 60.24 ? 18 A 5 +ATOM 278 H HD13 . ILE A1 1 18 ? -22.048 5.673 -16.277 1.0 25.35 ? 18 A 5 +ATOM 279 N N . THR A1 1 19 ? -20.0 8.659 -12.979 1.0 42.32 ? 19 A 5 +ATOM 280 C CA . THR A1 1 19 ? -18.629 8.552 -12.495 1.0 41.24 ? 19 A 5 +ATOM 281 C C . THR A1 1 19 ? -17.974 7.264 -12.978 1.0 70.21 ? 19 A 5 +ATOM 282 O O . THR A1 1 19 ? -18.594 6.2 -12.97 1.0 44.42 ? 19 A 5 +ATOM 283 C CB . THR A1 1 19 ? -18.572 8.598 -10.956 1.0 2.4 ? 19 A 5 +ATOM 284 O OG1 . THR A1 1 19 ? -19.813 9.087 -10.434 1.0 22.32 ? 19 A 5 +ATOM 285 C CG2 . THR A1 1 19 ? -17.432 9.487 -10.483 1.0 13.14 ? 19 A 5 +ATOM 286 H H . THR A1 1 19 ? -20.673 8.025 -12.655 1.0 1.15 ? 19 A 5 +ATOM 287 H HA . THR A1 1 19 ? -18.073 9.395 -12.88 1.0 65.43 ? 19 A 5 +ATOM 288 H HB . THR A1 1 19 ? -18.405 7.596 -10.587 1.0 44.24 ? 19 A 5 +ATOM 289 H HG1 . THR A1 1 19 ? -19.991 8.668 -9.588 1.0 60.25 ? 19 A 5 +ATOM 290 H HG21 . THR A1 1 19 ? -17.631 9.821 -9.476 1.0 73.33 ? 19 A 5 +ATOM 291 H HG22 . THR A1 1 19 ? -17.348 10.343 -11.136 1.0 23.45 ? 19 A 5 +ATOM 292 H HG23 . THR A1 1 19 ? -16.508 8.928 -10.501 1.0 51.03 ? 19 A 5 +ATOM 293 N N . ILE A1 1 20 ? -16.717 7.366 -13.398 1.0 2.13 ? 20 A 5 +ATOM 294 C CA . ILE A1 1 20 ? -15.978 6.208 -13.883 1.0 23.24 ? 20 A 5 +ATOM 295 C C . ILE A1 1 20 ? -14.516 6.268 -13.452 1.0 21.51 ? 20 A 5 +ATOM 296 O O . ILE A1 1 20 ? -13.856 7.296 -13.604 1.0 3.54 ? 20 A 5 +ATOM 297 C CB . ILE A1 1 20 ? -16.044 6.099 -15.418 1.0 55.55 ? 20 A 5 +ATOM 298 C CG1 . ILE A1 1 20 ? -16.023 7.492 -16.05 1.0 1.5 ? 20 A 5 +ATOM 299 C CG2 . ILE A1 1 20 ? -17.292 5.338 -15.841 1.0 1.32 ? 20 A 5 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.282 7.547 -17.368 1.0 2.4 ? 20 A 5 +ATOM 301 H H . ILE A1 1 20 ? -16.277 8.241 -13.38 1.0 32.52 ? 20 A 5 +ATOM 302 H HA . ILE A1 1 20 ? -16.43 5.322 -13.459 1.0 40.32 ? 20 A 5 +ATOM 303 H HB . ILE A1 1 20 ? -15.182 5.545 -15.755 1.0 75.22 ? 20 A 5 +ATOM 304 H HG12 . ILE A1 1 20 ? -17.037 7.816 -16.227 1.0 4.24 ? 20 A 5 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.543 8.181 -15.37 1.0 20.02 ? 20 A 5 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.127 4.887 -16.808 1.0 41.11 ? 20 A 5 +ATOM 307 H HG22 . ILE A1 1 20 ? -17.506 4.567 -15.117 1.0 51.34 ? 20 A 5 +ATOM 308 H HG23 . ILE A1 1 20 ? -18.127 6.02 -15.9 1.0 74.34 ? 20 A 5 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.586 8.427 -17.916 1.0 44.23 ? 20 A 5 +ATOM 310 H HD12 . ILE A1 1 20 ? -14.219 7.589 -17.181 1.0 43.31 ? 20 A 5 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.512 6.666 -17.947 1.0 23.14 ? 20 A 5 +ATOM 312 N N . ASP A1 1 21 ? -14.017 5.161 -12.915 1.0 44.41 ? 21 A 5 +ATOM 313 C CA . ASP A1 1 21 ? -12.632 5.086 -12.464 1.0 13.43 ? 21 A 5 +ATOM 314 C C . ASP A1 1 21 ? -11.697 4.784 -13.631 1.0 74.52 ? 21 A 5 +ATOM 315 O O . ASP A1 1 21 ? -11.847 3.771 -14.314 1.0 3.25 ? 21 A 5 +ATOM 316 C CB . ASP A1 1 21 ? -12.482 4.015 -11.383 1.0 40.32 ? 21 A 5 +ATOM 317 C CG . ASP A1 1 21 ? -12.784 2.623 -11.902 1.0 70.32 ? 21 A 5 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.973 2.324 -12.144 1.0 34.41 ? 21 A 5 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.832 1.832 -12.066 1.0 4.34 ? 21 A 5 +ATOM 320 H H . ASP A1 1 21 ? -14.594 4.374 -12.82 1.0 61.24 ? 21 A 5 +ATOM 321 H HA . ASP A1 1 21 ? -12.367 6.046 -12.047 1.0 0.1 ? 21 A 5 +ATOM 322 H HB2 . ASP A1 1 21 ? -11.468 4.028 -11.011 1.0 73.15 ? 21 A 5 +ATOM 323 H HB3 . ASP A1 1 21 ? -13.161 4.233 -10.572 1.0 61.23 ? 21 A 5 +ATOM 324 N N . VAL A1 1 22 ? -10.731 5.67 -13.853 1.0 30.34 ? 22 A 5 +ATOM 325 C CA . VAL A1 1 22 ? -9.771 5.498 -14.937 1.0 1.34 ? 22 A 5 +ATOM 326 C C . VAL A1 1 22 ? -8.349 5.773 -14.46 1.0 61.2 ? 22 A 5 +ATOM 327 O O . VAL A1 1 22 ? -8.142 6.372 -13.405 1.0 34.03 ? 22 A 5 +ATOM 328 C CB . VAL A1 1 22 ? -10.091 6.426 -16.124 1.0 60.13 ? 22 A 5 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.551 6.854 -16.088 1.0 14.0 ? 22 A 5 +ATOM 330 C CG2 . VAL A1 1 22 ? -9.172 7.638 -16.115 1.0 61.12 ? 22 A 5 +ATOM 331 H H . VAL A1 1 22 ? -10.662 6.457 -13.275 1.0 71.0 ? 22 A 5 +ATOM 332 H HA . VAL A1 1 22 ? -9.834 4.475 -15.28 1.0 41.13 ? 22 A 5 +ATOM 333 H HB . VAL A1 1 22 ? -9.922 5.879 -17.039 1.0 23.42 ? 22 A 5 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.814 7.313 -17.03 1.0 3.13 ? 22 A 5 +ATOM 335 H HG12 . VAL A1 1 22 ? -12.176 5.989 -15.921 1.0 11.12 ? 22 A 5 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.698 7.565 -15.289 1.0 2.3 ? 22 A 5 +ATOM 337 H HG21 . VAL A1 1 22 ? -9.15 8.067 -15.124 1.0 43.3 ? 22 A 5 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.175 7.335 -16.398 1.0 71.52 ? 22 A 5 +ATOM 339 H HG23 . VAL A1 1 22 ? -9.538 8.374 -16.816 1.0 24.41 ? 22 A 5 +ATOM 340 N N . ASP A1 1 23 ? -7.372 5.332 -15.246 1.0 73.14 ? 23 A 5 +ATOM 341 C CA . ASP A1 1 23 ? -5.968 5.532 -14.905 1.0 0.33 ? 23 A 5 +ATOM 342 C C . ASP A1 1 23 ? -5.293 6.464 -15.907 1.0 62.12 ? 23 A 5 +ATOM 343 O O . ASP A1 1 23 ? -5.705 6.55 -17.064 1.0 35.34 ? 23 A 5 +ATOM 344 C CB . ASP A1 1 23 ? -5.236 4.19 -14.863 1.0 24.44 ? 23 A 5 +ATOM 345 C CG . ASP A1 1 23 ? -4.508 3.968 -13.552 1.0 11.25 ? 23 A 5 +ATOM 346 O OD1 . ASP A1 1 23 ? -4.01 4.958 -12.975 1.0 71.52 ? 23 A 5 +ATOM 347 O OD2 . ASP A1 1 23 ? -4.436 2.805 -13.102 1.0 54.12 ? 23 A 5 +ATOM 348 H H . ASP A1 1 23 ? -7.601 4.862 -16.075 1.0 71.31 ? 23 A 5 +ATOM 349 H HA . ASP A1 1 23 ? -5.926 5.985 -13.926 1.0 62.03 ? 23 A 5 +ATOM 350 H HB2 . ASP A1 1 23 ? -5.952 3.392 -14.996 1.0 75.32 ? 23 A 5 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.513 4.157 -15.665 1.0 32.1 ? 23 A 5 +ATOM 352 N N . HIS A1 1 24 ? -4.255 7.16 -15.454 1.0 3.42 ? 24 A 5 +ATOM 353 C CA . HIS A1 1 24 ? -3.523 8.086 -16.311 1.0 64.1 ? 24 A 5 +ATOM 354 C C . HIS A1 1 24 ? -2.907 7.354 -17.499 1.0 13.22 ? 24 A 5 +ATOM 355 O O . HIS A1 1 24 ? -2.499 7.976 -18.48 1.0 40.32 ? 24 A 5 +ATOM 356 C CB . HIS A1 1 24 ? -2.431 8.797 -15.512 1.0 43.52 ? 24 A 5 +ATOM 357 C CG . HIS A1 1 24 ? -1.423 7.865 -14.913 1.0 63.23 ? 24 A 5 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.168 7.667 -15.448 1.0 33.23 ? 24 A 5 +ATOM 359 C CD2 . HIS A1 1 24 ? -1.491 7.074 -13.816 1.0 70.35 ? 24 A 5 +ATOM 360 C CE1 . HIS A1 1 24 ? 0.492 6.795 -14.708 1.0 52.22 ? 24 A 5 +ATOM 361 N NE2 . HIS A1 1 24 ? -0.289 6.42 -13.711 1.0 51.1 ? 24 A 5 +ATOM 362 H H . HIS A1 1 24 ? -3.975 7.047 -14.522 1.0 35.01 ? 24 A 5 +ATOM 363 H HA . HIS A1 1 24 ? -4.223 8.82 -16.68 1.0 52.33 ? 24 A 5 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.904 9.479 -16.164 1.0 74.33 ? 24 A 5 +ATOM 365 H HB3 . HIS A1 1 24 ? -2.887 9.355 -14.708 1.0 2.24 ? 24 A 5 +ATOM 366 H HD1 . HIS A1 1 24 ? 0.186 8.101 -16.252 1.0 61.24 ? 24 A 5 +ATOM 367 H HD2 . HIS A1 1 24 ? -2.335 6.976 -13.147 1.0 14.35 ? 24 A 5 +ATOM 368 H HE1 . HIS A1 1 24 ? 1.498 6.447 -14.887 1.0 73.24 ? 24 A 5 +ATOM 369 N N . ALA A1 1 25 ? -2.841 6.03 -17.404 1.0 63.43 ? 25 A 5 +ATOM 370 C CA . ALA A1 1 25 ? -2.276 5.214 -18.471 1.0 43.32 ? 25 A 5 +ATOM 371 C C . ALA A1 1 25 ? -3.331 4.872 -19.518 1.0 33.54 ? 25 A 5 +ATOM 372 O O . ALA A1 1 25 ? -3.081 4.083 -20.43 1.0 12.23 ? 25 A 5 +ATOM 373 C CB . ALA A1 1 25 ? -1.666 3.944 -17.898 1.0 51.34 ? 25 A 5 +ATOM 374 H H . ALA A1 1 25 ? -3.183 5.592 -16.597 1.0 55.41 ? 25 A 5 +ATOM 375 H HA . ALA A1 1 25 ? -1.487 5.782 -18.943 1.0 23.12 ? 25 A 5 +ATOM 376 H HB1 . ALA A1 1 25 ? -1.372 3.29 -18.706 1.0 42.21 ? 25 A 5 +ATOM 377 H HB2 . ALA A1 1 25 ? -0.8 4.196 -17.305 1.0 3.14 ? 25 A 5 +ATOM 378 H HB3 . ALA A1 1 25 ? -2.394 3.444 -17.278 1.0 44.44 ? 25 A 5 +ATOM 379 N N . ASP A1 1 26 ? -4.51 5.468 -19.38 1.0 53.31 ? 26 A 5 +ATOM 380 C CA . ASP A1 1 26 ? -5.603 5.225 -20.314 1.0 71.32 ? 26 A 5 +ATOM 381 C C . ASP A1 1 26 ? -5.715 6.361 -21.326 1.0 31.24 ? 26 A 5 +ATOM 382 O O . ASP A1 1 26 ? -4.818 7.197 -21.44 1.0 53.43 ? 26 A 5 +ATOM 383 C CB . ASP A1 1 26 ? -6.923 5.068 -19.558 1.0 21.1 ? 26 A 5 +ATOM 384 C CG . ASP A1 1 26 ? -6.841 4.024 -18.461 1.0 73.54 ? 26 A 5 +ATOM 385 O OD1 . ASP A1 1 26 ? -5.85 3.264 -18.438 1.0 73.22 ? 26 A 5 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.767 3.968 -17.625 1.0 2.02 ? 26 A 5 +ATOM 387 H H . ASP A1 1 26 ? -4.648 6.086 -18.632 1.0 73.33 ? 26 A 5 +ATOM 388 H HA . ASP A1 1 26 ? -5.39 4.309 -20.843 1.0 35.3 ? 26 A 5 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.189 6.014 -19.109 1.0 71.15 ? 26 A 5 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.696 4.774 -20.253 1.0 51.4 ? 26 A 5 +ATOM 391 N N . THR A1 1 27 ? -6.823 6.386 -22.06 1.0 11.22 ? 27 A 5 +ATOM 392 C CA . THR A1 1 27 ? -7.052 7.417 -23.064 1.0 12.11 ? 27 A 5 +ATOM 393 C C . THR A1 1 27 ? -8.534 7.75 -23.183 1.0 24.55 ? 27 A 5 +ATOM 394 O O . THR A1 1 27 ? -9.388 7.013 -22.69 1.0 14.34 ? 27 A 5 +ATOM 395 C CB . THR A1 1 27 ? -6.522 6.985 -24.445 1.0 24.42 ? 27 A 5 +ATOM 396 O OG1 . THR A1 1 27 ? -6.535 5.557 -24.549 1.0 51.41 ? 27 A 5 +ATOM 397 C CG2 . THR A1 1 27 ? -5.109 7.502 -24.669 1.0 72.22 ? 27 A 5 +ATOM 398 H H . THR A1 1 27 ? -7.501 5.692 -21.923 1.0 1.33 ? 27 A 5 +ATOM 399 H HA . THR A1 1 27 ? -6.517 8.305 -22.759 1.0 54.42 ? 27 A 5 +ATOM 400 H HB . THR A1 1 27 ? -7.166 7.4 -25.207 1.0 51.23 ? 27 A 5 +ATOM 401 H HG1 . THR A1 1 27 ? -7.23 5.201 -23.991 1.0 23.44 ? 27 A 5 +ATOM 402 H HG21 . THR A1 1 27 ? -4.739 7.14 -25.616 1.0 20.21 ? 27 A 5 +ATOM 403 H HG22 . THR A1 1 27 ? -4.467 7.152 -23.874 1.0 40.31 ? 27 A 5 +ATOM 404 H HG23 . THR A1 1 27 ? -5.118 8.582 -24.674 1.0 53.14 ? 27 A 5 +ATOM 405 N N . VAL A1 1 28 ? -8.835 8.865 -23.842 1.0 70.04 ? 28 A 5 +ATOM 406 C CA . VAL A1 1 28 ? -10.216 9.294 -24.027 1.0 40.12 ? 28 A 5 +ATOM 407 C C . VAL A1 1 28 ? -11.044 8.206 -24.701 1.0 43.3 ? 28 A 5 +ATOM 408 O O . VAL A1 1 28 ? -12.135 7.868 -24.242 1.0 51.44 ? 28 A 5 +ATOM 409 C CB . VAL A1 1 28 ? -10.296 10.581 -24.87 1.0 70.14 ? 28 A 5 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.701 11.162 -24.827 1.0 13.41 ? 28 A 5 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.274 11.599 -24.386 1.0 73.55 ? 28 A 5 +ATOM 412 H H . VAL A1 1 28 ? -8.111 9.411 -24.212 1.0 50.23 ? 28 A 5 +ATOM 413 H HA . VAL A1 1 28 ? -10.635 9.501 -23.053 1.0 62.42 ? 28 A 5 +ATOM 414 H HB . VAL A1 1 28 ? -10.065 10.33 -25.895 1.0 52.41 ? 28 A 5 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.819 11.877 -25.628 1.0 72.32 ? 28 A 5 +ATOM 416 H HG12 . VAL A1 1 28 ? -12.423 10.367 -24.943 1.0 75.12 ? 28 A 5 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.857 11.655 -23.879 1.0 43.12 ? 28 A 5 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.681 11.165 -23.594 1.0 22.23 ? 28 A 5 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.631 11.88 -25.206 1.0 21.24 ? 28 A 5 +ATOM 420 H HG23 . VAL A1 1 28 ? -9.786 12.474 -24.013 1.0 51.43 ? 28 A 5 +ATOM 421 N N . GLY A1 1 29 ? -10.518 7.66 -25.793 1.0 51.02 ? 29 A 5 +ATOM 422 C CA . GLY A1 1 29 ? -11.222 6.615 -26.513 1.0 24.21 ? 29 A 5 +ATOM 423 C C . GLY A1 1 29 ? -11.679 5.492 -25.604 1.0 62.32 ? 29 A 5 +ATOM 424 O O . GLY A1 1 29 ? -12.842 5.091 -25.639 1.0 1.41 ? 29 A 5 +ATOM 425 H H . GLY A1 1 29 ? -9.645 7.97 -26.113 1.0 25.44 ? 29 A 5 +ATOM 426 H HA2 . GLY A1 1 29 ? -12.085 7.046 -26.998 1.0 33.14 ? 29 A 5 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.564 6.208 -27.267 1.0 61.11 ? 29 A 5 +ATOM 428 N N . ALA A1 1 30 ? -10.762 4.982 -24.789 1.0 0.3 ? 30 A 5 +ATOM 429 C CA . ALA A1 1 30 ? -11.077 3.898 -23.867 1.0 24.42 ? 30 A 5 +ATOM 430 C C . ALA A1 1 30 ? -12.173 4.31 -22.889 1.0 23.15 ? 30 A 5 +ATOM 431 O O . ALA A1 1 30 ? -13.076 3.53 -22.589 1.0 23.32 ? 30 A 5 +ATOM 432 C CB . ALA A1 1 30 ? -9.828 3.467 -23.112 1.0 4.23 ? 30 A 5 +ATOM 433 H H . ALA A1 1 30 ? -9.852 5.344 -24.808 1.0 13.0 ? 30 A 5 +ATOM 434 H HA . ALA A1 1 30 ? -11.425 3.056 -24.448 1.0 42.35 ? 30 A 5 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.964 2.464 -22.735 1.0 24.3 ? 30 A 5 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.979 3.491 -23.778 1.0 15.25 ? 30 A 5 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.657 4.142 -22.286 1.0 54.13 ? 30 A 5 +ATOM 438 N N . VAL A1 1 31 ? -12.086 5.541 -22.395 1.0 44.02 ? 31 A 5 +ATOM 439 C CA . VAL A1 1 31 ? -13.07 6.057 -21.452 1.0 44.43 ? 31 A 5 +ATOM 440 C C . VAL A1 1 31 ? -14.464 6.082 -22.07 1.0 22.33 ? 31 A 5 +ATOM 441 O O . VAL A1 1 31 ? -15.445 5.699 -21.432 1.0 41.34 ? 31 A 5 +ATOM 442 C CB . VAL A1 1 31 ? -12.705 7.477 -20.98 1.0 42.01 ? 31 A 5 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.824 8.063 -20.131 1.0 61.22 ? 31 A 5 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.393 7.461 -20.21 1.0 34.2 ? 31 A 5 +ATOM 445 H H . VAL A1 1 31 ? -11.343 6.117 -22.673 1.0 33.11 ? 31 A 5 +ATOM 446 H HA . VAL A1 1 31 ? -13.081 5.406 -20.59 1.0 53.53 ? 31 A 5 +ATOM 447 H HB . VAL A1 1 31 ? -12.579 8.103 -21.851 1.0 34.14 ? 31 A 5 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.495 7.273 -19.827 1.0 24.43 ? 31 A 5 +ATOM 449 H HG12 . VAL A1 1 31 ? -13.402 8.536 -19.256 1.0 62.24 ? 31 A 5 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.368 8.794 -20.709 1.0 4.44 ? 31 A 5 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.59 7.777 -20.859 1.0 32.4 ? 31 A 5 +ATOM 452 H HG22 . VAL A1 1 31 ? -11.463 8.134 -19.368 1.0 31.51 ? 31 A 5 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.196 6.46 -19.855 1.0 2.41 ? 31 A 5 +ATOM 454 N N . LYS A1 1 32 ? -14.544 6.535 -23.316 1.0 44.33 ? 32 A 5 +ATOM 455 C CA . LYS A1 1 32 ? -15.817 6.608 -24.024 1.0 33.41 ? 32 A 5 +ATOM 456 C C . LYS A1 1 32 ? -16.502 5.246 -24.054 1.0 33.52 ? 32 A 5 +ATOM 457 O O . LYS A1 1 32 ? -17.714 5.145 -23.865 1.0 55.22 ? 32 A 5 +ATOM 458 C CB . LYS A1 1 32 ? -15.602 7.115 -25.452 1.0 21.43 ? 32 A 5 +ATOM 459 C CG . LYS A1 1 32 ? -16.171 8.501 -25.697 1.0 62.04 ? 32 A 5 +ATOM 460 C CD . LYS A1 1 32 ? -15.07 9.527 -25.906 1.0 13.3 ? 32 A 5 +ATOM 461 C CE . LYS A1 1 32 ? -14.975 9.955 -27.362 1.0 61.02 ? 32 A 5 +ATOM 462 N NZ . LYS A1 1 32 ? -16.239 10.584 -27.838 1.0 10.13 ? 32 A 5 +ATOM 463 H H . LYS A1 1 32 ? -13.726 6.826 -23.773 1.0 0.43 ? 32 A 5 +ATOM 464 H HA . LYS A1 1 32 ? -16.451 7.304 -23.495 1.0 20.21 ? 32 A 5 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.542 7.142 -25.655 1.0 31.13 ? 32 A 5 +ATOM 466 H HB3 . LYS A1 1 32 ? -16.074 6.428 -26.139 1.0 51.43 ? 32 A 5 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.794 8.474 -26.579 1.0 34.55 ? 32 A 5 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.765 8.793 -24.843 1.0 75.31 ? 32 A 5 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.28 10.396 -25.3 1.0 62.53 ? 32 A 5 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.126 9.095 -25.604 1.0 34.24 ? 32 A 5 +ATOM 471 H HE2 . LYS A1 1 32 ? -14.169 10.666 -27.463 1.0 32.35 ? 32 A 5 +ATOM 472 H HE3 . LYS A1 1 32 ? -14.766 9.085 -27.967 1.0 31.14 ? 32 A 5 +ATOM 473 H HZ1 . LYS A1 1 32 ? -16.768 10.977 -27.034 1.0 3.34 ? 32 A 5 +ATOM 474 H HZ2 . LYS A1 1 32 ? -16.831 9.876 -28.317 1.0 11.13 ? 32 A 5 +ATOM 475 H HZ3 . LYS A1 1 32 ? -16.026 11.351 -28.508 1.0 13.55 ? 32 A 5 +ATOM 476 N N . ALA A1 1 33 ? -15.718 4.199 -24.292 1.0 34.21 ? 33 A 5 +ATOM 477 C CA . ALA A1 1 33 ? -16.249 2.843 -24.343 1.0 60.31 ? 33 A 5 +ATOM 478 C C . ALA A1 1 33 ? -16.819 2.425 -22.992 1.0 31.03 ? 33 A 5 +ATOM 479 O O . ALA A1 1 33 ? -17.869 1.786 -22.92 1.0 31.32 ? 33 A 5 +ATOM 480 C CB . ALA A1 1 33 ? -15.167 1.869 -24.786 1.0 54.24 ? 33 A 5 +ATOM 481 H H . ALA A1 1 33 ? -14.759 4.343 -24.434 1.0 43.1 ? 33 A 5 +ATOM 482 H HA . ALA A1 1 33 ? -17.04 2.822 -25.079 1.0 53.01 ? 33 A 5 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.278 2.026 -24.192 1.0 2.33 ? 33 A 5 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.517 0.856 -24.65 1.0 61.23 ? 33 A 5 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.938 2.035 -25.828 1.0 53.23 ? 33 A 5 +ATOM 486 N N . LYS A1 1 34 ? -16.12 2.789 -21.922 1.0 30.14 ? 34 A 5 +ATOM 487 C CA . LYS A1 1 34 ? -16.557 2.453 -20.572 1.0 3.41 ? 34 A 5 +ATOM 488 C C . LYS A1 1 34 ? -17.931 3.048 -20.28 1.0 51.04 ? 34 A 5 +ATOM 489 O O . LYS A1 1 34 ? -18.789 2.39 -19.692 1.0 30.3 ? 34 A 5 +ATOM 490 C CB . LYS A1 1 34 ? -15.541 2.959 -19.545 1.0 63.02 ? 34 A 5 +ATOM 491 C CG . LYS A1 1 34 ? -15.888 2.589 -18.113 1.0 24.43 ? 34 A 5 +ATOM 492 C CD . LYS A1 1 34 ? -15.836 1.086 -17.898 1.0 44.42 ? 34 A 5 +ATOM 493 C CE . LYS A1 1 34 ? -14.424 0.546 -18.068 1.0 34.12 ? 34 A 5 +ATOM 494 N NZ . LYS A1 1 34 ? -14.244 -0.763 -17.382 1.0 13.0 ? 34 A 5 +ATOM 495 H H . LYS A1 1 34 ? -15.291 3.298 -22.044 1.0 65.25 ? 34 A 5 +ATOM 496 H HA . LYS A1 1 34 ? -16.621 1.378 -20.502 1.0 3.22 ? 34 A 5 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.573 2.542 -19.778 1.0 71.03 ? 34 A 5 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.486 4.036 -19.613 1.0 71.12 ? 34 A 5 +ATOM 499 H HG2 . LYS A1 1 34 ? -15.182 3.062 -17.447 1.0 24.23 ? 34 A 5 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.886 2.941 -17.892 1.0 22.21 ? 34 A 5 +ATOM 501 H HD2 . LYS A1 1 34 ? -16.176 0.862 -16.898 1.0 63.43 ? 34 A 5 +ATOM 502 H HD3 . LYS A1 1 34 ? -16.485 0.605 -18.617 1.0 75.33 ? 34 A 5 +ATOM 503 H HE2 . LYS A1 1 34 ? -14.226 0.422 -19.122 1.0 34.14 ? 34 A 5 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.728 1.26 -17.653 1.0 0.12 ? 34 A 5 +ATOM 505 H HZ1 . LYS A1 1 34 ? -14.685 -1.522 -17.939 1.0 62.42 ? 34 A 5 +ATOM 506 H HZ2 . LYS A1 1 34 ? -14.685 -0.736 -16.441 1.0 14.2 ? 34 A 5 +ATOM 507 H HZ3 . LYS A1 1 34 ? -13.231 -0.972 -17.272 1.0 65.2 ? 34 A 5 +ATOM 508 N N . ILE A1 1 35 ? -18.131 4.293 -20.696 1.0 14.42 ? 35 A 5 +ATOM 509 C CA . ILE A1 1 35 ? -19.402 4.974 -20.482 1.0 22.32 ? 35 A 5 +ATOM 510 C C . ILE A1 1 35 ? -20.516 4.33 -21.299 1.0 74.31 ? 35 A 5 +ATOM 511 O O . ILE A1 1 35 ? -21.659 4.243 -20.85 1.0 33.23 ? 35 A 5 +ATOM 512 C CB . ILE A1 1 35 ? -19.309 6.468 -20.847 1.0 42.5 ? 35 A 5 +ATOM 513 C CG1 . ILE A1 1 35 ? -18.163 7.132 -20.083 1.0 22.04 ? 35 A 5 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.627 7.168 -20.551 1.0 45.14 ? 35 A 5 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.296 7.026 -18.58 1.0 11.1 ? 35 A 5 +ATOM 516 H H . ILE A1 1 35 ? -17.409 4.765 -21.16 1.0 54.44 ? 35 A 5 +ATOM 517 H HA . ILE A1 1 35 ? -19.649 4.896 -19.432 1.0 30.01 ? 35 A 5 +ATOM 518 H HB . ILE A1 1 35 ? -19.119 6.544 -21.907 1.0 2.44 ? 35 A 5 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.232 6.666 -20.366 1.0 3.24 ? 35 A 5 +ATOM 520 H HG13 . ILE A1 1 35 ? -18.129 8.181 -20.341 1.0 0.11 ? 35 A 5 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.513 8.231 -20.708 1.0 65.32 ? 35 A 5 +ATOM 522 H HG22 . ILE A1 1 35 ? -21.393 6.788 -21.21 1.0 43.1 ? 35 A 5 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.91 6.984 -19.526 1.0 75.41 ? 35 A 5 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.745 7.829 -18.112 1.0 43.52 ? 35 A 5 +ATOM 525 H HD12 . ILE A1 1 35 ? -19.338 7.098 -18.305 1.0 71.15 ? 35 A 5 +ATOM 526 H HD13 . ILE A1 1 35 ? -17.901 6.077 -18.249 1.0 74.3 ? 35 A 5 +ATOM 527 N N . TYR A1 1 36 ? -20.175 3.879 -22.501 1.0 62.53 ? 36 A 5 +ATOM 528 C CA . TYR A1 1 36 ? -21.147 3.243 -23.383 1.0 64.44 ? 36 A 5 +ATOM 529 C C . TYR A1 1 36 ? -21.801 2.046 -22.7 1.0 53.42 ? 36 A 5 +ATOM 530 O O . TYR A1 1 36 ? -23.018 1.87 -22.761 1.0 34.33 ? 36 A 5 +ATOM 531 C CB . TYR A1 1 36 ? -20.473 2.797 -24.682 1.0 74.42 ? 36 A 5 +ATOM 532 C CG . TYR A1 1 36 ? -20.82 1.383 -25.09 1.0 43.51 ? 36 A 5 +ATOM 533 C CD1 . TYR A1 1 36 ? -22.074 1.074 -25.6 1.0 62.31 ? 36 A 5 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.892 0.356 -24.965 1.0 22.21 ? 36 A 5 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.395 -0.217 -25.973 1.0 25.24 ? 36 A 5 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.204 -0.937 -25.337 1.0 24.41 ? 36 A 5 +ATOM 537 C CZ . TYR A1 1 36 ? -21.457 -1.219 -25.84 1.0 51.0 ? 36 A 5 +ATOM 538 O OH . TYR A1 1 36 ? -21.772 -2.506 -26.211 1.0 31.41 ? 36 A 5 +ATOM 539 H H . TYR A1 1 36 ? -19.248 3.977 -22.804 1.0 42.53 ? 36 A 5 +ATOM 540 H HA . TYR A1 1 36 ? -21.91 3.971 -23.616 1.0 45.34 ? 36 A 5 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.776 3.456 -25.481 1.0 32.41 ? 36 A 5 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.401 2.855 -24.561 1.0 73.31 ? 36 A 5 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.807 1.861 -25.704 1.0 14.41 ? 36 A 5 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.911 0.58 -24.57 1.0 73.43 ? 36 A 5 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.376 -0.438 -26.368 1.0 30.0 ? 36 A 5 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.469 -1.722 -25.232 1.0 11.1 ? 36 A 5 +ATOM 547 H HH . TYR A1 1 36 ? -22.289 -2.487 -27.02 1.0 20.21 ? 36 A 5 +ATOM 548 N N . ASP A1 1 37 ? -20.984 1.226 -22.048 1.0 31.31 ? 37 A 5 +ATOM 549 C CA . ASP A1 1 37 ? -21.481 0.046 -21.35 1.0 4.3 ? 37 A 5 +ATOM 550 C C . ASP A1 1 37 ? -22.177 0.436 -20.05 1.0 30.32 ? 37 A 5 +ATOM 551 O O . ASP A1 1 37 ? -23.119 -0.226 -19.614 1.0 62.0 ? 37 A 5 +ATOM 552 C CB . ASP A1 1 37 ? -20.333 -0.922 -21.058 1.0 35.43 ? 37 A 5 +ATOM 553 C CG . ASP A1 1 37 ? -20.635 -2.334 -21.518 1.0 34.32 ? 37 A 5 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.328 -3.064 -20.778 1.0 31.12 ? 37 A 5 +ATOM 555 O OD2 . ASP A1 1 37 ? -20.181 -2.71 -22.619 1.0 3.2 ? 37 A 5 +ATOM 556 H H . ASP A1 1 37 ? -20.023 1.42 -22.035 1.0 51.42 ? 37 A 5 +ATOM 557 H HA . ASP A1 1 37 ? -22.196 -0.443 -21.994 1.0 32.24 ? 37 A 5 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.444 -0.58 -21.568 1.0 43.14 ? 37 A 5 +ATOM 559 H HB3 . ASP A1 1 37 ? -20.148 -0.94 -19.994 1.0 34.23 ? 37 A 5 +ATOM 560 N N . LYS A1 1 38 ? -21.706 1.515 -19.434 1.0 33.03 ? 38 A 5 +ATOM 561 C CA . LYS A1 1 38 ? -22.282 1.995 -18.183 1.0 33.5 ? 38 A 5 +ATOM 562 C C . LYS A1 1 38 ? -23.784 2.223 -18.328 1.0 62.1 ? 38 A 5 +ATOM 563 O O . LYS A1 1 38 ? -24.568 1.808 -17.475 1.0 13.24 ? 38 A 5 +ATOM 564 C CB . LYS A1 1 38 ? -21.599 3.293 -17.748 1.0 32.13 ? 38 A 5 +ATOM 565 C CG . LYS A1 1 38 ? -20.812 3.162 -16.455 1.0 11.13 ? 38 A 5 +ATOM 566 C CD . LYS A1 1 38 ? -19.35 2.846 -16.721 1.0 55.11 ? 38 A 5 +ATOM 567 C CE . LYS A1 1 38 ? -19.123 1.351 -16.879 1.0 12.13 ? 38 A 5 +ATOM 568 N NZ . LYS A1 1 38 ? -18.543 0.745 -15.649 1.0 62.42 ? 38 A 5 +ATOM 569 H H . LYS A1 1 38 ? -20.953 2.002 -19.831 1.0 40.1 ? 38 A 5 +ATOM 570 H HA . LYS A1 1 38 ? -22.116 1.24 -17.43 1.0 13.43 ? 38 A 5 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.92 3.608 -18.527 1.0 53.44 ? 38 A 5 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.353 4.055 -17.61 1.0 74.35 ? 38 A 5 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.875 4.093 -15.91 1.0 72.35 ? 38 A 5 +ATOM 574 H HG3 . LYS A1 1 38 ? -21.241 2.367 -15.863 1.0 65.33 ? 38 A 5 +ATOM 575 H HD2 . LYS A1 1 38 ? -19.043 3.344 -17.629 1.0 31.44 ? 38 A 5 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.756 3.206 -15.893 1.0 51.13 ? 38 A 5 +ATOM 577 H HE2 . LYS A1 1 38 ? -20.069 0.877 -17.092 1.0 72.24 ? 38 A 5 +ATOM 578 H HE3 . LYS A1 1 38 ? -18.445 1.189 -17.705 1.0 52.14 ? 38 A 5 +ATOM 579 H HZ1 . LYS A1 1 38 ? -19.282 0.624 -14.928 1.0 12.21 ? 38 A 5 +ATOM 580 H HZ2 . LYS A1 1 38 ? -17.796 1.36 -15.266 1.0 31.3 ? 38 A 5 +ATOM 581 H HZ3 . LYS A1 1 38 ? -18.132 -0.185 -15.868 1.0 72.13 ? 38 A 5 +ATOM 582 N N . GLU A1 1 39 ? -24.176 2.883 -19.413 1.0 74.33 ? 39 A 5 +ATOM 583 C CA . GLU A1 1 39 ? -25.584 3.164 -19.668 1.0 31.43 ? 39 A 5 +ATOM 584 C C . GLU A1 1 39 ? -26.092 2.359 -20.861 1.0 55.55 ? 39 A 5 +ATOM 585 O O . GLU A1 1 39 ? -27.08 1.633 -20.758 1.0 44.25 ? 39 A 5 +ATOM 586 C CB . GLU A1 1 39 ? -25.791 4.658 -19.922 1.0 31.12 ? 39 A 5 +ATOM 587 C CG . GLU A1 1 39 ? -24.617 5.325 -20.62 1.0 22.34 ? 39 A 5 +ATOM 588 C CD . GLU A1 1 39 ? -24.787 6.827 -20.742 1.0 34.02 ? 39 A 5 +ATOM 589 O OE1 . GLU A1 1 39 ? -25.942 7.283 -20.88 1.0 60.52 ? 39 A 5 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.767 7.546 -20.701 1.0 24.54 ? 39 A 5 +ATOM 591 H H . GLU A1 1 39 ? -23.503 3.188 -20.056 1.0 53.12 ? 39 A 5 +ATOM 592 H HA . GLU A1 1 39 ? -26.144 2.877 -18.791 1.0 24.23 ? 39 A 5 +ATOM 593 H HB2 . GLU A1 1 39 ? -26.669 4.789 -20.536 1.0 13.32 ? 39 A 5 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.948 5.154 -18.975 1.0 53.15 ? 39 A 5 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.718 5.126 -20.055 1.0 73.51 ? 39 A 5 +ATOM 596 H HG3 . GLU A1 1 39 ? -24.518 4.907 -21.61 1.0 55.55 ? 39 A 5 +ATOM 597 N N . GLY A1 1 40 ? -25.409 2.494 -21.993 1.0 41.31 ? 40 A 5 +ATOM 598 C CA . GLY A1 1 40 ? -25.806 1.775 -23.19 1.0 23.2 ? 40 A 5 +ATOM 599 C C . GLY A1 1 40 ? -26.074 2.7 -24.36 1.0 54.31 ? 40 A 5 +ATOM 600 O O . GLY A1 1 40 ? -27.114 2.602 -25.012 1.0 62.35 ? 40 A 5 +ATOM 601 H H . GLY A1 1 40 ? -24.629 3.088 -22.017 1.0 1.31 ? 40 A 5 +ATOM 602 H HA2 . GLY A1 1 40 ? -25.019 1.087 -23.46 1.0 42.33 ? 40 A 5 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.704 1.213 -22.977 1.0 42.25 ? 40 A 5 +ATOM 604 N N . ILE A1 1 41 ? -25.135 3.602 -24.627 1.0 11.45 ? 41 A 5 +ATOM 605 C CA . ILE A1 1 41 ? -25.276 4.548 -25.726 1.0 13.21 ? 41 A 5 +ATOM 606 C C . ILE A1 1 41 ? -24.065 4.501 -26.651 1.0 73.14 ? 41 A 5 +ATOM 607 O O . ILE A1 1 41 ? -22.981 4.056 -26.273 1.0 54.03 ? 41 A 5 +ATOM 608 C CB . ILE A1 1 41 ? -25.458 5.988 -25.21 1.0 13.54 ? 41 A 5 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.578 6.227 -23.981 1.0 35.25 ? 41 A 5 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.919 6.252 -24.881 1.0 15.54 ? 41 A 5 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.997 7.622 -23.917 1.0 51.21 ? 41 A 5 +ATOM 612 H H . ILE A1 1 41 ? -24.329 3.631 -24.071 1.0 10.31 ? 41 A 5 +ATOM 613 H HA . ILE A1 1 41 ? -26.157 4.275 -26.29 1.0 22.4 ? 41 A 5 +ATOM 614 H HB . ILE A1 1 41 ? -25.162 6.668 -25.994 1.0 2.22 ? 41 A 5 +ATOM 615 H HG12 . ILE A1 1 41 ? -25.164 6.071 -23.09 1.0 53.25 ? 41 A 5 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.756 5.525 -23.994 1.0 73.21 ? 41 A 5 +ATOM 617 H HG21 . ILE A1 1 41 ? -27.466 6.436 -25.794 1.0 41.34 ? 41 A 5 +ATOM 618 H HG22 . ILE A1 1 41 ? -27.336 5.391 -24.38 1.0 35.01 ? 41 A 5 +ATOM 619 H HG23 . ILE A1 1 41 ? -26.993 7.115 -24.236 1.0 24.24 ? 41 A 5 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.125 7.62 -23.279 1.0 13.35 ? 41 A 5 +ATOM 621 H HD12 . ILE A1 1 41 ? -23.714 7.942 -24.909 1.0 5.02 ? 41 A 5 +ATOM 622 H HD13 . ILE A1 1 41 ? -24.734 8.301 -23.515 1.0 73.01 ? 41 A 5 +ATOM 623 N N . PRO A1 1 42 ? -24.25 4.971 -27.893 1.0 42.01 ? 42 A 5 +ATOM 624 C CA . PRO A1 1 42 ? -23.183 4.995 -28.898 1.0 63.34 ? 42 A 5 +ATOM 625 C C . PRO A1 1 42 ? -22.099 6.016 -28.568 1.0 4.23 ? 42 A 5 +ATOM 626 O O . PRO A1 1 42 ? -22.334 7.225 -28.555 1.0 21.54 ? 42 A 5 +ATOM 627 C CB . PRO A1 1 42 ? -23.915 5.389 -30.184 1.0 63.45 ? 42 A 5 +ATOM 628 C CG . PRO A1 1 42 ? -25.115 6.14 -29.721 1.0 31.23 ? 42 A 5 +ATOM 629 C CD . PRO A1 1 42 ? -25.516 5.516 -28.413 1.0 52.22 ? 42 A 5 +ATOM 630 H HA . PRO A1 1 42 ? -22.733 4.021 -29.022 1.0 60.32 ? 42 A 5 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.271 6.009 -30.792 1.0 50.23 ? 42 A 5 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.192 4.501 -30.731 1.0 64.01 ? 42 A 5 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.866 7.181 -29.579 1.0 0.11 ? 42 A 5 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.912 6.039 -30.443 1.0 1.1 ? 42 A 5 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.917 6.264 -27.745 1.0 11.32 ? 42 A 5 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.236 4.728 -28.576 1.0 34.03 ? 42 A 5 +ATOM 637 N N . PRO A1 1 43 ? -20.883 5.522 -28.296 1.0 1.41 ? 43 A 5 +ATOM 638 C CA . PRO A1 1 43 ? -19.738 6.374 -27.961 1.0 62.53 ? 43 A 5 +ATOM 639 C C . PRO A1 1 43 ? -19.249 7.183 -29.158 1.0 21.35 ? 43 A 5 +ATOM 640 O O . PRO A1 1 43 ? -18.76 8.303 -29.005 1.0 73.42 ? 43 A 5 +ATOM 641 C CB . PRO A1 1 43 ? -18.668 5.374 -27.519 1.0 74.43 ? 43 A 5 +ATOM 642 C CG . PRO A1 1 43 ? -19.029 4.103 -28.206 1.0 42.11 ? 43 A 5 +ATOM 643 C CD . PRO A1 1 43 ? -20.53 4.092 -28.293 1.0 32.53 ? 43 A 5 +ATOM 644 H HA . PRO A1 1 43 ? -19.967 7.044 -27.145 1.0 3.1 ? 43 A 5 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.693 5.727 -27.825 1.0 1.2 ? 43 A 5 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.695 5.263 -26.445 1.0 52.2 ? 43 A 5 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.596 4.084 -29.195 1.0 21.5 ? 43 A 5 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.682 3.26 -27.627 1.0 41.32 ? 43 A 5 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.852 3.614 -29.207 1.0 55.24 ? 43 A 5 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.954 3.592 -27.434 1.0 31.14 ? 43 A 5 +ATOM 651 N N . ASP A1 1 44 ? -19.384 6.61 -30.349 1.0 54.12 ? 44 A 5 +ATOM 652 C CA . ASP A1 1 44 ? -18.957 7.279 -31.572 1.0 51.34 ? 44 A 5 +ATOM 653 C C . ASP A1 1 44 ? -19.924 8.398 -31.946 1.0 65.34 ? 44 A 5 +ATOM 654 O O . ASP A1 1 44 ? -19.597 9.27 -32.749 1.0 41.23 ? 44 A 5 +ATOM 655 C CB . ASP A1 1 44 ? -18.854 6.272 -32.72 1.0 23.35 ? 44 A 5 +ATOM 656 C CG . ASP A1 1 44 ? -17.933 6.748 -33.826 1.0 52.14 ? 44 A 5 +ATOM 657 O OD1 . ASP A1 1 44 ? -17.242 7.768 -33.624 1.0 70.43 ? 44 A 5 +ATOM 658 O OD2 . ASP A1 1 44 ? -17.904 6.1 -34.893 1.0 15.14 ? 44 A 5 +ATOM 659 H H . ASP A1 1 44 ? -19.781 5.715 -30.406 1.0 64.31 ? 44 A 5 +ATOM 660 H HA . ASP A1 1 44 ? -17.983 7.707 -31.393 1.0 72.42 ? 44 A 5 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.473 5.337 -32.336 1.0 64.21 ? 44 A 5 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.837 6.112 -33.138 1.0 74.33 ? 44 A 5 +ATOM 663 N N . GLN A1 1 45 ? -21.115 8.364 -31.357 1.0 24.51 ? 45 A 5 +ATOM 664 C CA . GLN A1 1 45 ? -22.13 9.375 -31.63 1.0 55.1 ? 45 A 5 +ATOM 665 C C . GLN A1 1 45 ? -22.035 10.525 -30.633 1.0 65.33 ? 45 A 5 +ATOM 666 O O . GLN A1 1 45 ? -22.644 11.577 -30.825 1.0 0.12 ? 45 A 5 +ATOM 667 C CB . GLN A1 1 45 ? -23.527 8.753 -31.578 1.0 3.33 ? 45 A 5 +ATOM 668 C CG . GLN A1 1 45 ? -23.967 8.134 -32.895 1.0 71.05 ? 45 A 5 +ATOM 669 C CD . GLN A1 1 45 ? -25.066 7.106 -32.718 1.0 50.21 ? 45 A 5 +ATOM 670 O OE1 . GLN A1 1 45 ? -26.167 7.427 -32.269 1.0 30.33 ? 45 A 5 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.774 5.86 -33.072 1.0 54.11 ? 45 A 5 +ATOM 672 H H . GLN A1 1 45 ? -21.317 7.643 -30.726 1.0 33.14 ? 45 A 5 +ATOM 673 H HA . GLN A1 1 45 ? -21.955 9.761 -32.623 1.0 54.13 ? 45 A 5 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.537 7.983 -30.822 1.0 72.22 ? 45 A 5 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.239 9.519 -31.31 1.0 51.24 ? 45 A 5 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.33 8.918 -33.543 1.0 11.31 ? 45 A 5 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.115 7.655 -33.355 1.0 33.23 ? 45 A 5 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.876 5.676 -33.421 1.0 35.4 ? 45 A 5 +ATOM 679 H HE22 . GLN A1 1 45 ? -25.465 5.174 -32.967 1.0 53.4 ? 45 A 5 +ATOM 680 N N . GLN A1 1 46 ? -21.268 10.316 -29.568 1.0 5.34 ? 46 A 5 +ATOM 681 C CA . GLN A1 1 46 ? -21.095 11.336 -28.54 1.0 54.21 ? 46 A 5 +ATOM 682 C C . GLN A1 1 46 ? -19.678 11.9 -28.566 1.0 23.33 ? 46 A 5 +ATOM 683 O O . GLN A1 1 46 ? -18.757 11.268 -29.084 1.0 42.0 ? 46 A 5 +ATOM 684 C CB . GLN A1 1 46 ? -21.4 10.754 -27.159 1.0 54.1 ? 46 A 5 +ATOM 685 C CG . GLN A1 1 46 ? -20.61 9.495 -26.841 1.0 63.33 ? 46 A 5 +ATOM 686 C CD . GLN A1 1 46 ? -20.559 9.197 -25.355 1.0 73.34 ? 46 A 5 +ATOM 687 O OE1 . GLN A1 1 46 ? -21.594 9.034 -24.707 1.0 62.34 ? 46 A 5 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.352 9.125 -24.806 1.0 52.51 ? 46 A 5 +ATOM 689 H H . GLN A1 1 46 ? -20.808 9.457 -29.471 1.0 61.13 ? 46 A 5 +ATOM 690 H HA . GLN A1 1 46 ? -21.791 12.135 -28.746 1.0 1.54 ? 46 A 5 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.169 11.497 -26.41 1.0 70.34 ? 46 A 5 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.452 10.516 -27.106 1.0 24.41 ? 46 A 5 +ATOM 693 H HG2 . GLN A1 1 46 ? -21.072 8.659 -27.344 1.0 71.34 ? 46 A 5 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.6 9.618 -27.203 1.0 12.44 ? 46 A 5 +ATOM 695 H HE21 . GLN A1 1 46 ? -18.573 9.268 -25.384 1.0 61.21 ? 46 A 5 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.29 8.935 -23.848 1.0 54.41 ? 46 A 5 +ATOM 697 N N . ARG A1 1 47 ? -19.511 13.092 -28.004 1.0 11.31 ? 47 A 5 +ATOM 698 C CA . ARG A1 1 47 ? -18.206 13.742 -27.964 1.0 74.42 ? 47 A 5 +ATOM 699 C C . ARG A1 1 47 ? -17.982 14.428 -26.62 1.0 0.05 ? 47 A 5 +ATOM 700 O O . ARG A1 1 47 ? -18.931 14.704 -25.885 1.0 62.43 ? 47 A 5 +ATOM 701 C CB . ARG A1 1 47 ? -18.087 14.764 -29.097 1.0 53.24 ? 47 A 5 +ATOM 702 C CG . ARG A1 1 47 ? -16.939 14.483 -30.052 1.0 25.13 ? 47 A 5 +ATOM 703 C CD . ARG A1 1 47 ? -17.227 13.275 -30.93 1.0 74.31 ? 47 A 5 +ATOM 704 N NE . ARG A1 1 47 ? -16.943 13.542 -32.337 1.0 72.02 ? 47 A 5 +ATOM 705 C CZ . ARG A1 1 47 ? -16.912 12.599 -33.272 1.0 4.33 ? 47 A 5 +ATOM 706 N NH1 . ARG A1 1 47 ? -17.147 11.334 -32.951 1.0 22.33 ? 47 A 5 +ATOM 707 N NH2 . ARG A1 1 47 ? -16.646 12.92 -34.532 1.0 24.44 ? 47 A 5 +ATOM 708 H H . ARG A1 1 47 ? -20.283 13.547 -27.608 1.0 14.32 ? 47 A 5 +ATOM 709 H HA . ARG A1 1 47 ? -17.452 12.981 -28.097 1.0 52.1 ? 47 A 5 +ATOM 710 H HB2 . ARG A1 1 47 ? -19.006 14.764 -29.664 1.0 12.43 ? 47 A 5 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.938 15.743 -28.667 1.0 31.22 ? 47 A 5 +ATOM 712 H HG2 . ARG A1 1 47 ? -16.789 15.346 -30.684 1.0 2.15 ? 47 A 5 +ATOM 713 H HG3 . ARG A1 1 47 ? -16.043 14.295 -29.478 1.0 3.22 ? 47 A 5 +ATOM 714 H HD2 . ARG A1 1 47 ? -16.613 12.451 -30.599 1.0 62.34 ? 47 A 5 +ATOM 715 H HD3 . ARG A1 1 47 ? -18.269 13.012 -30.826 1.0 4.32 ? 47 A 5 +ATOM 716 H HE . ARG A1 1 47 ? -16.767 14.47 -32.597 1.0 51.12 ? 47 A 5 +ATOM 717 H HH11 . ARG A1 1 47 ? -17.348 11.089 -32.002 1.0 35.02 ? 47 A 5 +ATOM 718 H HH12 . ARG A1 1 47 ? -17.124 10.626 -33.657 1.0 42.25 ? 47 A 5 +ATOM 719 H HH21 . ARG A1 1 47 ? -16.469 13.872 -34.778 1.0 32.54 ? 47 A 5 +ATOM 720 H HH22 . ARG A1 1 47 ? -16.623 12.209 -35.235 1.0 51.04 ? 47 A 5 +ATOM 721 N N . LEU A1 1 48 ? -16.72 14.7 -26.304 1.0 13.42 ? 48 A 5 +ATOM 722 C CA . LEU A1 1 48 ? -16.37 15.354 -25.048 1.0 63.04 ? 48 A 5 +ATOM 723 C C . LEU A1 1 48 ? -16.026 16.822 -25.276 1.0 70.54 ? 48 A 5 +ATOM 724 O O . LEU A1 1 48 ? -15.452 17.183 -26.304 1.0 13.22 ? 48 A 5 +ATOM 725 C CB . LEU A1 1 48 ? -15.189 14.638 -24.39 1.0 73.22 ? 48 A 5 +ATOM 726 C CG . LEU A1 1 48 ? -15.132 13.122 -24.582 1.0 23.01 ? 48 A 5 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.519 12.514 -24.445 1.0 2.23 ? 48 A 5 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.528 12.778 -25.935 1.0 62.5 ? 48 A 5 +ATOM 729 H H . LEU A1 1 48 ? -16.007 14.457 -26.93 1.0 13.1 ? 48 A 5 +ATOM 730 H HA . LEU A1 1 48 ? -17.227 15.295 -24.394 1.0 5.14 ? 48 A 5 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.281 15.057 -24.795 1.0 14.35 ? 48 A 5 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.233 14.837 -23.328 1.0 62.22 ? 48 A 5 +ATOM 733 H HG . LEU A1 1 48 ? -14.503 12.692 -23.815 1.0 74.12 ? 48 A 5 +ATOM 734 H HD11 . LEU A1 1 48 ? -16.98 12.447 -25.419 1.0 72.12 ? 48 A 5 +ATOM 735 H HD12 . LEU A1 1 48 ? -17.124 13.137 -23.803 1.0 51.52 ? 48 A 5 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.439 11.526 -24.015 1.0 50.13 ? 48 A 5 +ATOM 737 H HD21 . LEU A1 1 48 ? -13.966 11.86 -25.856 1.0 32.51 ? 48 A 5 +ATOM 738 H HD22 . LEU A1 1 48 ? -13.872 13.576 -26.249 1.0 4.35 ? 48 A 5 +ATOM 739 H HD23 . LEU A1 1 48 ? -15.318 12.655 -26.662 1.0 44.23 ? 48 A 5 +ATOM 740 N N . ILE A1 1 49 ? -16.378 17.664 -24.31 1.0 13.31 ? 49 A 5 +ATOM 741 C CA . ILE A1 1 49 ? -16.104 19.092 -24.404 1.0 13.25 ? 49 A 5 +ATOM 742 C C . ILE A1 1 49 ? -15.654 19.655 -23.06 1.0 73.24 ? 49 A 5 +ATOM 743 O O . ILE A1 1 49 ? -16.355 19.528 -22.056 1.0 20.41 ? 49 A 5 +ATOM 744 C CB . ILE A1 1 49 ? -17.34 19.873 -24.887 1.0 42.12 ? 49 A 5 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.332 19.991 -26.412 1.0 21.4 ? 49 A 5 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.381 21.251 -24.244 1.0 44.11 ? 49 A 5 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.617 19.526 -27.061 1.0 30.32 ? 49 A 5 +ATOM 748 H H . ILE A1 1 49 ? -16.833 17.316 -23.515 1.0 11.12 ? 49 A 5 +ATOM 749 H HA . ILE A1 1 49 ? -15.31 19.232 -25.124 1.0 31.54 ? 49 A 5 +ATOM 750 H HB . ILE A1 1 49 ? -18.222 19.332 -24.579 1.0 10.22 ? 49 A 5 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.177 21.022 -26.687 1.0 52.53 ? 49 A 5 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.524 19.392 -26.808 1.0 23.14 ? 49 A 5 +ATOM 753 H HG21 . ILE A1 1 49 ? -18.092 21.872 -24.769 1.0 54.41 ? 49 A 5 +ATOM 754 H HG22 . ILE A1 1 49 ? -17.682 21.157 -23.211 1.0 2.4 ? 49 A 5 +ATOM 755 H HG23 . ILE A1 1 49 ? -16.402 21.702 -24.295 1.0 53.42 ? 49 A 5 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.389 20.264 -26.899 1.0 43.14 ? 49 A 5 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.459 19.399 -28.122 1.0 61.33 ? 49 A 5 +ATOM 758 H HD13 . ILE A1 1 49 ? -18.921 18.586 -26.626 1.0 3.14 ? 49 A 5 +ATOM 759 N N . PHE A1 1 50 ? -14.481 20.28 -23.048 1.0 0.44 ? 50 A 5 +ATOM 760 C CA . PHE A1 1 50 ? -13.938 20.864 -21.828 1.0 63.4 ? 50 A 5 +ATOM 761 C C . PHE A1 1 50 ? -13.571 22.329 -22.042 1.0 34.31 ? 50 A 5 +ATOM 762 O O . PHE A1 1 50 ? -12.795 22.662 -22.937 1.0 24.03 ? 50 A 5 +ATOM 763 C CB . PHE A1 1 50 ? -12.706 20.081 -21.367 1.0 1.31 ? 50 A 5 +ATOM 764 C CG . PHE A1 1 50 ? -12.338 20.333 -19.933 1.0 63.44 ? 50 A 5 +ATOM 765 C CD1 . PHE A1 1 50 ? -11.742 21.526 -19.556 1.0 63.22 ? 50 A 5 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.587 19.377 -18.961 1.0 31.12 ? 50 A 5 +ATOM 767 C CE1 . PHE A1 1 50 ? -11.402 21.761 -18.237 1.0 44.05 ? 50 A 5 +ATOM 768 C CE2 . PHE A1 1 50 ? -12.25 19.607 -17.641 1.0 53.14 ? 50 A 5 +ATOM 769 C CZ . PHE A1 1 50 ? -11.656 20.8 -17.279 1.0 64.24 ? 50 A 5 +ATOM 770 H H . PHE A1 1 50 ? -13.968 20.349 -23.881 1.0 32.43 ? 50 A 5 +ATOM 771 H HA . PHE A1 1 50 ? -14.699 20.803 -21.065 1.0 55.42 ? 50 A 5 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.898 19.024 -21.479 1.0 72.21 ? 50 A 5 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.863 20.357 -21.981 1.0 52.42 ? 50 A 5 +ATOM 774 H HD1 . PHE A1 1 50 ? -11.543 22.279 -20.306 1.0 64.41 ? 50 A 5 +ATOM 775 H HD2 . PHE A1 1 50 ? -13.051 18.443 -19.243 1.0 25.0 ? 50 A 5 +ATOM 776 H HE1 . PHE A1 1 50 ? -10.938 22.695 -17.958 1.0 33.34 ? 50 A 5 +ATOM 777 H HE2 . PHE A1 1 50 ? -12.449 18.853 -16.893 1.0 34.14 ? 50 A 5 +ATOM 778 H HZ . PHE A1 1 50 ? -11.391 20.982 -16.248 1.0 42.2 ? 50 A 5 +ATOM 779 N N . GLY A1 1 51 ? -14.137 23.202 -21.214 1.0 53.44 ? 51 A 5 +ATOM 780 C CA . GLY A1 1 51 ? -13.859 24.622 -21.33 1.0 33.5 ? 51 A 5 +ATOM 781 C C . GLY A1 1 51 ? -14.394 25.214 -22.618 1.0 34.32 ? 51 A 5 +ATOM 782 O O . GLY A1 1 51 ? -14.09 26.357 -22.958 1.0 0.02 ? 51 A 5 +ATOM 783 H H . GLY A1 1 51 ? -14.749 22.879 -20.519 1.0 14.34 ? 51 A 5 +ATOM 784 H HA2 . GLY A1 1 51 ? -14.312 25.135 -20.494 1.0 71.3 ? 51 A 5 +ATOM 785 H HA3 . GLY A1 1 51 ? -12.79 24.772 -21.295 1.0 2.33 ? 51 A 5 +ATOM 786 N N . GLY A1 1 52 ? -15.194 24.434 -23.34 1.0 51.33 ? 52 A 5 +ATOM 787 C CA . GLY A1 1 52 ? -15.758 24.906 -24.591 1.0 70.11 ? 52 A 5 +ATOM 788 C C . GLY A1 1 52 ? -15.196 24.171 -25.793 1.0 64.35 ? 52 A 5 +ATOM 789 O O . GLY A1 1 52 ? -15.877 24.011 -26.806 1.0 21.12 ? 52 A 5 +ATOM 790 H H . GLY A1 1 52 ? -15.402 23.532 -23.02 1.0 52.33 ? 52 A 5 +ATOM 791 H HA2 . GLY A1 1 52 ? -16.828 24.768 -24.566 1.0 34.31 ? 52 A 5 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.543 25.959 -24.695 1.0 33.12 ? 52 A 5 +ATOM 793 N N . LYS A1 1 53 ? -13.95 23.724 -25.682 1.0 4.12 ? 53 A 5 +ATOM 794 C CA . LYS A1 1 53 ? -13.296 23.003 -26.767 1.0 20.15 ? 53 A 5 +ATOM 795 C C . LYS A1 1 53 ? -13.456 21.496 -26.593 1.0 12.34 ? 53 A 5 +ATOM 796 O O . LYS A1 1 53 ? -13.496 20.993 -25.471 1.0 53.3 ? 53 A 5 +ATOM 797 C CB . LYS A1 1 53 ? -11.81 23.366 -26.825 1.0 12.13 ? 53 A 5 +ATOM 798 C CG . LYS A1 1 53 ? -11.09 23.193 -25.499 1.0 34.42 ? 53 A 5 +ATOM 799 C CD . LYS A1 1 53 ? -10.497 21.801 -25.364 1.0 44.0 ? 53 A 5 +ATOM 800 C CE . LYS A1 1 53 ? -9.379 21.571 -26.369 1.0 75.53 ? 53 A 5 +ATOM 801 N NZ . LYS A1 1 53 ? -8.367 22.663 -26.333 1.0 61.53 ? 53 A 5 +ATOM 802 H H . LYS A1 1 53 ? -13.458 23.883 -24.848 1.0 32.12 ? 53 A 5 +ATOM 803 H HA . LYS A1 1 53 ? -13.766 23.299 -27.693 1.0 74.23 ? 53 A 5 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.327 22.737 -27.558 1.0 34.02 ? 53 A 5 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.716 24.398 -27.131 1.0 32.22 ? 53 A 5 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.293 23.92 -25.435 1.0 24.24 ? 53 A 5 +ATOM 807 H HG3 . LYS A1 1 53 ? -11.793 23.355 -24.695 1.0 53.0 ? 53 A 5 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.099 21.684 -24.367 1.0 22.42 ? 53 A 5 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.275 21.07 -25.531 1.0 0.05 ? 53 A 5 +ATOM 810 H HE2 . LYS A1 1 53 ? -8.893 20.635 -26.14 1.0 25.2 ? 53 A 5 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.807 21.521 -27.359 1.0 75.24 ? 53 A 5 +ATOM 812 H HZ1 . LYS A1 1 53 ? -8.53 23.328 -27.117 1.0 1.33 ? 53 A 5 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.41 22.267 -26.422 1.0 14.14 ? 53 A 5 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.433 23.182 -25.434 1.0 31.25 ? 53 A 5 +ATOM 815 N N . GLN A1 1 54 ? -13.546 20.782 -27.711 1.0 32.1 ? 54 A 5 +ATOM 816 C CA . GLN A1 1 54 ? -13.701 19.333 -27.681 1.0 3.14 ? 54 A 5 +ATOM 817 C C . GLN A1 1 54 ? -12.426 18.66 -27.182 1.0 14.5 ? 54 A 5 +ATOM 818 O O . GLN A1 1 54 ? -11.384 19.302 -27.046 1.0 22.04 ? 54 A 5 +ATOM 819 C CB . GLN A1 1 54 ? -14.058 18.808 -29.072 1.0 14.03 ? 54 A 5 +ATOM 820 C CG . GLN A1 1 54 ? -15.426 18.149 -29.141 1.0 52.41 ? 54 A 5 +ATOM 821 C CD . GLN A1 1 54 ? -15.868 17.867 -30.564 1.0 44.23 ? 54 A 5 +ATOM 822 O OE1 . GLN A1 1 54 ? -15.046 17.581 -31.436 1.0 25.33 ? 54 A 5 +ATOM 823 N NE2 . GLN A1 1 54 ? -17.171 17.947 -30.806 1.0 63.1 ? 54 A 5 +ATOM 824 H H . GLN A1 1 54 ? -13.508 21.241 -28.575 1.0 52.11 ? 54 A 5 +ATOM 825 H HA . GLN A1 1 54 ? -14.506 19.1 -27.0 1.0 62.04 ? 54 A 5 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.043 19.632 -29.77 1.0 31.24 ? 54 A 5 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.317 18.081 -29.371 1.0 25.42 ? 54 A 5 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.389 17.214 -28.601 1.0 52.11 ? 54 A 5 +ATOM 829 H HG3 . GLN A1 1 54 ? -16.15 18.803 -28.677 1.0 53.52 ? 54 A 5 +ATOM 830 H HE21 . GLN A1 1 54 ? -17.766 18.181 -30.063 1.0 45.55 ? 54 A 5 +ATOM 831 H HE22 . GLN A1 1 54 ? -17.484 17.77 -31.717 1.0 62.42 ? 54 A 5 +ATOM 832 N N . LEU A1 1 55 ? -12.516 17.363 -26.91 1.0 51.34 ? 55 A 5 +ATOM 833 C CA . LEU A1 1 55 ? -11.37 16.601 -26.425 1.0 40.45 ? 55 A 5 +ATOM 834 C C . LEU A1 1 55 ? -11.024 15.468 -27.386 1.0 63.5 ? 55 A 5 +ATOM 835 O O . LEU A1 1 55 ? -11.885 14.672 -27.757 1.0 52.11 ? 55 A 5 +ATOM 836 C CB . LEU A1 1 55 ? -11.66 16.036 -25.034 1.0 25.03 ? 55 A 5 +ATOM 837 C CG . LEU A1 1 55 ? -12.269 17.011 -24.026 1.0 41.33 ? 55 A 5 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.372 16.365 -22.653 1.0 33.24 ? 55 A 5 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.447 18.289 -23.957 1.0 52.23 ? 55 A 5 +ATOM 840 H H . LEU A1 1 55 ? -13.373 16.905 -27.037 1.0 12.34 ? 55 A 5 +ATOM 841 H HA . LEU A1 1 55 ? -10.528 17.274 -26.363 1.0 22.21 ? 55 A 5 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.344 15.209 -25.149 1.0 55.1 ? 55 A 5 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.727 15.674 -24.624 1.0 51.11 ? 55 A 5 +ATOM 844 H HG . LEU A1 1 55 ? -13.268 17.272 -24.347 1.0 72.12 ? 55 A 5 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.574 15.649 -22.532 1.0 32.04 ? 55 A 5 +ATOM 846 H HD12 . LEU A1 1 55 ? -13.323 15.863 -22.562 1.0 44.35 ? 55 A 5 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.292 17.126 -21.891 1.0 32.21 ? 55 A 5 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.237 18.527 -22.924 1.0 33.14 ? 55 A 5 +ATOM 849 H HD22 . LEU A1 1 55 ? -12.002 19.099 -24.407 1.0 72.01 ? 55 A 5 +ATOM 850 H HD23 . LEU A1 1 55 ? -10.518 18.149 -24.49 1.0 74.33 ? 55 A 5 +ATOM 851 N N . GLU A1 1 56 ? -9.756 15.401 -27.782 1.0 12.02 ? 56 A 5 +ATOM 852 C CA . GLU A1 1 56 ? -9.297 14.364 -28.698 1.0 31.33 ? 56 A 5 +ATOM 853 C C . GLU A1 1 56 ? -9.356 12.99 -28.037 1.0 62.51 ? 56 A 5 +ATOM 854 O O . GLU A1 1 56 ? -9.821 12.852 -26.906 1.0 51.02 ? 56 A 5 +ATOM 855 C CB . GLU A1 1 56 ? -7.869 14.658 -29.162 1.0 62.01 ? 56 A 5 +ATOM 856 C CG . GLU A1 1 56 ? -7.679 16.07 -29.69 1.0 21.02 ? 56 A 5 +ATOM 857 C CD . GLU A1 1 56 ? -8.797 16.5 -30.62 1.0 1.0 ? 56 A 5 +ATOM 858 O OE1 . GLU A1 1 56 ? -9.243 15.666 -31.436 1.0 61.34 ? 56 A 5 +ATOM 859 O OE2 . GLU A1 1 56 ? -9.226 17.669 -30.533 1.0 22.01 ? 56 A 5 +ATOM 860 H H . GLU A1 1 56 ? -9.116 16.065 -27.451 1.0 72.43 ? 56 A 5 +ATOM 861 H HA . GLU A1 1 56 ? -9.952 14.366 -29.556 1.0 4.21 ? 56 A 5 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.196 14.514 -28.329 1.0 41.11 ? 56 A 5 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.609 13.964 -29.947 1.0 51.02 ? 56 A 5 +ATOM 864 H HG2 . GLU A1 1 56 ? -7.645 16.752 -28.854 1.0 71.31 ? 56 A 5 +ATOM 865 H HG3 . GLU A1 1 56 ? -6.744 16.116 -30.229 1.0 60.44 ? 56 A 5 +ATOM 866 N N . ASP A1 1 57 ? -8.882 11.975 -28.752 1.0 71.03 ? 57 A 5 +ATOM 867 C CA . ASP A1 1 57 ? -8.879 10.611 -28.236 1.0 63.41 ? 57 A 5 +ATOM 868 C C . ASP A1 1 57 ? -7.821 10.443 -27.151 1.0 21.4 ? 57 A 5 +ATOM 869 O O . ASP A1 1 57 ? -7.934 9.57 -26.29 1.0 43.31 ? 57 A 5 +ATOM 870 C CB . ASP A1 1 57 ? -8.629 9.615 -29.37 1.0 45.31 ? 57 A 5 +ATOM 871 C CG . ASP A1 1 57 ? -9.65 9.737 -30.484 1.0 55.43 ? 57 A 5 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.832 9.418 -30.242 1.0 72.35 ? 57 A 5 +ATOM 873 O OD2 . ASP A1 1 57 ? -9.266 10.151 -31.598 1.0 15.11 ? 57 A 5 +ATOM 874 H H . ASP A1 1 57 ? -8.524 12.148 -29.648 1.0 23.12 ? 57 A 5 +ATOM 875 H HA . ASP A1 1 57 ? -9.851 10.417 -27.807 1.0 62.14 ? 57 A 5 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.647 9.792 -29.785 1.0 24.44 ? 57 A 5 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.672 8.611 -28.974 1.0 64.03 ? 57 A 5 +ATOM 878 N N . SER A1 1 58 ? -6.792 11.283 -27.199 1.0 32.51 ? 58 A 5 +ATOM 879 C CA . SER A1 1 58 ? -5.71 11.224 -26.223 1.0 62.24 ? 58 A 5 +ATOM 880 C C . SER A1 1 58 ? -5.746 12.437 -25.299 1.0 2.12 ? 58 A 5 +ATOM 881 O O . SER A1 1 58 ? -4.872 12.61 -24.449 1.0 12.21 ? 58 A 5 +ATOM 882 C CB . SER A1 1 58 ? -4.357 11.148 -26.933 1.0 65.11 ? 58 A 5 +ATOM 883 O OG . SER A1 1 58 ? -3.312 10.89 -26.012 1.0 34.21 ? 58 A 5 +ATOM 884 H H . SER A1 1 58 ? -6.759 11.957 -27.91 1.0 21.03 ? 58 A 5 +ATOM 885 H HA . SER A1 1 58 ? -5.847 10.331 -25.631 1.0 33.55 ? 58 A 5 +ATOM 886 H HB2 . SER A1 1 58 ? -4.381 10.355 -27.664 1.0 31.42 ? 58 A 5 +ATOM 887 H HB3 . SER A1 1 58 ? -4.161 12.088 -27.428 1.0 40.4 ? 58 A 5 +ATOM 888 H HG . SER A1 1 58 ? -2.517 11.35 -26.293 1.0 10.23 ? 58 A 5 +ATOM 889 N N . ASN A1 1 59 ? -6.762 13.276 -25.472 1.0 35.41 ? 59 A 5 +ATOM 890 C CA . ASN A1 1 59 ? -6.912 14.474 -24.655 1.0 52.34 ? 59 A 5 +ATOM 891 C C . ASN A1 1 59 ? -7.634 14.155 -23.349 1.0 4.01 ? 59 A 5 +ATOM 892 O O . ASN A1 1 59 ? -8.831 14.405 -23.213 1.0 42.21 ? 59 A 5 +ATOM 893 C CB . ASN A1 1 59 ? -7.68 15.55 -25.426 1.0 21.1 ? 59 A 5 +ATOM 894 C CG . ASN A1 1 59 ? -7.359 16.95 -24.939 1.0 14.54 ? 59 A 5 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.91 17.139 -23.809 1.0 24.42 ? 59 A 5 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.589 17.94 -25.794 1.0 14.44 ? 59 A 5 +ATOM 897 H H . ASN A1 1 59 ? -7.427 13.084 -26.166 1.0 5.51 ? 59 A 5 +ATOM 898 H HA . ASN A1 1 59 ? -5.924 14.844 -24.425 1.0 74.51 ? 59 A 5 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.423 15.486 -26.473 1.0 43.43 ? 59 A 5 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.74 15.381 -25.308 1.0 11.21 ? 59 A 5 +ATOM 901 H HD21 . ASN A1 1 59 ? -7.947 17.715 -26.678 1.0 21.33 ? 59 A 5 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.389 18.855 -25.506 1.0 12.0 ? 59 A 5 +ATOM 903 N N . ALA A1 1 60 ? -6.897 13.602 -22.391 1.0 13.11 ? 60 A 5 +ATOM 904 C CA . ALA A1 1 60 ? -7.466 13.252 -21.096 1.0 35.51 ? 60 A 5 +ATOM 905 C C . ALA A1 1 60 ? -6.383 12.785 -20.129 1.0 74.01 ? 60 A 5 +ATOM 906 O O . ALA A1 1 60 ? -5.922 13.55 -19.283 1.0 74.24 ? 60 A 5 +ATOM 907 C CB . ALA A1 1 60 ? -8.529 12.176 -21.26 1.0 64.13 ? 60 A 5 +ATOM 908 H H . ALA A1 1 60 ? -5.948 13.428 -22.56 1.0 31.12 ? 60 A 5 +ATOM 909 H HA . ALA A1 1 60 ? -7.941 14.134 -20.69 1.0 20.01 ? 60 A 5 +ATOM 910 H HB1 . ALA A1 1 60 ? -9.329 12.554 -21.88 1.0 72.33 ? 60 A 5 +ATOM 911 H HB2 . ALA A1 1 60 ? -8.092 11.306 -21.726 1.0 25.02 ? 60 A 5 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.922 11.907 -20.291 1.0 51.02 ? 60 A 5 +ATOM 913 N N . MET A1 1 61 ? -5.983 11.525 -20.26 1.0 21.52 ? 61 A 5 +ATOM 914 C CA . MET A1 1 61 ? -4.953 10.956 -19.398 1.0 32.03 ? 61 A 5 +ATOM 915 C C . MET A1 1 61 ? -3.574 11.485 -19.777 1.0 55.14 ? 61 A 5 +ATOM 916 O O . MET A1 1 61 ? -2.887 12.097 -18.958 1.0 73.23 ? 61 A 5 +ATOM 917 C CB . MET A1 1 61 ? -4.969 9.429 -19.487 1.0 33.12 ? 61 A 5 +ATOM 918 C CG . MET A1 1 61 ? -6.368 8.838 -19.546 1.0 10.31 ? 61 A 5 +ATOM 919 S SD . MET A1 1 61 ? -7.46 9.511 -18.278 1.0 3.45 ? 61 A 5 +ATOM 920 C CE . MET A1 1 61 ? -9.022 9.532 -19.154 1.0 11.34 ? 61 A 5 +ATOM 921 H H . MET A1 1 61 ? -6.388 10.963 -20.954 1.0 44.35 ? 61 A 5 +ATOM 922 H HA . MET A1 1 61 ? -5.172 11.251 -18.382 1.0 14.21 ? 61 A 5 +ATOM 923 H HB2 . MET A1 1 61 ? -4.436 9.127 -20.376 1.0 14.23 ? 61 A 5 +ATOM 924 H HB3 . MET A1 1 61 ? -4.467 9.024 -18.621 1.0 0.24 ? 61 A 5 +ATOM 925 H HG2 . MET A1 1 61 ? -6.793 9.049 -20.515 1.0 62.14 ? 61 A 5 +ATOM 926 H HG3 . MET A1 1 61 ? -6.298 7.769 -19.411 1.0 32.0 ? 61 A 5 +ATOM 927 H HE1 . MET A1 1 61 ? -8.846 9.376 -20.208 1.0 54.23 ? 61 A 5 +ATOM 928 H HE2 . MET A1 1 61 ? -9.658 8.745 -18.775 1.0 64.31 ? 61 A 5 +ATOM 929 H HE3 . MET A1 1 61 ? -9.504 10.487 -19.007 1.0 24.11 ? 61 A 5 +ATOM 930 N N . SER A1 1 62 ? -3.174 11.246 -21.021 1.0 73.15 ? 62 A 5 +ATOM 931 C CA . SER A1 1 62 ? -1.874 11.695 -21.507 1.0 12.22 ? 62 A 5 +ATOM 932 C C . SER A1 1 62 ? -1.736 13.208 -21.369 1.0 13.52 ? 62 A 5 +ATOM 933 O O . SER A1 1 62 ? -0.643 13.723 -21.13 1.0 42.51 ? 62 A 5 +ATOM 934 C CB . SER A1 1 62 ? -1.683 11.285 -22.969 1.0 62.33 ? 62 A 5 +ATOM 935 O OG . SER A1 1 62 ? -0.771 12.149 -23.625 1.0 14.13 ? 62 A 5 +ATOM 936 H H . SER A1 1 62 ? -3.767 10.753 -21.627 1.0 74.25 ? 62 A 5 +ATOM 937 H HA . SER A1 1 62 ? -1.114 11.219 -20.906 1.0 74.15 ? 62 A 5 +ATOM 938 H HB2 . SER A1 1 62 ? -1.3 10.277 -23.01 1.0 54.41 ? 62 A 5 +ATOM 939 H HB3 . SER A1 1 62 ? -2.634 11.33 -23.479 1.0 23.45 ? 62 A 5 +ATOM 940 H HG . SER A1 1 62 ? 0.055 11.685 -23.778 1.0 1.23 ? 62 A 5 +ATOM 941 N N . ASP A1 1 63 ? -2.851 13.914 -21.52 1.0 34.33 ? 63 A 5 +ATOM 942 C CA . ASP A1 1 63 ? -2.856 15.368 -21.411 1.0 10.21 ? 63 A 5 +ATOM 943 C C . ASP A1 1 63 ? -2.454 15.809 -20.007 1.0 63.54 ? 63 A 5 +ATOM 944 O O . ASP A1 1 63 ? -1.964 16.922 -19.811 1.0 31.33 ? 63 A 5 +ATOM 945 C CB . ASP A1 1 63 ? -4.239 15.922 -21.757 1.0 21.1 ? 63 A 5 +ATOM 946 C CG . ASP A1 1 63 ? -4.184 17.36 -22.232 1.0 12.2 ? 63 A 5 +ATOM 947 O OD1 . ASP A1 1 63 ? -3.598 17.608 -23.307 1.0 53.24 ? 63 A 5 +ATOM 948 O OD2 . ASP A1 1 63 ? -4.728 18.238 -21.53 1.0 3.13 ? 63 A 5 +ATOM 949 H H . ASP A1 1 63 ? -3.691 13.445 -21.709 1.0 14.4 ? 63 A 5 +ATOM 950 H HA . ASP A1 1 63 ? -2.137 15.756 -22.116 1.0 72.42 ? 63 A 5 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.676 15.32 -22.54 1.0 63.34 ? 63 A 5 +ATOM 952 H HB3 . ASP A1 1 63 ? -4.868 15.875 -20.88 1.0 44.51 ? 63 A 5 +ATOM 953 N N . TYR A1 1 64 ? -2.665 14.93 -19.033 1.0 43.15 ? 64 A 5 +ATOM 954 C CA . TYR A1 1 64 ? -2.328 15.23 -17.647 1.0 74.44 ? 64 A 5 +ATOM 955 C C . TYR A1 1 64 ? -3.401 16.103 -17.002 1.0 35.31 ? 64 A 5 +ATOM 956 O O . TYR A1 1 64 ? -3.127 16.851 -16.064 1.0 63.11 ? 64 A 5 +ATOM 957 C CB . TYR A1 1 64 ? -0.971 15.932 -17.57 1.0 41.31 ? 64 A 5 +ATOM 958 C CG . TYR A1 1 64 ? -0.087 15.421 -16.455 1.0 35.31 ? 64 A 5 +ATOM 959 C CD1 . TYR A1 1 64 ? -0.606 15.174 -15.189 1.0 10.21 ? 64 A 5 +ATOM 960 C CD2 . TYR A1 1 64 ? 1.266 15.186 -16.665 1.0 61.0 ? 64 A 5 +ATOM 961 C CE1 . TYR A1 1 64 ? 0.198 14.707 -14.167 1.0 31.32 ? 64 A 5 +ATOM 962 C CE2 . TYR A1 1 64 ? 2.076 14.719 -15.649 1.0 3.01 ? 64 A 5 +ATOM 963 C CZ . TYR A1 1 64 ? 1.538 14.481 -14.402 1.0 35.43 ? 64 A 5 +ATOM 964 O OH . TYR A1 1 64 ? 2.342 14.017 -13.386 1.0 23.32 ? 64 A 5 +ATOM 965 H H . TYR A1 1 64 ? -3.058 14.06 -19.252 1.0 10.22 ? 64 A 5 +ATOM 966 H HA . TYR A1 1 64 ? -2.269 14.295 -17.11 1.0 40.51 ? 64 A 5 +ATOM 967 H HB2 . TYR A1 1 64 ? -0.445 15.787 -18.501 1.0 75.32 ? 64 A 5 +ATOM 968 H HB3 . TYR A1 1 64 ? -1.128 16.989 -17.412 1.0 32.34 ? 64 A 5 +ATOM 969 H HD1 . TYR A1 1 64 ? -1.656 15.352 -15.009 1.0 1.35 ? 64 A 5 +ATOM 970 H HD2 . TYR A1 1 64 ? 1.685 15.374 -17.643 1.0 32.41 ? 64 A 5 +ATOM 971 H HE1 . TYR A1 1 64 ? -0.224 14.521 -13.19 1.0 52.21 ? 64 A 5 +ATOM 972 H HE2 . TYR A1 1 64 ? 3.126 14.542 -15.833 1.0 43.14 ? 64 A 5 +ATOM 973 H HH . TYR A1 1 64 ? 3.158 13.671 -13.757 1.0 23.33 ? 64 A 5 +ATOM 974 N N . ASN A1 1 65 ? -4.624 15.999 -17.512 1.0 61.21 ? 65 A 5 +ATOM 975 C CA . ASN A1 1 65 ? -5.739 16.778 -16.987 1.0 70.22 ? 65 A 5 +ATOM 976 C C . ASN A1 1 65 ? -6.75 15.875 -16.286 1.0 21.44 ? 65 A 5 +ATOM 977 O O . ASN A1 1 65 ? -7.866 16.296 -15.98 1.0 22.24 ? 65 A 5 +ATOM 978 C CB . ASN A1 1 65 ? -6.425 17.551 -18.115 1.0 30.31 ? 65 A 5 +ATOM 979 C CG . ASN A1 1 65 ? -7.301 18.675 -17.597 1.0 75.23 ? 65 A 5 +ATOM 980 O OD1 . ASN A1 1 65 ? -6.877 19.471 -16.758 1.0 74.2 ? 65 A 5 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.529 18.746 -18.095 1.0 12.4 ? 65 A 5 +ATOM 982 H H . ASN A1 1 65 ? -4.78 15.385 -18.26 1.0 72.01 ? 65 A 5 +ATOM 983 H HA . ASN A1 1 65 ? -5.344 17.481 -16.269 1.0 43.44 ? 65 A 5 +ATOM 984 H HB2 . ASN A1 1 65 ? -5.671 17.977 -18.761 1.0 12.24 ? 65 A 5 +ATOM 985 H HB3 . ASN A1 1 65 ? -7.041 16.873 -18.686 1.0 73.02 ? 65 A 5 +ATOM 986 H HD21 . ASN A1 1 65 ? -8.799 18.078 -18.76 1.0 23.44 ? 65 A 5 +ATOM 987 H HD22 . ASN A1 1 65 ? -9.117 19.463 -17.778 1.0 32.24 ? 65 A 5 +ATOM 988 N N . VAL A1 1 66 ? -6.352 14.632 -16.035 1.0 11.4 ? 66 A 5 +ATOM 989 C CA . VAL A1 1 66 ? -7.222 13.67 -15.369 1.0 70.45 ? 66 A 5 +ATOM 990 C C . VAL A1 1 66 ? -7.037 13.717 -13.857 1.0 73.11 ? 66 A 5 +ATOM 991 O O . VAL A1 1 66 ? -5.925 13.563 -13.353 1.0 33.12 ? 66 A 5 +ATOM 992 C CB . VAL A1 1 66 ? -6.955 12.236 -15.864 1.0 40.11 ? 66 A 5 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.524 11.822 -15.554 1.0 32.21 ? 66 A 5 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.947 11.265 -15.241 1.0 25.13 ? 66 A 5 +ATOM 995 H H . VAL A1 1 66 ? -5.451 14.356 -16.304 1.0 25.31 ? 66 A 5 +ATOM 996 H HA . VAL A1 1 66 ? -8.245 13.925 -15.606 1.0 44.24 ? 66 A 5 +ATOM 997 H HB . VAL A1 1 66 ? -7.088 12.216 -16.936 1.0 65.05 ? 66 A 5 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.422 11.648 -14.493 1.0 62.5 ? 66 A 5 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.287 10.916 -16.093 1.0 4.5 ? 66 A 5 +ATOM 1000 H HG13 . VAL A1 1 66 ? -4.849 12.609 -15.856 1.0 12.32 ? 66 A 5 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.951 11.553 -15.513 1.0 23.4 ? 66 A 5 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.747 10.267 -15.602 1.0 64.2 ? 66 A 5 +ATOM 1003 H HG23 . VAL A1 1 66 ? -7.845 11.286 -14.166 1.0 74.31 ? 66 A 5 +ATOM 1004 N N . GLN A1 1 67 ? -8.135 13.93 -13.139 1.0 5.43 ? 67 A 5 +ATOM 1005 C CA . GLN A1 1 67 ? -8.093 13.998 -11.683 1.0 15.5 ? 67 A 5 +ATOM 1006 C C . GLN A1 1 67 ? -9.034 12.97 -11.063 1.0 62.54 ? 67 A 5 +ATOM 1007 O O . GLN A1 1 67 ? -9.674 12.192 -11.771 1.0 44.01 ? 67 A 5 +ATOM 1008 C CB . GLN A1 1 67 ? -8.468 15.402 -11.205 1.0 35.11 ? 67 A 5 +ATOM 1009 C CG . GLN A1 1 67 ? -9.873 15.825 -11.602 1.0 11.21 ? 67 A 5 +ATOM 1010 C CD . GLN A1 1 67 ? -10.524 16.726 -10.572 1.0 34.44 ? 67 A 5 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.509 16.434 -9.376 1.0 41.54 ? 67 A 5 +ATOM 1012 N NE2 . GLN A1 1 67 ? -11.101 17.831 -11.031 1.0 50.51 ? 67 A 5 +ATOM 1013 H H . GLN A1 1 67 ? -8.992 14.046 -13.598 1.0 54.23 ? 67 A 5 +ATOM 1014 H HA . GLN A1 1 67 ? -7.084 13.778 -11.369 1.0 21.13 ? 67 A 5 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.396 15.434 -10.128 1.0 61.05 ? 67 A 5 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.77 16.11 -11.626 1.0 21.05 ? 67 A 5 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.823 16.356 -12.542 1.0 63.24 ? 67 A 5 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.481 14.941 -11.722 1.0 63.02 ? 67 A 5 +ATOM 1019 H HE21 . GLN A1 1 67 ? -11.075 17.999 -11.997 1.0 0.12 ? 67 A 5 +ATOM 1020 H HE22 . GLN A1 1 67 ? -11.53 18.431 -10.387 1.0 72.41 ? 67 A 5 +ATOM 1021 N N . LYS A1 1 68 ? -9.112 12.971 -9.737 1.0 63.33 ? 68 A 5 +ATOM 1022 C CA . LYS A1 1 68 ? -9.975 12.039 -9.02 1.0 34.0 ? 68 A 5 +ATOM 1023 C C . LYS A1 1 68 ? -11.444 12.315 -9.323 1.0 33.21 ? 68 A 5 +ATOM 1024 O O . LYS A1 1 68 ? -12.268 11.401 -9.328 1.0 33.01 ? 68 A 5 +ATOM 1025 C CB . LYS A1 1 68 ? -9.727 12.138 -7.513 1.0 41.41 ? 68 A 5 +ATOM 1026 C CG . LYS A1 1 68 ? -10.22 10.93 -6.735 1.0 61.44 ? 68 A 5 +ATOM 1027 C CD . LYS A1 1 68 ? -9.39 9.694 -7.04 1.0 43.41 ? 68 A 5 +ATOM 1028 C CE . LYS A1 1 68 ? -8.071 9.707 -6.282 1.0 23.43 ? 68 A 5 +ATOM 1029 N NZ . LYS A1 1 68 ? -8.279 9.76 -4.808 1.0 52.05 ? 68 A 5 +ATOM 1030 H H . LYS A1 1 68 ? -8.577 13.615 -9.227 1.0 75.53 ? 68 A 5 +ATOM 1031 H HA . LYS A1 1 68 ? -9.733 11.04 -9.352 1.0 31.4 ? 68 A 5 +ATOM 1032 H HB2 . LYS A1 1 68 ? -8.666 12.242 -7.341 1.0 51.5 ? 68 A 5 +ATOM 1033 H HB3 . LYS A1 1 68 ? -10.232 13.014 -7.134 1.0 62.4 ? 68 A 5 +ATOM 1034 H HG2 . LYS A1 1 68 ? -10.155 11.142 -5.678 1.0 22.33 ? 68 A 5 +ATOM 1035 H HG3 . LYS A1 1 68 ? -11.249 10.736 -7.003 1.0 45.02 ? 68 A 5 +ATOM 1036 H HD2 . LYS A1 1 68 ? -9.948 8.816 -6.752 1.0 14.2 ? 68 A 5 +ATOM 1037 H HD3 . LYS A1 1 68 ? -9.185 9.661 -8.101 1.0 13.53 ? 68 A 5 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.521 8.812 -6.527 1.0 43.13 ? 68 A 5 +ATOM 1039 H HE3 . LYS A1 1 68 ? -7.504 10.574 -6.588 1.0 63.42 ? 68 A 5 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.662 9.07 -4.335 1.0 1.54 ? 68 A 5 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -9.269 9.538 -4.579 1.0 73.32 ? 68 A 5 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.057 10.71 -4.45 1.0 23.44 ? 68 A 5 +ATOM 1043 N N . GLU A1 1 69 ? -11.764 13.58 -9.577 1.0 51.1 ? 69 A 5 +ATOM 1044 C CA . GLU A1 1 69 ? -13.135 13.974 -9.882 1.0 15.41 ? 69 A 5 +ATOM 1045 C C . GLU A1 1 69 ? -13.159 15.175 -10.823 1.0 20.25 ? 69 A 5 +ATOM 1046 O O . GLU A1 1 69 ? -13.301 16.317 -10.386 1.0 55.15 ? 69 A 5 +ATOM 1047 C CB . GLU A1 1 69 ? -13.892 14.306 -8.594 1.0 42.14 ? 69 A 5 +ATOM 1048 C CG . GLU A1 1 69 ? -13.102 15.176 -7.631 1.0 32.44 ? 69 A 5 +ATOM 1049 C CD . GLU A1 1 69 ? -13.966 16.208 -6.933 1.0 60.3 ? 69 A 5 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.856 16.783 -7.595 1.0 52.11 ? 69 A 5 +ATOM 1051 O OE2 . GLU A1 1 69 ? -13.753 16.44 -5.725 1.0 33.22 ? 69 A 5 +ATOM 1052 H H . GLU A1 1 69 ? -11.063 14.264 -9.559 1.0 51.55 ? 69 A 5 +ATOM 1053 H HA . GLU A1 1 69 ? -13.619 13.141 -10.369 1.0 21.13 ? 69 A 5 +ATOM 1054 H HB2 . GLU A1 1 69 ? -14.804 14.825 -8.851 1.0 70.35 ? 69 A 5 +ATOM 1055 H HB3 . GLU A1 1 69 ? -14.142 13.384 -8.091 1.0 25.14 ? 69 A 5 +ATOM 1056 H HG2 . GLU A1 1 69 ? -12.649 14.543 -6.882 1.0 60.54 ? 69 A 5 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.327 15.69 -8.182 1.0 2.43 ? 69 A 5 +ATOM 1058 N N . SER A1 1 70 ? -13.017 14.908 -12.117 1.0 51.41 ? 70 A 5 +ATOM 1059 C CA . SER A1 1 70 ? -13.018 15.967 -13.121 1.0 50.24 ? 70 A 5 +ATOM 1060 C C . SER A1 1 70 ? -14.389 16.09 -13.779 1.0 72.1 ? 70 A 5 +ATOM 1061 O O . SER A1 1 70 ? -14.974 15.098 -14.215 1.0 13.02 ? 70 A 5 +ATOM 1062 C CB . SER A1 1 70 ? -11.952 15.691 -14.184 1.0 75.43 ? 70 A 5 +ATOM 1063 O OG . SER A1 1 70 ? -12.479 15.857 -15.489 1.0 45.33 ? 70 A 5 +ATOM 1064 H H . SER A1 1 70 ? -12.907 13.977 -12.404 1.0 42.55 ? 70 A 5 +ATOM 1065 H HA . SER A1 1 70 ? -12.785 16.896 -12.623 1.0 61.25 ? 70 A 5 +ATOM 1066 H HB2 . SER A1 1 70 ? -11.13 16.377 -14.051 1.0 1.23 ? 70 A 5 +ATOM 1067 H HB3 . SER A1 1 70 ? -11.596 14.677 -14.078 1.0 50.33 ? 70 A 5 +ATOM 1068 H HG . SER A1 1 70 ? -11.919 16.455 -15.987 1.0 14.24 ? 70 A 5 +ATOM 1069 N N . THR A1 1 71 ? -14.897 17.317 -13.847 1.0 52.55 ? 71 A 5 +ATOM 1070 C CA . THR A1 1 71 ? -16.199 17.572 -14.449 1.0 43.33 ? 71 A 5 +ATOM 1071 C C . THR A1 1 71 ? -16.059 17.958 -15.917 1.0 63.44 ? 71 A 5 +ATOM 1072 O O . THR A1 1 71 ? -15.494 19.003 -16.244 1.0 13.52 ? 71 A 5 +ATOM 1073 C CB . THR A1 1 71 ? -16.953 18.691 -13.706 1.0 4.41 ? 71 A 5 +ATOM 1074 O OG1 . THR A1 1 71 ? -16.033 19.704 -13.282 1.0 4.41 ? 71 A 5 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.694 18.135 -12.499 1.0 4.35 ? 71 A 5 +ATOM 1076 H H . THR A1 1 71 ? -14.383 18.067 -13.481 1.0 14.04 ? 71 A 5 +ATOM 1077 H HA . THR A1 1 71 ? -16.783 16.666 -14.379 1.0 24.13 ? 71 A 5 +ATOM 1078 H HB . THR A1 1 71 ? -17.673 19.13 -14.381 1.0 70.41 ? 71 A 5 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.384 20.569 -13.506 1.0 53.11 ? 71 A 5 +ATOM 1080 H HG21 . THR A1 1 71 ? -17.775 18.901 -11.743 1.0 12.42 ? 71 A 5 +ATOM 1081 H HG22 . THR A1 1 71 ? -17.15 17.292 -12.1 1.0 75.2 ? 71 A 5 +ATOM 1082 H HG23 . THR A1 1 71 ? -18.682 17.818 -12.798 1.0 31.12 ? 71 A 5 +ATOM 1083 N N . LEU A1 1 72 ? -16.578 17.111 -16.799 1.0 74.32 ? 72 A 5 +ATOM 1084 C CA . LEU A1 1 72 ? -16.511 17.364 -18.234 1.0 62.12 ? 72 A 5 +ATOM 1085 C C . LEU A1 1 72 ? -17.903 17.328 -18.859 1.0 14.1 ? 72 A 5 +ATOM 1086 O O . LEU A1 1 72 ? -18.802 16.651 -18.358 1.0 22.33 ? 72 A 5 +ATOM 1087 C CB . LEU A1 1 72 ? -15.609 16.332 -18.913 1.0 54.24 ? 72 A 5 +ATOM 1088 C CG . LEU A1 1 72 ? -16.316 15.127 -19.533 1.0 12.34 ? 72 A 5 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.606 15.377 -21.005 1.0 71.53 ? 72 A 5 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.477 13.869 -19.36 1.0 45.31 ? 72 A 5 +ATOM 1091 H H . LEU A1 1 72 ? -17.016 16.295 -16.479 1.0 40.44 ? 72 A 5 +ATOM 1092 H HA . LEU A1 1 72 ? -16.091 18.348 -18.378 1.0 22.23 ? 72 A 5 +ATOM 1093 H HB2 . LEU A1 1 72 ? -15.063 16.835 -19.696 1.0 24.33 ? 72 A 5 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.913 15.964 -18.172 1.0 64.44 ? 72 A 5 +ATOM 1095 H HG . LEU A1 1 72 ? -17.26 14.972 -19.029 1.0 60.22 ? 72 A 5 +ATOM 1096 H HD11 . LEU A1 1 72 ? -16.193 14.573 -21.595 1.0 22.12 ? 72 A 5 +ATOM 1097 H HD12 . LEU A1 1 72 ? -16.156 16.312 -21.306 1.0 11.12 ? 72 A 5 +ATOM 1098 H HD13 . LEU A1 1 72 ? -17.674 15.426 -21.158 1.0 74.11 ? 72 A 5 +ATOM 1099 H HD21 . LEU A1 1 72 ? -14.429 14.124 -19.417 1.0 45.11 ? 72 A 5 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.719 13.164 -20.142 1.0 64.51 ? 72 A 5 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.689 13.425 -18.398 1.0 15.53 ? 72 A 5 +ATOM 1102 N N . HIS A1 1 73 ? -18.072 18.059 -19.956 1.0 22.1 ? 73 A 5 +ATOM 1103 C CA . HIS A1 1 73 ? -19.354 18.109 -20.65 1.0 43.22 ? 73 A 5 +ATOM 1104 C C . HIS A1 1 73 ? -19.371 17.14 -21.829 1.0 1.12 ? 73 A 5 +ATOM 1105 O O . HIS A1 1 73 ? -18.554 17.246 -22.745 1.0 41.41 ? 73 A 5 +ATOM 1106 C CB . HIS A1 1 73 ? -19.638 19.529 -21.139 1.0 34.11 ? 73 A 5 +ATOM 1107 C CG . HIS A1 1 73 ? -21.061 19.747 -21.552 1.0 25.31 ? 73 A 5 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.778 20.876 -21.217 1.0 22.31 ? 73 A 5 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.901 18.972 -22.279 1.0 30.12 ? 73 A 5 +ATOM 1110 C CE1 . HIS A1 1 73 ? -22.997 20.786 -21.719 1.0 74.03 ? 73 A 5 +ATOM 1111 N NE2 . HIS A1 1 73 ? -23.097 19.64 -22.368 1.0 22.32 ? 73 A 5 +ATOM 1112 H H . HIS A1 1 73 ? -17.318 18.577 -20.306 1.0 41.1 ? 73 A 5 +ATOM 1113 H HA . HIS A1 1 73 ? -20.122 17.817 -19.95 1.0 23.25 ? 73 A 5 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.414 20.227 -20.346 1.0 51.13 ? 73 A 5 +ATOM 1115 H HB3 . HIS A1 1 73 ? -19.008 19.744 -21.99 1.0 64.13 ? 73 A 5 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.444 21.63 -20.689 1.0 63.31 ? 73 A 5 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.672 18.007 -22.709 1.0 71.43 ? 73 A 5 +ATOM 1118 H HE1 . HIS A1 1 73 ? -23.779 21.523 -21.616 1.0 3.34 ? 73 A 5 +ATOM 1119 N N . LEU A1 1 74 ? -20.305 16.196 -21.799 1.0 31.4 ? 74 A 5 +ATOM 1120 C CA . LEU A1 1 74 ? -20.427 15.207 -22.865 1.0 41.22 ? 74 A 5 +ATOM 1121 C C . LEU A1 1 74 ? -21.727 15.4 -23.639 1.0 21.0 ? 74 A 5 +ATOM 1122 O O . LEU A1 1 74 ? -22.818 15.251 -23.089 1.0 70.53 ? 74 A 5 +ATOM 1123 C CB . LEU A1 1 74 ? -20.371 13.793 -22.284 1.0 42.32 ? 74 A 5 +ATOM 1124 C CG . LEU A1 1 74 ? -20.856 12.671 -23.203 1.0 13.02 ? 74 A 5 +ATOM 1125 C CD1 . LEU A1 1 74 ? -19.964 12.563 -24.43 1.0 50.12 ? 74 A 5 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.896 11.347 -22.452 1.0 22.4 ? 74 A 5 +ATOM 1127 H H . LEU A1 1 74 ? -20.927 16.162 -21.043 1.0 53.04 ? 74 A 5 +ATOM 1128 H HA . LEU A1 1 74 ? -19.596 15.343 -23.54 1.0 65.43 ? 74 A 5 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.346 13.584 -22.02 1.0 22.02 ? 74 A 5 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.981 13.778 -21.392 1.0 20.31 ? 74 A 5 +ATOM 1131 H HG . LEU A1 1 74 ? -21.859 12.896 -23.539 1.0 34.12 ? 74 A 5 +ATOM 1132 H HD11 . LEU A1 1 74 ? -19.044 13.1 -24.254 1.0 33.01 ? 74 A 5 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.472 12.988 -25.283 1.0 1.34 ? 74 A 5 +ATOM 1134 H HD13 . LEU A1 1 74 ? -19.743 11.523 -24.624 1.0 63.14 ? 74 A 5 +ATOM 1135 H HD21 . LEU A1 1 74 ? -21.407 10.609 -23.052 1.0 12.32 ? 74 A 5 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.422 11.48 -21.518 1.0 54.43 ? 74 A 5 +ATOM 1137 H HD23 . LEU A1 1 74 ? -19.887 11.015 -22.254 1.0 14.02 ? 74 A 5 +ATOM 1138 N N . VAL A1 1 75 ? -21.603 15.73 -24.921 1.0 43.5 ? 75 A 5 +ATOM 1139 C CA . VAL A1 1 75 ? -22.768 15.939 -25.773 1.0 52.32 ? 75 A 5 +ATOM 1140 C C . VAL A1 1 75 ? -22.875 14.851 -26.835 1.0 61.15 ? 75 A 5 +ATOM 1141 O O . VAL A1 1 75 ? -21.869 14.414 -27.396 1.0 54.31 ? 75 A 5 +ATOM 1142 C CB . VAL A1 1 75 ? -22.717 17.314 -26.465 1.0 24.5 ? 75 A 5 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.954 17.527 -27.323 1.0 55.3 ? 75 A 5 +ATOM 1144 C CG2 . VAL A1 1 75 ? -22.576 18.424 -25.434 1.0 64.14 ? 75 A 5 +ATOM 1145 H H . VAL A1 1 75 ? -20.707 15.834 -25.303 1.0 70.11 ? 75 A 5 +ATOM 1146 H HA . VAL A1 1 75 ? -23.649 15.907 -25.148 1.0 60.52 ? 75 A 5 +ATOM 1147 H HB . VAL A1 1 75 ? -21.85 17.338 -27.109 1.0 44.41 ? 75 A 5 +ATOM 1148 H HG11 . VAL A1 1 75 ? -24.205 18.577 -27.339 1.0 31.54 ? 75 A 5 +ATOM 1149 H HG12 . VAL A1 1 75 ? -23.757 17.187 -28.33 1.0 61.34 ? 75 A 5 +ATOM 1150 H HG13 . VAL A1 1 75 ? -24.78 16.967 -26.909 1.0 54.52 ? 75 A 5 +ATOM 1151 H HG21 . VAL A1 1 75 ? -23.128 18.162 -24.544 1.0 5.24 ? 75 A 5 +ATOM 1152 H HG22 . VAL A1 1 75 ? -21.533 18.554 -25.186 1.0 61.35 ? 75 A 5 +ATOM 1153 H HG23 . VAL A1 1 75 ? -22.966 19.346 -25.841 1.0 24.43 ? 75 A 5 +ATOM 1154 N N . LEU A1 1 76 ? -24.1 14.418 -27.109 1.0 35.1 ? 76 A 5 +ATOM 1155 C CA . LEU A1 1 76 ? -24.34 13.38 -28.105 1.0 22.53 ? 76 A 5 +ATOM 1156 C C . LEU A1 1 76 ? -25.324 13.861 -29.167 1.0 2.14 ? 76 A 5 +ATOM 1157 O O . LEU A1 1 76 ? -26.317 14.518 -28.854 1.0 21.5 ? 76 A 5 +ATOM 1158 C CB . LEU A1 1 76 ? -24.875 12.114 -27.434 1.0 73.12 ? 76 A 5 +ATOM 1159 C CG . LEU A1 1 76 ? -24.98 12.156 -25.909 1.0 64.45 ? 76 A 5 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.829 11.002 -25.4 1.0 24.13 ? 76 A 5 +ATOM 1161 C CD2 . LEU A1 1 76 ? -23.595 12.121 -25.278 1.0 22.03 ? 76 A 5 +ATOM 1162 H H . LEU A1 1 76 ? -24.863 14.804 -26.63 1.0 44.32 ? 76 A 5 +ATOM 1163 H HA . LEU A1 1 76 ? -23.398 13.154 -28.582 1.0 53.04 ? 76 A 5 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.862 11.923 -27.828 1.0 71.31 ? 76 A 5 +ATOM 1165 H HB3 . LEU A1 1 76 ? -24.219 11.297 -27.699 1.0 62.14 ? 76 A 5 +ATOM 1166 H HG . LEU A1 1 76 ? -25.46 13.079 -25.613 1.0 42.11 ? 76 A 5 +ATOM 1167 H HD11 . LEU A1 1 76 ? -26.674 10.86 -26.056 1.0 12.14 ? 76 A 5 +ATOM 1168 H HD12 . LEU A1 1 76 ? -26.18 11.225 -24.404 1.0 23.21 ? 76 A 5 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.234 10.1 -25.378 1.0 40.2 ? 76 A 5 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.335 11.101 -25.039 1.0 53.24 ? 76 A 5 +ATOM 1171 H HD22 . LEU A1 1 76 ? -23.596 12.715 -24.376 1.0 72.02 ? 76 A 5 +ATOM 1172 H HD23 . LEU A1 1 76 ? -22.873 12.525 -25.973 1.0 63.4 ? 76 A 5 +ATOM 1173 N N . ARG A1 1 77 ? -25.043 13.528 -30.422 1.0 50.44 ? 77 A 5 +ATOM 1174 C CA . ARG A1 1 77 ? -25.904 13.926 -31.529 1.0 12.4 ? 77 A 5 +ATOM 1175 C C . ARG A1 1 77 ? -26.73 12.743 -32.027 1.0 10.32 ? 77 A 5 +ATOM 1176 O O . ARG A1 1 77 ? -26.808 12.489 -33.23 1.0 12.43 ? 77 A 5 +ATOM 1177 C CB . ARG A1 1 77 ? -25.066 14.495 -32.676 1.0 55.35 ? 77 A 5 +ATOM 1178 C CG . ARG A1 1 77 ? -24.128 15.612 -32.249 1.0 12.22 ? 77 A 5 +ATOM 1179 C CD . ARG A1 1 77 ? -22.671 15.196 -32.376 1.0 60.22 ? 77 A 5 +ATOM 1180 N NE . ARG A1 1 77 ? -21.817 16.311 -32.776 1.0 64.33 ? 77 A 5 +ATOM 1181 C CZ . ARG A1 1 77 ? -20.522 16.184 -33.048 1.0 13.31 ? 77 A 5 +ATOM 1182 N NH1 . ARG A1 1 77 ? -19.937 14.997 -32.963 1.0 63.3 ? 77 A 5 +ATOM 1183 N NH2 . ARG A1 1 77 ? -19.811 17.245 -33.406 1.0 70.54 ? 77 A 5 +ATOM 1184 H H . ARG A1 1 77 ? -24.236 13.003 -30.608 1.0 2.41 ? 77 A 5 +ATOM 1185 H HA . ARG A1 1 77 ? -26.574 14.692 -31.17 1.0 53.23 ? 77 A 5 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.472 13.7 -33.102 1.0 41.04 ? 77 A 5 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.73 14.882 -33.433 1.0 23.23 ? 77 A 5 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.301 16.474 -32.876 1.0 3.21 ? 77 A 5 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.333 15.867 -31.219 1.0 45.32 ? 77 A 5 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.333 14.821 -31.421 1.0 24.22 ? 77 A 5 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.598 14.414 -33.116 1.0 55.12 ? 77 A 5 +ATOM 1192 H HE . ARG A1 1 77 ? -22.229 17.197 -32.845 1.0 41.44 ? 77 A 5 +ATOM 1193 H HH11 . ARG A1 1 77 ? -20.471 14.196 -32.694 1.0 31.24 ? 77 A 5 +ATOM 1194 H HH12 . ARG A1 1 77 ? -18.963 14.904 -33.169 1.0 72.5 ? 77 A 5 +ATOM 1195 H HH21 . ARG A1 1 77 ? -20.249 18.141 -33.471 1.0 71.34 ? 77 A 5 +ATOM 1196 H HH22 . ARG A1 1 77 ? -18.838 17.149 -33.61 1.0 1.44 ? 77 A 5 +ATOM 1197 N N . LEU A1 1 78 ? -27.344 12.024 -31.095 1.0 31.03 ? 78 A 5 +ATOM 1198 C CA . LEU A1 1 78 ? -28.164 10.867 -31.438 1.0 51.32 ? 78 A 5 +ATOM 1199 C C . LEU A1 1 78 ? -29.309 11.267 -32.365 1.0 14.11 ? 78 A 5 +ATOM 1200 O O . LEU A1 1 78 ? -29.574 10.599 -33.364 1.0 12.31 ? 78 A 5 +ATOM 1201 C CB . LEU A1 1 78 ? -28.722 10.218 -30.171 1.0 42.51 ? 78 A 5 +ATOM 1202 C CG . LEU A1 1 78 ? -28.046 8.92 -29.728 1.0 51.45 ? 78 A 5 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.909 9.214 -28.761 1.0 14.44 ? 78 A 5 +ATOM 1204 C CD2 . LEU A1 1 78 ? -29.06 7.981 -29.091 1.0 25.32 ? 78 A 5 +ATOM 1205 H H . LEU A1 1 78 ? -27.245 12.275 -30.154 1.0 75.31 ? 78 A 5 +ATOM 1206 H HA . LEU A1 1 78 ? -27.535 10.155 -31.951 1.0 64.2 ? 78 A 5 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.629 10.931 -29.366 1.0 61.14 ? 78 A 5 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.768 10.006 -30.341 1.0 62.32 ? 78 A 5 +ATOM 1209 H HG . LEU A1 1 78 ? -27.628 8.426 -30.594 1.0 53.42 ? 78 A 5 +ATOM 1210 H HD11 . LEU A1 1 78 ? -27.008 10.22 -28.384 1.0 3.24 ? 78 A 5 +ATOM 1211 H HD12 . LEU A1 1 78 ? -25.965 9.114 -29.276 1.0 74.14 ? 78 A 5 +ATOM 1212 H HD13 . LEU A1 1 78 ? -26.946 8.514 -27.939 1.0 11.41 ? 78 A 5 +ATOM 1213 H HD21 . LEU A1 1 78 ? -29.891 7.837 -29.766 1.0 65.32 ? 78 A 5 +ATOM 1214 H HD22 . LEU A1 1 78 ? -29.417 8.41 -28.166 1.0 65.43 ? 78 A 5 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.591 7.029 -28.888 1.0 34.04 ? 78 A 5 +ATOM 1216 N N . ARG A1 1 79 ? -29.982 12.362 -32.026 1.0 44.5 ? 79 A 5 +ATOM 1217 C CA . ARG A1 1 79 ? -31.097 12.851 -32.828 1.0 54.44 ? 79 A 5 +ATOM 1218 C C . ARG A1 1 79 ? -32.178 11.783 -32.965 1.0 43.43 ? 79 A 5 +ATOM 1219 O O . ARG A1 1 79 ? -32.755 11.604 -34.037 1.0 24.23 ? 79 A 5 +ATOM 1220 C CB . ARG A1 1 79 ? -30.608 13.278 -34.213 1.0 53.1 ? 79 A 5 +ATOM 1221 C CG . ARG A1 1 79 ? -31.356 14.473 -34.781 1.0 62.42 ? 79 A 5 +ATOM 1222 C CD . ARG A1 1 79 ? -30.408 15.611 -35.128 1.0 15.2 ? 79 A 5 +ATOM 1223 N NE . ARG A1 1 79 ? -29.783 15.423 -36.435 1.0 22.21 ? 79 A 5 +ATOM 1224 C CZ . ARG A1 1 79 ? -30.423 15.594 -37.586 1.0 43.33 ? 79 A 5 +ATOM 1225 N NH1 . ARG A1 1 79 ? -31.698 15.955 -37.593 1.0 51.34 ? 79 A 5 +ATOM 1226 N NH2 . ARG A1 1 79 ? -29.785 15.405 -38.735 1.0 24.34 ? 79 A 5 +ATOM 1227 H H . ARG A1 1 79 ? -29.723 12.852 -31.218 1.0 30.43 ? 79 A 5 +ATOM 1228 H HA . ARG A1 1 79 ? -31.517 13.709 -32.324 1.0 75.12 ? 79 A 5 +ATOM 1229 H HB2 . ARG A1 1 79 ? -29.561 13.535 -34.15 1.0 72.51 ? 79 A 5 +ATOM 1230 H HB3 . ARG A1 1 79 ? -30.727 12.45 -34.895 1.0 62.3 ? 79 A 5 +ATOM 1231 H HG2 . ARG A1 1 79 ? -31.876 14.168 -35.677 1.0 34.21 ? 79 A 5 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.069 14.821 -34.049 1.0 51.44 ? 79 A 5 +ATOM 1233 H HD2 . ARG A1 1 79 ? -30.965 16.536 -35.135 1.0 21.42 ? 79 A 5 +ATOM 1234 H HD3 . ARG A1 1 79 ? -29.637 15.661 -34.374 1.0 24.22 ? 79 A 5 +ATOM 1235 H HE . ARG A1 1 79 ? -28.841 15.157 -36.453 1.0 63.2 ? 79 A 5 +ATOM 1236 H HH11 . ARG A1 1 79 ? -32.181 16.1 -36.729 1.0 0.03 ? 79 A 5 +ATOM 1237 H HH12 . ARG A1 1 79 ? -32.177 16.085 -38.462 1.0 54.33 ? 79 A 5 +ATOM 1238 H HH21 . ARG A1 1 79 ? -28.824 15.133 -38.734 1.0 72.3 ? 79 A 5 +ATOM 1239 H HH22 . ARG A1 1 79 ? -30.267 15.534 -39.601 1.0 2.44 ? 79 A 5 +ATOM 1240 N N . GLY A1 1 80 ? -32.446 11.075 -31.872 1.0 11.03 ? 80 A 5 +ATOM 1241 C CA . GLY A1 1 80 ? -33.456 10.033 -31.892 1.0 3.12 ? 80 A 5 +ATOM 1242 C C . GLY A1 1 80 ? -32.976 8.774 -32.586 1.0 52.34 ? 80 A 5 +ATOM 1243 O O . GLY A1 1 80 ? -33.115 8.636 -33.801 1.0 43.44 ? 80 A 5 +ATOM 1244 H H . GLY A1 1 80 ? -31.954 11.262 -31.045 1.0 0.24 ? 80 A 5 +ATOM 1245 H HA2 . GLY A1 1 80 ? -33.727 9.791 -30.875 1.0 71.24 ? 80 A 5 +ATOM 1246 H HA3 . GLY A1 1 80 ? -34.329 10.405 -32.408 1.0 43.14 ? 80 A 5 +ATOM 1247 N N . GLY A1 1 81 ? -32.409 7.853 -31.813 1.0 43.34 ? 81 A 5 +ATOM 1248 C CA . GLY A1 1 81 ? -31.914 6.612 -32.38 1.0 20.2 ? 81 A 5 +ATOM 1249 C C . GLY A1 1 81 ? -32.036 5.447 -31.418 1.0 63.23 ? 81 A 5 +ATOM 1250 O O . GLY A1 1 81 ? -33.104 5.204 -30.856 1.0 30.24 ? 81 A 5 +ATOM 1251 H H . GLY A1 1 81 ? -32.325 8.018 -30.851 1.0 11.33 ? 81 A 5 +ATOM 1252 H HA2 . GLY A1 1 81 ? -32.476 6.387 -33.274 1.0 30.51 ? 81 A 5 +ATOM 1253 H HA3 . GLY A1 1 81 ? -30.874 6.739 -32.643 1.0 55.14 ? 81 A 5 +ATOM 1254 N N . VAL A1 1 82 ? -30.938 4.722 -31.227 1.0 30.52 ? 82 A 5 +ATOM 1255 C CA . VAL A1 1 82 ? -30.926 3.575 -30.327 1.0 4.45 ? 82 A 5 +ATOM 1256 C C . VAL A1 1 82 ? -31.164 4.006 -28.884 1.0 63.52 ? 82 A 5 +ATOM 1257 O O . VAL A1 1 82 ? -31.004 5.177 -28.541 1.0 12.52 ? 82 A 5 +ATOM 1258 C CB . VAL A1 1 82 ? -29.592 2.81 -30.409 1.0 53.54 ? 82 A 5 +ATOM 1259 C CG1 . VAL A1 1 82 ? -29.59 1.633 -29.447 1.0 33.31 ? 82 A 5 +ATOM 1260 C CG2 . VAL A1 1 82 ? -29.331 2.345 -31.834 1.0 1.13 ? 82 A 5 +ATOM 1261 H H . VAL A1 1 82 ? -30.116 4.964 -31.703 1.0 42.11 ? 82 A 5 +ATOM 1262 H HA . VAL A1 1 82 ? -31.719 2.906 -30.628 1.0 65.12 ? 82 A 5 +ATOM 1263 H HB . VAL A1 1 82 ? -28.797 3.483 -30.122 1.0 3.02 ? 82 A 5 +ATOM 1264 H HG11 . VAL A1 1 82 ? -29.738 1.992 -28.439 1.0 71.54 ? 82 A 5 +ATOM 1265 H HG12 . VAL A1 1 82 ? -30.387 0.952 -29.708 1.0 43.52 ? 82 A 5 +ATOM 1266 H HG13 . VAL A1 1 82 ? -28.642 1.118 -29.509 1.0 60.31 ? 82 A 5 +ATOM 1267 H HG21 . VAL A1 1 82 ? -28.881 3.148 -32.399 1.0 51.1 ? 82 A 5 +ATOM 1268 H HG22 . VAL A1 1 82 ? -28.664 1.496 -31.819 1.0 43.42 ? 82 A 5 +ATOM 1269 H HG23 . VAL A1 1 82 ? -30.266 2.06 -32.296 1.0 61.21 ? 82 A 5 +ATOM 1 N N . GLY A1 1 1 ? -15.425 -4.098 -5.149 1.0 13.0 ? 1 A 6 +ATOM 2 C CA . GLY A1 1 1 ? -14.182 -3.541 -4.647 1.0 45.03 ? 1 A 6 +ATOM 3 C C . GLY A1 1 1 ? -13.391 -2.824 -5.723 1.0 65.21 ? 1 A 6 +ATOM 4 O O . GLY A1 1 1 ? -12.316 -3.264 -6.131 1.0 33.34 ? 1 A 6 +ATOM 5 H H1 . GLY A1 1 1 ? -15.746 -3.849 -6.041 1.0 52.4 ? 1 A 6 +ATOM 6 H HA2 . GLY A1 1 1 ? -14.407 -2.843 -3.855 1.0 14.15 ? 1 A 6 +ATOM 7 H HA3 . GLY A1 1 1 ? -13.578 -4.342 -4.247 1.0 34.23 ? 1 A 6 +ATOM 8 N N . PRO A1 1 2 ? -13.928 -1.692 -6.202 1.0 55.32 ? 2 A 6 +ATOM 9 C CA . PRO A1 1 2 ? -13.283 -0.889 -7.245 1.0 21.43 ? 2 A 6 +ATOM 10 C C . PRO A1 1 2 ? -12.022 -0.194 -6.744 1.0 41.45 ? 2 A 6 +ATOM 11 O O . PRO A1 1 2 ? -11.953 0.236 -5.591 1.0 62.42 ? 2 A 6 +ATOM 12 C CB . PRO A1 1 2 ? -14.353 0.143 -7.611 1.0 51.45 ? 2 A 6 +ATOM 13 C CG . PRO A1 1 2 ? -15.202 0.257 -6.392 1.0 43.11 ? 2 A 6 +ATOM 14 C CD . PRO A1 1 2 ? -15.207 -1.109 -5.762 1.0 64.14 ? 2 A 6 +ATOM 15 H HA . PRO A1 1 2 ? -13.043 -1.485 -8.113 1.0 31.54 ? 2 A 6 +ATOM 16 H HB2 . PRO A1 1 2 ? -13.88 1.085 -7.853 1.0 42.4 ? 2 A 6 +ATOM 17 H HB3 . PRO A1 1 2 ? -14.923 -0.208 -8.457 1.0 62.54 ? 2 A 6 +ATOM 18 H HG2 . PRO A1 1 2 ? -14.777 0.981 -5.714 1.0 3.22 ? 2 A 6 +ATOM 19 H HG3 . PRO A1 1 2 ? -16.205 0.545 -6.67 1.0 51.14 ? 2 A 6 +ATOM 20 H HD2 . PRO A1 1 2 ? -15.244 -1.028 -4.686 1.0 11.0 ? 2 A 6 +ATOM 21 H HD3 . PRO A1 1 2 ? -16.041 -1.69 -6.127 1.0 24.12 ? 2 A 6 +ATOM 22 N N . LEU A1 1 3 ? -11.025 -0.086 -7.616 1.0 34.12 ? 3 A 6 +ATOM 23 C CA . LEU A1 1 3 ? -9.765 0.558 -7.262 1.0 54.03 ? 3 A 6 +ATOM 24 C C . LEU A1 1 3 ? -8.955 0.892 -8.51 1.0 63.21 ? 3 A 6 +ATOM 25 O O . LEU A1 1 3 ? -9.145 0.29 -9.565 1.0 11.24 ? 3 A 6 +ATOM 26 C CB . LEU A1 1 3 ? -8.949 -0.347 -6.337 1.0 60.12 ? 3 A 6 +ATOM 27 C CG . LEU A1 1 3 ? -8.726 0.171 -4.916 1.0 64.13 ? 3 A 6 +ATOM 28 C CD1 . LEU A1 1 3 ? -8.564 -0.988 -3.945 1.0 62.25 ? 3 A 6 +ATOM 29 C CD2 . LEU A1 1 3 ? -7.51 1.085 -4.866 1.0 0.12 ? 3 A 6 +ATOM 30 H H . LEU A1 1 3 ? -11.139 -0.447 -8.519 1.0 52.35 ? 3 A 6 +ATOM 31 H HA . LEU A1 1 3 ? -9.997 1.475 -6.741 1.0 43.13 ? 3 A 6 +ATOM 32 H HB2 . LEU A1 1 3 ? -9.46 -1.295 -6.267 1.0 74.24 ? 3 A 6 +ATOM 33 H HB3 . LEU A1 1 3 ? -7.98 -0.496 -6.793 1.0 72.41 ? 3 A 6 +ATOM 34 H HG . LEU A1 1 3 ? -9.589 0.745 -4.609 1.0 43.5 ? 3 A 6 +ATOM 35 H HD11 . LEU A1 1 3 ? -8.47 -1.911 -4.497 1.0 50.45 ? 3 A 6 +ATOM 36 H HD12 . LEU A1 1 3 ? -9.429 -1.041 -3.3 1.0 4.34 ? 3 A 6 +ATOM 37 H HD13 . LEU A1 1 3 ? -7.678 -0.835 -3.346 1.0 54.42 ? 3 A 6 +ATOM 38 H HD21 . LEU A1 1 3 ? -6.613 0.498 -5.0 1.0 23.33 ? 3 A 6 +ATOM 39 H HD22 . LEU A1 1 3 ? -7.475 1.584 -3.91 1.0 1.01 ? 3 A 6 +ATOM 40 H HD23 . LEU A1 1 3 ? -7.58 1.82 -5.654 1.0 75.24 ? 3 A 6 +ATOM 41 N N . GLY A1 1 4 ? -8.048 1.857 -8.38 1.0 4.21 ? 4 A 6 +ATOM 42 C CA . GLY A1 1 4 ? -7.221 2.253 -9.505 1.0 43.34 ? 4 A 6 +ATOM 43 C C . GLY A1 1 4 ? -6.41 3.501 -9.217 1.0 32.24 ? 4 A 6 +ATOM 44 O O . GLY A1 1 4 ? -6.069 3.776 -8.066 1.0 73.31 ? 4 A 6 +ATOM 45 H H . GLY A1 1 4 ? -7.941 2.303 -7.514 1.0 2.13 ? 4 A 6 +ATOM 46 H HA2 . GLY A1 1 4 ? -6.546 1.445 -9.744 1.0 53.5 ? 4 A 6 +ATOM 47 H HA3 . GLY A1 1 4 ? -7.858 2.441 -10.357 1.0 61.41 ? 4 A 6 +ATOM 48 N N . SER A1 1 5 ? -6.098 4.257 -10.264 1.0 14.33 ? 5 A 6 +ATOM 49 C CA . SER A1 1 5 ? -5.317 5.48 -10.119 1.0 12.42 ? 5 A 6 +ATOM 50 C C . SER A1 1 5 ? -6.214 6.656 -9.744 1.0 43.22 ? 5 A 6 +ATOM 51 O O . SER A1 1 5 ? -6.229 7.097 -8.595 1.0 33.52 ? 5 A 6 +ATOM 52 C CB . SER A1 1 5 ? -4.568 5.789 -11.417 1.0 72.02 ? 5 A 6 +ATOM 53 O OG . SER A1 1 5 ? -3.836 6.998 -11.308 1.0 21.35 ? 5 A 6 +ATOM 54 H H . SER A1 1 5 ? -6.399 3.985 -11.157 1.0 31.12 ? 5 A 6 +ATOM 55 H HA . SER A1 1 5 ? -4.6 5.323 -9.328 1.0 12.32 ? 5 A 6 +ATOM 56 H HB2 . SER A1 1 5 ? -3.881 4.985 -11.633 1.0 41.01 ? 5 A 6 +ATOM 57 H HB3 . SER A1 1 5 ? -5.278 5.883 -12.225 1.0 74.13 ? 5 A 6 +ATOM 58 H HG . SER A1 1 5 ? -2.897 6.81 -11.368 1.0 33.45 ? 5 A 6 +ATOM 59 N N . MET A1 1 6 ? -6.96 7.159 -10.722 1.0 14.01 ? 6 A 6 +ATOM 60 C CA . MET A1 1 6 ? -7.861 8.283 -10.495 1.0 54.33 ? 6 A 6 +ATOM 61 C C . MET A1 1 6 ? -9.212 8.04 -11.16 1.0 31.44 ? 6 A 6 +ATOM 62 O O . MET A1 1 6 ? -9.43 6.998 -11.778 1.0 1.11 ? 6 A 6 +ATOM 63 C CB . MET A1 1 6 ? -7.242 9.576 -11.03 1.0 70.21 ? 6 A 6 +ATOM 64 C CG . MET A1 1 6 ? -7.021 9.567 -12.534 1.0 25.05 ? 6 A 6 +ATOM 65 S SD . MET A1 1 6 ? -5.275 9.506 -12.979 1.0 3.44 ? 6 A 6 +ATOM 66 C CE . MET A1 1 6 ? -4.662 10.969 -12.148 1.0 13.21 ? 6 A 6 +ATOM 67 H H . MET A1 1 6 ? -6.905 6.764 -11.618 1.0 2.32 ? 6 A 6 +ATOM 68 H HA . MET A1 1 6 ? -8.008 8.379 -9.43 1.0 5.22 ? 6 A 6 +ATOM 69 H HB2 . MET A1 1 6 ? -7.895 10.401 -10.788 1.0 62.43 ? 6 A 6 +ATOM 70 H HB3 . MET A1 1 6 ? -6.287 9.73 -10.549 1.0 63.34 ? 6 A 6 +ATOM 71 H HG2 . MET A1 1 6 ? -7.514 8.703 -12.952 1.0 33.13 ? 6 A 6 +ATOM 72 H HG3 . MET A1 1 6 ? -7.454 10.464 -12.952 1.0 12.41 ? 6 A 6 +ATOM 73 H HE1 . MET A1 1 6 ? -5.496 11.564 -11.804 1.0 12.23 ? 6 A 6 +ATOM 74 H HE2 . MET A1 1 6 ? -4.056 10.677 -11.303 1.0 52.54 ? 6 A 6 +ATOM 75 H HE3 . MET A1 1 6 ? -4.065 11.55 -12.836 1.0 2.41 ? 6 A 6 +ATOM 76 N N . GLN A1 1 7 ? -10.114 9.006 -11.027 1.0 13.12 ? 7 A 6 +ATOM 77 C CA . GLN A1 1 7 ? -11.444 8.895 -11.614 1.0 13.2 ? 7 A 6 +ATOM 78 C C . GLN A1 1 7 ? -11.877 10.219 -12.236 1.0 42.42 ? 7 A 6 +ATOM 79 O O . GLN A1 1 7 ? -11.384 11.283 -11.86 1.0 71.33 ? 7 A 6 +ATOM 80 C CB . GLN A1 1 7 ? -12.458 8.46 -10.555 1.0 42.01 ? 7 A 6 +ATOM 81 C CG . GLN A1 1 7 ? -11.949 7.355 -9.644 1.0 12.34 ? 7 A 6 +ATOM 82 C CD . GLN A1 1 7 ? -11.424 7.882 -8.323 1.0 44.31 ? 7 A 6 +ATOM 83 O OE1 . GLN A1 1 7 ? -11.306 9.092 -8.128 1.0 33.44 ? 7 A 6 +ATOM 84 N NE2 . GLN A1 1 7 ? -11.106 6.975 -7.407 1.0 73.32 ? 7 A 6 +ATOM 85 H H . GLN A1 1 7 ? -9.88 9.812 -10.522 1.0 71.21 ? 7 A 6 +ATOM 86 H HA . GLN A1 1 7 ? -11.403 8.145 -12.389 1.0 62.03 ? 7 A 6 +ATOM 87 H HB2 . GLN A1 1 7 ? -12.711 9.314 -9.943 1.0 13.25 ? 7 A 6 +ATOM 88 H HB3 . GLN A1 1 7 ? -13.35 8.106 -11.051 1.0 41.42 ? 7 A 6 +ATOM 89 H HG2 . GLN A1 1 7 ? -12.76 6.67 -9.443 1.0 43.33 ? 7 A 6 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.152 6.829 -10.148 1.0 33.21 ? 7 A 6 +ATOM 91 H HE21 . GLN A1 1 7 ? -11.225 6.028 -7.633 1.0 52.01 ? 7 A 6 +ATOM 92 H HE22 . GLN A1 1 7 ? -10.763 7.288 -6.545 1.0 55.43 ? 7 A 6 +ATOM 93 N N . ILE A1 1 8 ? -12.8 10.146 -13.189 1.0 12.12 ? 8 A 6 +ATOM 94 C CA . ILE A1 1 8 ? -13.299 11.338 -13.862 1.0 64.2 ? 8 A 6 +ATOM 95 C C . ILE A1 1 8 ? -14.823 11.38 -13.848 1.0 0.33 ? 8 A 6 +ATOM 96 O O . ILE A1 1 8 ? -15.481 10.36 -13.644 1.0 11.35 ? 8 A 6 +ATOM 97 C CB . ILE A1 1 8 ? -12.809 11.409 -15.32 1.0 65.34 ? 8 A 6 +ATOM 98 C CG1 . ILE A1 1 8 ? -11.931 10.198 -15.645 1.0 72.33 ? 8 A 6 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.045 12.703 -15.56 1.0 55.24 ? 8 A 6 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.571 10.089 -17.11 1.0 11.02 ? 8 A 6 +ATOM 101 H H . ILE A1 1 8 ? -13.154 9.269 -13.445 1.0 43.45 ? 8 A 6 +ATOM 102 H HA . ILE A1 1 8 ? -12.921 12.202 -13.334 1.0 41.41 ? 8 A 6 +ATOM 103 H HB . ILE A1 1 8 ? -13.672 11.403 -15.968 1.0 13.24 ? 8 A 6 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.013 10.266 -15.083 1.0 4.11 ? 8 A 6 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.456 9.297 -15.363 1.0 33.41 ? 8 A 6 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.36 12.569 -16.384 1.0 12.11 ? 8 A 6 +ATOM 107 H HG22 . ILE A1 1 8 ? -12.742 13.492 -15.798 1.0 14.43 ? 8 A 6 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.493 12.966 -14.671 1.0 53.13 ? 8 A 6 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.167 9.313 -17.57 1.0 4.51 ? 8 A 6 +ATOM 110 H HD12 . ILE A1 1 8 ? -11.767 11.031 -17.601 1.0 22.53 ? 8 A 6 +ATOM 111 H HD13 . ILE A1 1 8 ? -10.524 9.843 -17.207 1.0 32.23 ? 8 A 6 +ATOM 112 N N . PHE A1 1 9 ? -15.379 12.568 -14.067 1.0 44.42 ? 9 A 6 +ATOM 113 C CA . PHE A1 1 9 ? -16.827 12.743 -14.08 1.0 45.42 ? 9 A 6 +ATOM 114 C C . PHE A1 1 9 ? -17.308 13.191 -15.457 1.0 62.05 ? 9 A 6 +ATOM 115 O O . PHE A1 1 9 ? -16.828 14.185 -16.002 1.0 33.13 ? 9 A 6 +ATOM 116 C CB . PHE A1 1 9 ? -17.247 13.767 -13.023 1.0 42.3 ? 9 A 6 +ATOM 117 C CG . PHE A1 1 9 ? -18.03 13.17 -11.889 1.0 44.44 ? 9 A 6 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.284 12.622 -12.108 1.0 24.21 ? 9 A 6 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.513 13.158 -10.604 1.0 24.11 ? 9 A 6 +ATOM 120 C CE1 . PHE A1 1 9 ? -20.007 12.072 -11.066 1.0 54.33 ? 9 A 6 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.231 12.609 -9.558 1.0 62.43 ? 9 A 6 +ATOM 122 C CZ . PHE A1 1 9 ? -19.48 12.066 -9.79 1.0 72.21 ? 9 A 6 +ATOM 123 H H . PHE A1 1 9 ? -14.801 13.344 -14.223 1.0 15.35 ? 9 A 6 +ATOM 124 H HA . PHE A1 1 9 ? -17.277 11.791 -13.846 1.0 72.15 ? 9 A 6 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.364 14.229 -12.609 1.0 13.22 ? 9 A 6 +ATOM 126 H HB3 . PHE A1 1 9 ? -17.86 14.524 -13.49 1.0 20.44 ? 9 A 6 +ATOM 127 H HD1 . PHE A1 1 9 ? -19.697 12.627 -13.107 1.0 63.23 ? 9 A 6 +ATOM 128 H HD2 . PHE A1 1 9 ? -16.537 13.582 -10.421 1.0 43.5 ? 9 A 6 +ATOM 129 H HE1 . PHE A1 1 9 ? -20.983 11.649 -11.251 1.0 53.21 ? 9 A 6 +ATOM 130 H HE2 . PHE A1 1 9 ? -17.817 12.606 -8.561 1.0 61.25 ? 9 A 6 +ATOM 131 H HZ . PHE A1 1 9 ? -20.043 11.637 -8.975 1.0 11.33 ? 9 A 6 +ATOM 132 N N . VAL A1 1 10 ? -18.259 12.448 -16.015 1.0 35.51 ? 10 A 6 +ATOM 133 C CA . VAL A1 1 10 ? -18.806 12.767 -17.328 1.0 51.35 ? 10 A 6 +ATOM 134 C C . VAL A1 1 10 ? -20.284 13.131 -17.234 1.0 20.3 ? 10 A 6 +ATOM 135 O O . VAL A1 1 10 ? -21.073 12.413 -16.62 1.0 33.54 ? 10 A 6 +ATOM 136 C CB . VAL A1 1 10 ? -18.639 11.59 -18.307 1.0 1.24 ? 10 A 6 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.209 12.091 -19.677 1.0 43.55 ? 10 A 6 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.64 10.582 -17.761 1.0 70.41 ? 10 A 6 +ATOM 139 H H . VAL A1 1 10 ? -18.601 11.668 -15.531 1.0 13.11 ? 10 A 6 +ATOM 140 H HA . VAL A1 1 10 ? -18.261 13.614 -17.72 1.0 52.2 ? 10 A 6 +ATOM 141 H HB . VAL A1 1 10 ? -19.595 11.097 -18.412 1.0 21.21 ? 10 A 6 +ATOM 142 H HG11 . VAL A1 1 10 ? -18.576 13.097 -19.823 1.0 75.22 ? 10 A 6 +ATOM 143 H HG12 . VAL A1 1 10 ? -17.131 12.086 -19.741 1.0 54.41 ? 10 A 6 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.618 11.446 -20.441 1.0 61.31 ? 10 A 6 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.358 9.893 -18.544 1.0 13.24 ? 10 A 6 +ATOM 146 H HG22 . VAL A1 1 10 ? -16.763 11.102 -17.406 1.0 62.44 ? 10 A 6 +ATOM 147 H HG23 . VAL A1 1 10 ? -18.089 10.034 -16.945 1.0 2.35 ? 10 A 6 +ATOM 148 N N . LYS A1 1 11 ? -20.652 14.25 -17.848 1.0 23.3 ? 11 A 6 +ATOM 149 C CA . LYS A1 1 11 ? -22.036 14.709 -17.836 1.0 10.31 ? 11 A 6 +ATOM 150 C C . LYS A1 1 11 ? -22.688 14.507 -19.2 1.0 22.12 ? 11 A 6 +ATOM 151 O O . LYS A1 1 11 ? -22.288 15.123 -20.189 1.0 63.21 ? 11 A 6 +ATOM 152 C CB . LYS A1 1 11 ? -22.101 16.187 -17.442 1.0 34.41 ? 11 A 6 +ATOM 153 C CG . LYS A1 1 11 ? -23.453 16.827 -17.704 1.0 63.11 ? 11 A 6 +ATOM 154 C CD . LYS A1 1 11 ? -23.446 18.306 -17.356 1.0 3.15 ? 11 A 6 +ATOM 155 C CE . LYS A1 1 11 ? -23.128 19.163 -18.572 1.0 2.52 ? 11 A 6 +ATOM 156 N NZ . LYS A1 1 11 ? -23.198 20.618 -18.259 1.0 51.12 ? 11 A 6 +ATOM 157 H H . LYS A1 1 11 ? -19.977 14.78 -18.322 1.0 4.15 ? 11 A 6 +ATOM 158 H HA . LYS A1 1 11 ? -22.573 14.126 -17.104 1.0 44.21 ? 11 A 6 +ATOM 159 H HB2 . LYS A1 1 11 ? -21.882 16.276 -16.388 1.0 75.01 ? 11 A 6 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.354 16.73 -18.003 1.0 15.43 ? 11 A 6 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.698 16.716 -18.75 1.0 73.24 ? 11 A 6 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.2 16.329 -17.103 1.0 30.03 ? 11 A 6 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.42 18.584 -16.98 1.0 63.51 ? 11 A 6 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.7 18.485 -16.595 1.0 61.22 ? 11 A 6 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.132 18.925 -18.913 1.0 70.24 ? 11 A 6 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.84 18.937 -19.352 1.0 3.13 ? 11 A 6 +ATOM 167 H HZ1 . LYS A1 1 11 ? -22.532 21.145 -18.859 1.0 1.34 ? 11 A 6 +ATOM 168 H HZ2 . LYS A1 1 11 ? -22.954 20.78 -17.261 1.0 61.44 ? 11 A 6 +ATOM 169 H HZ3 . LYS A1 1 11 ? -24.16 20.974 -18.431 1.0 12.11 ? 11 A 6 +ATOM 170 N N . THR A1 1 12 ? -23.696 13.641 -19.247 1.0 60.33 ? 12 A 6 +ATOM 171 C CA . THR A1 1 12 ? -24.403 13.358 -20.49 1.0 63.11 ? 12 A 6 +ATOM 172 C C . THR A1 1 12 ? -25.329 14.508 -20.869 1.0 63.2 ? 12 A 6 +ATOM 173 O O . THR A1 1 12 ? -25.701 15.324 -20.024 1.0 23.14 ? 12 A 6 +ATOM 174 C CB . THR A1 1 12 ? -25.229 12.063 -20.384 1.0 13.53 ? 12 A 6 +ATOM 175 O OG1 . THR A1 1 12 ? -26.206 12.188 -19.344 1.0 44.22 ? 12 A 6 +ATOM 176 C CG2 . THR A1 1 12 ? -24.33 10.869 -20.1 1.0 44.25 ? 12 A 6 +ATOM 177 H H . THR A1 1 12 ? -23.968 13.182 -18.426 1.0 50.31 ? 12 A 6 +ATOM 178 H HA . THR A1 1 12 ? -23.668 13.229 -21.27 1.0 15.31 ? 12 A 6 +ATOM 179 H HB . THR A1 1 12 ? -25.735 11.898 -21.324 1.0 3.11 ? 12 A 6 +ATOM 180 H HG1 . THR A1 1 12 ? -26.94 11.595 -19.521 1.0 54.01 ? 12 A 6 +ATOM 181 H HG21 . THR A1 1 12 ? -23.709 10.674 -20.961 1.0 54.24 ? 12 A 6 +ATOM 182 H HG22 . THR A1 1 12 ? -24.938 10.002 -19.89 1.0 51.32 ? 12 A 6 +ATOM 183 H HG23 . THR A1 1 12 ? -23.704 11.085 -19.247 1.0 74.05 ? 12 A 6 +ATOM 184 N N . LEU A1 1 13 ? -25.699 14.568 -22.143 1.0 74.21 ? 13 A 6 +ATOM 185 C CA . LEU A1 1 13 ? -26.584 15.619 -22.635 1.0 74.52 ? 13 A 6 +ATOM 186 C C . LEU A1 1 13 ? -27.919 15.596 -21.897 1.0 25.21 ? 13 A 6 +ATOM 187 O O . LEU A1 1 13 ? -28.662 16.578 -21.904 1.0 11.35 ? 13 A 6 +ATOM 188 C CB . LEU A1 1 13 ? -26.817 15.455 -24.138 1.0 31.51 ? 13 A 6 +ATOM 189 C CG . LEU A1 1 13 ? -27.528 16.614 -24.837 1.0 30.32 ? 13 A 6 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.517 17.625 -25.357 1.0 44.31 ? 13 A 6 +ATOM 191 C CD2 . LEU A1 1 13 ? -28.4 16.098 -25.972 1.0 64.01 ? 13 A 6 +ATOM 192 H H . LEU A1 1 13 ? -25.371 13.89 -22.769 1.0 42.02 ? 13 A 6 +ATOM 193 H HA . LEU A1 1 13 ? -26.103 16.568 -22.455 1.0 34.1 ? 13 A 6 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.855 15.325 -24.609 1.0 62.11 ? 13 A 6 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.411 14.564 -24.285 1.0 43.21 ? 13 A 6 +ATOM 196 H HG . LEU A1 1 13 ? -28.167 17.118 -24.125 1.0 45.4 ? 13 A 6 +ATOM 197 H HD11 . LEU A1 1 13 ? -27.032 18.401 -25.902 1.0 62.23 ? 13 A 6 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.817 17.129 -26.012 1.0 23.44 ? 13 A 6 +ATOM 199 H HD13 . LEU A1 1 13 ? -25.984 18.061 -24.524 1.0 25.55 ? 13 A 6 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.023 15.144 -26.311 1.0 62.14 ? 13 A 6 +ATOM 201 H HD22 . LEU A1 1 13 ? -28.381 16.803 -26.79 1.0 41.34 ? 13 A 6 +ATOM 202 H HD23 . LEU A1 1 13 ? -29.415 15.98 -25.621 1.0 51.42 ? 13 A 6 +ATOM 203 N N . THR A1 1 14 ? -28.217 14.469 -21.258 1.0 31.41 ? 14 A 6 +ATOM 204 C CA . THR A1 1 14 ? -29.461 14.319 -20.514 1.0 30.33 ? 14 A 6 +ATOM 205 C C . THR A1 1 14 ? -29.308 14.814 -19.081 1.0 22.13 ? 14 A 6 +ATOM 206 O O . THR A1 1 14 ? -30.233 14.713 -18.276 1.0 5.31 ? 14 A 6 +ATOM 207 C CB . THR A1 1 14 ? -29.928 12.851 -20.491 1.0 34.54 ? 14 A 6 +ATOM 208 O OG1 . THR A1 1 14 ? -29.043 12.068 -19.682 1.0 3.22 ? 14 A 6 +ATOM 209 C CG2 . THR A1 1 14 ? -29.978 12.277 -21.899 1.0 34.11 ? 14 A 6 +ATOM 210 H H . THR A1 1 14 ? -27.585 13.721 -21.29 1.0 2.31 ? 14 A 6 +ATOM 211 H HA . THR A1 1 14 ? -30.219 14.908 -21.009 1.0 25.44 ? 14 A 6 +ATOM 212 H HB . THR A1 1 14 ? -30.921 12.812 -20.066 1.0 55.24 ? 14 A 6 +ATOM 213 H HG1 . THR A1 1 14 ? -29.555 11.458 -19.145 1.0 24.42 ? 14 A 6 +ATOM 214 H HG21 . THR A1 1 14 ? -30.779 11.556 -21.965 1.0 1.02 ? 14 A 6 +ATOM 215 H HG22 . THR A1 1 14 ? -29.04 11.793 -22.124 1.0 12.23 ? 14 A 6 +ATOM 216 H HG23 . THR A1 1 14 ? -30.152 13.074 -22.606 1.0 12.42 ? 14 A 6 +ATOM 217 N N . GLY A1 1 15 ? -28.132 15.351 -18.767 1.0 61.2 ? 15 A 6 +ATOM 218 C CA . GLY A1 1 15 ? -27.88 15.854 -17.43 1.0 25.44 ? 15 A 6 +ATOM 219 C C . GLY A1 1 15 ? -27.64 14.743 -16.427 1.0 2.34 ? 15 A 6 +ATOM 220 O O . GLY A1 1 15 ? -28.293 14.684 -15.385 1.0 24.03 ? 15 A 6 +ATOM 221 H H . GLY A1 1 15 ? -27.431 15.405 -19.45 1.0 73.22 ? 15 A 6 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.011 16.495 -17.456 1.0 10.15 ? 15 A 6 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.733 16.434 -17.109 1.0 23.53 ? 15 A 6 +ATOM 224 N N . LYS A1 1 16 ? -26.701 13.857 -16.742 1.0 11.21 ? 16 A 6 +ATOM 225 C CA . LYS A1 1 16 ? -26.375 12.741 -15.862 1.0 34.13 ? 16 A 6 +ATOM 226 C C . LYS A1 1 16 ? -24.875 12.682 -15.591 1.0 15.24 ? 16 A 6 +ATOM 227 O O . LYS A1 1 16 ? -24.072 12.528 -16.513 1.0 50.04 ? 16 A 6 +ATOM 228 C CB . LYS A1 1 16 ? -26.845 11.423 -16.481 1.0 31.42 ? 16 A 6 +ATOM 229 C CG . LYS A1 1 16 ? -27.306 10.401 -15.457 1.0 73.35 ? 16 A 6 +ATOM 230 C CD . LYS A1 1 16 ? -26.154 9.533 -14.977 1.0 50.3 ? 16 A 6 +ATOM 231 C CE . LYS A1 1 16 ? -25.635 8.633 -16.088 1.0 52.44 ? 16 A 6 +ATOM 232 N NZ . LYS A1 1 16 ? -25.99 7.205 -15.856 1.0 2.53 ? 16 A 6 +ATOM 233 H H . LYS A1 1 16 ? -26.213 13.958 -17.587 1.0 52.54 ? 16 A 6 +ATOM 234 H HA . LYS A1 1 16 ? -26.891 12.895 -14.927 1.0 34.34 ? 16 A 6 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.667 11.627 -17.151 1.0 44.24 ? 16 A 6 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.03 10.994 -17.046 1.0 12.13 ? 16 A 6 +ATOM 237 H HG2 . LYS A1 1 16 ? -27.729 10.919 -14.609 1.0 3.41 ? 16 A 6 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.058 9.768 -15.906 1.0 74.14 ? 16 A 6 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.35 10.171 -14.641 1.0 63.23 ? 16 A 6 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.496 8.918 -14.157 1.0 14.51 ? 16 A 6 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.064 8.954 -17.024 1.0 44.12 ? 16 A 6 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.56 8.725 -16.134 1.0 75.31 ? 16 A 6 +ATOM 243 H HZ1 . LYS A1 1 16 ? -25.285 6.757 -15.237 1.0 61.55 ? 16 A 6 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.017 6.693 -16.761 1.0 23.15 ? 16 A 6 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.925 7.138 -15.405 1.0 43.23 ? 16 A 6 +ATOM 246 N N . THR A1 1 17 ? -24.502 12.803 -14.321 1.0 33.03 ? 17 A 6 +ATOM 247 C CA . THR A1 1 17 ? -23.099 12.763 -13.929 1.0 61.21 ? 17 A 6 +ATOM 248 C C . THR A1 1 17 ? -22.665 11.343 -13.583 1.0 13.11 ? 17 A 6 +ATOM 249 O O . THR A1 1 17 ? -23.202 10.727 -12.662 1.0 32.24 ? 17 A 6 +ATOM 250 C CB . THR A1 1 17 ? -22.826 13.679 -12.722 1.0 22.54 ? 17 A 6 +ATOM 251 O OG1 . THR A1 1 17 ? -23.573 13.229 -11.586 1.0 24.32 ? 17 A 6 +ATOM 252 C CG2 . THR A1 1 17 ? -23.197 15.12 -13.041 1.0 72.42 ? 17 A 6 +ATOM 253 H H . THR A1 1 17 ? -25.188 12.924 -13.632 1.0 63.53 ? 17 A 6 +ATOM 254 H HA . THR A1 1 17 ? -22.509 13.116 -14.763 1.0 15.15 ? 17 A 6 +ATOM 255 H HB . THR A1 1 17 ? -21.771 13.638 -12.489 1.0 61.22 ? 17 A 6 +ATOM 256 H HG1 . THR A1 1 17 ? -22.975 12.844 -10.942 1.0 54.0 ? 17 A 6 +ATOM 257 H HG21 . THR A1 1 17 ? -22.789 15.772 -12.284 1.0 31.34 ? 17 A 6 +ATOM 258 H HG22 . THR A1 1 17 ? -24.272 15.219 -13.06 1.0 12.24 ? 17 A 6 +ATOM 259 H HG23 . THR A1 1 17 ? -22.793 15.39 -14.005 1.0 74.01 ? 17 A 6 +ATOM 260 N N . ILE A1 1 18 ? -21.691 10.829 -14.327 1.0 21.15 ? 18 A 6 +ATOM 261 C CA . ILE A1 1 18 ? -21.184 9.482 -14.096 1.0 42.23 ? 18 A 6 +ATOM 262 C C . ILE A1 1 18 ? -19.708 9.507 -13.717 1.0 2.02 ? 18 A 6 +ATOM 263 O O . ILE A1 1 18 ? -18.926 10.284 -14.267 1.0 34.24 ? 18 A 6 +ATOM 264 C CB . ILE A1 1 18 ? -21.368 8.591 -15.339 1.0 20.13 ? 18 A 6 +ATOM 265 C CG1 . ILE A1 1 18 ? -20.483 7.348 -15.238 1.0 0.43 ? 18 A 6 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.048 9.374 -16.604 1.0 34.34 ? 18 A 6 +ATOM 267 C CD1 . ILE A1 1 18 ? -20.79 6.3 -16.285 1.0 41.12 ? 18 A 6 +ATOM 268 H H . ILE A1 1 18 ? -21.303 11.369 -15.046 1.0 72.35 ? 18 A 6 +ATOM 269 H HA . ILE A1 1 18 ? -21.747 9.049 -13.282 1.0 33.1 ? 18 A 6 +ATOM 270 H HB . ILE A1 1 18 ? -22.402 8.286 -15.386 1.0 55.23 ? 18 A 6 +ATOM 271 H HG12 . ILE A1 1 18 ? -19.45 7.638 -15.353 1.0 35.45 ? 18 A 6 +ATOM 272 H HG13 . ILE A1 1 18 ? -20.619 6.896 -14.266 1.0 15.51 ? 18 A 6 +ATOM 273 H HG21 . ILE A1 1 18 ? -20.029 9.728 -16.56 1.0 31.24 ? 18 A 6 +ATOM 274 H HG22 . ILE A1 1 18 ? -21.17 8.733 -17.464 1.0 60.32 ? 18 A 6 +ATOM 275 H HG23 . ILE A1 1 18 ? -21.718 10.217 -16.685 1.0 71.44 ? 18 A 6 +ATOM 276 H HD11 . ILE A1 1 18 ? -21.006 6.785 -17.226 1.0 32.31 ? 18 A 6 +ATOM 277 H HD12 . ILE A1 1 18 ? -19.937 5.649 -16.405 1.0 60.24 ? 18 A 6 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.646 5.721 -15.975 1.0 25.35 ? 18 A 6 +ATOM 279 N N . THR A1 1 19 ? -19.33 8.65 -12.773 1.0 42.32 ? 19 A 6 +ATOM 280 C CA . THR A1 1 19 ? -17.947 8.573 -12.32 1.0 41.24 ? 19 A 6 +ATOM 281 C C . THR A1 1 19 ? -17.277 7.296 -12.813 1.0 70.21 ? 19 A 6 +ATOM 282 O O . THR A1 1 19 ? -17.873 6.219 -12.78 1.0 44.42 ? 19 A 6 +ATOM 283 C CB . THR A1 1 19 ? -17.856 8.626 -10.783 1.0 2.4 ? 19 A 6 +ATOM 284 O OG1 . THR A1 1 19 ? -19.144 8.909 -10.225 1.0 22.32 ? 19 A 6 +ATOM 285 C CG2 . THR A1 1 19 ? -16.86 9.686 -10.336 1.0 13.14 ? 19 A 6 +ATOM 286 H H . THR A1 1 19 ? -19.999 8.057 -12.372 1.0 1.15 ? 19 A 6 +ATOM 287 H HA . THR A1 1 19 ? -17.417 9.424 -12.721 1.0 65.43 ? 19 A 6 +ATOM 288 H HB . THR A1 1 19 ? -17.52 7.664 -10.424 1.0 44.24 ? 19 A 6 +ATOM 289 H HG1 . THR A1 1 19 ? -19.112 8.795 -9.272 1.0 60.25 ? 19 A 6 +ATOM 290 H HG21 . THR A1 1 19 ? -17.052 9.948 -9.307 1.0 73.33 ? 19 A 6 +ATOM 291 H HG22 . THR A1 1 19 ? -16.967 10.564 -10.956 1.0 23.45 ? 19 A 6 +ATOM 292 H HG23 . THR A1 1 19 ? -15.856 9.299 -10.429 1.0 51.03 ? 19 A 6 +ATOM 293 N N . ILE A1 1 20 ? -16.036 7.423 -13.27 1.0 2.13 ? 20 A 6 +ATOM 294 C CA . ILE A1 1 20 ? -15.285 6.277 -13.769 1.0 23.24 ? 20 A 6 +ATOM 295 C C . ILE A1 1 20 ? -13.812 6.378 -13.388 1.0 21.51 ? 20 A 6 +ATOM 296 O O . ILE A1 1 20 ? -13.183 7.42 -13.57 1.0 3.54 ? 20 A 6 +ATOM 297 C CB . ILE A1 1 20 ? -15.401 6.151 -15.299 1.0 55.55 ? 20 A 6 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.464 7.538 -15.944 1.0 1.5 ? 20 A 6 +ATOM 299 C CG2 . ILE A1 1 20 ? -16.627 5.332 -15.672 1.0 1.32 ? 20 A 6 +ATOM 300 C CD1 . ILE A1 1 20 ? -14.829 7.596 -17.316 1.0 2.4 ? 20 A 6 +ATOM 301 H H . ILE A1 1 20 ? -15.615 8.307 -13.271 1.0 32.52 ? 20 A 6 +ATOM 302 H HA . ILE A1 1 20 ? -15.702 5.386 -13.322 1.0 40.32 ? 20 A 6 +ATOM 303 H HB . ILE A1 1 20 ? -14.527 5.632 -15.663 1.0 75.22 ? 20 A 6 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.496 7.835 -16.044 1.0 4.24 ? 20 A 6 +ATOM 305 H HG13 . ILE A1 1 20 ? -14.95 8.245 -15.309 1.0 20.02 ? 20 A 6 +ATOM 306 H HG21 . ILE A1 1 20 ? -16.42 4.76 -16.565 1.0 41.11 ? 20 A 6 +ATOM 307 H HG22 . ILE A1 1 20 ? -16.87 4.659 -14.863 1.0 51.34 ? 20 A 6 +ATOM 308 H HG23 . ILE A1 1 20 ? -17.461 5.993 -15.854 1.0 74.34 ? 20 A 6 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.142 6.738 -17.894 1.0 44.23 ? 20 A 6 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.139 8.5 -17.819 1.0 43.31 ? 20 A 6 +ATOM 311 H HD13 . ILE A1 1 20 ? -13.754 7.589 -17.216 1.0 23.14 ? 20 A 6 +ATOM 312 N N . ASP A1 1 21 ? -13.267 5.287 -12.861 1.0 44.41 ? 21 A 6 +ATOM 313 C CA . ASP A1 1 21 ? -11.866 5.25 -12.458 1.0 13.43 ? 21 A 6 +ATOM 314 C C . ASP A1 1 21 ? -10.966 4.928 -13.647 1.0 74.52 ? 21 A 6 +ATOM 315 O O . ASP A1 1 21 ? -11.096 3.874 -14.269 1.0 3.25 ? 21 A 6 +ATOM 316 C CB . ASP A1 1 21 ? -11.659 4.216 -11.35 1.0 40.32 ? 21 A 6 +ATOM 317 C CG . ASP A1 1 21 ? -11.97 2.805 -11.81 1.0 70.32 ? 21 A 6 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.142 2.537 -12.148 1.0 34.41 ? 21 A 6 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.043 1.969 -11.831 1.0 4.34 ? 21 A 6 +ATOM 320 H H . ASP A1 1 21 ? -13.82 4.486 -12.742 1.0 61.24 ? 21 A 6 +ATOM 321 H HA . ASP A1 1 21 ? -11.605 6.227 -12.079 1.0 0.1 ? 21 A 6 +ATOM 322 H HB2 . ASP A1 1 21 ? -10.63 4.249 -11.023 1.0 73.15 ? 21 A 6 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.305 4.455 -10.518 1.0 61.23 ? 21 A 6 +ATOM 324 N N . VAL A1 1 22 ? -10.054 5.843 -13.957 1.0 30.34 ? 22 A 6 +ATOM 325 C CA . VAL A1 1 22 ? -9.132 5.657 -15.071 1.0 1.34 ? 22 A 6 +ATOM 326 C C . VAL A1 1 22 ? -7.691 5.903 -14.639 1.0 61.2 ? 22 A 6 +ATOM 327 O O . VAL A1 1 22 ? -7.439 6.511 -13.599 1.0 34.03 ? 22 A 6 +ATOM 328 C CB . VAL A1 1 22 ? -9.472 6.595 -16.244 1.0 60.13 ? 22 A 6 +ATOM 329 C CG1 . VAL A1 1 22 ? -10.908 7.085 -16.138 1.0 14.0 ? 22 A 6 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.503 7.767 -16.287 1.0 61.12 ? 22 A 6 +ATOM 331 H H . VAL A1 1 22 ? -9.999 6.664 -13.424 1.0 71.0 ? 22 A 6 +ATOM 332 H HA . VAL A1 1 22 ? -9.226 4.637 -15.415 1.0 41.13 ? 22 A 6 +ATOM 333 H HB . VAL A1 1 22 ? -9.373 6.039 -17.165 1.0 23.42 ? 22 A 6 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.559 6.249 -15.925 1.0 3.13 ? 22 A 6 +ATOM 335 H HG12 . VAL A1 1 22 ? -10.983 7.812 -15.342 1.0 11.12 ? 22 A 6 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.203 7.541 -17.071 1.0 2.3 ? 22 A 6 +ATOM 337 H HG21 . VAL A1 1 22 ? -7.535 7.422 -16.618 1.0 43.3 ? 22 A 6 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.873 8.515 -16.972 1.0 71.52 ? 22 A 6 +ATOM 339 H HG23 . VAL A1 1 22 ? -8.413 8.197 -15.3 1.0 24.41 ? 22 A 6 +ATOM 340 N N . ASP A1 1 23 ? -6.748 5.426 -15.445 1.0 73.14 ? 23 A 6 +ATOM 341 C CA . ASP A1 1 23 ? -5.331 5.595 -15.147 1.0 0.33 ? 23 A 6 +ATOM 342 C C . ASP A1 1 23 ? -4.645 6.427 -16.226 1.0 62.12 ? 23 A 6 +ATOM 343 O O . ASP A1 1 23 ? -5.164 6.578 -17.332 1.0 35.34 ? 23 A 6 +ATOM 344 C CB . ASP A1 1 23 ? -4.647 4.232 -15.024 1.0 24.44 ? 23 A 6 +ATOM 345 C CG . ASP A1 1 23 ? -5.462 3.248 -14.209 1.0 11.25 ? 23 A 6 +ATOM 346 O OD1 . ASP A1 1 23 ? -6.436 2.687 -14.754 1.0 71.52 ? 23 A 6 +ATOM 347 O OD2 . ASP A1 1 23 ? -5.125 3.036 -13.025 1.0 54.12 ? 23 A 6 +ATOM 348 H H . ASP A1 1 23 ? -7.012 4.949 -16.26 1.0 71.31 ? 23 A 6 +ATOM 349 H HA . ASP A1 1 23 ? -5.25 6.114 -14.204 1.0 62.03 ? 23 A 6 +ATOM 350 H HB2 . ASP A1 1 23 ? -4.502 3.819 -16.012 1.0 75.32 ? 23 A 6 +ATOM 351 H HB3 . ASP A1 1 23 ? -3.687 4.36 -14.547 1.0 32.1 ? 23 A 6 +ATOM 352 N N . HIS A1 1 24 ? -3.475 6.965 -15.896 1.0 3.42 ? 24 A 6 +ATOM 353 C CA . HIS A1 1 24 ? -2.717 7.782 -16.837 1.0 64.1 ? 24 A 6 +ATOM 354 C C . HIS A1 1 24 ? -2.377 6.989 -18.095 1.0 13.22 ? 24 A 6 +ATOM 355 O O . HIS A1 1 24 ? -2.035 7.562 -19.129 1.0 40.32 ? 24 A 6 +ATOM 356 C CB . HIS A1 1 24 ? -1.434 8.296 -16.182 1.0 43.52 ? 24 A 6 +ATOM 357 C CG . HIS A1 1 24 ? -0.441 7.216 -15.883 1.0 63.23 ? 24 A 6 +ATOM 358 N ND1 . HIS A1 1 24 ? 0.411 6.692 -16.833 1.0 33.23 ? 24 A 6 +ATOM 359 C CD2 . HIS A1 1 24 ? -0.164 6.561 -14.731 1.0 70.35 ? 24 A 6 +ATOM 360 C CE1 . HIS A1 1 24 ? 1.166 5.761 -16.279 1.0 52.22 ? 24 A 6 +ATOM 361 N NE2 . HIS A1 1 24 ? 0.838 5.663 -15.003 1.0 51.1 ? 24 A 6 +ATOM 362 H H . HIS A1 1 24 ? -3.112 6.809 -15.0 1.0 35.01 ? 24 A 6 +ATOM 363 H HA . HIS A1 1 24 ? -3.332 8.625 -17.114 1.0 52.33 ? 24 A 6 +ATOM 364 H HB2 . HIS A1 1 24 ? -0.961 9.008 -16.842 1.0 74.33 ? 24 A 6 +ATOM 365 H HB3 . HIS A1 1 24 ? -1.684 8.785 -15.252 1.0 2.24 ? 24 A 6 +ATOM 366 H HD1 . HIS A1 1 24 ? 0.453 6.962 -17.774 1.0 61.24 ? 24 A 6 +ATOM 367 H HD2 . HIS A1 1 24 ? -0.643 6.716 -13.774 1.0 14.35 ? 24 A 6 +ATOM 368 H HE1 . HIS A1 1 24 ? 1.925 5.18 -16.782 1.0 73.24 ? 24 A 6 +ATOM 369 N N . ALA A1 1 25 ? -2.473 5.667 -17.999 1.0 63.43 ? 25 A 6 +ATOM 370 C CA . ALA A1 1 25 ? -2.177 4.795 -19.129 1.0 43.32 ? 25 A 6 +ATOM 371 C C . ALA A1 1 25 ? -3.424 4.546 -19.971 1.0 33.54 ? 25 A 6 +ATOM 372 O O . ALA A1 1 25 ? -3.405 3.739 -20.902 1.0 12.23 ? 25 A 6 +ATOM 373 C CB . ALA A1 1 25 ? -1.596 3.476 -18.64 1.0 51.34 ? 25 A 6 +ATOM 374 H H . ALA A1 1 25 ? -2.751 5.268 -17.148 1.0 55.41 ? 25 A 6 +ATOM 375 H HA . ALA A1 1 25 ? -1.433 5.283 -19.741 1.0 23.12 ? 25 A 6 +ATOM 376 H HB1 . ALA A1 1 25 ? -2.275 3.025 -17.932 1.0 42.21 ? 25 A 6 +ATOM 377 H HB2 . ALA A1 1 25 ? -1.456 2.812 -19.48 1.0 3.14 ? 25 A 6 +ATOM 378 H HB3 . ALA A1 1 25 ? -0.645 3.658 -18.162 1.0 44.44 ? 25 A 6 +ATOM 379 N N . ASP A1 1 26 ? -4.505 5.242 -19.639 1.0 53.31 ? 26 A 6 +ATOM 380 C CA . ASP A1 1 26 ? -5.761 5.096 -20.366 1.0 71.32 ? 26 A 6 +ATOM 381 C C . ASP A1 1 26 ? -6.112 6.382 -21.107 1.0 31.24 ? 26 A 6 +ATOM 382 O O . ASP A1 1 26 ? -6.27 7.44 -20.497 1.0 53.43 ? 26 A 6 +ATOM 383 C CB . ASP A1 1 26 ? -6.891 4.722 -19.404 1.0 21.1 ? 26 A 6 +ATOM 384 C CG . ASP A1 1 26 ? -6.652 3.389 -18.722 1.0 73.54 ? 26 A 6 +ATOM 385 O OD1 . ASP A1 1 26 ? -5.665 3.278 -17.964 1.0 73.22 ? 26 A 6 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.453 2.458 -18.944 1.0 2.02 ? 26 A 6 +ATOM 387 H H . ASP A1 1 26 ? -4.457 5.869 -18.887 1.0 73.33 ? 26 A 6 +ATOM 388 H HA . ASP A1 1 26 ? -5.637 4.302 -21.087 1.0 35.3 ? 26 A 6 +ATOM 389 H HB2 . ASP A1 1 26 ? -6.975 5.485 -18.644 1.0 71.15 ? 26 A 6 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.818 4.664 -19.955 1.0 51.4 ? 26 A 6 +ATOM 391 N N . THR A1 1 27 ? -6.233 6.284 -22.427 1.0 11.22 ? 27 A 6 +ATOM 392 C CA . THR A1 1 27 ? -6.563 7.439 -23.253 1.0 12.11 ? 27 A 6 +ATOM 393 C C . THR A1 1 27 ? -8.066 7.69 -23.272 1.0 24.55 ? 27 A 6 +ATOM 394 O O . THR A1 1 27 ? -8.85 6.861 -22.807 1.0 14.34 ? 27 A 6 +ATOM 395 C CB . THR A1 1 27 ? -6.066 7.256 -24.699 1.0 24.42 ? 27 A 6 +ATOM 396 O OG1 . THR A1 1 27 ? -6.13 5.874 -25.068 1.0 51.41 ? 27 A 6 +ATOM 397 C CG2 . THR A1 1 27 ? -4.639 7.761 -24.849 1.0 72.22 ? 27 A 6 +ATOM 398 H H . THR A1 1 27 ? -6.095 5.413 -22.855 1.0 1.33 ? 27 A 6 +ATOM 399 H HA . THR A1 1 27 ? -6.069 8.302 -22.831 1.0 54.42 ? 27 A 6 +ATOM 400 H HB . THR A1 1 27 ? -6.705 7.827 -25.358 1.0 51.23 ? 27 A 6 +ATOM 401 H HG1 . THR A1 1 27 ? -6.002 5.79 -26.016 1.0 23.44 ? 27 A 6 +ATOM 402 H HG21 . THR A1 1 27 ? -4.329 7.663 -25.878 1.0 20.21 ? 27 A 6 +ATOM 403 H HG22 . THR A1 1 27 ? -3.983 7.178 -24.219 1.0 40.31 ? 27 A 6 +ATOM 404 H HG23 . THR A1 1 27 ? -4.591 8.799 -24.556 1.0 53.14 ? 27 A 6 +ATOM 405 N N . VAL A1 1 28 ? -8.464 8.837 -23.812 1.0 70.04 ? 28 A 6 +ATOM 406 C CA . VAL A1 1 28 ? -9.874 9.196 -23.893 1.0 40.12 ? 28 A 6 +ATOM 407 C C . VAL A1 1 28 ? -10.688 8.082 -24.542 1.0 43.3 ? 28 A 6 +ATOM 408 O O . VAL A1 1 28 ? -11.737 7.689 -24.034 1.0 51.44 ? 28 A 6 +ATOM 409 C CB . VAL A1 1 28 ? -10.078 10.497 -24.692 1.0 70.14 ? 28 A 6 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.466 11.065 -24.443 1.0 13.41 ? 28 A 6 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.004 11.514 -24.335 1.0 73.55 ? 28 A 6 +ATOM 412 H H . VAL A1 1 28 ? -7.792 9.457 -24.165 1.0 50.23 ? 28 A 6 +ATOM 413 H HA . VAL A1 1 28 ? -10.237 9.355 -22.888 1.0 62.42 ? 28 A 6 +ATOM 414 H HB . VAL A1 1 28 ? -9.99 10.267 -25.744 1.0 52.41 ? 28 A 6 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.488 11.553 -23.48 1.0 72.32 ? 28 A 6 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.707 11.781 -25.216 1.0 75.12 ? 28 A 6 +ATOM 417 H HG13 . VAL A1 1 28 ? -12.191 10.264 -24.456 1.0 43.12 ? 28 A 6 +ATOM 418 H HG21 . VAL A1 1 28 ? -9.315 12.496 -24.66 1.0 22.23 ? 28 A 6 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.857 11.519 -23.265 1.0 21.24 ? 28 A 6 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.079 11.249 -24.825 1.0 51.43 ? 28 A 6 +ATOM 421 N N . GLY A1 1 29 ? -10.197 7.576 -25.669 1.0 51.02 ? 29 A 6 +ATOM 422 C CA . GLY A1 1 29 ? -10.891 6.512 -26.369 1.0 24.21 ? 29 A 6 +ATOM 423 C C . GLY A1 1 29 ? -11.347 5.406 -25.438 1.0 62.32 ? 29 A 6 +ATOM 424 O O . GLY A1 1 29 ? -12.513 5.015 -25.453 1.0 1.41 ? 29 A 6 +ATOM 425 H H . GLY A1 1 29 ? -9.355 7.929 -26.028 1.0 25.44 ? 29 A 6 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.753 6.927 -26.869 1.0 33.14 ? 29 A 6 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.226 6.091 -27.11 1.0 61.11 ? 29 A 6 +ATOM 428 N N . ALA A1 1 30 ? -10.424 4.9 -24.626 1.0 0.3 ? 30 A 6 +ATOM 429 C CA . ALA A1 1 30 ? -10.738 3.834 -23.683 1.0 24.42 ? 30 A 6 +ATOM 430 C C . ALA A1 1 30 ? -11.807 4.276 -22.69 1.0 23.15 ? 30 A 6 +ATOM 431 O O . ALA A1 1 30 ? -12.662 3.486 -22.29 1.0 23.32 ? 30 A 6 +ATOM 432 C CB . ALA A1 1 30 ? -9.482 3.393 -22.948 1.0 4.23 ? 30 A 6 +ATOM 433 H H . ALA A1 1 30 ? -9.511 5.254 -24.661 1.0 13.0 ? 30 A 6 +ATOM 434 H HA . ALA A1 1 30 ? -11.111 2.99 -24.246 1.0 42.35 ? 30 A 6 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.748 2.692 -22.17 1.0 24.3 ? 30 A 6 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.805 2.919 -23.643 1.0 15.25 ? 30 A 6 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.002 4.254 -22.508 1.0 54.13 ? 30 A 6 +ATOM 438 N N . VAL A1 1 31 ? -11.753 5.544 -22.295 1.0 44.02 ? 31 A 6 +ATOM 439 C CA . VAL A1 1 31 ? -12.717 6.091 -21.348 1.0 44.43 ? 31 A 6 +ATOM 440 C C . VAL A1 1 31 ? -14.127 6.078 -21.929 1.0 22.33 ? 31 A 6 +ATOM 441 O O . VAL A1 1 31 ? -15.083 5.687 -21.258 1.0 41.34 ? 31 A 6 +ATOM 442 C CB . VAL A1 1 31 ? -12.353 7.533 -20.947 1.0 42.01 ? 31 A 6 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.461 8.15 -20.106 1.0 61.22 ? 31 A 6 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.028 7.56 -20.2 1.0 34.2 ? 31 A 6 +ATOM 445 H H . VAL A1 1 31 ? -11.048 6.125 -22.649 1.0 33.11 ? 31 A 6 +ATOM 446 H HA . VAL A1 1 31 ? -12.698 5.477 -20.459 1.0 53.53 ? 31 A 6 +ATOM 447 H HB . VAL A1 1 31 ? -12.247 8.12 -21.847 1.0 34.14 ? 31 A 6 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.157 7.379 -19.808 1.0 24.43 ? 31 A 6 +ATOM 449 H HG12 . VAL A1 1 31 ? -13.033 8.61 -19.227 1.0 62.24 ? 31 A 6 +ATOM 450 H HG13 . VAL A1 1 31 ? -13.98 8.897 -20.687 1.0 4.44 ? 31 A 6 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.234 7.819 -20.884 1.0 32.4 ? 31 A 6 +ATOM 452 H HG22 . VAL A1 1 31 ? -11.076 8.293 -19.409 1.0 31.51 ? 31 A 6 +ATOM 453 H HG23 . VAL A1 1 31 ? -10.834 6.585 -19.776 1.0 2.41 ? 31 A 6 +ATOM 454 N N . LYS A1 1 32 ? -14.249 6.506 -23.181 1.0 44.33 ? 32 A 6 +ATOM 455 C CA . LYS A1 1 32 ? -15.541 6.541 -23.855 1.0 33.41 ? 32 A 6 +ATOM 456 C C . LYS A1 1 32 ? -16.206 5.169 -23.831 1.0 33.52 ? 32 A 6 +ATOM 457 O O . LYS A1 1 32 ? -17.407 5.054 -23.59 1.0 55.22 ? 32 A 6 +ATOM 458 C CB . LYS A1 1 32 ? -15.372 7.013 -25.301 1.0 21.43 ? 32 A 6 +ATOM 459 C CG . LYS A1 1 32 ? -15.938 8.399 -25.558 1.0 62.04 ? 32 A 6 +ATOM 460 C CD . LYS A1 1 32 ? -14.84 9.447 -25.624 1.0 13.3 ? 32 A 6 +ATOM 461 C CE . LYS A1 1 32 ? -14.545 9.856 -27.059 1.0 61.02 ? 32 A 6 +ATOM 462 N NZ . LYS A1 1 32 ? -14.311 8.676 -27.936 1.0 10.13 ? 32 A 6 +ATOM 463 H H . LYS A1 1 32 ? -13.449 6.804 -23.664 1.0 0.43 ? 32 A 6 +ATOM 464 H HA . LYS A1 1 32 ? -16.171 7.242 -23.328 1.0 20.21 ? 32 A 6 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.32 7.026 -25.542 1.0 31.13 ? 32 A 6 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.874 6.315 -25.955 1.0 51.43 ? 32 A 6 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.47 8.392 -26.498 1.0 34.55 ? 32 A 6 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.619 8.654 -24.759 1.0 75.31 ? 32 A 6 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.152 10.319 -25.07 1.0 62.53 ? 32 A 6 +ATOM 470 H HD3 . LYS A1 1 32 ? -13.94 9.041 -25.183 1.0 34.24 ? 32 A 6 +ATOM 471 H HE2 . LYS A1 1 32 ? -15.386 10.415 -27.44 1.0 32.35 ? 32 A 6 +ATOM 472 H HE3 . LYS A1 1 32 ? -13.664 10.481 -27.067 1.0 31.14 ? 32 A 6 +ATOM 473 H HZ1 . LYS A1 1 32 ? -15.219 8.271 -28.241 1.0 3.34 ? 32 A 6 +ATOM 474 H HZ2 . LYS A1 1 32 ? -13.775 7.948 -27.42 1.0 11.13 ? 32 A 6 +ATOM 475 H HZ3 . LYS A1 1 32 ? -13.768 8.958 -28.777 1.0 13.55 ? 32 A 6 +ATOM 476 N N . ALA A1 1 33 ? -15.415 4.13 -24.081 1.0 34.21 ? 33 A 6 +ATOM 477 C CA . ALA A1 1 33 ? -15.927 2.765 -24.084 1.0 60.31 ? 33 A 6 +ATOM 478 C C . ALA A1 1 33 ? -16.436 2.365 -22.704 1.0 31.03 ? 33 A 6 +ATOM 479 O O . ALA A1 1 33 ? -17.474 1.716 -22.577 1.0 31.32 ? 33 A 6 +ATOM 480 C CB . ALA A1 1 33 ? -14.848 1.798 -24.551 1.0 54.24 ? 33 A 6 +ATOM 481 H H . ALA A1 1 33 ? -14.466 4.285 -24.266 1.0 43.1 ? 33 A 6 +ATOM 482 H HA . ALA A1 1 33 ? -16.746 2.717 -24.787 1.0 53.01 ? 33 A 6 +ATOM 483 H HB1 . ALA A1 1 33 ? -13.948 1.96 -23.976 1.0 2.33 ? 33 A 6 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.189 0.783 -24.41 1.0 61.23 ? 33 A 6 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.642 1.967 -25.598 1.0 53.23 ? 33 A 6 +ATOM 486 N N . LYS A1 1 34 ? -15.698 2.757 -21.67 1.0 30.14 ? 34 A 6 +ATOM 487 C CA . LYS A1 1 34 ? -16.074 2.441 -20.297 1.0 3.41 ? 34 A 6 +ATOM 488 C C . LYS A1 1 34 ? -17.442 3.026 -19.96 1.0 51.04 ? 34 A 6 +ATOM 489 O O . LYS A1 1 34 ? -18.252 2.386 -19.289 1.0 30.3 ? 34 A 6 +ATOM 490 C CB . LYS A1 1 34 ? -15.024 2.978 -19.322 1.0 63.02 ? 34 A 6 +ATOM 491 C CG . LYS A1 1 34 ? -15.301 2.621 -17.872 1.0 24.43 ? 34 A 6 +ATOM 492 C CD . LYS A1 1 34 ? -15.192 1.124 -17.636 1.0 44.42 ? 34 A 6 +ATOM 493 C CE . LYS A1 1 34 ? -13.771 0.628 -17.854 1.0 34.12 ? 34 A 6 +ATOM 494 N NZ . LYS A1 1 34 ? -13.443 -0.523 -16.968 1.0 13.0 ? 34 A 6 +ATOM 495 H H . LYS A1 1 34 ? -14.881 3.273 -21.835 1.0 65.25 ? 34 A 6 +ATOM 496 H HA . LYS A1 1 34 ? -16.123 1.367 -20.206 1.0 3.22 ? 34 A 6 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.059 2.574 -19.593 1.0 71.03 ? 34 A 6 +ATOM 498 H HB3 . LYS A1 1 34 ? -14.989 4.055 -19.406 1.0 71.12 ? 34 A 6 +ATOM 499 H HG2 . LYS A1 1 34 ? -14.585 3.127 -17.243 1.0 24.23 ? 34 A 6 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.3 2.945 -17.616 1.0 22.21 ? 34 A 6 +ATOM 501 H HD2 . LYS A1 1 34 ? -15.484 0.907 -16.619 1.0 63.43 ? 34 A 6 +ATOM 502 H HD3 . LYS A1 1 34 ? -15.853 0.611 -18.32 1.0 75.33 ? 34 A 6 +ATOM 503 H HE2 . LYS A1 1 34 ? -13.666 0.32 -18.883 1.0 34.14 ? 34 A 6 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.086 1.436 -17.649 1.0 0.12 ? 34 A 6 +ATOM 505 H HZ1 . LYS A1 1 34 ? -14.206 -1.229 -17.002 1.0 62.42 ? 34 A 6 +ATOM 506 H HZ2 . LYS A1 1 34 ? -13.33 -0.197 -15.987 1.0 14.2 ? 34 A 6 +ATOM 507 H HZ3 . LYS A1 1 34 ? -12.557 -0.971 -17.277 1.0 65.2 ? 34 A 6 +ATOM 508 N N . ILE A1 1 35 ? -17.692 4.243 -20.43 1.0 14.42 ? 35 A 6 +ATOM 509 C CA . ILE A1 1 35 ? -18.963 4.912 -20.179 1.0 22.32 ? 35 A 6 +ATOM 510 C C . ILE A1 1 35 ? -20.1 4.233 -20.936 1.0 74.31 ? 35 A 6 +ATOM 511 O O . ILE A1 1 35 ? -21.224 4.145 -20.44 1.0 33.23 ? 35 A 6 +ATOM 512 C CB . ILE A1 1 35 ? -18.907 6.397 -20.584 1.0 42.5 ? 35 A 6 +ATOM 513 C CG1 . ILE A1 1 35 ? -17.757 7.102 -19.862 1.0 22.04 ? 35 A 6 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.231 7.08 -20.274 1.0 45.14 ? 35 A 6 +ATOM 515 C CD1 . ILE A1 1 35 ? -17.863 7.043 -18.355 1.0 11.1 ? 35 A 6 +ATOM 516 H H . ILE A1 1 35 ? -17.007 4.702 -20.958 1.0 54.44 ? 35 A 6 +ATOM 517 H HA . ILE A1 1 35 ? -19.166 4.856 -19.119 1.0 30.01 ? 35 A 6 +ATOM 518 H HB . ILE A1 1 35 ? -18.742 6.451 -21.649 1.0 2.44 ? 35 A 6 +ATOM 519 H HG12 . ILE A1 1 35 ? -16.825 6.639 -20.147 1.0 3.24 ? 35 A 6 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.742 8.142 -20.155 1.0 0.11 ? 35 A 6 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.072 7.856 -19.54 1.0 65.32 ? 35 A 6 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.63 7.517 -21.178 1.0 43.1 ? 35 A 6 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.929 6.354 -19.886 1.0 75.41 ? 35 A 6 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.327 7.877 -17.924 1.0 43.52 ? 35 A 6 +ATOM 525 H HD12 . ILE A1 1 35 ? -18.901 7.096 -18.064 1.0 71.15 ? 35 A 6 +ATOM 526 H HD13 . ILE A1 1 35 ? -17.435 6.119 -17.998 1.0 74.3 ? 35 A 6 +ATOM 527 N N . TYR A1 1 36 ? -19.8 3.753 -22.137 1.0 62.53 ? 36 A 6 +ATOM 528 C CA . TYR A1 1 36 ? -20.797 3.082 -22.963 1.0 64.44 ? 36 A 6 +ATOM 529 C C . TYR A1 1 36 ? -21.414 1.901 -22.22 1.0 53.42 ? 36 A 6 +ATOM 530 O O . TYR A1 1 36 ? -22.63 1.713 -22.231 1.0 34.33 ? 36 A 6 +ATOM 531 C CB . TYR A1 1 36 ? -20.167 2.603 -24.272 1.0 74.42 ? 36 A 6 +ATOM 532 C CG . TYR A1 1 36 ? -20.506 1.171 -24.619 1.0 43.51 ? 36 A 6 +ATOM 533 C CD1 . TYR A1 1 36 ? -21.768 0.83 -25.089 1.0 62.31 ? 36 A 6 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.565 0.159 -24.475 1.0 22.21 ? 36 A 6 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.083 -0.477 -25.407 1.0 25.24 ? 36 A 6 +ATOM 536 C CE2 . TYR A1 1 36 ? -19.87 -1.151 -24.792 1.0 24.41 ? 36 A 6 +ATOM 537 C CZ . TYR A1 1 36 ? -21.13 -1.464 -25.257 1.0 51.0 ? 36 A 6 +ATOM 538 O OH . TYR A1 1 36 ? -21.439 -2.767 -25.572 1.0 31.41 ? 36 A 6 +ATOM 539 H H . TYR A1 1 36 ? -18.887 3.854 -22.478 1.0 42.53 ? 36 A 6 +ATOM 540 H HA . TYR A1 1 36 ? -21.575 3.796 -23.19 1.0 45.34 ? 36 A 6 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.511 3.23 -25.08 1.0 32.41 ? 36 A 6 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.092 2.681 -24.195 1.0 73.31 ? 36 A 6 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.512 1.605 -25.206 1.0 14.41 ? 36 A 6 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.579 0.408 -24.11 1.0 73.43 ? 36 A 6 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.069 -0.723 -25.771 1.0 30.0 ? 36 A 6 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.125 -1.923 -24.674 1.0 11.1 ? 36 A 6 +ATOM 547 H HH . TYR A1 1 36 ? -20.86 -3.359 -25.086 1.0 20.21 ? 36 A 6 +ATOM 548 N N . ASP A1 1 37 ? -20.565 1.107 -21.576 1.0 31.31 ? 37 A 6 +ATOM 549 C CA . ASP A1 1 37 ? -21.025 -0.056 -20.826 1.0 4.3 ? 37 A 6 +ATOM 550 C C . ASP A1 1 37 ? -21.671 0.367 -19.51 1.0 30.32 ? 37 A 6 +ATOM 551 O O . ASP A1 1 37 ? -22.613 -0.269 -19.036 1.0 62.0 ? 37 A 6 +ATOM 552 C CB . ASP A1 1 37 ? -19.859 -1.007 -20.553 1.0 35.43 ? 37 A 6 +ATOM 553 C CG . ASP A1 1 37 ? -20.303 -2.452 -20.444 1.0 34.32 ? 37 A 6 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.073 -2.767 -19.513 1.0 31.12 ? 37 A 6 +ATOM 555 O OD2 . ASP A1 1 37 ? -19.881 -3.268 -21.29 1.0 3.2 ? 37 A 6 +ATOM 556 H H . ASP A1 1 37 ? -19.606 1.309 -21.605 1.0 51.42 ? 37 A 6 +ATOM 557 H HA . ASP A1 1 37 ? -21.762 -0.568 -21.426 1.0 32.24 ? 37 A 6 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.143 -0.929 -21.358 1.0 43.14 ? 37 A 6 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.382 -0.725 -19.625 1.0 34.23 ? 37 A 6 +ATOM 560 N N . LYS A1 1 38 ? -21.159 1.444 -18.924 1.0 33.03 ? 38 A 6 +ATOM 561 C CA . LYS A1 1 38 ? -21.685 1.953 -17.664 1.0 33.5 ? 38 A 6 +ATOM 562 C C . LYS A1 1 38 ? -23.177 2.251 -17.777 1.0 62.1 ? 38 A 6 +ATOM 563 O O . LYS A1 1 38 ? -23.966 1.844 -16.926 1.0 13.24 ? 38 A 6 +ATOM 564 C CB . LYS A1 1 38 ? -20.932 3.219 -17.247 1.0 32.13 ? 38 A 6 +ATOM 565 C CG . LYS A1 1 38 ? -20.113 3.05 -15.979 1.0 11.13 ? 38 A 6 +ATOM 566 C CD . LYS A1 1 38 ? -18.648 2.796 -16.292 1.0 55.11 ? 38 A 6 +ATOM 567 C CE . LYS A1 1 38 ? -18.368 1.313 -16.484 1.0 12.13 ? 38 A 6 +ATOM 568 N NZ . LYS A1 1 38 ? -17.621 0.736 -15.332 1.0 62.42 ? 38 A 6 +ATOM 569 H H . LYS A1 1 38 ? -20.408 1.909 -19.351 1.0 40.1 ? 38 A 6 +ATOM 570 H HA . LYS A1 1 38 ? -21.538 1.193 -16.912 1.0 13.43 ? 38 A 6 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.265 3.506 -18.046 1.0 53.44 ? 38 A 6 +ATOM 572 H HB3 . LYS A1 1 38 ? -21.648 4.012 -17.085 1.0 74.35 ? 38 A 6 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.193 3.949 -15.387 1.0 72.35 ? 38 A 6 +ATOM 574 H HG3 . LYS A1 1 38 ? -20.503 2.211 -15.419 1.0 65.33 ? 38 A 6 +ATOM 575 H HD2 . LYS A1 1 38 ? -18.386 3.32 -17.199 1.0 31.44 ? 38 A 6 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.045 3.164 -15.474 1.0 51.13 ? 38 A 6 +ATOM 577 H HE2 . LYS A1 1 38 ? -19.308 0.793 -16.59 1.0 72.24 ? 38 A 6 +ATOM 578 H HE3 . LYS A1 1 38 ? -17.782 1.185 -17.383 1.0 52.14 ? 38 A 6 +ATOM 579 H HZ1 . LYS A1 1 38 ? -17.248 -0.202 -15.582 1.0 12.21 ? 38 A 6 +ATOM 580 H HZ2 . LYS A1 1 38 ? -18.252 0.639 -14.51 1.0 31.3 ? 38 A 6 +ATOM 581 H HZ3 . LYS A1 1 38 ? -16.827 1.356 -15.074 1.0 72.13 ? 38 A 6 +ATOM 582 N N . GLU A1 1 39 ? -23.555 2.962 -18.835 1.0 74.33 ? 39 A 6 +ATOM 583 C CA . GLU A1 1 39 ? -24.953 3.312 -19.059 1.0 31.43 ? 39 A 6 +ATOM 584 C C . GLU A1 1 39 ? -25.566 2.436 -20.148 1.0 55.55 ? 39 A 6 +ATOM 585 O O . GLU A1 1 39 ? -26.572 1.764 -19.926 1.0 44.25 ? 39 A 6 +ATOM 586 C CB . GLU A1 1 39 ? -25.076 4.787 -19.447 1.0 31.12 ? 39 A 6 +ATOM 587 C CG . GLU A1 1 39 ? -23.879 5.627 -19.035 1.0 22.34 ? 39 A 6 +ATOM 588 C CD . GLU A1 1 39 ? -23.763 5.781 -17.531 1.0 34.02 ? 39 A 6 +ATOM 589 O OE1 . GLU A1 1 39 ? -23.936 4.772 -16.816 1.0 60.52 ? 39 A 6 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.501 6.911 -17.069 1.0 24.54 ? 39 A 6 +ATOM 591 H H . GLU A1 1 39 ? -22.879 3.258 -19.48 1.0 53.12 ? 39 A 6 +ATOM 592 H HA . GLU A1 1 39 ? -25.488 3.146 -18.137 1.0 24.23 ? 39 A 6 +ATOM 593 H HB2 . GLU A1 1 39 ? -25.188 4.857 -20.519 1.0 13.32 ? 39 A 6 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.956 5.198 -18.975 1.0 53.15 ? 39 A 6 +ATOM 595 H HG2 . GLU A1 1 39 ? -22.98 5.154 -19.403 1.0 73.51 ? 39 A 6 +ATOM 596 H HG3 . GLU A1 1 39 ? -23.974 6.608 -19.477 1.0 55.55 ? 39 A 6 +ATOM 597 N N . GLY A1 1 40 ? -24.951 2.45 -21.327 1.0 41.31 ? 40 A 6 +ATOM 598 C CA . GLY A1 1 40 ? -25.449 1.654 -22.433 1.0 23.2 ? 40 A 6 +ATOM 599 C C . GLY A1 1 40 ? -25.756 2.492 -23.658 1.0 54.31 ? 40 A 6 +ATOM 600 O O . GLY A1 1 40 ? -26.808 2.335 -24.278 1.0 62.35 ? 40 A 6 +ATOM 601 H H . GLY A1 1 40 ? -24.152 3.005 -21.446 1.0 1.31 ? 40 A 6 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.708 0.913 -22.692 1.0 42.33 ? 40 A 6 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.353 1.15 -22.121 1.0 42.25 ? 40 A 6 +ATOM 604 N N . ILE A1 1 41 ? -24.836 3.384 -24.008 1.0 11.45 ? 41 A 6 +ATOM 605 C CA . ILE A1 1 41 ? -25.014 4.25 -25.167 1.0 13.21 ? 41 A 6 +ATOM 606 C C . ILE A1 1 41 ? -23.796 4.199 -26.084 1.0 73.14 ? 41 A 6 +ATOM 607 O O . ILE A1 1 41 ? -22.696 3.828 -25.675 1.0 54.03 ? 41 A 6 +ATOM 608 C CB . ILE A1 1 41 ? -25.263 5.711 -24.745 1.0 13.54 ? 41 A 6 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.421 6.061 -23.517 1.0 35.25 ? 41 A 6 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.741 5.935 -24.462 1.0 15.54 ? 41 A 6 +ATOM 611 C CD1 . ILE A1 1 41 ? -24.551 7.506 -23.087 1.0 51.21 ? 41 A 6 +ATOM 612 H H . ILE A1 1 41 ? -24.018 3.462 -23.474 1.0 10.31 ? 41 A 6 +ATOM 613 H HA . ILE A1 1 41 ? -25.878 3.902 -25.713 1.0 22.4 ? 41 A 6 +ATOM 614 H HB . ILE A1 1 41 ? -24.977 6.352 -25.564 1.0 2.22 ? 41 A 6 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.727 5.441 -22.689 1.0 53.25 ? 41 A 6 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.38 5.872 -23.738 1.0 73.21 ? 41 A 6 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.928 5.811 -23.406 1.0 41.34 ? 41 A 6 +ATOM 618 H HG22 . ILE A1 1 41 ? -27.017 6.935 -24.76 1.0 35.01 ? 41 A 6 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.327 5.219 -25.018 1.0 24.24 ? 41 A 6 +ATOM 620 H HD11 . ILE A1 1 41 ? -25.383 7.961 -23.604 1.0 13.35 ? 41 A 6 +ATOM 621 H HD12 . ILE A1 1 41 ? -24.722 7.551 -22.022 1.0 5.02 ? 41 A 6 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.643 8.037 -23.33 1.0 73.01 ? 41 A 6 +ATOM 623 N N . PRO A1 1 42 ? -23.996 4.581 -27.354 1.0 42.01 ? 42 A 6 +ATOM 624 C CA . PRO A1 1 42 ? -22.925 4.59 -28.355 1.0 63.34 ? 42 A 6 +ATOM 625 C C . PRO A1 1 42 ? -21.89 5.676 -28.088 1.0 4.23 ? 42 A 6 +ATOM 626 O O . PRO A1 1 42 ? -22.198 6.868 -28.059 1.0 21.54 ? 42 A 6 +ATOM 627 C CB . PRO A1 1 42 ? -23.667 4.868 -29.665 1.0 63.45 ? 42 A 6 +ATOM 628 C CG . PRO A1 1 42 ? -24.902 5.593 -29.254 1.0 31.23 ? 42 A 6 +ATOM 629 C CD . PRO A1 1 42 ? -25.282 5.035 -27.91 1.0 52.22 ? 42 A 6 +ATOM 630 H HA . PRO A1 1 42 ? -22.432 3.631 -28.416 1.0 60.32 ? 42 A 6 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.048 5.476 -30.31 1.0 50.23 ? 42 A 6 +ATOM 632 H HB3 . PRO A1 1 42 ? -23.901 3.936 -30.156 1.0 64.01 ? 42 A 6 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.7 6.65 -29.177 1.0 0.11 ? 42 A 6 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.69 5.411 -29.97 1.0 1.1 ? 42 A 6 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.719 5.805 -27.292 1.0 11.32 ? 42 A 6 +ATOM 636 H HD3 . PRO A1 1 42 ? -25.965 4.207 -28.024 1.0 34.03 ? 42 A 6 +ATOM 637 N N . PRO A1 1 43 ? -20.631 5.259 -27.887 1.0 1.41 ? 43 A 6 +ATOM 638 C CA . PRO A1 1 43 ? -19.524 6.182 -27.619 1.0 62.53 ? 43 A 6 +ATOM 639 C C . PRO A1 1 43 ? -19.157 7.017 -28.841 1.0 21.35 ? 43 A 6 +ATOM 640 O O . PRO A1 1 43 ? -18.964 8.229 -28.742 1.0 73.42 ? 43 A 6 +ATOM 641 C CB . PRO A1 1 43 ? -18.37 5.251 -27.24 1.0 74.43 ? 43 A 6 +ATOM 642 C CG . PRO A1 1 43 ? -18.691 3.958 -27.907 1.0 42.11 ? 43 A 6 +ATOM 643 C CD . PRO A1 1 43 ? -20.191 3.854 -27.906 1.0 32.53 ? 43 A 6 +ATOM 644 H HA . PRO A1 1 43 ? -19.747 6.838 -26.79 1.0 3.1 ? 43 A 6 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.438 5.663 -27.602 1.0 1.2 ? 43 A 6 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.328 5.142 -26.167 1.0 52.2 ? 43 A 6 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.316 3.964 -28.919 1.0 21.5 ? 43 A 6 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.259 3.141 -27.349 1.0 41.32 ? 43 A 6 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.535 3.355 -28.8 1.0 55.24 ? 43 A 6 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.533 3.332 -27.025 1.0 31.14 ? 43 A 6 +ATOM 651 N N . ASP A1 1 44 ? -19.061 6.361 -29.992 1.0 54.12 ? 44 A 6 +ATOM 652 C CA . ASP A1 1 44 ? -18.718 7.043 -31.235 1.0 51.34 ? 44 A 6 +ATOM 653 C C . ASP A1 1 44 ? -19.763 8.099 -31.581 1.0 65.34 ? 44 A 6 +ATOM 654 O O . ASP A1 1 44 ? -19.509 8.995 -32.387 1.0 41.23 ? 44 A 6 +ATOM 655 C CB . ASP A1 1 44 ? -18.596 6.035 -32.378 1.0 23.35 ? 44 A 6 +ATOM 656 C CG . ASP A1 1 44 ? -17.721 6.542 -33.507 1.0 52.14 ? 44 A 6 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.86 7.408 -33.246 1.0 70.43 ? 44 A 6 +ATOM 658 O OD2 . ASP A1 1 44 ? -17.897 6.075 -34.652 1.0 15.14 ? 44 A 6 +ATOM 659 H H . ASP A1 1 44 ? -19.227 5.395 -30.007 1.0 64.31 ? 44 A 6 +ATOM 660 H HA . ASP A1 1 44 ? -17.765 7.53 -31.093 1.0 72.42 ? 44 A 6 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.166 5.119 -31.998 1.0 64.21 ? 44 A 6 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.58 5.828 -32.774 1.0 74.33 ? 44 A 6 +ATOM 663 N N . GLN A1 1 45 ? -20.936 7.987 -30.967 1.0 24.51 ? 45 A 6 +ATOM 664 C CA . GLN A1 1 45 ? -22.019 8.932 -31.213 1.0 55.1 ? 45 A 6 +ATOM 665 C C . GLN A1 1 45 ? -21.949 10.105 -30.24 1.0 65.33 ? 45 A 6 +ATOM 666 O O . GLN A1 1 45 ? -22.631 11.114 -30.421 1.0 0.12 ? 45 A 6 +ATOM 667 C CB . GLN A1 1 45 ? -23.374 8.232 -31.089 1.0 3.33 ? 45 A 6 +ATOM 668 C CG . GLN A1 1 45 ? -23.844 7.585 -32.381 1.0 71.05 ? 45 A 6 +ATOM 669 C CD . GLN A1 1 45 ? -25.009 6.638 -32.17 1.0 50.21 ? 45 A 6 +ATOM 670 O OE1 . GLN A1 1 45 ? -26.056 7.029 -31.652 1.0 30.33 ? 45 A 6 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.834 5.384 -32.569 1.0 54.11 ? 45 A 6 +ATOM 672 H H . GLN A1 1 45 ? -21.077 7.252 -30.336 1.0 33.14 ? 45 A 6 +ATOM 673 H HA . GLN A1 1 45 ? -21.91 9.308 -32.219 1.0 54.13 ? 45 A 6 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.301 7.465 -30.333 1.0 72.22 ? 45 A 6 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.114 8.957 -30.785 1.0 51.24 ? 45 A 6 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.151 8.361 -33.067 1.0 11.31 ? 45 A 6 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.023 7.031 -32.811 1.0 33.23 ? 45 A 6 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.973 5.143 -32.972 1.0 35.4 ? 45 A 6 +ATOM 679 H HE22 . GLN A1 1 45 ? -25.57 4.751 -32.444 1.0 53.4 ? 45 A 6 +ATOM 680 N N . GLN A1 1 46 ? -21.122 9.964 -29.21 1.0 5.34 ? 46 A 6 +ATOM 681 C CA . GLN A1 1 46 ? -20.965 11.012 -28.208 1.0 54.21 ? 46 A 6 +ATOM 682 C C . GLN A1 1 46 ? -19.537 11.548 -28.2 1.0 23.33 ? 46 A 6 +ATOM 683 O O . GLN A1 1 46 ? -18.598 10.846 -28.579 1.0 42.0 ? 46 A 6 +ATOM 684 C CB . GLN A1 1 46 ? -21.33 10.481 -26.821 1.0 54.1 ? 46 A 6 +ATOM 685 C CG . GLN A1 1 46 ? -20.554 9.236 -26.423 1.0 63.33 ? 46 A 6 +ATOM 686 C CD . GLN A1 1 46 ? -20.509 9.032 -24.921 1.0 73.34 ? 46 A 6 +ATOM 687 O OE1 . GLN A1 1 46 ? -21.546 8.981 -24.259 1.0 62.34 ? 46 A 6 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.304 8.915 -24.375 1.0 52.51 ? 46 A 6 +ATOM 689 H H . GLN A1 1 46 ? -20.606 9.136 -29.12 1.0 61.13 ? 46 A 6 +ATOM 690 H HA . GLN A1 1 46 ? -21.636 11.818 -28.463 1.0 1.54 ? 46 A 6 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.134 11.251 -26.09 1.0 70.34 ? 46 A 6 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.383 10.241 -26.807 1.0 24.41 ? 46 A 6 +ATOM 693 H HG2 . GLN A1 1 46 ? -21.023 8.374 -26.873 1.0 71.34 ? 46 A 6 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.542 9.326 -26.789 1.0 12.44 ? 46 A 6 +ATOM 695 H HE21 . GLN A1 1 46 ? -18.522 8.967 -24.964 1.0 61.21 ? 46 A 6 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.246 8.783 -23.406 1.0 54.41 ? 46 A 6 +ATOM 697 N N . ARG A1 1 47 ? -19.38 12.794 -27.768 1.0 11.31 ? 47 A 6 +ATOM 698 C CA . ARG A1 1 47 ? -18.066 13.424 -27.712 1.0 74.42 ? 47 A 6 +ATOM 699 C C . ARG A1 1 47 ? -17.878 14.174 -26.397 1.0 0.05 ? 47 A 6 +ATOM 700 O O . ARG A1 1 47 ? -18.842 14.439 -25.677 1.0 62.43 ? 47 A 6 +ATOM 701 C CB . ARG A1 1 47 ? -17.888 14.385 -28.889 1.0 53.24 ? 47 A 6 +ATOM 702 C CG . ARG A1 1 47 ? -18.192 13.757 -30.24 1.0 25.13 ? 47 A 6 +ATOM 703 C CD . ARG A1 1 47 ? -18.32 14.811 -31.328 1.0 74.31 ? 47 A 6 +ATOM 704 N NE . ARG A1 1 47 ? -19.698 15.266 -31.491 1.0 72.02 ? 47 A 6 +ATOM 705 C CZ . ARG A1 1 47 ? -20.045 16.308 -32.239 1.0 4.33 ? 47 A 6 +ATOM 706 N NH1 . ARG A1 1 47 ? -19.119 16.998 -32.889 1.0 22.33 ? 47 A 6 +ATOM 707 N NH2 . ARG A1 1 47 ? -21.32 16.66 -32.337 1.0 24.44 ? 47 A 6 +ATOM 708 H H . ARG A1 1 47 ? -20.166 13.303 -27.48 1.0 14.32 ? 47 A 6 +ATOM 709 H HA . ARG A1 1 47 ? -17.321 12.645 -27.779 1.0 52.1 ? 47 A 6 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.547 15.229 -28.753 1.0 12.43 ? 47 A 6 +ATOM 711 H HB3 . ARG A1 1 47 ? -16.866 14.735 -28.901 1.0 31.22 ? 47 A 6 +ATOM 712 H HG2 . ARG A1 1 47 ? -17.391 13.082 -30.501 1.0 2.15 ? 47 A 6 +ATOM 713 H HG3 . ARG A1 1 47 ? -19.119 13.209 -30.17 1.0 3.22 ? 47 A 6 +ATOM 714 H HD2 . ARG A1 1 47 ? -17.701 15.657 -31.067 1.0 62.34 ? 47 A 6 +ATOM 715 H HD3 . ARG A1 1 47 ? -17.977 14.389 -32.261 1.0 4.32 ? 47 A 6 +ATOM 716 H HE . ARG A1 1 47 ? -20.398 14.77 -31.019 1.0 51.12 ? 47 A 6 +ATOM 717 H HH11 . ARG A1 1 47 ? -18.157 16.735 -32.818 1.0 35.02 ? 47 A 6 +ATOM 718 H HH12 . ARG A1 1 47 ? -19.383 17.782 -33.453 1.0 42.25 ? 47 A 6 +ATOM 719 H HH21 . ARG A1 1 47 ? -22.021 16.141 -31.848 1.0 32.54 ? 47 A 6 +ATOM 720 H HH22 . ARG A1 1 47 ? -21.58 17.444 -32.9 1.0 51.04 ? 47 A 6 +ATOM 721 N N . LEU A1 1 48 ? -16.631 14.513 -26.088 1.0 13.42 ? 48 A 6 +ATOM 722 C CA . LEU A1 1 48 ? -16.315 15.232 -24.859 1.0 63.04 ? 48 A 6 +ATOM 723 C C . LEU A1 1 48 ? -16.037 16.704 -25.145 1.0 70.54 ? 48 A 6 +ATOM 724 O O . LEU A1 1 48 ? -15.493 17.05 -26.195 1.0 13.22 ? 48 A 6 +ATOM 725 C CB . LEU A1 1 48 ? -15.106 14.597 -24.17 1.0 73.22 ? 48 A 6 +ATOM 726 C CG . LEU A1 1 48 ? -14.989 13.077 -24.285 1.0 23.01 ? 48 A 6 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.355 12.424 -24.139 1.0 2.23 ? 48 A 6 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.35 12.69 -25.61 1.0 62.5 ? 48 A 6 +ATOM 729 H H . LEU A1 1 48 ? -15.905 14.274 -26.701 1.0 13.1 ? 48 A 6 +ATOM 730 H HA . LEU A1 1 48 ? -17.171 15.16 -24.204 1.0 5.14 ? 48 A 6 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.216 15.03 -24.599 1.0 14.35 ? 48 A 6 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.156 14.848 -23.12 1.0 62.22 ? 48 A 6 +ATOM 733 H HG . LEU A1 1 48 ? -14.358 12.709 -23.488 1.0 74.12 ? 48 A 6 +ATOM 734 H HD11 . LEU A1 1 48 ? -16.781 12.259 -25.117 1.0 72.12 ? 48 A 6 +ATOM 735 H HD12 . LEU A1 1 48 ? -17.005 13.071 -23.569 1.0 51.52 ? 48 A 6 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.25 11.479 -23.627 1.0 50.13 ? 48 A 6 +ATOM 737 H HD21 . LEU A1 1 48 ? -13.721 13.497 -25.956 1.0 32.51 ? 48 A 6 +ATOM 738 H HD22 . LEU A1 1 48 ? -15.123 12.497 -26.34 1.0 4.35 ? 48 A 6 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.753 11.799 -25.475 1.0 44.23 ? 48 A 6 +ATOM 740 N N . ILE A1 1 49 ? -16.411 17.565 -24.205 1.0 13.31 ? 49 A 6 +ATOM 741 C CA . ILE A1 1 49 ? -16.198 18.999 -24.356 1.0 13.25 ? 49 A 6 +ATOM 742 C C . ILE A1 1 49 ? -15.745 19.628 -23.043 1.0 73.24 ? 49 A 6 +ATOM 743 O O . ILE A1 1 49 ? -16.413 19.5 -22.017 1.0 20.41 ? 49 A 6 +ATOM 744 C CB . ILE A1 1 49 ? -17.476 19.71 -24.838 1.0 42.12 ? 49 A 6 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.522 19.742 -26.367 1.0 21.4 ? 49 A 6 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.544 21.121 -24.271 1.0 44.11 ? 49 A 6 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.837 19.263 -26.942 1.0 30.32 ? 49 A 6 +ATOM 748 H H . ILE A1 1 49 ? -16.839 17.228 -23.391 1.0 11.12 ? 49 A 6 +ATOM 749 H HA . ILE A1 1 49 ? -15.427 19.146 -25.098 1.0 31.54 ? 49 A 6 +ATOM 750 H HB . ILE A1 1 49 ? -18.329 19.16 -24.471 1.0 10.22 ? 49 A 6 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.362 20.754 -26.705 1.0 52.53 ? 49 A 6 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.738 19.108 -26.756 1.0 23.14 ? 49 A 6 +ATOM 753 H HG21 . ILE A1 1 49 ? -17.833 21.077 -23.232 1.0 54.41 ? 49 A 6 +ATOM 754 H HG22 . ILE A1 1 49 ? -16.574 21.588 -24.355 1.0 2.4 ? 49 A 6 +ATOM 755 H HG23 . ILE A1 1 49 ? -18.271 21.697 -24.824 1.0 53.42 ? 49 A 6 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.449 18.855 -26.15 1.0 43.14 ? 49 A 6 +ATOM 757 H HD12 . ILE A1 1 49 ? -19.352 20.093 -27.403 1.0 61.33 ? 49 A 6 +ATOM 758 H HD13 . ILE A1 1 49 ? -18.65 18.499 -27.681 1.0 3.14 ? 49 A 6 +ATOM 759 N N . PHE A1 1 50 ? -14.605 20.311 -23.082 1.0 0.44 ? 50 A 6 +ATOM 760 C CA . PHE A1 1 50 ? -14.062 20.962 -21.896 1.0 63.4 ? 50 A 6 +ATOM 761 C C . PHE A1 1 50 ? -13.76 22.431 -22.172 1.0 34.31 ? 50 A 6 +ATOM 762 O O . PHE A1 1 50 ? -13.02 22.761 -23.098 1.0 24.03 ? 50 A 6 +ATOM 763 C CB . PHE A1 1 50 ? -12.792 20.246 -21.432 1.0 1.31 ? 50 A 6 +ATOM 764 C CG . PHE A1 1 50 ? -12.409 20.562 -20.014 1.0 63.44 ? 50 A 6 +ATOM 765 C CD1 . PHE A1 1 50 ? -11.849 21.787 -19.691 1.0 63.22 ? 50 A 6 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.611 19.634 -19.006 1.0 31.12 ? 50 A 6 +ATOM 767 C CE1 . PHE A1 1 50 ? -11.495 22.079 -18.387 1.0 44.05 ? 50 A 6 +ATOM 768 C CE2 . PHE A1 1 50 ? -12.259 19.921 -17.7 1.0 53.14 ? 50 A 6 +ATOM 769 C CZ . PHE A1 1 50 ? -11.702 21.146 -17.39 1.0 64.24 ? 50 A 6 +ATOM 770 H H . PHE A1 1 50 ? -14.118 20.378 -23.93 1.0 32.43 ? 50 A 6 +ATOM 771 H HA . PHE A1 1 50 ? -14.805 20.9 -21.116 1.0 55.42 ? 50 A 6 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.941 19.179 -21.505 1.0 72.21 ? 50 A 6 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.971 20.535 -22.071 1.0 52.42 ? 50 A 6 +ATOM 774 H HD1 . PHE A1 1 50 ? -11.687 22.518 -20.469 1.0 64.41 ? 50 A 6 +ATOM 775 H HD2 . PHE A1 1 50 ? -13.047 18.675 -19.247 1.0 25.0 ? 50 A 6 +ATOM 776 H HE1 . PHE A1 1 50 ? -11.06 23.038 -18.147 1.0 33.34 ? 50 A 6 +ATOM 777 H HE2 . PHE A1 1 50 ? -12.423 19.188 -16.923 1.0 34.14 ? 50 A 6 +ATOM 778 H HZ . PHE A1 1 50 ? -11.426 21.372 -16.371 1.0 42.2 ? 50 A 6 +ATOM 779 N N . GLY A1 1 51 ? -14.338 23.311 -21.36 1.0 53.44 ? 51 A 6 +ATOM 780 C CA . GLY A1 1 51 ? -14.12 24.736 -21.533 1.0 33.5 ? 51 A 6 +ATOM 781 C C . GLY A1 1 51 ? -14.716 25.261 -22.824 1.0 34.32 ? 51 A 6 +ATOM 782 O O . GLY A1 1 51 ? -14.472 26.404 -23.209 1.0 0.02 ? 51 A 6 +ATOM 783 H H . GLY A1 1 51 ? -14.918 22.991 -20.638 1.0 14.34 ? 51 A 6 +ATOM 784 H HA2 . GLY A1 1 51 ? -14.566 25.261 -20.702 1.0 71.3 ? 51 A 6 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.057 24.927 -21.538 1.0 2.33 ? 51 A 6 +ATOM 786 N N . GLY A1 1 52 ? -15.5 24.424 -23.496 1.0 51.33 ? 52 A 6 +ATOM 787 C CA . GLY A1 1 52 ? -16.119 24.828 -24.745 1.0 70.11 ? 52 A 6 +ATOM 788 C C . GLY A1 1 52 ? -15.563 24.076 -25.938 1.0 64.35 ? 52 A 6 +ATOM 789 O O . GLY A1 1 52 ? -16.265 23.856 -26.925 1.0 21.12 ? 52 A 6 +ATOM 790 H H . GLY A1 1 52 ? -15.66 23.524 -23.141 1.0 52.33 ? 52 A 6 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.182 24.647 -24.682 1.0 34.31 ? 52 A 6 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.952 25.885 -24.891 1.0 33.12 ? 52 A 6 +ATOM 793 N N . LYS A1 1 53 ? -14.298 23.681 -25.848 1.0 4.12 ? 53 A 6 +ATOM 794 C CA . LYS A1 1 53 ? -13.646 22.949 -26.928 1.0 20.15 ? 53 A 6 +ATOM 795 C C . LYS A1 1 53 ? -13.742 21.444 -26.701 1.0 12.34 ? 53 A 6 +ATOM 796 O O . LYS A1 1 53 ? -13.732 20.978 -25.563 1.0 53.3 ? 53 A 6 +ATOM 797 C CB . LYS A1 1 53 ? -12.178 23.366 -27.041 1.0 12.13 ? 53 A 6 +ATOM 798 C CG . LYS A1 1 53 ? -11.412 23.252 -25.734 1.0 34.42 ? 53 A 6 +ATOM 799 C CD . LYS A1 1 53 ? -10.759 21.888 -25.587 1.0 44.0 ? 53 A 6 +ATOM 800 C CE . LYS A1 1 53 ? -9.688 21.666 -26.643 1.0 75.53 ? 53 A 6 +ATOM 801 N NZ . LYS A1 1 53 ? -8.476 21.012 -26.076 1.0 61.53 ? 53 A 6 +ATOM 802 H H . LYS A1 1 53 ? -13.79 23.885 -25.035 1.0 32.12 ? 53 A 6 +ATOM 803 H HA . LYS A1 1 53 ? -14.153 23.196 -27.849 1.0 74.23 ? 53 A 6 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.693 22.738 -27.774 1.0 34.02 ? 53 A 6 +ATOM 805 H HB3 . LYS A1 1 53 ? -12.132 24.393 -27.372 1.0 32.22 ? 53 A 6 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.643 24.011 -25.71 1.0 24.24 ? 53 A 6 +ATOM 807 H HG3 . LYS A1 1 53 ? -12.096 23.405 -24.912 1.0 53.0 ? 53 A 6 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.305 21.819 -24.61 1.0 22.42 ? 53 A 6 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.517 21.124 -25.688 1.0 0.05 ? 53 A 6 +ATOM 810 H HE2 . LYS A1 1 53 ? -10.093 21.038 -27.422 1.0 25.2 ? 53 A 6 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.409 22.622 -27.061 1.0 75.24 ? 53 A 6 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.837 21.729 -25.677 1.0 1.33 ? 53 A 6 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.972 20.488 -26.819 1.0 14.14 ? 53 A 6 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.748 20.348 -25.323 1.0 31.25 ? 53 A 6 +ATOM 815 N N . GLN A1 1 54 ? -13.834 20.69 -27.792 1.0 32.1 ? 54 A 6 +ATOM 816 C CA . GLN A1 1 54 ? -13.932 19.238 -27.711 1.0 3.14 ? 54 A 6 +ATOM 817 C C . GLN A1 1 54 ? -12.615 18.63 -27.24 1.0 14.5 ? 54 A 6 +ATOM 818 O O . GLN A1 1 54 ? -11.603 19.323 -27.13 1.0 22.04 ? 54 A 6 +ATOM 819 C CB . GLN A1 1 54 ? -14.319 18.654 -29.071 1.0 14.03 ? 54 A 6 +ATOM 820 C CG . GLN A1 1 54 ? -15.71 18.043 -29.097 1.0 52.41 ? 54 A 6 +ATOM 821 C CD . GLN A1 1 54 ? -16.155 17.662 -30.495 1.0 44.23 ? 54 A 6 +ATOM 822 O OE1 . GLN A1 1 54 ? -17.159 18.165 -30.999 1.0 25.33 ? 54 A 6 +ATOM 823 N NE2 . GLN A1 1 54 ? -15.406 16.768 -31.131 1.0 63.1 ? 54 A 6 +ATOM 824 H H . GLN A1 1 54 ? -13.838 21.121 -28.672 1.0 52.11 ? 54 A 6 +ATOM 825 H HA . GLN A1 1 54 ? -14.702 18.997 -26.994 1.0 62.04 ? 54 A 6 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.28 19.44 -29.811 1.0 31.24 ? 54 A 6 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.607 17.886 -29.336 1.0 25.42 ? 54 A 6 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.711 17.155 -28.481 1.0 52.11 ? 54 A 6 +ATOM 829 H HG3 . GLN A1 1 54 ? -16.411 18.759 -28.694 1.0 53.52 ? 54 A 6 +ATOM 830 H HE21 . GLN A1 1 54 ? -14.621 16.408 -30.667 1.0 45.55 ? 54 A 6 +ATOM 831 H HE22 . GLN A1 1 54 ? -15.671 16.503 -32.036 1.0 62.42 ? 54 A 6 +ATOM 832 N N . LEU A1 1 55 ? -12.635 17.331 -26.962 1.0 51.34 ? 55 A 6 +ATOM 833 C CA . LEU A1 1 55 ? -11.442 16.629 -26.502 1.0 40.45 ? 55 A 6 +ATOM 834 C C . LEU A1 1 55 ? -11.109 15.459 -27.423 1.0 63.5 ? 55 A 6 +ATOM 835 O O . LEU A1 1 55 ? -11.963 14.621 -27.71 1.0 52.11 ? 55 A 6 +ATOM 836 C CB . LEU A1 1 55 ? -11.642 16.125 -25.071 1.0 25.03 ? 55 A 6 +ATOM 837 C CG . LEU A1 1 55 ? -12.2 17.141 -24.074 1.0 41.33 ? 55 A 6 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.22 16.557 -22.671 1.0 33.24 ? 55 A 6 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.384 18.425 -24.108 1.0 52.23 ? 55 A 6 +ATOM 840 H H . LEU A1 1 55 ? -13.47 16.831 -27.068 1.0 12.34 ? 55 A 6 +ATOM 841 H HA . LEU A1 1 55 ? -10.619 17.328 -26.517 1.0 22.21 ? 55 A 6 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.323 15.289 -25.107 1.0 55.1 ? 55 A 6 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.683 15.791 -24.702 1.0 51.11 ? 55 A 6 +ATOM 844 H HG . LEU A1 1 55 ? -13.218 17.384 -24.349 1.0 72.12 ? 55 A 6 +ATOM 845 H HD11 . LEU A1 1 55 ? -13.19 16.127 -22.474 1.0 32.04 ? 55 A 6 +ATOM 846 H HD12 . LEU A1 1 55 ? -12.02 17.338 -21.952 1.0 44.35 ? 55 A 6 +ATOM 847 H HD13 . LEU A1 1 55 ? -11.463 15.791 -22.589 1.0 32.21 ? 55 A 6 +ATOM 848 H HD21 . LEU A1 1 55 ? -11.879 19.15 -24.736 1.0 33.14 ? 55 A 6 +ATOM 849 H HD22 . LEU A1 1 55 ? -10.401 18.216 -24.504 1.0 72.01 ? 55 A 6 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.292 18.819 -23.106 1.0 74.33 ? 55 A 6 +ATOM 851 N N . GLU A1 1 56 ? -9.862 15.408 -27.88 1.0 12.02 ? 56 A 6 +ATOM 852 C CA . GLU A1 1 56 ? -9.417 14.34 -28.767 1.0 31.33 ? 56 A 6 +ATOM 853 C C . GLU A1 1 56 ? -9.426 12.995 -28.047 1.0 62.51 ? 56 A 6 +ATOM 854 O O . GLU A1 1 56 ? -9.791 12.91 -26.874 1.0 51.02 ? 56 A 6 +ATOM 855 C CB . GLU A1 1 56 ? -8.013 14.638 -29.297 1.0 62.01 ? 56 A 6 +ATOM 856 C CG . GLU A1 1 56 ? -7.832 14.301 -30.767 1.0 21.02 ? 56 A 6 +ATOM 857 C CD . GLU A1 1 56 ? -7.948 15.519 -31.663 1.0 1.0 ? 56 A 6 +ATOM 858 O OE1 . GLU A1 1 56 ? -8.495 16.544 -31.205 1.0 61.34 ? 56 A 6 +ATOM 859 O OE2 . GLU A1 1 56 ? -7.492 15.446 -32.824 1.0 22.01 ? 56 A 6 +ATOM 860 H H . GLU A1 1 56 ? -9.227 16.106 -27.616 1.0 72.43 ? 56 A 6 +ATOM 861 H HA . GLU A1 1 56 ? -10.103 14.293 -29.6 1.0 4.21 ? 56 A 6 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.805 15.689 -29.161 1.0 41.11 ? 56 A 6 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.298 14.063 -28.727 1.0 51.02 ? 56 A 6 +ATOM 864 H HG2 . GLU A1 1 56 ? -6.855 13.863 -30.906 1.0 71.31 ? 56 A 6 +ATOM 865 H HG3 . GLU A1 1 56 ? -8.59 13.587 -31.055 1.0 60.44 ? 56 A 6 +ATOM 866 N N . ASP A1 1 57 ? -9.023 11.947 -28.757 1.0 71.03 ? 57 A 6 +ATOM 867 C CA . ASP A1 1 57 ? -8.984 10.606 -28.186 1.0 63.41 ? 57 A 6 +ATOM 868 C C . ASP A1 1 57 ? -7.845 10.477 -27.179 1.0 21.4 ? 57 A 6 +ATOM 869 O O . ASP A1 1 57 ? -7.837 9.568 -26.349 1.0 43.31 ? 57 A 6 +ATOM 870 C CB . ASP A1 1 57 ? -8.823 9.562 -29.292 1.0 45.31 ? 57 A 6 +ATOM 871 C CG . ASP A1 1 57 ? -9.736 9.826 -30.474 1.0 55.43 ? 57 A 6 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.811 10.428 -30.27 1.0 72.35 ? 57 A 6 +ATOM 873 O OD2 . ASP A1 1 57 ? -9.376 9.429 -31.602 1.0 15.11 ? 57 A 6 +ATOM 874 H H . ASP A1 1 57 ? -8.744 12.079 -29.687 1.0 23.12 ? 57 A 6 +ATOM 875 H HA . ASP A1 1 57 ? -9.92 10.435 -27.675 1.0 62.14 ? 57 A 6 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.801 9.572 -29.642 1.0 24.44 ? 57 A 6 +ATOM 877 H HB3 . ASP A1 1 57 ? -9.054 8.586 -28.893 1.0 64.03 ? 57 A 6 +ATOM 878 N N . SER A1 1 58 ? -6.884 11.392 -27.26 1.0 32.51 ? 58 A 6 +ATOM 879 C CA . SER A1 1 58 ? -5.738 11.378 -26.359 1.0 62.24 ? 58 A 6 +ATOM 880 C C . SER A1 1 58 ? -5.803 12.544 -25.377 1.0 2.12 ? 58 A 6 +ATOM 881 O O . SER A1 1 58 ? -4.889 12.751 -24.581 1.0 12.21 ? 58 A 6 +ATOM 882 C CB . SER A1 1 58 ? -4.434 11.441 -27.157 1.0 65.11 ? 58 A 6 +ATOM 883 O OG . SER A1 1 58 ? -3.307 11.365 -26.301 1.0 34.21 ? 58 A 6 +ATOM 884 H H . SER A1 1 58 ? -6.947 12.092 -27.943 1.0 21.03 ? 58 A 6 +ATOM 885 H HA . SER A1 1 58 ? -5.765 10.453 -25.802 1.0 33.55 ? 58 A 6 +ATOM 886 H HB2 . SER A1 1 58 ? -4.4 10.615 -27.851 1.0 31.42 ? 58 A 6 +ATOM 887 H HB3 . SER A1 1 58 ? -4.394 12.372 -27.703 1.0 40.4 ? 58 A 6 +ATOM 888 H HG . SER A1 1 58 ? -3.471 10.715 -25.613 1.0 10.23 ? 58 A 6 +ATOM 889 N N . ASN A1 1 59 ? -6.892 13.303 -25.442 1.0 35.41 ? 59 A 6 +ATOM 890 C CA . ASN A1 1 59 ? -7.078 14.45 -24.561 1.0 52.34 ? 59 A 6 +ATOM 891 C C . ASN A1 1 59 ? -7.559 14.004 -23.183 1.0 4.01 ? 59 A 6 +ATOM 892 O O . ASN A1 1 59 ? -8.757 14.015 -22.899 1.0 42.21 ? 59 A 6 +ATOM 893 C CB . ASN A1 1 59 ? -8.081 15.431 -25.171 1.0 21.1 ? 59 A 6 +ATOM 894 C CG . ASN A1 1 59 ? -7.411 16.478 -26.039 1.0 14.54 ? 59 A 6 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.497 16.172 -26.805 1.0 24.42 ? 59 A 6 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.864 17.721 -25.924 1.0 14.44 ? 59 A 6 +ATOM 897 H H . ASN A1 1 59 ? -7.587 13.088 -26.099 1.0 5.51 ? 59 A 6 +ATOM 898 H HA . ASN A1 1 59 ? -6.124 14.944 -24.454 1.0 74.51 ? 59 A 6 +ATOM 899 H HB2 . ASN A1 1 59 ? -8.786 14.884 -25.78 1.0 43.43 ? 59 A 6 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.612 15.934 -24.377 1.0 11.21 ? 59 A 6 +ATOM 901 H HD21 . ASN A1 1 59 ? -8.595 17.891 -25.293 1.0 21.33 ? 59 A 6 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.449 18.417 -26.474 1.0 12.0 ? 59 A 6 +ATOM 903 N N . ALA A1 1 60 ? -6.617 13.614 -22.331 1.0 13.11 ? 60 A 6 +ATOM 904 C CA . ALA A1 1 60 ? -6.944 13.167 -20.983 1.0 35.51 ? 60 A 6 +ATOM 905 C C . ALA A1 1 60 ? -5.68 12.878 -20.179 1.0 74.01 ? 60 A 6 +ATOM 906 O O . ALA A1 1 60 ? -5.165 13.75 -19.48 1.0 74.24 ? 60 A 6 +ATOM 907 C CB . ALA A1 1 60 ? -7.832 11.933 -21.036 1.0 64.13 ? 60 A 6 +ATOM 908 H H . ALA A1 1 60 ? -5.68 13.628 -22.616 1.0 31.12 ? 60 A 6 +ATOM 909 H HA . ALA A1 1 60 ? -7.496 13.957 -20.494 1.0 20.01 ? 60 A 6 +ATOM 910 H HB1 . ALA A1 1 60 ? -7.398 11.207 -21.708 1.0 72.33 ? 60 A 6 +ATOM 911 H HB2 . ALA A1 1 60 ? -7.914 11.506 -20.048 1.0 25.02 ? 60 A 6 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.813 12.211 -21.391 1.0 51.02 ? 60 A 6 +ATOM 913 N N . MET A1 1 61 ? -5.188 11.648 -20.282 1.0 21.52 ? 61 A 6 +ATOM 914 C CA . MET A1 1 61 ? -3.984 11.244 -19.565 1.0 32.03 ? 61 A 6 +ATOM 915 C C . MET A1 1 61 ? -2.826 12.188 -19.872 1.0 55.14 ? 61 A 6 +ATOM 916 O O . MET A1 1 61 ? -2.168 12.694 -18.963 1.0 73.23 ? 61 A 6 +ATOM 917 C CB . MET A1 1 61 ? -3.6 9.81 -19.935 1.0 33.12 ? 61 A 6 +ATOM 918 C CG . MET A1 1 61 ? -3.906 9.454 -21.381 1.0 10.31 ? 61 A 6 +ATOM 919 S SD . MET A1 1 61 ? -2.628 8.424 -22.128 1.0 3.45 ? 61 A 6 +ATOM 920 C CE . MET A1 1 61 ? -1.973 9.542 -23.364 1.0 11.34 ? 61 A 6 +ATOM 921 H H . MET A1 1 61 ? -5.643 10.996 -20.855 1.0 44.35 ? 61 A 6 +ATOM 922 H HA . MET A1 1 61 ? -4.198 11.288 -18.508 1.0 14.21 ? 61 A 6 +ATOM 923 H HB2 . MET A1 1 61 ? -2.541 9.68 -19.771 1.0 14.23 ? 61 A 6 +ATOM 924 H HB3 . MET A1 1 61 ? -4.142 9.129 -19.297 1.0 0.24 ? 61 A 6 +ATOM 925 H HG2 . MET A1 1 61 ? -4.844 8.919 -21.416 1.0 62.14 ? 61 A 6 +ATOM 926 H HG3 . MET A1 1 61 ? -3.993 10.366 -21.951 1.0 32.0 ? 61 A 6 +ATOM 927 H HE1 . MET A1 1 61 ? -1.125 10.073 -22.955 1.0 54.23 ? 61 A 6 +ATOM 928 H HE2 . MET A1 1 61 ? -1.66 8.977 -24.23 1.0 64.31 ? 61 A 6 +ATOM 929 H HE3 . MET A1 1 61 ? -2.737 10.248 -23.652 1.0 24.11 ? 61 A 6 +ATOM 930 N N . SER A1 1 62 ? -2.583 12.421 -21.158 1.0 73.15 ? 62 A 6 +ATOM 931 C CA . SER A1 1 62 ? -1.501 13.301 -21.584 1.0 12.22 ? 62 A 6 +ATOM 932 C C . SER A1 1 62 ? -1.883 14.765 -21.388 1.0 13.52 ? 62 A 6 +ATOM 933 O O . SER A1 1 62 ? -1.032 15.606 -21.097 1.0 42.51 ? 62 A 6 +ATOM 934 C CB . SER A1 1 62 ? -1.155 13.045 -23.052 1.0 62.33 ? 62 A 6 +ATOM 935 O OG . SER A1 1 62 ? -0.508 14.167 -23.627 1.0 14.13 ? 62 A 6 +ATOM 936 H H . SER A1 1 62 ? -3.143 11.988 -21.836 1.0 74.25 ? 62 A 6 +ATOM 937 H HA . SER A1 1 62 ? -0.636 13.082 -20.976 1.0 74.15 ? 62 A 6 +ATOM 938 H HB2 . SER A1 1 62 ? -0.498 12.191 -23.121 1.0 54.41 ? 62 A 6 +ATOM 939 H HB3 . SER A1 1 62 ? -2.063 12.846 -23.604 1.0 23.45 ? 62 A 6 +ATOM 940 H HG . SER A1 1 62 ? -0.977 14.435 -24.421 1.0 1.23 ? 62 A 6 +ATOM 941 N N . ASP A1 1 63 ? -3.167 15.062 -21.55 1.0 34.33 ? 63 A 6 +ATOM 942 C CA . ASP A1 1 63 ? -3.664 16.423 -21.39 1.0 10.21 ? 63 A 6 +ATOM 943 C C . ASP A1 1 63 ? -3.326 16.966 -20.004 1.0 63.54 ? 63 A 6 +ATOM 944 O O . ASP A1 1 63 ? -3.218 18.177 -19.81 1.0 31.33 ? 63 A 6 +ATOM 945 C CB . ASP A1 1 63 ? -5.176 16.467 -21.613 1.0 21.1 ? 63 A 6 +ATOM 946 C CG . ASP A1 1 63 ? -5.673 17.862 -21.937 1.0 12.2 ? 63 A 6 +ATOM 947 O OD1 . ASP A1 1 63 ? -5.635 18.244 -23.125 1.0 53.24 ? 63 A 6 +ATOM 948 O OD2 . ASP A1 1 63 ? -6.1 18.573 -21.003 1.0 3.13 ? 63 A 6 +ATOM 949 H H . ASP A1 1 63 ? -3.797 14.347 -21.782 1.0 14.4 ? 63 A 6 +ATOM 950 H HA . ASP A1 1 63 ? -3.182 17.042 -22.132 1.0 72.42 ? 63 A 6 +ATOM 951 H HB2 . ASP A1 1 63 ? -5.431 15.815 -22.435 1.0 63.34 ? 63 A 6 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.676 16.125 -20.719 1.0 44.51 ? 63 A 6 +ATOM 953 N N . TYR A1 1 64 ? -3.16 16.062 -19.045 1.0 43.15 ? 64 A 6 +ATOM 954 C CA . TYR A1 1 64 ? -2.838 16.45 -17.677 1.0 74.44 ? 64 A 6 +ATOM 955 C C . TYR A1 1 64 ? -4.059 17.036 -16.975 1.0 35.31 ? 64 A 6 +ATOM 956 O O . TYR A1 1 64 ? -3.936 17.722 -15.961 1.0 63.11 ? 64 A 6 +ATOM 957 C CB . TYR A1 1 64 ? -1.694 17.465 -17.668 1.0 41.31 ? 64 A 6 +ATOM 958 C CG . TYR A1 1 64 ? -0.54 17.069 -16.776 1.0 35.31 ? 64 A 6 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.299 16.016 -17.12 1.0 10.21 ? 64 A 6 +ATOM 960 C CD2 . TYR A1 1 64 ? -0.288 17.746 -15.59 1.0 61.0 ? 64 A 6 +ATOM 961 C CE1 . TYR A1 1 64 ? 1.355 15.649 -16.308 1.0 31.32 ? 64 A 6 +ATOM 962 C CE2 . TYR A1 1 64 ? 0.767 17.388 -14.773 1.0 3.01 ? 64 A 6 +ATOM 963 C CZ . TYR A1 1 64 ? 1.585 16.339 -15.136 1.0 35.43 ? 64 A 6 +ATOM 964 O OH . TYR A1 1 64 ? 2.636 15.978 -14.324 1.0 23.32 ? 64 A 6 +ATOM 965 H H . TYR A1 1 64 ? -3.259 15.111 -19.262 1.0 10.22 ? 64 A 6 +ATOM 966 H HA . TYR A1 1 64 ? -2.523 15.563 -17.146 1.0 40.51 ? 64 A 6 +ATOM 967 H HB2 . TYR A1 1 64 ? -1.314 17.577 -18.672 1.0 75.32 ? 64 A 6 +ATOM 968 H HB3 . TYR A1 1 64 ? -2.07 18.417 -17.322 1.0 32.34 ? 64 A 6 +ATOM 969 H HD1 . TYR A1 1 64 ? 0.117 15.477 -18.039 1.0 1.35 ? 64 A 6 +ATOM 970 H HD2 . TYR A1 1 64 ? -0.931 18.567 -15.308 1.0 32.41 ? 64 A 6 +ATOM 971 H HE1 . TYR A1 1 64 ? 1.997 14.828 -16.592 1.0 52.21 ? 64 A 6 +ATOM 972 H HE2 . TYR A1 1 64 ? 0.946 17.927 -13.854 1.0 43.14 ? 64 A 6 +ATOM 973 H HH . TYR A1 1 64 ? 3.066 16.767 -13.988 1.0 23.33 ? 64 A 6 +ATOM 974 N N . ASN A1 1 65 ? -5.238 16.76 -17.523 1.0 61.21 ? 65 A 6 +ATOM 975 C CA . ASN A1 1 65 ? -6.483 17.26 -16.951 1.0 70.22 ? 65 A 6 +ATOM 976 C C . ASN A1 1 65 ? -7.293 16.123 -16.334 1.0 21.44 ? 65 A 6 +ATOM 977 O O . ASN A1 1 65 ? -8.472 16.286 -16.019 1.0 22.24 ? 65 A 6 +ATOM 978 C CB . ASN A1 1 65 ? -7.313 17.969 -18.022 1.0 30.31 ? 65 A 6 +ATOM 979 C CG . ASN A1 1 65 ? -8.123 17.001 -18.862 1.0 75.23 ? 65 A 6 +ATOM 980 O OD1 . ASN A1 1 65 ? -7.601 15.999 -19.352 1.0 74.2 ? 65 A 6 +ATOM 981 N ND2 . ASN A1 1 65 ? -9.407 17.295 -19.031 1.0 12.4 ? 65 A 6 +ATOM 982 H H . ASN A1 1 65 ? -5.272 16.208 -18.332 1.0 72.01 ? 65 A 6 +ATOM 983 H HA . ASN A1 1 65 ? -6.231 17.968 -16.176 1.0 43.44 ? 65 A 6 +ATOM 984 H HB2 . ASN A1 1 65 ? -7.994 18.658 -17.544 1.0 12.24 ? 65 A 6 +ATOM 985 H HB3 . ASN A1 1 65 ? -6.652 18.519 -18.676 1.0 73.02 ? 65 A 6 +ATOM 986 H HD21 . ASN A1 1 65 ? -9.755 18.11 -18.611 1.0 23.44 ? 65 A 6 +ATOM 987 H HD22 . ASN A1 1 65 ? -9.954 16.686 -19.569 1.0 32.24 ? 65 A 6 +ATOM 988 N N . VAL A1 1 66 ? -6.652 14.971 -16.164 1.0 11.4 ? 66 A 6 +ATOM 989 C CA . VAL A1 1 66 ? -7.311 13.807 -15.584 1.0 70.45 ? 66 A 6 +ATOM 990 C C . VAL A1 1 66 ? -6.99 13.677 -14.099 1.0 73.11 ? 66 A 6 +ATOM 991 O O . VAL A1 1 66 ? -6.071 12.954 -13.715 1.0 33.12 ? 66 A 6 +ATOM 992 C CB . VAL A1 1 66 ? -6.896 12.51 -16.304 1.0 40.11 ? 66 A 6 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.382 12.418 -16.408 1.0 32.21 ? 66 A 6 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.464 11.297 -15.583 1.0 25.13 ? 66 A 6 +ATOM 995 H H . VAL A1 1 66 ? -5.712 14.903 -16.435 1.0 25.31 ? 66 A 6 +ATOM 996 H HA . VAL A1 1 66 ? -8.377 13.934 -15.702 1.0 44.24 ? 66 A 6 +ATOM 997 H HB . VAL A1 1 66 ? -7.303 12.532 -17.304 1.0 65.05 ? 66 A 6 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.067 11.406 -16.199 1.0 62.5 ? 66 A 6 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.072 12.694 -17.406 1.0 4.5 ? 66 A 6 +ATOM 1000 H HG13 . VAL A1 1 66 ? -4.93 13.089 -15.692 1.0 12.32 ? 66 A 6 +ATOM 1001 H HG21 . VAL A1 1 66 ? -7.512 10.462 -16.266 1.0 23.4 ? 66 A 6 +ATOM 1002 H HG22 . VAL A1 1 66 ? -6.827 11.044 -14.748 1.0 64.2 ? 66 A 6 +ATOM 1003 H HG23 . VAL A1 1 66 ? -8.456 11.524 -15.222 1.0 74.31 ? 66 A 6 +ATOM 1004 N N . GLN A1 1 67 ? -7.753 14.381 -13.27 1.0 5.43 ? 67 A 6 +ATOM 1005 C CA . GLN A1 1 67 ? -7.549 14.344 -11.827 1.0 15.5 ? 67 A 6 +ATOM 1006 C C . GLN A1 1 67 ? -8.47 13.319 -11.173 1.0 62.54 ? 67 A 6 +ATOM 1007 O O . GLN A1 1 67 ? -9.222 12.621 -11.854 1.0 44.01 ? 67 A 6 +ATOM 1008 C CB . GLN A1 1 67 ? -7.793 15.727 -11.22 1.0 35.11 ? 67 A 6 +ATOM 1009 C CG . GLN A1 1 67 ? -9.2 16.254 -11.454 1.0 11.21 ? 67 A 6 +ATOM 1010 C CD . GLN A1 1 67 ? -9.212 17.687 -11.948 1.0 34.44 ? 67 A 6 +ATOM 1011 O OE1 . GLN A1 1 67 ? -8.545 18.024 -12.926 1.0 41.54 ? 67 A 6 +ATOM 1012 N NE2 . GLN A1 1 67 ? -9.973 18.54 -11.272 1.0 50.51 ? 67 A 6 +ATOM 1013 H H . GLN A1 1 67 ? -8.47 14.939 -13.638 1.0 54.23 ? 67 A 6 +ATOM 1014 H HA . GLN A1 1 67 ? -6.525 14.057 -11.645 1.0 21.13 ? 67 A 6 +ATOM 1015 H HB2 . GLN A1 1 67 ? -7.624 15.675 -10.155 1.0 61.05 ? 67 A 6 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.094 16.426 -11.654 1.0 21.05 ? 67 A 6 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.686 15.632 -12.191 1.0 63.24 ? 67 A 6 +ATOM 1018 H HG3 . GLN A1 1 67 ? -9.748 16.204 -10.525 1.0 63.02 ? 67 A 6 +ATOM 1019 H HE21 . GLN A1 1 67 ? -10.476 18.201 -10.502 1.0 0.12 ? 67 A 6 +ATOM 1020 H HE22 . GLN A1 1 67 ? -9.998 19.473 -11.569 1.0 72.41 ? 67 A 6 +ATOM 1021 N N . LYS A1 1 68 ? -8.405 13.233 -9.849 1.0 63.33 ? 68 A 6 +ATOM 1022 C CA . LYS A1 1 68 ? -9.233 12.294 -9.102 1.0 34.0 ? 68 A 6 +ATOM 1023 C C . LYS A1 1 68 ? -10.714 12.532 -9.382 1.0 33.21 ? 68 A 6 +ATOM 1024 O O . LYS A1 1 68 ? -11.518 11.601 -9.348 1.0 33.01 ? 68 A 6 +ATOM 1025 C CB . LYS A1 1 68 ? -8.96 12.423 -7.601 1.0 41.41 ? 68 A 6 +ATOM 1026 C CG . LYS A1 1 68 ? -9.495 11.261 -6.783 1.0 61.44 ? 68 A 6 +ATOM 1027 C CD . LYS A1 1 68 ? -8.737 9.977 -7.077 1.0 43.41 ? 68 A 6 +ATOM 1028 C CE . LYS A1 1 68 ? -7.404 9.938 -6.346 1.0 23.43 ? 68 A 6 +ATOM 1029 N NZ . LYS A1 1 68 ? -7.577 10.02 -4.87 1.0 52.05 ? 68 A 6 +ATOM 1030 H H . LYS A1 1 68 ? -7.786 13.817 -9.362 1.0 75.53 ? 68 A 6 +ATOM 1031 H HA . LYS A1 1 68 ? -8.975 11.296 -9.421 1.0 31.4 ? 68 A 6 +ATOM 1032 H HB2 . LYS A1 1 68 ? -7.893 12.485 -7.446 1.0 51.5 ? 68 A 6 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.421 13.332 -7.241 1.0 62.4 ? 68 A 6 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.394 11.494 -5.734 1.0 22.33 ? 68 A 6 +ATOM 1035 H HG3 . LYS A1 1 68 ? -10.539 11.115 -7.022 1.0 45.02 ? 68 A 6 +ATOM 1036 H HD2 . LYS A1 1 68 ? -9.334 9.136 -6.757 1.0 14.2 ? 68 A 6 +ATOM 1037 H HD3 . LYS A1 1 68 ? -8.558 9.91 -8.14 1.0 13.53 ? 68 A 6 +ATOM 1038 H HE2 . LYS A1 1 68 ? -6.902 9.014 -6.59 1.0 43.13 ? 68 A 6 +ATOM 1039 H HE3 . LYS A1 1 68 ? -6.803 10.773 -6.677 1.0 63.42 ? 68 A 6 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.661 11.013 -4.574 1.0 1.54 ? 68 A 6 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -6.759 9.594 -4.39 1.0 73.32 ? 68 A 6 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.437 9.51 -4.582 1.0 23.44 ? 68 A 6 +ATOM 1043 N N . GLU A1 1 69 ? -11.066 13.783 -9.66 1.0 51.1 ? 69 A 6 +ATOM 1044 C CA . GLU A1 1 69 ? -12.45 14.141 -9.947 1.0 15.41 ? 69 A 6 +ATOM 1045 C C . GLU A1 1 69 ? -12.518 15.305 -10.931 1.0 20.25 ? 69 A 6 +ATOM 1046 O O . GLU A1 1 69 ? -12.65 16.462 -10.532 1.0 55.15 ? 69 A 6 +ATOM 1047 C CB . GLU A1 1 69 ? -13.183 14.507 -8.655 1.0 42.14 ? 69 A 6 +ATOM 1048 C CG . GLU A1 1 69 ? -12.433 15.508 -7.792 1.0 32.44 ? 69 A 6 +ATOM 1049 C CD . GLU A1 1 69 ? -13.361 16.47 -7.074 1.0 60.3 ? 69 A 6 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.521 16.091 -6.812 1.0 52.11 ? 69 A 6 +ATOM 1051 O OE2 . GLU A1 1 69 ? -12.925 17.601 -6.775 1.0 33.22 ? 69 A 6 +ATOM 1052 H H . GLU A1 1 69 ? -10.379 14.482 -9.672 1.0 51.55 ? 69 A 6 +ATOM 1053 H HA . GLU A1 1 69 ? -12.929 13.282 -10.391 1.0 21.13 ? 69 A 6 +ATOM 1054 H HB2 . GLU A1 1 69 ? -14.145 14.93 -8.908 1.0 70.35 ? 69 A 6 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.337 13.609 -8.076 1.0 25.14 ? 69 A 6 +ATOM 1056 H HG2 . GLU A1 1 69 ? -11.859 14.969 -7.054 1.0 60.54 ? 69 A 6 +ATOM 1057 H HG3 . GLU A1 1 69 ? -11.765 16.078 -8.421 1.0 2.43 ? 69 A 6 +ATOM 1058 N N . SER A1 1 70 ? -12.427 14.99 -12.219 1.0 51.41 ? 70 A 6 +ATOM 1059 C CA . SER A1 1 70 ? -12.473 16.009 -13.261 1.0 50.24 ? 70 A 6 +ATOM 1060 C C . SER A1 1 70 ? -13.877 16.124 -13.846 1.0 72.1 ? 70 A 6 +ATOM 1061 O O . SER A1 1 70 ? -14.482 15.127 -14.242 1.0 13.02 ? 70 A 6 +ATOM 1062 C CB . SER A1 1 70 ? -11.471 15.682 -14.369 1.0 75.43 ? 70 A 6 +ATOM 1063 O OG . SER A1 1 70 ? -10.676 16.81 -14.687 1.0 45.33 ? 70 A 6 +ATOM 1064 H H . SER A1 1 70 ? -12.323 14.049 -12.474 1.0 42.55 ? 70 A 6 +ATOM 1065 H HA . SER A1 1 70 ? -12.205 16.954 -12.812 1.0 61.25 ? 70 A 6 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.825 14.882 -14.042 1.0 1.23 ? 70 A 6 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.007 15.373 -15.255 1.0 50.33 ? 70 A 6 +ATOM 1068 H HG . SER A1 1 70 ? -11.244 17.561 -14.873 1.0 14.24 ? 70 A 6 +ATOM 1069 N N . THR A1 1 71 ? -14.392 17.349 -13.897 1.0 52.55 ? 71 A 6 +ATOM 1070 C CA . THR A1 1 71 ? -15.725 17.596 -14.433 1.0 43.33 ? 71 A 6 +ATOM 1071 C C . THR A1 1 71 ? -15.664 17.975 -15.908 1.0 63.44 ? 71 A 6 +ATOM 1072 O O . THR A1 1 71 ? -15.064 18.986 -16.275 1.0 13.52 ? 71 A 6 +ATOM 1073 C CB . THR A1 1 71 ? -16.444 18.715 -13.656 1.0 4.41 ? 71 A 6 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.503 19.719 -13.261 1.0 4.41 ? 71 A 6 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.144 18.157 -12.426 1.0 4.35 ? 71 A 6 +ATOM 1076 H H . THR A1 1 71 ? -13.862 18.103 -13.566 1.0 14.04 ? 71 A 6 +ATOM 1077 H HA . THR A1 1 71 ? -16.3 16.687 -14.328 1.0 24.13 ? 71 A 6 +ATOM 1078 H HB . THR A1 1 71 ? -17.186 19.162 -14.303 1.0 70.41 ? 71 A 6 +ATOM 1079 H HG1 . THR A1 1 71 ? -15.832 20.585 -13.515 1.0 53.11 ? 71 A 6 +ATOM 1080 H HG21 . THR A1 1 71 ? -16.585 17.316 -12.044 1.0 12.42 ? 71 A 6 +ATOM 1081 H HG22 . THR A1 1 71 ? -18.14 17.834 -12.694 1.0 75.2 ? 71 A 6 +ATOM 1082 H HG23 . THR A1 1 71 ? -17.206 18.923 -11.668 1.0 31.12 ? 71 A 6 +ATOM 1083 N N . LEU A1 1 72 ? -16.288 17.159 -16.75 1.0 74.32 ? 72 A 6 +ATOM 1084 C CA . LEU A1 1 72 ? -16.305 17.409 -18.187 1.0 62.12 ? 72 A 6 +ATOM 1085 C C . LEU A1 1 72 ? -17.72 17.286 -18.744 1.0 14.1 ? 72 A 6 +ATOM 1086 O O . LEU A1 1 72 ? -18.554 16.565 -18.196 1.0 22.33 ? 72 A 6 +ATOM 1087 C CB . LEU A1 1 72 ? -15.374 16.432 -18.906 1.0 54.24 ? 72 A 6 +ATOM 1088 C CG . LEU A1 1 72 ? -16.02 15.145 -19.42 1.0 12.34 ? 72 A 6 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.4 15.286 -20.886 1.0 71.53 ? 72 A 6 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.083 13.962 -19.222 1.0 45.31 ? 72 A 6 +ATOM 1091 H H . LEU A1 1 72 ? -16.749 16.369 -16.398 1.0 40.44 ? 72 A 6 +ATOM 1092 H HA . LEU A1 1 72 ? -15.953 18.417 -18.352 1.0 22.23 ? 72 A 6 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.944 16.946 -19.752 1.0 24.33 ? 72 A 6 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.588 16.157 -18.217 1.0 64.44 ? 72 A 6 +ATOM 1095 H HG . LEU A1 1 72 ? -16.924 14.954 -18.858 1.0 60.22 ? 72 A 6 +ATOM 1096 H HD11 . LEU A1 1 72 ? -17.468 15.419 -20.969 1.0 22.12 ? 72 A 6 +ATOM 1097 H HD12 . LEU A1 1 72 ? -16.105 14.396 -21.421 1.0 11.12 ? 72 A 6 +ATOM 1098 H HD13 . LEU A1 1 72 ? -15.895 16.143 -21.307 1.0 74.11 ? 72 A 6 +ATOM 1099 H HD21 . LEU A1 1 72 ? -14.06 14.308 -19.228 1.0 45.11 ? 72 A 6 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.227 13.251 -20.021 1.0 64.51 ? 72 A 6 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.297 13.488 -18.275 1.0 15.53 ? 72 A 6 +ATOM 1102 N N . HIS A1 1 73 ? -17.983 17.992 -19.84 1.0 22.1 ? 73 A 6 +ATOM 1103 C CA . HIS A1 1 73 ? -19.296 17.959 -20.474 1.0 43.22 ? 73 A 6 +ATOM 1104 C C . HIS A1 1 73 ? -19.316 16.962 -21.629 1.0 1.12 ? 73 A 6 +ATOM 1105 O O . HIS A1 1 73 ? -18.549 17.087 -22.584 1.0 41.41 ? 73 A 6 +ATOM 1106 C CB . HIS A1 1 73 ? -19.677 19.351 -20.979 1.0 34.11 ? 73 A 6 +ATOM 1107 C CG . HIS A1 1 73 ? -21.121 19.477 -21.354 1.0 25.31 ? 73 A 6 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.953 18.39 -21.524 1.0 22.31 ? 73 A 6 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.882 20.572 -21.589 1.0 30.12 ? 73 A 6 +ATOM 1110 C CE1 . HIS A1 1 73 ? -23.162 18.811 -21.85 1.0 74.03 ? 73 A 6 +ATOM 1111 N NE2 . HIS A1 1 73 ? -23.146 20.131 -21.896 1.0 22.32 ? 73 A 6 +ATOM 1112 H H . HIS A1 1 73 ? -17.277 18.547 -20.231 1.0 41.1 ? 73 A 6 +ATOM 1113 H HA . HIS A1 1 73 ? -20.014 17.645 -19.732 1.0 23.25 ? 73 A 6 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.47 20.076 -20.206 1.0 51.13 ? 73 A 6 +ATOM 1115 H HB3 . HIS A1 1 73 ? -19.085 19.584 -21.852 1.0 64.13 ? 73 A 6 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.694 17.451 -21.423 1.0 63.31 ? 73 A 6 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.556 21.601 -21.545 1.0 71.43 ? 73 A 6 +ATOM 1118 H HE1 . HIS A1 1 73 ? -24.018 18.183 -22.045 1.0 3.34 ? 73 A 6 +ATOM 1119 N N . LEU A1 1 74 ? -20.198 15.973 -21.535 1.0 31.4 ? 74 A 6 +ATOM 1120 C CA . LEU A1 1 74 ? -20.319 14.954 -22.572 1.0 41.22 ? 74 A 6 +ATOM 1121 C C . LEU A1 1 74 ? -21.635 15.1 -23.329 1.0 21.0 ? 74 A 6 +ATOM 1122 O O . LEU A1 1 74 ? -22.714 14.957 -22.753 1.0 70.53 ? 74 A 6 +ATOM 1123 C CB . LEU A1 1 74 ? -20.224 13.557 -21.955 1.0 42.32 ? 74 A 6 +ATOM 1124 C CG . LEU A1 1 74 ? -20.696 12.401 -22.837 1.0 13.02 ? 74 A 6 +ATOM 1125 C CD1 . LEU A1 1 74 ? -19.894 12.353 -24.129 1.0 50.12 ? 74 A 6 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.586 11.08 -22.089 1.0 22.4 ? 74 A 6 +ATOM 1127 H H . LEU A1 1 74 ? -20.783 15.926 -20.751 1.0 53.04 ? 74 A 6 +ATOM 1128 H HA . LEU A1 1 74 ? -19.502 15.089 -23.265 1.0 65.43 ? 74 A 6 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.19 13.378 -21.701 1.0 22.02 ? 74 A 6 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.821 13.553 -21.055 1.0 20.31 ? 74 A 6 +ATOM 1131 H HG . LEU A1 1 74 ? -21.735 12.554 -23.096 1.0 34.12 ? 74 A 6 +ATOM 1132 H HD11 . LEU A1 1 74 ? -18.964 12.883 -23.995 1.0 33.01 ? 74 A 6 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.462 12.816 -24.922 1.0 1.34 ? 74 A 6 +ATOM 1134 H HD13 . LEU A1 1 74 ? -19.689 11.324 -24.387 1.0 63.14 ? 74 A 6 +ATOM 1135 H HD21 . LEU A1 1 74 ? -21.324 10.39 -22.468 1.0 12.32 ? 74 A 6 +ATOM 1136 H HD22 . LEU A1 1 74 ? -20.755 11.249 -21.036 1.0 54.43 ? 74 A 6 +ATOM 1137 H HD23 . LEU A1 1 74 ? -19.598 10.667 -22.233 1.0 14.02 ? 74 A 6 +ATOM 1138 N N . VAL A1 1 75 ? -21.539 15.384 -24.624 1.0 43.5 ? 75 A 6 +ATOM 1139 C CA . VAL A1 1 75 ? -22.722 15.546 -25.461 1.0 52.32 ? 75 A 6 +ATOM 1140 C C . VAL A1 1 75 ? -22.837 14.413 -26.474 1.0 61.15 ? 75 A 6 +ATOM 1141 O O . VAL A1 1 75 ? -21.843 13.994 -27.07 1.0 54.31 ? 75 A 6 +ATOM 1142 C CB . VAL A1 1 75 ? -22.699 16.891 -26.211 1.0 24.5 ? 75 A 6 +ATOM 1143 C CG1 . VAL A1 1 75 ? -22.979 18.04 -25.255 1.0 55.3 ? 75 A 6 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.365 17.085 -26.915 1.0 64.14 ? 75 A 6 +ATOM 1145 H H . VAL A1 1 75 ? -20.651 15.486 -25.026 1.0 70.11 ? 75 A 6 +ATOM 1146 H HA . VAL A1 1 75 ? -23.59 15.53 -24.818 1.0 60.52 ? 75 A 6 +ATOM 1147 H HB . VAL A1 1 75 ? -23.478 16.876 -26.959 1.0 44.41 ? 75 A 6 +ATOM 1148 H HG11 . VAL A1 1 75 ? -23.653 17.707 -24.479 1.0 31.54 ? 75 A 6 +ATOM 1149 H HG12 . VAL A1 1 75 ? -22.052 18.373 -24.81 1.0 61.34 ? 75 A 6 +ATOM 1150 H HG13 . VAL A1 1 75 ? -23.432 18.857 -25.797 1.0 54.52 ? 75 A 6 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.216 16.291 -27.631 1.0 5.24 ? 75 A 6 +ATOM 1152 H HG22 . VAL A1 1 75 ? -21.363 18.036 -27.426 1.0 61.35 ? 75 A 6 +ATOM 1153 H HG23 . VAL A1 1 75 ? -20.567 17.066 -26.187 1.0 24.43 ? 75 A 6 +ATOM 1154 N N . LEU A1 1 76 ? -24.056 13.92 -26.667 1.0 35.1 ? 76 A 6 +ATOM 1155 C CA . LEU A1 1 76 ? -24.302 12.835 -27.61 1.0 22.53 ? 76 A 6 +ATOM 1156 C C . LEU A1 1 76 ? -25.355 13.235 -28.638 1.0 2.14 ? 76 A 6 +ATOM 1157 O O . LEU A1 1 76 ? -26.368 13.847 -28.297 1.0 21.5 ? 76 A 6 +ATOM 1158 C CB . LEU A1 1 76 ? -24.752 11.577 -26.864 1.0 73.12 ? 76 A 6 +ATOM 1159 C CG . LEU A1 1 76 ? -24.477 11.553 -25.36 1.0 64.45 ? 76 A 6 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.622 12.2 -24.598 1.0 24.13 ? 76 A 6 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.253 10.126 -24.882 1.0 22.03 ? 76 A 6 +ATOM 1162 H H . LEU A1 1 76 ? -24.808 14.294 -26.163 1.0 44.32 ? 76 A 6 +ATOM 1163 H HA . LEU A1 1 76 ? -23.376 12.626 -28.124 1.0 53.04 ? 76 A 6 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.817 11.472 -27.007 1.0 71.31 ? 76 A 6 +ATOM 1165 H HB3 . LEU A1 1 76 ? -24.246 10.732 -27.308 1.0 62.14 ? 76 A 6 +ATOM 1166 H HG . LEU A1 1 76 ? -23.579 12.12 -25.157 1.0 42.11 ? 76 A 6 +ATOM 1167 H HD11 . LEU A1 1 76 ? -25.617 11.851 -23.576 1.0 12.14 ? 76 A 6 +ATOM 1168 H HD12 . LEU A1 1 76 ? -26.56 11.936 -25.064 1.0 23.21 ? 76 A 6 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.504 13.274 -24.612 1.0 40.2 ? 76 A 6 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.884 9.526 -25.7 1.0 53.24 ? 76 A 6 +ATOM 1171 H HD22 . LEU A1 1 76 ? -25.186 9.716 -24.526 1.0 72.02 ? 76 A 6 +ATOM 1172 H HD23 . LEU A1 1 76 ? -23.53 10.125 -24.079 1.0 63.4 ? 76 A 6 +ATOM 1173 N N . ARG A1 1 77 ? -25.111 12.883 -29.896 1.0 50.44 ? 77 A 6 +ATOM 1174 C CA . ARG A1 1 77 ? -26.039 13.205 -30.973 1.0 12.4 ? 77 A 6 +ATOM 1175 C C . ARG A1 1 77 ? -26.915 12.003 -31.313 1.0 10.32 ? 77 A 6 +ATOM 1176 O O . ARG A1 1 77 ? -27.106 11.672 -32.484 1.0 12.43 ? 77 A 6 +ATOM 1177 C CB . ARG A1 1 77 ? -25.272 13.659 -32.217 1.0 55.35 ? 77 A 6 +ATOM 1178 C CG . ARG A1 1 77 ? -24.248 12.646 -32.704 1.0 12.22 ? 77 A 6 +ATOM 1179 C CD . ARG A1 1 77 ? -22.835 13.202 -32.626 1.0 60.22 ? 77 A 6 +ATOM 1180 N NE . ARG A1 1 77 ? -22.505 14.025 -33.786 1.0 64.33 ? 77 A 6 +ATOM 1181 C CZ . ARG A1 1 77 ? -22.124 13.527 -34.957 1.0 13.31 ? 77 A 6 +ATOM 1182 N NH1 . ARG A1 1 77 ? -22.026 12.215 -35.122 1.0 63.3 ? 77 A 6 +ATOM 1183 N NH2 . ARG A1 1 77 ? -21.841 14.341 -35.965 1.0 70.54 ? 77 A 6 +ATOM 1184 H H . ARG A1 1 77 ? -24.286 12.397 -30.105 1.0 2.41 ? 77 A 6 +ATOM 1185 H HA . ARG A1 1 77 ? -26.671 14.013 -30.637 1.0 53.23 ? 77 A 6 +ATOM 1186 H HB2 . ARG A1 1 77 ? -25.977 13.837 -33.015 1.0 41.04 ? 77 A 6 +ATOM 1187 H HB3 . ARG A1 1 77 ? -24.756 14.58 -31.991 1.0 23.23 ? 77 A 6 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.31 11.761 -32.089 1.0 3.21 ? 77 A 6 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.469 12.39 -33.73 1.0 45.32 ? 77 A 6 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.747 13.803 -31.733 1.0 24.22 ? 77 A 6 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.141 12.376 -32.573 1.0 55.12 ? 77 A 6 +ATOM 1192 H HE . ARG A1 1 77 ? -22.571 14.997 -33.686 1.0 41.44 ? 77 A 6 +ATOM 1193 H HH11 . ARG A1 1 77 ? -22.239 11.599 -34.364 1.0 31.24 ? 77 A 6 +ATOM 1194 H HH12 . ARG A1 1 77 ? -21.74 11.842 -36.005 1.0 72.5 ? 77 A 6 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.914 15.33 -35.844 1.0 71.34 ? 77 A 6 +ATOM 1196 H HH22 . ARG A1 1 77 ? -21.554 13.965 -36.846 1.0 1.44 ? 77 A 6 +ATOM 1197 N N . LEU A1 1 78 ? -27.445 11.354 -30.283 1.0 31.03 ? 78 A 6 +ATOM 1198 C CA . LEU A1 1 78 ? -28.301 10.188 -30.471 1.0 51.32 ? 78 A 6 +ATOM 1199 C C . LEU A1 1 78 ? -29.544 10.55 -31.278 1.0 14.11 ? 78 A 6 +ATOM 1200 O O . LEU A1 1 78 ? -29.923 9.836 -32.206 1.0 12.31 ? 78 A 6 +ATOM 1201 C CB . LEU A1 1 78 ? -28.71 9.606 -29.117 1.0 42.51 ? 78 A 6 +ATOM 1202 C CG . LEU A1 1 78 ? -27.928 8.378 -28.65 1.0 51.45 ? 78 A 6 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.575 8.789 -28.09 1.0 14.44 ? 78 A 6 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.724 7.602 -27.611 1.0 25.32 ? 78 A 6 +ATOM 1205 H H . LEU A1 1 78 ? -27.257 11.665 -29.373 1.0 75.31 ? 78 A 6 +ATOM 1206 H HA . LEU A1 1 78 ? -27.736 9.447 -31.016 1.0 64.2 ? 78 A 6 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.586 10.379 -28.374 1.0 61.14 ? 78 A 6 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.754 9.332 -29.177 1.0 62.32 ? 78 A 6 +ATOM 1209 H HG . LEU A1 1 78 ? -27.755 7.727 -29.495 1.0 53.42 ? 78 A 6 +ATOM 1210 H HD11 . LEU A1 1 78 ? -26.698 9.149 -27.08 1.0 3.24 ? 78 A 6 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.154 9.572 -28.703 1.0 74.14 ? 78 A 6 +ATOM 1212 H HD13 . LEU A1 1 78 ? -25.911 7.936 -28.09 1.0 11.41 ? 78 A 6 +ATOM 1213 H HD21 . LEU A1 1 78 ? -28.907 6.601 -27.972 1.0 65.32 ? 78 A 6 +ATOM 1214 H HD22 . LEU A1 1 78 ? -29.666 8.1 -27.435 1.0 65.43 ? 78 A 6 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.163 7.556 -26.689 1.0 34.04 ? 78 A 6 +ATOM 1216 N N . ARG A1 1 79 ? -30.172 11.665 -30.919 1.0 44.5 ? 79 A 6 +ATOM 1217 C CA . ARG A1 1 79 ? -31.372 12.122 -31.611 1.0 54.44 ? 79 A 6 +ATOM 1218 C C . ARG A1 1 79 ? -32.49 11.09 -31.5 1.0 43.43 ? 79 A 6 +ATOM 1219 O O . ARG A1 1 79 ? -32.364 10.097 -30.785 1.0 24.23 ? 79 A 6 +ATOM 1220 C CB . ARG A1 1 79 ? -31.063 12.4 -33.083 1.0 53.1 ? 79 A 6 +ATOM 1221 C CG . ARG A1 1 79 ? -31.704 13.673 -33.61 1.0 62.42 ? 79 A 6 +ATOM 1222 C CD . ARG A1 1 79 ? -30.715 14.828 -33.629 1.0 15.2 ? 79 A 6 +ATOM 1223 N NE . ARG A1 1 79 ? -30.531 15.369 -34.973 1.0 22.21 ? 79 A 6 +ATOM 1224 C CZ . ARG A1 1 79 ? -29.679 16.347 -35.261 1.0 43.33 ? 79 A 6 +ATOM 1225 N NH1 . ARG A1 1 79 ? -28.937 16.887 -34.305 1.0 51.34 ? 79 A 6 +ATOM 1226 N NH2 . ARG A1 1 79 ? -29.568 16.785 -36.509 1.0 24.34 ? 79 A 6 +ATOM 1227 H H . ARG A1 1 79 ? -29.822 12.192 -30.171 1.0 30.43 ? 79 A 6 +ATOM 1228 H HA . ARG A1 1 79 ? -31.696 13.038 -31.141 1.0 75.12 ? 79 A 6 +ATOM 1229 H HB2 . ARG A1 1 79 ? -29.993 12.485 -33.205 1.0 72.51 ? 79 A 6 +ATOM 1230 H HB3 . ARG A1 1 79 ? -31.419 11.571 -33.675 1.0 62.3 ? 79 A 6 +ATOM 1231 H HG2 . ARG A1 1 79 ? -32.055 13.498 -34.617 1.0 34.21 ? 79 A 6 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.538 13.934 -32.976 1.0 51.44 ? 79 A 6 +ATOM 1233 H HD2 . ARG A1 1 79 ? -31.085 15.611 -32.984 1.0 21.42 ? 79 A 6 +ATOM 1234 H HD3 . ARG A1 1 79 ? -29.764 14.476 -33.259 1.0 24.22 ? 79 A 6 +ATOM 1235 H HE . ARG A1 1 79 ? -31.07 14.984 -35.695 1.0 63.2 ? 79 A 6 +ATOM 1236 H HH11 . ARG A1 1 79 ? -29.017 16.558 -33.364 1.0 0.03 ? 79 A 6 +ATOM 1237 H HH12 . ARG A1 1 79 ? -28.295 17.622 -34.525 1.0 54.33 ? 79 A 6 +ATOM 1238 H HH21 . ARG A1 1 79 ? -30.126 16.38 -37.232 1.0 72.3 ? 79 A 6 +ATOM 1239 H HH22 . ARG A1 1 79 ? -28.927 17.521 -36.725 1.0 2.44 ? 79 A 6 +ATOM 1240 N N . GLY A1 1 80 ? -33.585 11.332 -32.214 1.0 11.03 ? 80 A 6 +ATOM 1241 C CA . GLY A1 1 80 ? -34.71 10.416 -32.182 1.0 3.12 ? 80 A 6 +ATOM 1242 C C . GLY A1 1 80 ? -34.695 9.439 -33.341 1.0 52.34 ? 80 A 6 +ATOM 1243 O O . GLY A1 1 80 ? -35.619 9.415 -34.154 1.0 43.44 ? 80 A 6 +ATOM 1244 H H . GLY A1 1 80 ? -33.63 12.14 -32.767 1.0 0.24 ? 80 A 6 +ATOM 1245 H HA2 . GLY A1 1 80 ? -34.681 9.86 -31.257 1.0 71.24 ? 80 A 6 +ATOM 1246 H HA3 . GLY A1 1 80 ? -35.626 10.987 -32.219 1.0 43.14 ? 80 A 6 +ATOM 1247 N N . GLY A1 1 81 ? -33.642 8.631 -33.42 1.0 43.34 ? 81 A 6 +ATOM 1248 C CA . GLY A1 1 81 ? -33.53 7.661 -34.493 1.0 20.2 ? 81 A 6 +ATOM 1249 C C . GLY A1 1 81 ? -32.108 7.516 -34.997 1.0 63.23 ? 81 A 6 +ATOM 1250 O O . GLY A1 1 81 ? -31.664 8.28 -35.854 1.0 30.24 ? 81 A 6 +ATOM 1251 H H . GLY A1 1 81 ? -32.935 8.695 -32.744 1.0 11.33 ? 81 A 6 +ATOM 1252 H HA2 . GLY A1 1 81 ? -33.873 6.702 -34.134 1.0 30.51 ? 81 A 6 +ATOM 1253 H HA3 . GLY A1 1 81 ? -34.16 7.974 -35.313 1.0 55.14 ? 81 A 6 +ATOM 1254 N N . VAL A1 1 82 ? -31.389 6.533 -34.464 1.0 30.52 ? 82 A 6 +ATOM 1255 C CA . VAL A1 1 82 ? -30.009 6.291 -34.864 1.0 4.45 ? 82 A 6 +ATOM 1256 C C . VAL A1 1 82 ? -29.143 7.523 -34.627 1.0 63.52 ? 82 A 6 +ATOM 1257 O O . VAL A1 1 82 ? -28.251 7.513 -33.779 1.0 12.52 ? 82 A 6 +ATOM 1258 C CB . VAL A1 1 82 ? -29.917 5.891 -36.349 1.0 53.54 ? 82 A 6 +ATOM 1259 C CG1 . VAL A1 1 82 ? -28.47 5.646 -36.748 1.0 33.31 ? 82 A 6 +ATOM 1260 C CG2 . VAL A1 1 82 ? -30.769 4.661 -36.622 1.0 1.13 ? 82 A 6 +ATOM 1261 H H . VAL A1 1 82 ? -31.798 5.957 -33.785 1.0 42.11 ? 82 A 6 +ATOM 1262 H HA . VAL A1 1 82 ? -29.627 5.474 -34.269 1.0 65.12 ? 82 A 6 +ATOM 1263 H HB . VAL A1 1 82 ? -30.298 6.707 -36.945 1.0 3.02 ? 82 A 6 +ATOM 1264 H HG11 . VAL A1 1 82 ? -27.877 5.47 -35.862 1.0 71.54 ? 82 A 6 +ATOM 1265 H HG12 . VAL A1 1 82 ? -28.415 4.783 -37.395 1.0 43.52 ? 82 A 6 +ATOM 1266 H HG13 . VAL A1 1 82 ? -28.089 6.512 -37.269 1.0 60.31 ? 82 A 6 +ATOM 1267 H HG21 . VAL A1 1 82 ? -31.806 4.952 -36.705 1.0 51.1 ? 82 A 6 +ATOM 1268 H HG22 . VAL A1 1 82 ? -30.449 4.2 -37.545 1.0 43.42 ? 82 A 6 +ATOM 1269 H HG23 . VAL A1 1 82 ? -30.657 3.956 -35.811 1.0 61.21 ? 82 A 6 +ATOM 1 N N . GLY A1 1 1 ? -16.213 -2.755 -4.123 1.0 13.0 ? 1 A 7 +ATOM 2 C CA . GLY A1 1 1 ? -14.78 -2.971 -4.2 1.0 45.03 ? 1 A 7 +ATOM 3 C C . GLY A1 1 1 ? -14.121 -2.115 -5.264 1.0 65.21 ? 1 A 7 +ATOM 4 O O . GLY A1 1 1 ? -13.649 -2.613 -6.286 1.0 33.34 ? 1 A 7 +ATOM 5 H H1 . GLY A1 1 1 ? -16.621 -2.484 -3.274 1.0 52.4 ? 1 A 7 +ATOM 6 H HA2 . GLY A1 1 1 ? -14.34 -2.738 -3.242 1.0 14.15 ? 1 A 7 +ATOM 7 H HA3 . GLY A1 1 1 ? -14.596 -4.011 -4.426 1.0 34.23 ? 1 A 7 +ATOM 8 N N . PRO A1 1 2 ? -14.084 -0.795 -5.028 1.0 55.32 ? 2 A 7 +ATOM 9 C CA . PRO A1 1 2 ? -13.482 0.159 -5.963 1.0 21.43 ? 2 A 7 +ATOM 10 C C . PRO A1 1 2 ? -11.964 0.029 -6.027 1.0 41.45 ? 2 A 7 +ATOM 11 O O . PRO A1 1 2 ? -11.329 -0.42 -5.072 1.0 62.42 ? 2 A 7 +ATOM 12 C CB . PRO A1 1 2 ? -13.878 1.52 -5.386 1.0 51.45 ? 2 A 7 +ATOM 13 C CG . PRO A1 1 2 ? -14.091 1.268 -3.933 1.0 43.11 ? 2 A 7 +ATOM 14 C CD . PRO A1 1 2 ? -14.628 -0.133 -3.83 1.0 64.14 ? 2 A 7 +ATOM 15 H HA . PRO A1 1 2 ? -13.893 0.054 -6.957 1.0 31.54 ? 2 A 7 +ATOM 16 H HB2 . PRO A1 1 2 ? -13.081 2.231 -5.552 1.0 42.4 ? 2 A 7 +ATOM 17 H HB3 . PRO A1 1 2 ? -14.783 1.868 -5.862 1.0 62.54 ? 2 A 7 +ATOM 18 H HG2 . PRO A1 1 2 ? -13.153 1.35 -3.405 1.0 3.22 ? 2 A 7 +ATOM 19 H HG3 . PRO A1 1 2 ? -14.808 1.973 -3.539 1.0 51.14 ? 2 A 7 +ATOM 20 H HD2 . PRO A1 1 2 ? -14.269 -0.61 -2.93 1.0 11.0 ? 2 A 7 +ATOM 21 H HD3 . PRO A1 1 2 ? -15.708 -0.126 -3.851 1.0 24.12 ? 2 A 7 +ATOM 22 N N . LEU A1 1 3 ? -11.387 0.426 -7.156 1.0 34.12 ? 3 A 7 +ATOM 23 C CA . LEU A1 1 3 ? -9.943 0.354 -7.344 1.0 54.03 ? 3 A 7 +ATOM 24 C C . LEU A1 1 3 ? -9.527 1.044 -8.639 1.0 63.21 ? 3 A 7 +ATOM 25 O O . LEU A1 1 3 ? -10.21 0.941 -9.656 1.0 11.24 ? 3 A 7 +ATOM 26 C CB . LEU A1 1 3 ? -9.482 -1.105 -7.359 1.0 60.12 ? 3 A 7 +ATOM 27 C CG . LEU A1 1 3 ? -8.224 -1.42 -6.55 1.0 64.13 ? 3 A 7 +ATOM 28 C CD1 . LEU A1 1 3 ? -7.058 -0.564 -7.021 1.0 62.25 ? 3 A 7 +ATOM 29 C CD2 . LEU A1 1 3 ? -8.477 -1.208 -5.065 1.0 0.12 ? 3 A 7 +ATOM 30 H H . LEU A1 1 3 ? -11.946 0.775 -7.881 1.0 52.35 ? 3 A 7 +ATOM 31 H HA . LEU A1 1 3 ? -9.475 0.862 -6.513 1.0 43.13 ? 3 A 7 +ATOM 32 H HB2 . LEU A1 1 3 ? -10.286 -1.709 -6.969 1.0 74.24 ? 3 A 7 +ATOM 33 H HB3 . LEU A1 1 3 ? -9.293 -1.38 -8.387 1.0 72.41 ? 3 A 7 +ATOM 34 H HG . LEU A1 1 3 ? -7.957 -2.457 -6.7 1.0 43.5 ? 3 A 7 +ATOM 35 H HD11 . LEU A1 1 3 ? -7.061 0.373 -6.486 1.0 50.45 ? 3 A 7 +ATOM 36 H HD12 . LEU A1 1 3 ? -7.155 -0.375 -8.08 1.0 4.34 ? 3 A 7 +ATOM 37 H HD13 . LEU A1 1 3 ? -6.13 -1.085 -6.832 1.0 54.42 ? 3 A 7 +ATOM 38 H HD21 . LEU A1 1 3 ? -7.534 -1.172 -4.54 1.0 23.33 ? 3 A 7 +ATOM 39 H HD22 . LEU A1 1 3 ? -9.072 -2.024 -4.682 1.0 1.01 ? 3 A 7 +ATOM 40 H HD23 . LEU A1 1 3 ? -9.007 -0.277 -4.92 1.0 75.24 ? 3 A 7 +ATOM 41 N N . GLY A1 1 4 ? -8.399 1.748 -8.593 1.0 4.21 ? 4 A 7 +ATOM 42 C CA . GLY A1 1 4 ? -7.911 2.443 -9.77 1.0 43.34 ? 4 A 7 +ATOM 43 C C . GLY A1 1 4 ? -7.184 3.727 -9.424 1.0 32.24 ? 4 A 7 +ATOM 44 O O . GLY A1 1 4 ? -7.356 4.272 -8.333 1.0 73.31 ? 4 A 7 +ATOM 45 H H . GLY A1 1 4 ? -7.895 1.795 -7.754 1.0 2.13 ? 4 A 7 +ATOM 46 H HA2 . GLY A1 1 4 ? -7.235 1.792 -10.304 1.0 53.5 ? 4 A 7 +ATOM 47 H HA3 . GLY A1 1 4 ? -8.749 2.678 -10.409 1.0 61.41 ? 4 A 7 +ATOM 48 N N . SER A1 1 5 ? -6.367 4.212 -10.354 1.0 14.33 ? 5 A 7 +ATOM 49 C CA . SER A1 1 5 ? -5.607 5.438 -10.14 1.0 12.42 ? 5 A 7 +ATOM 50 C C . SER A1 1 5 ? -6.534 6.598 -9.79 1.0 43.22 ? 5 A 7 +ATOM 51 O O . SER A1 1 5 ? -6.616 7.015 -8.635 1.0 33.52 ? 5 A 7 +ATOM 52 C CB . SER A1 1 5 ? -4.791 5.782 -11.387 1.0 72.02 ? 5 A 7 +ATOM 53 O OG . SER A1 1 5 ? -4.221 7.075 -11.284 1.0 21.35 ? 5 A 7 +ATOM 54 H H . SER A1 1 5 ? -6.272 3.733 -11.203 1.0 31.12 ? 5 A 7 +ATOM 55 H HA . SER A1 1 5 ? -4.933 5.27 -9.313 1.0 12.32 ? 5 A 7 +ATOM 56 H HB2 . SER A1 1 5 ? -3.997 5.06 -11.504 1.0 41.01 ? 5 A 7 +ATOM 57 H HB3 . SER A1 1 5 ? -5.434 5.753 -12.254 1.0 74.13 ? 5 A 7 +ATOM 58 H HG . SER A1 1 5 ? -3.843 7.189 -10.409 1.0 33.45 ? 5 A 7 +ATOM 59 N N . MET A1 1 6 ? -7.231 7.115 -10.796 1.0 14.01 ? 6 A 7 +ATOM 60 C CA . MET A1 1 6 ? -8.154 8.226 -10.595 1.0 54.33 ? 6 A 7 +ATOM 61 C C . MET A1 1 6 ? -9.479 7.967 -11.305 1.0 31.44 ? 6 A 7 +ATOM 62 O O . MET A1 1 6 ? -9.656 6.934 -11.95 1.0 1.11 ? 6 A 7 +ATOM 63 C CB . MET A1 1 6 ? -7.535 9.529 -11.105 1.0 70.21 ? 6 A 7 +ATOM 64 C CG . MET A1 1 6 ? -7.19 9.5 -12.585 1.0 25.05 ? 6 A 7 +ATOM 65 S SD . MET A1 1 6 ? -5.413 9.452 -12.883 1.0 3.44 ? 6 A 7 +ATOM 66 C CE . MET A1 1 6 ? -4.889 10.95 -12.053 1.0 13.21 ? 6 A 7 +ATOM 67 H H . MET A1 1 6 ? -7.124 6.74 -11.695 1.0 2.32 ? 6 A 7 +ATOM 68 H HA . MET A1 1 6 ? -8.338 8.316 -9.535 1.0 5.22 ? 6 A 7 +ATOM 69 H HB2 . MET A1 1 6 ? -8.233 10.335 -10.936 1.0 62.43 ? 6 A 7 +ATOM 70 H HB3 . MET A1 1 6 ? -6.63 9.725 -10.551 1.0 63.34 ? 6 A 7 +ATOM 71 H HG2 . MET A1 1 6 ? -7.639 8.623 -13.029 1.0 33.13 ? 6 A 7 +ATOM 72 H HG3 . MET A1 1 6 ? -7.597 10.385 -13.053 1.0 12.41 ? 6 A 7 +ATOM 73 H HE1 . MET A1 1 6 ? -5.74 11.408 -11.568 1.0 12.23 ? 6 A 7 +ATOM 74 H HE2 . MET A1 1 6 ? -4.14 10.709 -11.313 1.0 52.54 ? 6 A 7 +ATOM 75 H HE3 . MET A1 1 6 ? -4.474 11.636 -12.776 1.0 2.41 ? 6 A 7 +ATOM 76 N N . GLN A1 1 7 ? -10.407 8.911 -11.18 1.0 13.12 ? 7 A 7 +ATOM 77 C CA . GLN A1 1 7 ? -11.716 8.783 -11.809 1.0 13.2 ? 7 A 7 +ATOM 78 C C . GLN A1 1 7 ? -12.157 10.108 -12.422 1.0 42.42 ? 7 A 7 +ATOM 79 O O . GLN A1 1 7 ? -11.703 11.176 -12.009 1.0 71.33 ? 7 A 7 +ATOM 80 C CB . GLN A1 1 7 ? -12.752 8.311 -10.787 1.0 42.01 ? 7 A 7 +ATOM 81 C CG . GLN A1 1 7 ? -12.248 7.201 -9.878 1.0 12.34 ? 7 A 7 +ATOM 82 C CD . GLN A1 1 7 ? -11.771 7.718 -8.535 1.0 44.31 ? 7 A 7 +ATOM 83 O OE1 . GLN A1 1 7 ? -11.653 8.926 -8.328 1.0 33.44 ? 7 A 7 +ATOM 84 N NE2 . GLN A1 1 7 ? -11.493 6.803 -7.613 1.0 73.32 ? 7 A 7 +ATOM 85 H H . GLN A1 1 7 ? -10.206 9.712 -10.652 1.0 71.21 ? 7 A 7 +ATOM 86 H HA . GLN A1 1 7 ? -11.636 8.047 -12.593 1.0 62.03 ? 7 A 7 +ATOM 87 H HB2 . GLN A1 1 7 ? -13.04 9.149 -10.17 1.0 13.25 ? 7 A 7 +ATOM 88 H HB3 . GLN A1 1 7 ? -13.621 7.947 -11.315 1.0 41.42 ? 7 A 7 +ATOM 89 H HG2 . GLN A1 1 7 ? -13.05 6.498 -9.711 1.0 43.33 ? 7 A 7 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.426 6.699 -10.367 1.0 33.21 ? 7 A 7 +ATOM 91 H HE21 . GLN A1 1 7 ? -11.61 5.859 -7.85 1.0 52.01 ? 7 A 7 +ATOM 92 H HE22 . GLN A1 1 7 ? -11.182 7.109 -6.737 1.0 55.43 ? 7 A 7 +ATOM 93 N N . ILE A1 1 8 ? -13.043 10.032 -13.409 1.0 12.12 ? 8 A 7 +ATOM 94 C CA . ILE A1 1 8 ? -13.546 11.225 -14.078 1.0 64.2 ? 8 A 7 +ATOM 95 C C . ILE A1 1 8 ? -15.07 11.233 -14.117 1.0 0.33 ? 8 A 7 +ATOM 96 O O . ILE A1 1 8 ? -15.711 10.191 -13.974 1.0 11.35 ? 8 A 7 +ATOM 97 C CB . ILE A1 1 8 ? -13.007 11.333 -15.517 1.0 65.34 ? 8 A 7 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.09 10.149 -15.831 1.0 72.33 ? 8 A 7 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.266 12.648 -15.708 1.0 55.24 ? 8 A 7 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.677 10.073 -17.284 1.0 11.02 ? 8 A 7 +ATOM 101 H H . ILE A1 1 8 ? -13.367 9.152 -13.693 1.0 43.45 ? 8 A 7 +ATOM 102 H HA . ILE A1 1 8 ? -13.206 12.087 -13.522 1.0 41.41 ? 8 A 7 +ATOM 103 H HB . ILE A1 1 8 ? -13.846 11.319 -16.194 1.0 13.24 ? 8 A 7 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.194 10.227 -15.236 1.0 4.11 ? 8 A 7 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.603 9.231 -15.583 1.0 33.41 ? 8 A 7 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.753 12.908 -14.793 1.0 12.11 ? 8 A 7 +ATOM 107 H HG22 . ILE A1 1 8 ? -11.546 12.543 -16.505 1.0 14.43 ? 8 A 7 +ATOM 108 H HG23 . ILE A1 1 8 ? -12.972 13.426 -15.959 1.0 53.13 ? 8 A 7 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.249 9.303 -17.781 1.0 4.51 ? 8 A 7 +ATOM 110 H HD12 . ILE A1 1 8 ? -11.865 11.024 -17.762 1.0 22.53 ? 8 A 7 +ATOM 111 H HD13 . ILE A1 1 8 ? -10.625 9.839 -17.349 1.0 32.23 ? 8 A 7 +ATOM 112 N N . PHE A1 1 9 ? -15.645 12.415 -14.312 1.0 44.42 ? 9 A 7 +ATOM 113 C CA . PHE A1 1 9 ? -17.095 12.559 -14.37 1.0 45.42 ? 9 A 7 +ATOM 114 C C . PHE A1 1 9 ? -17.542 13.009 -15.758 1.0 62.05 ? 9 A 7 +ATOM 115 O O . PHE A1 1 9 ? -17.065 14.017 -16.28 1.0 33.13 ? 9 A 7 +ATOM 116 C CB . PHE A1 1 9 ? -17.572 13.564 -13.319 1.0 42.3 ? 9 A 7 +ATOM 117 C CG . PHE A1 1 9 ? -17.571 13.014 -11.921 1.0 44.44 ? 9 A 7 +ATOM 118 C CD1 . PHE A1 1 9 ? -16.384 12.864 -11.222 1.0 24.21 ? 9 A 7 +ATOM 119 C CD2 . PHE A1 1 9 ? -18.758 12.648 -11.306 1.0 24.11 ? 9 A 7 +ATOM 120 C CE1 . PHE A1 1 9 ? -16.38 12.359 -9.935 1.0 54.33 ? 9 A 7 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.76 12.143 -10.019 1.0 62.43 ? 9 A 7 +ATOM 122 C CZ . PHE A1 1 9 ? -17.57 11.997 -9.334 1.0 72.21 ? 9 A 7 +ATOM 123 H H . PHE A1 1 9 ? -15.081 13.21 -14.418 1.0 15.35 ? 9 A 7 +ATOM 124 H HA . PHE A1 1 9 ? -17.532 11.596 -14.159 1.0 72.15 ? 9 A 7 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.923 14.427 -13.336 1.0 13.22 ? 9 A 7 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.579 13.871 -13.556 1.0 20.44 ? 9 A 7 +ATOM 127 H HD1 . PHE A1 1 9 ? -15.453 13.146 -11.692 1.0 63.23 ? 9 A 7 +ATOM 128 H HD2 . PHE A1 1 9 ? -19.689 12.76 -11.841 1.0 43.5 ? 9 A 7 +ATOM 129 H HE1 . PHE A1 1 9 ? -15.448 12.246 -9.402 1.0 53.21 ? 9 A 7 +ATOM 130 H HE2 . PHE A1 1 9 ? -19.691 11.86 -9.551 1.0 61.25 ? 9 A 7 +ATOM 131 H HZ . PHE A1 1 9 ? -17.569 11.603 -8.328 1.0 11.33 ? 9 A 7 +ATOM 132 N N . VAL A1 1 10 ? -18.46 12.252 -16.352 1.0 35.51 ? 10 A 7 +ATOM 133 C CA . VAL A1 1 10 ? -18.972 12.572 -17.679 1.0 51.35 ? 10 A 7 +ATOM 134 C C . VAL A1 1 10 ? -20.449 12.942 -17.623 1.0 20.3 ? 10 A 7 +ATOM 135 O O . VAL A1 1 10 ? -21.254 12.244 -17.006 1.0 33.54 ? 10 A 7 +ATOM 136 C CB . VAL A1 1 10 ? -18.786 11.391 -18.651 1.0 1.24 ? 10 A 7 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.466 11.896 -20.05 1.0 43.55 ? 10 A 7 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.696 10.456 -18.15 1.0 70.41 ? 10 A 7 +ATOM 139 H H . VAL A1 1 10 ? -18.801 11.461 -15.885 1.0 13.11 ? 10 A 7 +ATOM 140 H HA . VAL A1 1 10 ? -18.413 13.415 -18.059 1.0 52.2 ? 10 A 7 +ATOM 141 H HB . VAL A1 1 10 ? -19.713 10.839 -18.696 1.0 21.21 ? 10 A 7 +ATOM 142 H HG11 . VAL A1 1 10 ? -17.394 11.971 -20.168 1.0 75.22 ? 10 A 7 +ATOM 143 H HG12 . VAL A1 1 10 ? -18.863 11.208 -20.781 1.0 54.41 ? 10 A 7 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.911 12.87 -20.191 1.0 61.31 ? 10 A 7 +ATOM 145 H HG21 . VAL A1 1 10 ? -16.868 11.036 -17.773 1.0 13.24 ? 10 A 7 +ATOM 146 H HG22 . VAL A1 1 10 ? -18.091 9.835 -17.36 1.0 62.44 ? 10 A 7 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.356 9.831 -18.963 1.0 2.35 ? 10 A 7 +ATOM 148 N N . LYS A1 1 11 ? -20.801 14.047 -18.273 1.0 23.3 ? 11 A 7 +ATOM 149 C CA . LYS A1 1 11 ? -22.183 14.511 -18.301 1.0 10.31 ? 11 A 7 +ATOM 150 C C . LYS A1 1 11 ? -22.799 14.305 -19.68 1.0 22.12 ? 11 A 7 +ATOM 151 O O . LYS A1 1 11 ? -22.4 14.945 -20.653 1.0 63.21 ? 11 A 7 +ATOM 152 C CB . LYS A1 1 11 ? -22.253 15.991 -17.915 1.0 34.41 ? 11 A 7 +ATOM 153 C CG . LYS A1 1 11 ? -23.631 16.603 -18.1 1.0 63.11 ? 11 A 7 +ATOM 154 C CD . LYS A1 1 11 ? -23.564 17.9 -18.888 1.0 3.15 ? 11 A 7 +ATOM 155 C CE . LYS A1 1 11 ? -23.362 17.64 -20.373 1.0 2.52 ? 11 A 7 +ATOM 156 N NZ . LYS A1 1 11 ? -23.796 18.798 -21.202 1.0 51.12 ? 11 A 7 +ATOM 157 H H . LYS A1 1 11 ? -20.115 14.561 -18.747 1.0 4.15 ? 11 A 7 +ATOM 158 H HA . LYS A1 1 11 ? -22.742 13.934 -17.58 1.0 44.21 ? 11 A 7 +ATOM 159 H HB2 . LYS A1 1 11 ? -21.972 16.094 -16.878 1.0 75.01 ? 11 A 7 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.553 16.543 -18.526 1.0 15.43 ? 11 A 7 +ATOM 161 H HG2 . LYS A1 1 11 ? -24.258 15.903 -18.632 1.0 73.24 ? 11 A 7 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.058 16.804 -17.127 1.0 30.03 ? 11 A 7 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.488 18.442 -18.751 1.0 63.51 ? 11 A 7 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.738 18.493 -18.519 1.0 61.22 ? 11 A 7 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.315 17.452 -20.553 1.0 70.24 ? 11 A 7 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.938 16.771 -20.654 1.0 3.13 ? 11 A 7 +ATOM 167 H HZ1 . LYS A1 1 11 ? -23.755 19.674 -20.643 1.0 1.34 ? 11 A 7 +ATOM 168 H HZ2 . LYS A1 1 11 ? -24.772 18.656 -21.532 1.0 61.44 ? 11 A 7 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.174 18.898 -22.03 1.0 12.11 ? 11 A 7 +ATOM 170 N N . THR A1 1 12 ? -23.777 13.407 -19.759 1.0 60.33 ? 12 A 7 +ATOM 171 C CA . THR A1 1 12 ? -24.449 13.116 -21.019 1.0 63.11 ? 12 A 7 +ATOM 172 C C . THR A1 1 12 ? -25.405 14.239 -21.404 1.0 63.2 ? 12 A 7 +ATOM 173 O O . THR A1 1 12 ? -25.859 15.002 -20.55 1.0 23.14 ? 12 A 7 +ATOM 174 C CB . THR A1 1 12 ? -25.232 11.792 -20.946 1.0 13.53 ? 12 A 7 +ATOM 175 O OG1 . THR A1 1 12 ? -26.378 11.947 -20.102 1.0 44.22 ? 12 A 7 +ATOM 176 C CG2 . THR A1 1 12 ? -24.352 10.671 -20.414 1.0 44.25 ? 12 A 7 +ATOM 177 H H . THR A1 1 12 ? -24.051 12.929 -18.949 1.0 50.31 ? 12 A 7 +ATOM 178 H HA . THR A1 1 12 ? -23.693 13.022 -21.786 1.0 15.31 ? 12 A 7 +ATOM 179 H HB . THR A1 1 12 ? -25.561 11.53 -21.942 1.0 3.11 ? 12 A 7 +ATOM 180 H HG1 . THR A1 1 12 ? -26.092 12.112 -19.2 1.0 54.01 ? 12 A 7 +ATOM 181 H HG21 . THR A1 1 12 ? -23.344 10.804 -20.776 1.0 54.24 ? 12 A 7 +ATOM 182 H HG22 . THR A1 1 12 ? -24.735 9.721 -20.755 1.0 51.32 ? 12 A 7 +ATOM 183 H HG23 . THR A1 1 12 ? -24.353 10.694 -19.334 1.0 74.05 ? 12 A 7 +ATOM 184 N N . LEU A1 1 13 ? -25.709 14.336 -22.694 1.0 74.21 ? 13 A 7 +ATOM 185 C CA . LEU A1 1 13 ? -26.613 15.366 -23.192 1.0 74.52 ? 13 A 7 +ATOM 186 C C . LEU A1 1 13 ? -28.002 15.213 -22.58 1.0 25.21 ? 13 A 7 +ATOM 187 O O . LEU A1 1 13 ? -28.815 16.138 -22.618 1.0 11.35 ? 13 A 7 +ATOM 188 C CB . LEU A1 1 13 ? -26.705 15.297 -24.717 1.0 31.51 ? 13 A 7 +ATOM 189 C CG . LEU A1 1 13 ? -27.244 16.547 -25.414 1.0 30.32 ? 13 A 7 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.255 17.696 -25.289 1.0 44.31 ? 13 A 7 +ATOM 191 C CD2 . LEU A1 1 13 ? -27.542 16.255 -26.877 1.0 64.01 ? 13 A 7 +ATOM 192 H H . LEU A1 1 13 ? -25.316 13.699 -23.327 1.0 42.02 ? 13 A 7 +ATOM 193 H HA . LEU A1 1 13 ? -26.211 16.326 -22.906 1.0 34.1 ? 13 A 7 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.714 15.107 -25.1 1.0 62.11 ? 13 A 7 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.352 14.47 -24.972 1.0 43.21 ? 13 A 7 +ATOM 196 H HG . LEU A1 1 13 ? -28.166 16.848 -24.937 1.0 45.4 ? 13 A 7 +ATOM 197 H HD11 . LEU A1 1 13 ? -25.907 17.98 -26.271 1.0 62.23 ? 13 A 7 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.415 17.384 -24.685 1.0 23.44 ? 13 A 7 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.741 18.54 -24.821 1.0 25.55 ? 13 A 7 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.457 16.752 -27.164 1.0 62.14 ? 13 A 7 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.652 15.19 -27.016 1.0 41.34 ? 13 A 7 +ATOM 202 H HD23 . LEU A1 1 13 ? -26.728 16.616 -27.49 1.0 51.42 ? 13 A 7 +ATOM 203 N N . THR A1 1 14 ? -28.268 14.04 -22.014 1.0 31.41 ? 14 A 7 +ATOM 204 C CA . THR A1 1 14 ? -29.558 13.766 -21.393 1.0 30.33 ? 14 A 7 +ATOM 205 C C . THR A1 1 14 ? -29.6 14.287 -19.961 1.0 22.13 ? 14 A 7 +ATOM 206 O O . THR A1 1 14 ? -30.643 14.254 -19.309 1.0 5.31 ? 14 A 7 +ATOM 207 C CB . THR A1 1 14 ? -29.871 12.258 -21.389 1.0 34.54 ? 14 A 7 +ATOM 208 O OG1 . THR A1 1 14 ? -29.033 11.587 -20.442 1.0 3.22 ? 14 A 7 +ATOM 209 C CG2 . THR A1 1 14 ? -29.663 11.659 -22.772 1.0 34.11 ? 14 A 7 +ATOM 210 H H . THR A1 1 14 ? -27.58 13.343 -22.016 1.0 2.31 ? 14 A 7 +ATOM 211 H HA . THR A1 1 14 ? -30.32 14.269 -21.971 1.0 25.44 ? 14 A 7 +ATOM 212 H HB . THR A1 1 14 ? -30.905 12.121 -21.105 1.0 55.24 ? 14 A 7 +ATOM 213 H HG1 . THR A1 1 14 ? -29.301 10.667 -20.372 1.0 24.42 ? 14 A 7 +ATOM 214 H HG21 . THR A1 1 14 ? -30.246 10.754 -22.863 1.0 1.02 ? 14 A 7 +ATOM 215 H HG22 . THR A1 1 14 ? -28.617 11.428 -22.911 1.0 12.23 ? 14 A 7 +ATOM 216 H HG23 . THR A1 1 14 ? -29.978 12.368 -23.523 1.0 12.42 ? 14 A 7 +ATOM 217 N N . GLY A1 1 15 ? -28.459 14.767 -19.477 1.0 61.2 ? 15 A 7 +ATOM 218 C CA . GLY A1 1 15 ? -28.387 15.288 -18.124 1.0 25.44 ? 15 A 7 +ATOM 219 C C . GLY A1 1 15 ? -28.157 14.199 -17.095 1.0 2.34 ? 15 A 7 +ATOM 220 O O . GLY A1 1 15 ? -28.999 13.966 -16.227 1.0 24.03 ? 15 A 7 +ATOM 221 H H . GLY A1 1 15 ? -27.658 14.767 -20.043 1.0 73.22 ? 15 A 7 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.578 16.0 -18.067 1.0 10.15 ? 15 A 7 +ATOM 223 H HA3 . GLY A1 1 15 ? -29.315 15.792 -17.896 1.0 23.53 ? 15 A 7 +ATOM 224 N N . LYS A1 1 16 ? -27.015 13.527 -17.192 1.0 11.21 ? 16 A 7 +ATOM 225 C CA . LYS A1 1 16 ? -26.675 12.456 -16.263 1.0 34.13 ? 16 A 7 +ATOM 226 C C . LYS A1 1 16 ? -25.181 12.457 -15.954 1.0 15.24 ? 16 A 7 +ATOM 227 O O . LYS A1 1 16 ? -24.349 12.498 -16.86 1.0 50.04 ? 16 A 7 +ATOM 228 C CB . LYS A1 1 16 ? -27.086 11.101 -16.842 1.0 31.42 ? 16 A 7 +ATOM 229 C CG . LYS A1 1 16 ? -27.399 10.057 -15.785 1.0 73.35 ? 16 A 7 +ATOM 230 C CD . LYS A1 1 16 ? -26.156 9.278 -15.385 1.0 50.3 ? 16 A 7 +ATOM 231 C CE . LYS A1 1 16 ? -25.653 8.408 -16.526 1.0 52.44 ? 16 A 7 +ATOM 232 N NZ . LYS A1 1 16 ? -25.985 6.971 -16.316 1.0 2.53 ? 16 A 7 +ATOM 233 H H . LYS A1 1 16 ? -26.384 13.759 -17.906 1.0 52.54 ? 16 A 7 +ATOM 234 H HA . LYS A1 1 16 ? -27.22 12.627 -15.347 1.0 34.34 ? 16 A 7 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.964 11.237 -17.456 1.0 44.24 ? 16 A 7 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.281 10.728 -17.459 1.0 12.13 ? 16 A 7 +ATOM 237 H HG2 . LYS A1 1 16 ? -27.798 10.55 -14.911 1.0 3.41 ? 16 A 7 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.133 9.368 -16.178 1.0 74.14 ? 16 A 7 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.379 9.975 -15.109 1.0 63.23 ? 16 A 7 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.394 8.648 -14.54 1.0 14.51 ? 16 A 7 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.108 8.743 -17.445 1.0 44.12 ? 16 A 7 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.58 8.514 -16.596 1.0 75.31 ? 16 A 7 +ATOM 243 H HZ1 . LYS A1 1 16 ? -26.147 6.504 -17.231 1.0 61.55 ? 16 A 7 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.845 6.885 -15.738 1.0 23.15 ? 16 A 7 +ATOM 245 H HZ3 . LYS A1 1 16 ? -25.203 6.491 -15.827 1.0 43.23 ? 16 A 7 +ATOM 246 N N . THR A1 1 17 ? -24.847 12.411 -14.668 1.0 33.03 ? 17 A 7 +ATOM 247 C CA . THR A1 1 17 ? -23.454 12.406 -14.239 1.0 61.21 ? 17 A 7 +ATOM 248 C C . THR A1 1 17 ? -22.97 10.988 -13.958 1.0 13.11 ? 17 A 7 +ATOM 249 O O . THR A1 1 17 ? -23.497 10.305 -13.08 1.0 32.24 ? 17 A 7 +ATOM 250 C CB . THR A1 1 17 ? -23.252 13.265 -12.977 1.0 22.54 ? 17 A 7 +ATOM 251 O OG1 . THR A1 1 17 ? -24.483 13.372 -12.254 1.0 24.32 ? 17 A 7 +ATOM 252 C CG2 . THR A1 1 17 ? -22.75 14.654 -13.342 1.0 72.42 ? 17 A 7 +ATOM 253 H H . THR A1 1 17 ? -25.556 12.38 -13.992 1.0 63.53 ? 17 A 7 +ATOM 254 H HA . THR A1 1 17 ? -22.859 12.828 -15.036 1.0 15.15 ? 17 A 7 +ATOM 255 H HB . THR A1 1 17 ? -22.514 12.786 -12.349 1.0 61.22 ? 17 A 7 +ATOM 256 H HG1 . THR A1 1 17 ? -24.305 13.34 -11.311 1.0 54.0 ? 17 A 7 +ATOM 257 H HG21 . THR A1 1 17 ? -23.268 15.391 -12.747 1.0 31.34 ? 17 A 7 +ATOM 258 H HG22 . THR A1 1 17 ? -22.939 14.841 -14.389 1.0 12.24 ? 17 A 7 +ATOM 259 H HG23 . THR A1 1 17 ? -21.69 14.716 -13.15 1.0 74.01 ? 17 A 7 +ATOM 260 N N . ILE A1 1 18 ? -21.964 10.552 -14.709 1.0 21.15 ? 18 A 7 +ATOM 261 C CA . ILE A1 1 18 ? -21.409 9.215 -14.539 1.0 42.23 ? 18 A 7 +ATOM 262 C C . ILE A1 1 18 ? -19.939 9.278 -14.136 1.0 2.02 ? 18 A 7 +ATOM 263 O O . ILE A1 1 18 ? -19.178 10.099 -14.648 1.0 34.24 ? 18 A 7 +ATOM 264 C CB . ILE A1 1 18 ? -21.542 8.382 -15.827 1.0 20.13 ? 18 A 7 +ATOM 265 C CG1 . ILE A1 1 18 ? -20.646 7.144 -15.754 1.0 0.43 ? 18 A 7 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.189 9.226 -17.042 1.0 34.34 ? 18 A 7 +ATOM 267 C CD1 . ILE A1 1 18 ? -20.909 6.142 -16.856 1.0 41.12 ? 18 A 7 +ATOM 268 H H . ILE A1 1 18 ? -21.587 11.143 -15.393 1.0 72.35 ? 18 A 7 +ATOM 269 H HA . ILE A1 1 18 ? -21.965 8.721 -13.755 1.0 33.1 ? 18 A 7 +ATOM 270 H HB . ILE A1 1 18 ? -22.57 8.068 -15.922 1.0 55.23 ? 18 A 7 +ATOM 271 H HG12 . ILE A1 1 18 ? -19.614 7.449 -15.823 1.0 35.45 ? 18 A 7 +ATOM 272 H HG13 . ILE A1 1 18 ? -20.807 6.647 -14.808 1.0 15.51 ? 18 A 7 +ATOM 273 H HG21 . ILE A1 1 18 ? -21.878 10.054 -17.117 1.0 31.24 ? 18 A 7 +ATOM 274 H HG22 . ILE A1 1 18 ? -20.184 9.604 -16.938 1.0 60.32 ? 18 A 7 +ATOM 275 H HG23 . ILE A1 1 18 ? -21.256 8.62 -17.934 1.0 71.44 ? 18 A 7 +ATOM 276 H HD11 . ILE A1 1 18 ? -21.303 6.654 -17.722 1.0 32.31 ? 18 A 7 +ATOM 277 H HD12 . ILE A1 1 18 ? -19.986 5.647 -17.121 1.0 60.24 ? 18 A 7 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.625 5.41 -16.515 1.0 25.35 ? 18 A 7 +ATOM 279 N N . THR A1 1 19 ? -19.545 8.403 -13.216 1.0 42.32 ? 19 A 7 +ATOM 280 C CA . THR A1 1 19 ? -18.167 8.358 -12.745 1.0 41.24 ? 19 A 7 +ATOM 281 C C . THR A1 1 19 ? -17.459 7.1 -13.236 1.0 70.21 ? 19 A 7 +ATOM 282 O O . THR A1 1 19 ? -18.036 6.013 -13.238 1.0 44.42 ? 19 A 7 +ATOM 283 C CB . THR A1 1 19 ? -18.097 8.406 -11.207 1.0 2.4 ? 19 A 7 +ATOM 284 O OG1 . THR A1 1 19 ? -19.204 9.152 -10.689 1.0 22.32 ? 19 A 7 +ATOM 285 C CG2 . THR A1 1 19 ? -16.792 9.036 -10.744 1.0 13.14 ? 19 A 7 +ATOM 286 H H . THR A1 1 19 ? -20.199 7.774 -12.846 1.0 1.15 ? 19 A 7 +ATOM 287 H HA . THR A1 1 19 ? -17.652 9.225 -13.135 1.0 65.43 ? 19 A 7 +ATOM 288 H HB . THR A1 1 19 ? -18.145 7.395 -10.828 1.0 44.24 ? 19 A 7 +ATOM 289 H HG1 . THR A1 1 19 ? -19.192 9.118 -9.729 1.0 60.25 ? 19 A 7 +ATOM 290 H HG21 . THR A1 1 19 ? -15.979 8.347 -10.913 1.0 73.33 ? 19 A 7 +ATOM 291 H HG22 . THR A1 1 19 ? -16.857 9.264 -9.69 1.0 23.45 ? 19 A 7 +ATOM 292 H HG23 . THR A1 1 19 ? -16.615 9.946 -11.299 1.0 51.03 ? 19 A 7 +ATOM 293 N N . ILE A1 1 20 ? -16.206 7.256 -13.65 1.0 2.13 ? 20 A 7 +ATOM 294 C CA . ILE A1 1 20 ? -15.419 6.132 -14.142 1.0 23.24 ? 20 A 7 +ATOM 295 C C . ILE A1 1 20 ? -13.962 6.25 -13.71 1.0 21.51 ? 20 A 7 +ATOM 296 O O . ILE A1 1 20 ? -13.343 7.304 -13.859 1.0 3.54 ? 20 A 7 +ATOM 297 C CB . ILE A1 1 20 ? -15.481 6.029 -15.677 1.0 55.55 ? 20 A 7 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.547 7.425 -16.301 1.0 1.5 ? 20 A 7 +ATOM 299 C CG2 . ILE A1 1 20 ? -16.68 5.195 -16.104 1.0 1.32 ? 20 A 7 +ATOM 300 C CD1 . ILE A1 1 20 ? -14.872 7.516 -17.651 1.0 2.4 ? 20 A 7 +ATOM 301 H H . ILE A1 1 20 ? -15.801 8.148 -13.624 1.0 32.52 ? 20 A 7 +ATOM 302 H HA . ILE A1 1 20 ? -15.835 5.226 -13.723 1.0 40.32 ? 20 A 7 +ATOM 303 H HB . ILE A1 1 20 ? -14.587 5.532 -16.019 1.0 75.22 ? 20 A 7 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.58 7.708 -16.427 1.0 4.24 ? 20 A 7 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.064 8.13 -15.639 1.0 20.02 ? 20 A 7 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.565 5.815 -16.113 1.0 41.11 ? 20 A 7 +ATOM 307 H HG22 . ILE A1 1 20 ? -16.508 4.8 -17.094 1.0 51.34 ? 20 A 7 +ATOM 308 H HG23 . ILE A1 1 20 ? -16.818 4.381 -15.41 1.0 74.34 ? 20 A 7 +ATOM 309 H HD11 . ILE A1 1 20 ? -13.803 7.591 -17.515 1.0 44.23 ? 20 A 7 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.098 6.631 -18.228 1.0 43.31 ? 20 A 7 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.229 8.389 -18.175 1.0 23.14 ? 20 A 7 +ATOM 312 N N . ASP A1 1 21 ? -13.419 5.162 -13.175 1.0 44.41 ? 21 A 7 +ATOM 313 C CA . ASP A1 1 21 ? -12.032 5.142 -12.724 1.0 13.43 ? 21 A 7 +ATOM 314 C C . ASP A1 1 21 ? -11.087 4.845 -13.884 1.0 74.52 ? 21 A 7 +ATOM 315 O O . ASP A1 1 21 ? -11.178 3.793 -14.518 1.0 3.25 ? 21 A 7 +ATOM 316 C CB . ASP A1 1 21 ? -11.847 4.1 -11.62 1.0 40.32 ? 21 A 7 +ATOM 317 C CG . ASP A1 1 21 ? -12.287 2.715 -12.051 1.0 70.32 ? 21 A 7 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.481 2.392 -11.879 1.0 34.41 ? 21 A 7 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.438 1.954 -12.56 1.0 4.34 ? 21 A 7 +ATOM 320 H H . ASP A1 1 21 ? -13.963 4.352 -13.083 1.0 61.24 ? 21 A 7 +ATOM 321 H HA . ASP A1 1 21 ? -11.798 6.119 -12.328 1.0 0.1 ? 21 A 7 +ATOM 322 H HB2 . ASP A1 1 21 ? -10.803 4.057 -11.345 1.0 73.15 ? 21 A 7 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.43 4.392 -10.758 1.0 61.23 ? 21 A 7 +ATOM 324 N N . VAL A1 1 22 ? -10.181 5.778 -14.157 1.0 30.34 ? 22 A 7 +ATOM 325 C CA . VAL A1 1 22 ? -9.219 5.616 -15.241 1.0 1.34 ? 22 A 7 +ATOM 326 C C . VAL A1 1 22 ? -7.795 5.848 -14.751 1.0 61.2 ? 22 A 7 +ATOM 327 O O . VAL A1 1 22 ? -7.58 6.435 -13.69 1.0 34.03 ? 22 A 7 +ATOM 328 C CB . VAL A1 1 22 ? -9.514 6.584 -16.403 1.0 60.13 ? 22 A 7 +ATOM 329 C CG1 . VAL A1 1 22 ? -10.954 7.07 -16.34 1.0 14.0 ? 22 A 7 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.545 7.756 -16.378 1.0 61.12 ? 22 A 7 +ATOM 331 H H . VAL A1 1 22 ? -10.158 6.595 -13.616 1.0 71.0 ? 22 A 7 +ATOM 332 H HA . VAL A1 1 22 ? -9.302 4.605 -15.613 1.0 41.13 ? 22 A 7 +ATOM 333 H HB . VAL A1 1 22 ? -9.378 6.05 -17.332 1.0 23.42 ? 22 A 7 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.055 7.791 -15.542 1.0 3.13 ? 22 A 7 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.22 7.532 -17.279 1.0 11.12 ? 22 A 7 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.609 6.232 -16.152 1.0 2.3 ? 22 A 7 +ATOM 337 H HG21 . VAL A1 1 22 ? -8.494 8.161 -15.379 1.0 43.3 ? 22 A 7 +ATOM 338 H HG22 . VAL A1 1 22 ? -7.565 7.418 -16.681 1.0 71.52 ? 22 A 7 +ATOM 339 H HG23 . VAL A1 1 22 ? -8.888 8.521 -17.059 1.0 24.41 ? 22 A 7 +ATOM 340 N N . ASP A1 1 23 ? -6.824 5.383 -15.53 1.0 73.14 ? 23 A 7 +ATOM 341 C CA . ASP A1 1 23 ? -5.418 5.541 -15.176 1.0 0.33 ? 23 A 7 +ATOM 342 C C . ASP A1 1 23 ? -4.685 6.376 -16.221 1.0 62.12 ? 23 A 7 +ATOM 343 O O . ASP A1 1 23 ? -5.157 6.533 -17.347 1.0 35.34 ? 23 A 7 +ATOM 344 C CB . ASP A1 1 23 ? -4.748 4.172 -15.037 1.0 24.44 ? 23 A 7 +ATOM 345 C CG . ASP A1 1 23 ? -3.698 4.15 -13.944 1.0 11.25 ? 23 A 7 +ATOM 346 O OD1 . ASP A1 1 23 ? -2.806 5.024 -13.961 1.0 71.52 ? 23 A 7 +ATOM 347 O OD2 . ASP A1 1 23 ? -3.767 3.258 -13.072 1.0 54.12 ? 23 A 7 +ATOM 348 H H . ASP A1 1 23 ? -7.059 4.923 -16.363 1.0 71.31 ? 23 A 7 +ATOM 349 H HA . ASP A1 1 23 ? -5.37 6.052 -14.226 1.0 62.03 ? 23 A 7 +ATOM 350 H HB2 . ASP A1 1 23 ? -5.5 3.433 -14.803 1.0 75.32 ? 23 A 7 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.275 3.914 -15.973 1.0 32.1 ? 23 A 7 +ATOM 352 N N . HIS A1 1 24 ? -3.529 6.91 -15.839 1.0 3.42 ? 24 A 7 +ATOM 353 C CA . HIS A1 1 24 ? -2.731 7.731 -16.744 1.0 64.1 ? 24 A 7 +ATOM 354 C C . HIS A1 1 24 ? -2.337 6.941 -17.988 1.0 13.22 ? 24 A 7 +ATOM 355 O O . HIS A1 1 24 ? -1.948 7.518 -19.003 1.0 40.32 ? 24 A 7 +ATOM 356 C CB . HIS A1 1 24 ? -1.478 8.24 -16.031 1.0 43.52 ? 24 A 7 +ATOM 357 C CG . HIS A1 1 24 ? -0.655 7.152 -15.415 1.0 63.23 ? 24 A 7 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.431 7.054 -14.057 1.0 33.23 ? 24 A 7 +ATOM 359 C CD2 . HIS A1 1 24 ? -0.001 6.109 -15.978 1.0 70.35 ? 24 A 7 +ATOM 360 C CE1 . HIS A1 1 24 ? 0.326 6.0 -13.813 1.0 52.22 ? 24 A 7 +ATOM 361 N NE2 . HIS A1 1 24 ? 0.6 5.408 -14.961 1.0 51.1 ? 24 A 7 +ATOM 362 H H . HIS A1 1 24 ? -3.206 6.749 -14.929 1.0 35.01 ? 24 A 7 +ATOM 363 H HA . HIS A1 1 24 ? -3.332 8.575 -17.044 1.0 52.33 ? 24 A 7 +ATOM 364 H HB2 . HIS A1 1 24 ? -0.855 8.764 -16.742 1.0 74.33 ? 24 A 7 +ATOM 365 H HB3 . HIS A1 1 24 ? -1.77 8.922 -15.246 1.0 2.24 ? 24 A 7 +ATOM 366 H HD1 . HIS A1 1 24 ? -0.774 7.668 -13.375 1.0 61.24 ? 24 A 7 +ATOM 367 H HD2 . HIS A1 1 24 ? 0.04 5.871 -17.032 1.0 14.35 ? 24 A 7 +ATOM 368 H HE1 . HIS A1 1 24 ? 0.663 5.675 -12.84 1.0 73.24 ? 24 A 7 +ATOM 369 N N . ALA A1 1 25 ? -2.441 5.619 -17.902 1.0 63.43 ? 25 A 7 +ATOM 370 C CA . ALA A1 1 25 ? -2.097 4.751 -19.022 1.0 43.32 ? 25 A 7 +ATOM 371 C C . ALA A1 1 25 ? -3.311 4.491 -19.908 1.0 33.54 ? 25 A 7 +ATOM 372 O O . ALA A1 1 25 ? -3.249 3.691 -20.841 1.0 12.23 ? 25 A 7 +ATOM 373 C CB . ALA A1 1 25 ? -1.521 3.438 -18.514 1.0 51.34 ? 25 A 7 +ATOM 374 H H . ALA A1 1 25 ? -2.757 5.218 -17.066 1.0 55.41 ? 25 A 7 +ATOM 375 H HA . ALA A1 1 25 ? -1.336 5.247 -19.607 1.0 23.12 ? 25 A 7 +ATOM 376 H HB1 . ALA A1 1 25 ? -1.343 2.776 -19.349 1.0 42.21 ? 25 A 7 +ATOM 377 H HB2 . ALA A1 1 25 ? -0.591 3.628 -18.0 1.0 3.14 ? 25 A 7 +ATOM 378 H HB3 . ALA A1 1 25 ? -2.221 2.977 -17.833 1.0 44.44 ? 25 A 7 +ATOM 379 N N . ASP A1 1 26 ? -4.412 5.171 -19.609 1.0 53.31 ? 26 A 7 +ATOM 380 C CA . ASP A1 1 26 ? -5.64 5.014 -20.379 1.0 71.32 ? 26 A 7 +ATOM 381 C C . ASP A1 1 26 ? -5.973 6.295 -21.138 1.0 31.24 ? 26 A 7 +ATOM 382 O O . ASP A1 1 26 ? -6.165 7.353 -20.539 1.0 53.43 ? 26 A 7 +ATOM 383 C CB . ASP A1 1 26 ? -6.801 4.637 -19.457 1.0 21.1 ? 26 A 7 +ATOM 384 C CG . ASP A1 1 26 ? -6.58 3.307 -18.763 1.0 73.54 ? 26 A 7 +ATOM 385 O OD1 . ASP A1 1 26 ? -6.587 2.268 -19.455 1.0 73.22 ? 26 A 7 +ATOM 386 O OD2 . ASP A1 1 26 ? -6.4 3.305 -17.527 1.0 2.02 ? 26 A 7 +ATOM 387 H H . ASP A1 1 26 ? -4.398 5.795 -18.853 1.0 73.33 ? 26 A 7 +ATOM 388 H HA . ASP A1 1 26 ? -5.485 4.218 -21.092 1.0 35.3 ? 26 A 7 +ATOM 389 H HB2 . ASP A1 1 26 ? -6.915 5.401 -18.702 1.0 71.15 ? 26 A 7 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.708 4.572 -20.039 1.0 51.4 ? 26 A 7 +ATOM 391 N N . THR A1 1 27 ? -6.039 6.192 -22.462 1.0 11.22 ? 27 A 7 +ATOM 392 C CA . THR A1 1 27 ? -6.347 7.341 -23.304 1.0 12.11 ? 27 A 7 +ATOM 393 C C . THR A1 1 27 ? -7.85 7.579 -23.381 1.0 24.55 ? 27 A 7 +ATOM 394 O O . THR A1 1 27 ? -8.645 6.744 -22.949 1.0 14.34 ? 27 A 7 +ATOM 395 C CB . THR A1 1 27 ? -5.793 7.158 -24.729 1.0 24.42 ? 27 A 7 +ATOM 396 O OG1 . THR A1 1 27 ? -5.862 5.778 -25.108 1.0 51.41 ? 27 A 7 +ATOM 397 C CG2 . THR A1 1 27 ? -4.354 7.642 -24.818 1.0 72.22 ? 27 A 7 +ATOM 398 H H . THR A1 1 27 ? -5.877 5.321 -22.881 1.0 1.33 ? 27 A 7 +ATOM 399 H HA . THR A1 1 27 ? -5.876 8.21 -22.866 1.0 54.42 ? 27 A 7 +ATOM 400 H HB . THR A1 1 27 ? -6.396 7.74 -25.411 1.0 51.23 ? 27 A 7 +ATOM 401 H HG1 . THR A1 1 27 ? -5.909 5.71 -26.064 1.0 23.44 ? 27 A 7 +ATOM 402 H HG21 . THR A1 1 27 ? -3.995 7.52 -25.829 1.0 20.21 ? 27 A 7 +ATOM 403 H HG22 . THR A1 1 27 ? -3.738 7.064 -24.145 1.0 40.31 ? 27 A 7 +ATOM 404 H HG23 . THR A1 1 27 ? -4.308 8.685 -24.542 1.0 53.14 ? 27 A 7 +ATOM 405 N N . VAL A1 1 28 ? -8.236 8.725 -23.935 1.0 70.04 ? 28 A 7 +ATOM 406 C CA . VAL A1 1 28 ? -9.645 9.072 -24.071 1.0 40.12 ? 28 A 7 +ATOM 407 C C . VAL A1 1 28 ? -10.423 7.954 -24.755 1.0 43.3 ? 28 A 7 +ATOM 408 O O . VAL A1 1 28 ? -11.491 7.553 -24.293 1.0 51.44 ? 28 A 7 +ATOM 409 C CB . VAL A1 1 28 ? -9.827 10.374 -24.874 1.0 70.14 ? 28 A 7 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.221 10.944 -24.657 1.0 13.41 ? 28 A 7 +ATOM 411 C CG2 . VAL A1 1 28 ? -8.761 11.389 -24.49 1.0 73.55 ? 28 A 7 +ATOM 412 H H . VAL A1 1 28 ? -7.556 9.35 -24.261 1.0 50.23 ? 28 A 7 +ATOM 413 H HA . VAL A1 1 28 ? -10.049 9.225 -23.081 1.0 62.42 ? 28 A 7 +ATOM 414 H HB . VAL A1 1 28 ? -9.715 10.145 -25.923 1.0 52.41 ? 28 A 7 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.437 11.669 -25.429 1.0 72.32 ? 28 A 7 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.947 10.146 -24.697 1.0 75.12 ? 28 A 7 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.267 11.425 -23.691 1.0 43.12 ? 28 A 7 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.615 11.372 -23.42 1.0 22.23 ? 28 A 7 +ATOM 419 H HG22 . VAL A1 1 28 ? -7.834 11.141 -24.985 1.0 21.24 ? 28 A 7 +ATOM 420 H HG23 . VAL A1 1 28 ? -9.078 12.377 -24.793 1.0 51.43 ? 28 A 7 +ATOM 421 N N . GLY A1 1 29 ? -9.88 7.452 -25.86 1.0 51.02 ? 29 A 7 +ATOM 422 C CA . GLY A1 1 29 ? -10.537 6.384 -26.591 1.0 24.21 ? 29 A 7 +ATOM 423 C C . GLY A1 1 29 ? -11.019 5.271 -25.681 1.0 62.32 ? 29 A 7 +ATOM 424 O O . GLY A1 1 29 ? -12.18 4.866 -25.747 1.0 1.41 ? 29 A 7 +ATOM 425 H H . GLY A1 1 29 ? -9.027 7.81 -26.182 1.0 25.44 ? 29 A 7 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.383 6.793 -27.122 1.0 33.14 ? 29 A 7 +ATOM 427 H HA3 . GLY A1 1 29 ? -9.84 5.971 -27.306 1.0 61.11 ? 29 A 7 +ATOM 428 N N . ALA A1 1 30 ? -10.127 4.775 -24.831 1.0 0.3 ? 30 A 7 +ATOM 429 C CA . ALA A1 1 30 ? -10.468 3.703 -23.904 1.0 24.42 ? 30 A 7 +ATOM 430 C C . ALA A1 1 30 ? -11.585 4.13 -22.958 1.0 23.15 ? 30 A 7 +ATOM 431 O O . ALA A1 1 30 ? -12.441 3.326 -22.588 1.0 23.32 ? 30 A 7 +ATOM 432 C CB . ALA A1 1 30 ? -9.239 3.276 -23.115 1.0 4.23 ? 30 A 7 +ATOM 433 H H . ALA A1 1 30 ? -9.217 5.139 -24.826 1.0 13.0 ? 30 A 7 +ATOM 434 H HA . ALA A1 1 30 ? -10.806 2.855 -24.484 1.0 42.35 ? 30 A 7 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.51 2.488 -22.428 1.0 24.3 ? 30 A 7 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.482 2.916 -23.796 1.0 15.25 ? 30 A 7 +ATOM 437 H HB3 . ALA A1 1 30 ? -8.855 4.12 -22.563 1.0 54.13 ? 30 A 7 +ATOM 438 N N . VAL A1 1 31 ? -11.57 5.4 -22.568 1.0 44.02 ? 31 A 7 +ATOM 439 C CA . VAL A1 1 31 ? -12.582 5.935 -21.664 1.0 44.43 ? 31 A 7 +ATOM 440 C C . VAL A1 1 31 ? -13.962 5.912 -22.31 1.0 22.33 ? 31 A 7 +ATOM 441 O O . VAL A1 1 31 ? -14.945 5.511 -21.686 1.0 41.34 ? 31 A 7 +ATOM 442 C CB . VAL A1 1 31 ? -12.25 7.378 -21.24 1.0 42.01 ? 31 A 7 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.378 7.962 -20.404 1.0 61.22 ? 31 A 7 +ATOM 444 C CG2 . VAL A1 1 31 ? -10.934 7.419 -20.478 1.0 34.2 ? 31 A 7 +ATOM 445 H H . VAL A1 1 31 ? -10.862 5.993 -22.896 1.0 33.11 ? 31 A 7 +ATOM 446 H HA . VAL A1 1 31 ? -12.598 5.316 -20.778 1.0 53.53 ? 31 A 7 +ATOM 447 H HB . VAL A1 1 31 ? -12.144 7.978 -22.131 1.0 34.14 ? 31 A 7 +ATOM 448 H HG11 . VAL A1 1 31 ? -12.972 8.386 -19.498 1.0 24.43 ? 31 A 7 +ATOM 449 H HG12 . VAL A1 1 31 ? -13.884 8.731 -20.968 1.0 62.24 ? 31 A 7 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.08 7.18 -20.151 1.0 4.44 ? 31 A 7 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.137 7.702 -21.149 1.0 32.4 ? 31 A 7 +ATOM 452 H HG22 . VAL A1 1 31 ? -11.004 8.141 -19.678 1.0 31.51 ? 31 A 7 +ATOM 453 H HG23 . VAL A1 1 31 ? -10.726 6.443 -20.064 1.0 2.41 ? 31 A 7 +ATOM 454 N N . LYS A1 1 32 ? -14.03 6.343 -23.565 1.0 44.33 ? 32 A 7 +ATOM 455 C CA . LYS A1 1 32 ? -15.29 6.371 -24.298 1.0 33.41 ? 32 A 7 +ATOM 456 C C . LYS A1 1 32 ? -15.945 4.994 -24.307 1.0 33.52 ? 32 A 7 +ATOM 457 O O . LYS A1 1 32 ? -17.156 4.87 -24.126 1.0 55.22 ? 32 A 7 +ATOM 458 C CB . LYS A1 1 32 ? -15.058 6.847 -25.734 1.0 21.43 ? 32 A 7 +ATOM 459 C CG . LYS A1 1 32 ? -15.779 8.141 -26.07 1.0 62.04 ? 32 A 7 +ATOM 460 C CD . LYS A1 1 32 ? -14.853 9.341 -25.956 1.0 13.3 ? 32 A 7 +ATOM 461 C CE . LYS A1 1 32 ? -14.328 9.771 -27.317 1.0 61.02 ? 32 A 7 +ATOM 462 N NZ . LYS A1 1 32 ? -13.756 8.626 -28.079 1.0 10.13 ? 32 A 7 +ATOM 463 H H . LYS A1 1 32 ? -13.211 6.65 -24.009 1.0 0.43 ? 32 A 7 +ATOM 464 H HA . LYS A1 1 32 ? -15.949 7.066 -23.8 1.0 20.21 ? 32 A 7 +ATOM 465 H HB2 . LYS A1 1 32 ? -13.999 7.0 -25.883 1.0 31.13 ? 32 A 7 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.401 6.081 -26.414 1.0 51.43 ? 32 A 7 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.151 8.082 -27.082 1.0 34.55 ? 32 A 7 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.606 8.269 -25.387 1.0 75.31 ? 32 A 7 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.397 10.163 -25.516 1.0 62.53 ? 32 A 7 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.017 9.08 -25.323 1.0 34.24 ? 32 A 7 +ATOM 471 H HE2 . LYS A1 1 32 ? -15.141 10.198 -27.884 1.0 32.35 ? 32 A 7 +ATOM 472 H HE3 . LYS A1 1 32 ? -13.56 10.516 -27.173 1.0 31.14 ? 32 A 7 +ATOM 473 H HZ1 . LYS A1 1 32 ? -13.059 8.121 -27.495 1.0 3.34 ? 32 A 7 +ATOM 474 H HZ2 . LYS A1 1 32 ? -13.288 8.969 -28.942 1.0 11.13 ? 32 A 7 +ATOM 475 H HZ3 . LYS A1 1 32 ? -14.511 7.963 -28.348 1.0 13.55 ? 32 A 7 +ATOM 476 N N . ALA A1 1 33 ? -15.136 3.96 -24.517 1.0 34.21 ? 33 A 7 +ATOM 477 C CA . ALA A1 1 33 ? -15.636 2.592 -24.546 1.0 60.31 ? 33 A 7 +ATOM 478 C C . ALA A1 1 33 ? -16.213 2.189 -23.193 1.0 31.03 ? 33 A 7 +ATOM 479 O O . ALA A1 1 33 ? -17.254 1.536 -23.119 1.0 31.32 ? 33 A 7 +ATOM 480 C CB . ALA A1 1 33 ? -14.528 1.633 -24.956 1.0 54.24 ? 33 A 7 +ATOM 481 H H . ALA A1 1 33 ? -14.179 4.122 -24.655 1.0 43.1 ? 33 A 7 +ATOM 482 H HA . ALA A1 1 33 ? -16.418 2.538 -25.29 1.0 53.01 ? 33 A 7 +ATOM 483 H HB1 . ALA A1 1 33 ? -13.655 1.811 -24.345 1.0 2.33 ? 33 A 7 +ATOM 484 H HB2 . ALA A1 1 33 ? -14.863 0.616 -24.819 1.0 61.23 ? 33 A 7 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.279 1.794 -25.995 1.0 53.23 ? 33 A 7 +ATOM 486 N N . LYS A1 1 34 ? -15.529 2.582 -22.124 1.0 30.14 ? 34 A 7 +ATOM 487 C CA . LYS A1 1 34 ? -15.972 2.263 -20.772 1.0 3.41 ? 34 A 7 +ATOM 488 C C . LYS A1 1 34 ? -17.356 2.846 -20.501 1.0 51.04 ? 34 A 7 +ATOM 489 O O . LYS A1 1 34 ? -18.217 2.182 -19.924 1.0 30.3 ? 34 A 7 +ATOM 490 C CB . LYS A1 1 34 ? -14.972 2.799 -19.745 1.0 63.02 ? 34 A 7 +ATOM 491 C CG . LYS A1 1 34 ? -15.329 2.453 -18.31 1.0 24.43 ? 34 A 7 +ATOM 492 C CD . LYS A1 1 34 ? -14.168 2.718 -17.367 1.0 44.42 ? 34 A 7 +ATOM 493 C CE . LYS A1 1 34 ? -14.599 2.622 -15.911 1.0 34.12 ? 34 A 7 +ATOM 494 N NZ . LYS A1 1 34 ? -14.026 1.423 -15.241 1.0 13.0 ? 34 A 7 +ATOM 495 H H . LYS A1 1 34 ? -14.706 3.1 -22.247 1.0 65.25 ? 34 A 7 +ATOM 496 H HA . LYS A1 1 34 ? -16.025 1.189 -20.685 1.0 3.22 ? 34 A 7 +ATOM 497 H HB2 . LYS A1 1 34 ? -13.997 2.387 -19.961 1.0 71.03 ? 34 A 7 +ATOM 498 H HB3 . LYS A1 1 34 ? -14.926 3.875 -19.833 1.0 71.12 ? 34 A 7 +ATOM 499 H HG2 . LYS A1 1 34 ? -16.173 3.054 -18.003 1.0 24.23 ? 34 A 7 +ATOM 500 H HG3 . LYS A1 1 34 ? -15.593 1.406 -18.257 1.0 22.21 ? 34 A 7 +ATOM 501 H HD2 . LYS A1 1 34 ? -13.393 1.989 -17.549 1.0 63.43 ? 34 A 7 +ATOM 502 H HD3 . LYS A1 1 34 ? -13.783 3.71 -17.554 1.0 75.33 ? 34 A 7 +ATOM 503 H HE2 . LYS A1 1 34 ? -14.266 3.508 -15.392 1.0 34.14 ? 34 A 7 +ATOM 504 H HE3 . LYS A1 1 34 ? -15.677 2.566 -15.872 1.0 0.12 ? 34 A 7 +ATOM 505 H HZ1 . LYS A1 1 34 ? -13.07 1.233 -15.604 1.0 62.42 ? 34 A 7 +ATOM 506 H HZ2 . LYS A1 1 34 ? -14.625 0.592 -15.421 1.0 14.2 ? 34 A 7 +ATOM 507 H HZ3 . LYS A1 1 34 ? -13.971 1.579 -14.214 1.0 65.2 ? 34 A 7 +ATOM 508 N N . ILE A1 1 35 ? -17.562 4.089 -20.924 1.0 14.42 ? 35 A 7 +ATOM 509 C CA . ILE A1 1 35 ? -18.842 4.759 -20.729 1.0 22.32 ? 35 A 7 +ATOM 510 C C . ILE A1 1 35 ? -19.944 4.085 -21.539 1.0 74.31 ? 35 A 7 +ATOM 511 O O . ILE A1 1 35 ? -21.089 3.997 -21.096 1.0 33.23 ? 35 A 7 +ATOM 512 C CB . ILE A1 1 35 ? -18.765 6.245 -21.125 1.0 42.5 ? 35 A 7 +ATOM 513 C CG1 . ILE A1 1 35 ? -17.633 6.94 -20.365 1.0 22.04 ? 35 A 7 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.094 6.935 -20.854 1.0 45.14 ? 35 A 7 +ATOM 515 C CD1 . ILE A1 1 35 ? -17.789 6.88 -18.861 1.0 11.1 ? 35 A 7 +ATOM 516 H H . ILE A1 1 35 ? -16.837 4.566 -21.378 1.0 54.44 ? 35 A 7 +ATOM 517 H HA . ILE A1 1 35 ? -19.093 4.699 -19.68 1.0 30.01 ? 35 A 7 +ATOM 518 H HB . ILE A1 1 35 ? -18.566 6.303 -22.184 1.0 2.44 ? 35 A 7 +ATOM 519 H HG12 . ILE A1 1 35 ? -16.696 6.471 -20.62 1.0 3.24 ? 35 A 7 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.601 7.981 -20.655 1.0 0.11 ? 35 A 7 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.819 6.204 -20.528 1.0 65.32 ? 35 A 7 +ATOM 522 H HG22 . ILE A1 1 35 ? -19.962 7.678 -20.082 1.0 43.1 ? 35 A 7 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.443 7.411 -21.757 1.0 75.41 ? 35 A 7 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.331 7.752 -18.417 1.0 43.52 ? 35 A 7 +ATOM 525 H HD12 . ILE A1 1 35 ? -18.839 6.858 -18.608 1.0 71.15 ? 35 A 7 +ATOM 526 H HD13 . ILE A1 1 35 ? -17.308 5.99 -18.484 1.0 74.3 ? 35 A 7 +ATOM 527 N N . TYR A1 1 36 ? -19.59 3.61 -22.728 1.0 62.53 ? 36 A 7 +ATOM 528 C CA . TYR A1 1 36 ? -20.549 2.944 -23.601 1.0 64.44 ? 36 A 7 +ATOM 529 C C . TYR A1 1 36 ? -21.198 1.758 -22.894 1.0 53.42 ? 36 A 7 +ATOM 530 O O . TYR A1 1 36 ? -22.414 1.574 -22.954 1.0 34.33 ? 36 A 7 +ATOM 531 C CB . TYR A1 1 36 ? -19.862 2.473 -24.884 1.0 74.42 ? 36 A 7 +ATOM 532 C CG . TYR A1 1 36 ? -20.204 1.051 -25.267 1.0 43.51 ? 36 A 7 +ATOM 533 C CD1 . TYR A1 1 36 ? -21.453 0.73 -25.783 1.0 62.31 ? 36 A 7 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.276 0.027 -25.113 1.0 22.21 ? 36 A 7 +ATOM 535 C CE1 . TYR A1 1 36 ? -21.769 -0.568 -26.134 1.0 25.24 ? 36 A 7 +ATOM 536 C CE2 . TYR A1 1 36 ? -19.583 -1.274 -25.462 1.0 24.41 ? 36 A 7 +ATOM 537 C CZ . TYR A1 1 36 ? -20.831 -1.566 -25.971 1.0 51.0 ? 36 A 7 +ATOM 538 O OH . TYR A1 1 36 ? -21.142 -2.861 -26.32 1.0 31.41 ? 36 A 7 +ATOM 539 H H . TYR A1 1 36 ? -18.662 3.71 -23.027 1.0 42.53 ? 36 A 7 +ATOM 540 H HA . TYR A1 1 36 ? -21.317 3.659 -23.858 1.0 45.34 ? 36 A 7 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.157 3.115 -25.699 1.0 32.41 ? 36 A 7 +ATOM 542 H HB3 . TYR A1 1 36 ? -18.791 2.534 -24.753 1.0 73.31 ? 36 A 7 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.185 1.514 -25.909 1.0 14.41 ? 36 A 7 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.299 0.26 -24.713 1.0 73.43 ? 36 A 7 +ATOM 545 H HE1 . TYR A1 1 36 ? -22.746 -0.798 -26.533 1.0 30.0 ? 36 A 7 +ATOM 546 H HE2 . TYR A1 1 36 ? -18.849 -2.056 -25.335 1.0 11.1 ? 36 A 7 +ATOM 547 H HH . TYR A1 1 36 ? -20.334 -3.346 -26.5 1.0 20.21 ? 36 A 7 +ATOM 548 N N . ASP A1 1 37 ? -20.378 0.957 -22.223 1.0 31.31 ? 37 A 7 +ATOM 549 C CA . ASP A1 1 37 ? -20.87 -0.211 -21.501 1.0 4.3 ? 37 A 7 +ATOM 550 C C . ASP A1 1 37 ? -21.566 0.203 -20.208 1.0 30.32 ? 37 A 7 +ATOM 551 O O . ASP A1 1 37 ? -22.528 -0.434 -19.777 1.0 62.0 ? 37 A 7 +ATOM 552 C CB . ASP A1 1 37 ? -19.718 -1.168 -21.191 1.0 35.43 ? 37 A 7 +ATOM 553 C CG . ASP A1 1 37 ? -20.021 -2.593 -21.611 1.0 34.32 ? 37 A 7 +ATOM 554 O OD1 . ASP A1 1 37 ? -19.874 -2.901 -22.812 1.0 31.12 ? 37 A 7 +ATOM 555 O OD2 . ASP A1 1 37 ? -20.405 -3.4 -20.739 1.0 3.2 ? 37 A 7 +ATOM 556 H H . ASP A1 1 37 ? -19.418 1.156 -22.212 1.0 51.42 ? 37 A 7 +ATOM 557 H HA . ASP A1 1 37 ? -21.584 -0.715 -22.134 1.0 32.24 ? 37 A 7 +ATOM 558 H HB2 . ASP A1 1 37 ? -18.833 -0.838 -21.716 1.0 43.14 ? 37 A 7 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.526 -1.158 -20.128 1.0 34.23 ? 37 A 7 +ATOM 560 N N . LYS A1 1 38 ? -21.073 1.272 -19.593 1.0 33.03 ? 38 A 7 +ATOM 561 C CA . LYS A1 1 38 ? -21.647 1.772 -18.349 1.0 33.5 ? 38 A 7 +ATOM 562 C C . LYS A1 1 38 ? -23.131 2.08 -18.519 1.0 62.1 ? 38 A 7 +ATOM 563 O O . LYS A1 1 38 ? -23.955 1.676 -17.7 1.0 13.24 ? 38 A 7 +ATOM 564 C CB . LYS A1 1 38 ? -20.904 3.029 -17.89 1.0 32.13 ? 38 A 7 +ATOM 565 C CG . LYS A1 1 38 ? -20.195 2.863 -16.557 1.0 11.13 ? 38 A 7 +ATOM 566 C CD . LYS A1 1 38 ? -18.734 2.49 -16.745 1.0 55.11 ? 38 A 7 +ATOM 567 C CE . LYS A1 1 38 ? -18.518 0.991 -16.602 1.0 12.13 ? 38 A 7 +ATOM 568 N NZ . LYS A1 1 38 ? -17.837 0.412 -17.793 1.0 62.42 ? 38 A 7 +ATOM 569 H H . LYS A1 1 38 ? -20.305 1.737 -19.986 1.0 40.1 ? 38 A 7 +ATOM 570 H HA . LYS A1 1 38 ? -21.534 1.003 -17.6 1.0 13.43 ? 38 A 7 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.168 3.29 -18.636 1.0 53.44 ? 38 A 7 +ATOM 572 H HB3 . LYS A1 1 38 ? -21.614 3.838 -17.798 1.0 74.35 ? 38 A 7 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.25 3.793 -16.012 1.0 72.35 ? 38 A 7 +ATOM 574 H HG3 . LYS A1 1 38 ? -20.686 2.083 -15.993 1.0 65.33 ? 38 A 7 +ATOM 575 H HD2 . LYS A1 1 38 ? -18.418 2.794 -17.732 1.0 31.44 ? 38 A 7 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.141 3.003 -16.001 1.0 51.13 ? 38 A 7 +ATOM 577 H HE2 . LYS A1 1 38 ? -17.912 0.81 -15.727 1.0 72.24 ? 38 A 7 +ATOM 578 H HE3 . LYS A1 1 38 ? -19.479 0.513 -16.479 1.0 52.14 ? 38 A 7 +ATOM 579 H HZ1 . LYS A1 1 38 ? -18.416 -0.349 -18.201 1.0 12.21 ? 38 A 7 +ATOM 580 H HZ2 . LYS A1 1 38 ? -16.912 0.021 -17.52 1.0 31.3 ? 38 A 7 +ATOM 581 H HZ3 . LYS A1 1 38 ? -17.691 1.147 -18.513 1.0 72.13 ? 38 A 7 +ATOM 582 N N . GLU A1 1 39 ? -23.464 2.795 -19.589 1.0 74.33 ? 39 A 7 +ATOM 583 C CA . GLU A1 1 39 ? -24.849 3.156 -19.866 1.0 31.43 ? 39 A 7 +ATOM 584 C C . GLU A1 1 39 ? -25.42 2.298 -20.992 1.0 55.55 ? 39 A 7 +ATOM 585 O O . GLU A1 1 39 ? -26.437 1.628 -20.822 1.0 44.25 ? 39 A 7 +ATOM 586 C CB . GLU A1 1 39 ? -24.95 4.637 -20.236 1.0 31.12 ? 39 A 7 +ATOM 587 C CG . GLU A1 1 39 ? -23.779 5.469 -19.743 1.0 22.34 ? 39 A 7 +ATOM 588 C CD . GLU A1 1 39 ? -23.755 5.606 -18.233 1.0 34.02 ? 39 A 7 +ATOM 589 O OE1 . GLU A1 1 39 ? -23.895 4.576 -17.541 1.0 60.52 ? 39 A 7 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.597 6.744 -17.743 1.0 24.54 ? 39 A 7 +ATOM 591 H H . GLU A1 1 39 ? -22.761 3.088 -20.206 1.0 53.12 ? 39 A 7 +ATOM 592 H HA . GLU A1 1 39 ? -25.423 2.979 -18.969 1.0 24.23 ? 39 A 7 +ATOM 593 H HB2 . GLU A1 1 39 ? -25.0 4.724 -21.312 1.0 13.32 ? 39 A 7 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.856 5.041 -19.81 1.0 53.15 ? 39 A 7 +ATOM 595 H HG2 . GLU A1 1 39 ? -22.86 4.998 -20.06 1.0 73.51 ? 39 A 7 +ATOM 596 H HG3 . GLU A1 1 39 ? -23.845 6.455 -20.178 1.0 55.55 ? 39 A 7 +ATOM 597 N N . GLY A1 1 40 ? -24.756 2.327 -22.144 1.0 41.31 ? 40 A 7 +ATOM 598 C CA . GLY A1 1 40 ? -25.212 1.549 -23.282 1.0 23.2 ? 40 A 7 +ATOM 599 C C . GLY A1 1 40 ? -25.48 2.409 -24.501 1.0 54.31 ? 40 A 7 +ATOM 600 O O . GLY A1 1 40 ? -26.515 2.266 -25.153 1.0 62.35 ? 40 A 7 +ATOM 601 H H . GLY A1 1 40 ? -23.951 2.88 -22.222 1.0 1.31 ? 40 A 7 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.457 0.818 -23.529 1.0 42.33 ? 40 A 7 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.122 1.035 -23.011 1.0 42.25 ? 40 A 7 +ATOM 604 N N . ILE A1 1 41 ? -24.548 3.304 -24.809 1.0 11.45 ? 41 A 7 +ATOM 605 C CA . ILE A1 1 41 ? -24.69 4.19 -25.957 1.0 13.21 ? 41 A 7 +ATOM 606 C C . ILE A1 1 41 ? -23.46 4.126 -26.856 1.0 73.14 ? 41 A 7 +ATOM 607 O O . ILE A1 1 41 ? -22.376 3.719 -26.439 1.0 54.03 ? 41 A 7 +ATOM 608 C CB . ILE A1 1 41 ? -24.916 5.649 -25.518 1.0 13.54 ? 41 A 7 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.104 5.957 -24.258 1.0 35.25 ? 41 A 7 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.396 5.907 -25.278 1.0 15.54 ? 41 A 7 +ATOM 611 C CD1 . ILE A1 1 41 ? -24.213 7.397 -23.806 1.0 51.21 ? 41 A 7 +ATOM 612 H H . ILE A1 1 41 ? -23.745 3.37 -24.25 1.0 10.31 ? 41 A 7 +ATOM 613 H HA . ILE A1 1 41 ? -25.553 3.868 -26.522 1.0 22.4 ? 41 A 7 +ATOM 614 H HB . ILE A1 1 41 ? -24.587 6.297 -26.317 1.0 2.22 ? 41 A 7 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.451 5.33 -23.452 1.0 53.25 ? 41 A 7 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.062 5.746 -24.45 1.0 73.21 ? 41 A 7 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.974 5.092 -25.688 1.0 41.34 ? 41 A 7 +ATOM 618 H HG22 . ILE A1 1 41 ? -26.58 5.98 -24.217 1.0 35.01 ? 41 A 7 +ATOM 619 H HG23 . ILE A1 1 41 ? -26.683 6.83 -25.758 1.0 24.24 ? 41 A 7 +ATOM 620 H HD11 . ILE A1 1 41 ? -24.994 7.891 -24.366 1.0 13.35 ? 41 A 7 +ATOM 621 H HD12 . ILE A1 1 41 ? -24.452 7.427 -22.753 1.0 5.02 ? 41 A 7 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.274 7.9 -23.978 1.0 73.01 ? 41 A 7 +ATOM 623 N N . PRO A1 1 42 ? -23.629 4.54 -28.121 1.0 42.01 ? 42 A 7 +ATOM 624 C CA . PRO A1 1 42 ? -22.543 4.542 -29.105 1.0 63.34 ? 42 A 7 +ATOM 625 C C . PRO A1 1 42 ? -21.485 5.595 -28.799 1.0 4.23 ? 42 A 7 +ATOM 626 O O . PRO A1 1 42 ? -21.751 6.797 -28.803 1.0 21.54 ? 42 A 7 +ATOM 627 C CB . PRO A1 1 42 ? -23.257 4.867 -30.42 1.0 63.45 ? 42 A 7 +ATOM 628 C CG . PRO A1 1 42 ? -24.479 5.614 -30.013 1.0 31.23 ? 42 A 7 +ATOM 629 C CD . PRO A1 1 42 ? -24.894 5.039 -28.687 1.0 52.22 ? 42 A 7 +ATOM 630 H HA . PRO A1 1 42 ? -22.073 3.572 -29.179 1.0 60.32 ? 42 A 7 +ATOM 631 H HB2 . PRO A1 1 42 ? -22.612 5.472 -31.042 1.0 50.23 ? 42 A 7 +ATOM 632 H HB3 . PRO A1 1 42 ? -23.507 3.951 -30.934 1.0 64.01 ? 42 A 7 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.251 6.664 -29.911 1.0 0.11 ? 42 A 7 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.26 5.468 -30.745 1.0 1.1 ? 42 A 7 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.321 5.806 -28.059 1.0 11.32 ? 42 A 7 +ATOM 636 H HD3 . PRO A1 1 42 ? -25.597 4.231 -28.829 1.0 34.03 ? 42 A 7 +ATOM 637 N N . PRO A1 1 43 ? -20.254 5.137 -28.527 1.0 1.41 ? 43 A 7 +ATOM 638 C CA . PRO A1 1 43 ? -19.13 6.025 -28.214 1.0 62.53 ? 43 A 7 +ATOM 639 C C . PRO A1 1 43 ? -18.67 6.827 -29.427 1.0 21.35 ? 43 A 7 +ATOM 640 O O . PRO A1 1 43 ? -18.194 7.954 -29.293 1.0 73.42 ? 43 A 7 +ATOM 641 C CB . PRO A1 1 43 ? -18.031 5.06 -27.763 1.0 74.43 ? 43 A 7 +ATOM 642 C CG . PRO A1 1 43 ? -18.363 3.769 -28.427 1.0 42.11 ? 43 A 7 +ATOM 643 C CD . PRO A1 1 43 ? -19.864 3.717 -28.504 1.0 32.53 ? 43 A 7 +ATOM 644 H HA . PRO A1 1 43 ? -19.371 6.701 -27.407 1.0 3.1 ? 43 A 7 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.068 5.433 -28.081 1.0 1.2 ? 43 A 7 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.049 4.966 -26.687 1.0 52.2 ? 43 A 7 +ATOM 647 H HG2 . PRO A1 1 43 ? -17.936 3.745 -29.418 1.0 21.5 ? 43 A 7 +ATOM 648 H HG3 . PRO A1 1 43 ? -17.99 2.945 -27.837 1.0 41.32 ? 43 A 7 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.179 3.216 -29.407 1.0 55.24 ? 43 A 7 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.27 3.221 -27.634 1.0 31.14 ? 43 A 7 +ATOM 651 N N . ASP A1 1 44 ? -18.814 6.238 -30.609 1.0 54.12 ? 44 A 7 +ATOM 652 C CA . ASP A1 1 44 ? -18.414 6.898 -31.846 1.0 51.34 ? 44 A 7 +ATOM 653 C C . ASP A1 1 44 ? -19.398 8.005 -32.213 1.0 65.34 ? 44 A 7 +ATOM 654 O O . ASP A1 1 44 ? -19.095 8.868 -33.037 1.0 41.23 ? 44 A 7 +ATOM 655 C CB . ASP A1 1 44 ? -18.322 5.882 -32.985 1.0 23.35 ? 44 A 7 +ATOM 656 C CG . ASP A1 1 44 ? -17.501 6.393 -34.152 1.0 52.14 ? 44 A 7 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.278 6.574 -33.982 1.0 70.43 ? 44 A 7 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.082 6.613 -35.236 1.0 15.14 ? 44 A 7 +ATOM 659 H H . ASP A1 1 44 ? -19.2 5.337 -30.65 1.0 64.31 ? 44 A 7 +ATOM 660 H HA . ASP A1 1 44 ? -17.441 7.337 -31.688 1.0 72.42 ? 44 A 7 +ATOM 661 H HB2 . ASP A1 1 44 ? -17.863 4.977 -32.615 1.0 64.21 ? 44 A 7 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.318 5.657 -33.339 1.0 74.33 ? 44 A 7 +ATOM 663 N N . GLN A1 1 45 ? -20.575 7.972 -31.598 1.0 24.51 ? 45 A 7 +ATOM 664 C CA . GLN A1 1 45 ? -21.603 8.972 -31.862 1.0 55.1 ? 45 A 7 +ATOM 665 C C . GLN A1 1 45 ? -21.565 10.081 -30.816 1.0 65.33 ? 45 A 7 +ATOM 666 O O . GLN A1 1 45 ? -22.194 11.126 -30.983 1.0 0.12 ? 45 A 7 +ATOM 667 C CB . GLN A1 1 45 ? -22.987 8.319 -31.88 1.0 3.33 ? 45 A 7 +ATOM 668 C CG . GLN A1 1 45 ? -23.389 7.783 -33.244 1.0 71.05 ? 45 A 7 +ATOM 669 C CD . GLN A1 1 45 ? -24.403 6.66 -33.154 1.0 50.21 ? 45 A 7 +ATOM 670 O OE1 . GLN A1 1 45 ? -25.506 6.844 -32.639 1.0 30.33 ? 45 A 7 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.035 5.487 -33.657 1.0 54.11 ? 45 A 7 +ATOM 672 H H . GLN A1 1 45 ? -20.757 7.259 -30.951 1.0 33.14 ? 45 A 7 +ATOM 673 H HA . GLN A1 1 45 ? -21.406 9.402 -32.832 1.0 54.13 ? 45 A 7 +ATOM 674 H HB2 . GLN A1 1 45 ? -22.993 7.498 -31.178 1.0 72.22 ? 45 A 7 +ATOM 675 H HB3 . GLN A1 1 45 ? -23.72 9.05 -31.574 1.0 51.24 ? 45 A 7 +ATOM 676 H HG2 . GLN A1 1 45 ? -23.818 8.589 -33.821 1.0 11.31 ? 45 A 7 +ATOM 677 H HG3 . GLN A1 1 45 ? -22.506 7.413 -33.745 1.0 33.23 ? 45 A 7 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.14 5.414 -34.051 1.0 35.4 ? 45 A 7 +ATOM 679 H HE22 . GLN A1 1 45 ? -24.67 4.744 -33.612 1.0 53.4 ? 45 A 7 +ATOM 680 N N . GLN A1 1 46 ? -20.824 9.847 -29.738 1.0 5.34 ? 46 A 7 +ATOM 681 C CA . GLN A1 1 46 ? -20.705 10.827 -28.665 1.0 54.21 ? 46 A 7 +ATOM 682 C C . GLN A1 1 46 ? -19.275 11.346 -28.558 1.0 23.33 ? 46 A 7 +ATOM 683 O O . GLN A1 1 46 ? -18.321 10.638 -28.88 1.0 42.0 ? 46 A 7 +ATOM 684 C CB . GLN A1 1 46 ? -21.138 10.211 -27.333 1.0 54.1 ? 46 A 7 +ATOM 685 C CG . GLN A1 1 46 ? -20.292 9.021 -26.91 1.0 63.33 ? 46 A 7 +ATOM 686 C CD . GLN A1 1 46 ? -20.183 8.889 -25.404 1.0 73.34 ? 46 A 7 +ATOM 687 O OE1 . GLN A1 1 46 ? -21.161 8.579 -24.724 1.0 62.34 ? 46 A 7 +ATOM 688 N NE2 . GLN A1 1 46 ? -18.988 9.124 -24.874 1.0 52.51 ? 46 A 7 +ATOM 689 H H . GLN A1 1 46 ? -20.346 8.995 -29.663 1.0 61.13 ? 46 A 7 +ATOM 690 H HA . GLN A1 1 46 ? -21.359 11.654 -28.898 1.0 1.54 ? 46 A 7 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.071 10.965 -26.563 1.0 70.34 ? 46 A 7 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.164 9.884 -27.418 1.0 24.41 ? 46 A 7 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.739 8.12 -27.303 1.0 71.34 ? 46 A 7 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.3 9.137 -27.32 1.0 12.44 ? 46 A 7 +ATOM 695 H HE21 . GLN A1 1 46 ? -18.254 9.368 -25.478 1.0 61.21 ? 46 A 7 +ATOM 696 H HE22 . GLN A1 1 46 ? -18.889 9.047 -23.903 1.0 54.41 ? 46 A 7 +ATOM 697 N N . ARG A1 1 47 ? -19.134 12.587 -28.104 1.0 11.31 ? 47 A 7 +ATOM 698 C CA . ARG A1 1 47 ? -17.821 13.202 -27.956 1.0 74.42 ? 47 A 7 +ATOM 699 C C . ARG A1 1 47 ? -17.72 13.958 -26.634 1.0 0.05 ? 47 A 7 +ATOM 700 O O . ARG A1 1 47 ? -18.73 14.233 -25.985 1.0 62.43 ? 47 A 7 +ATOM 701 C CB . ARG A1 1 47 ? -17.545 14.153 -29.122 1.0 53.24 ? 47 A 7 +ATOM 702 C CG . ARG A1 1 47 ? -17.727 13.511 -30.487 1.0 25.13 ? 47 A 7 +ATOM 703 C CD . ARG A1 1 47 ? -17.195 14.404 -31.598 1.0 74.31 ? 47 A 7 +ATOM 704 N NE . ARG A1 1 47 ? -17.435 13.834 -32.921 1.0 72.02 ? 47 A 7 +ATOM 705 C CZ . ARG A1 1 47 ? -17.357 14.533 -34.047 1.0 4.33 ? 47 A 7 +ATOM 706 N NH1 . ARG A1 1 47 ? -17.046 15.821 -34.012 1.0 22.33 ? 47 A 7 +ATOM 707 N NH2 . ARG A1 1 47 ? -17.589 13.943 -35.213 1.0 24.44 ? 47 A 7 +ATOM 708 H H . ARG A1 1 47 ? -19.933 13.102 -27.863 1.0 14.32 ? 47 A 7 +ATOM 709 H HA . ARG A1 1 47 ? -17.083 12.414 -27.963 1.0 52.1 ? 47 A 7 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.218 14.995 -29.052 1.0 12.43 ? 47 A 7 +ATOM 711 H HB3 . ARG A1 1 47 ? -16.528 14.509 -29.048 1.0 31.22 ? 47 A 7 +ATOM 712 H HG2 . ARG A1 1 47 ? -17.192 12.573 -30.508 1.0 2.15 ? 47 A 7 +ATOM 713 H HG3 . ARG A1 1 47 ? -18.779 13.332 -30.653 1.0 3.22 ? 47 A 7 +ATOM 714 H HD2 . ARG A1 1 47 ? -17.685 15.364 -31.536 1.0 62.34 ? 47 A 7 +ATOM 715 H HD3 . ARG A1 1 47 ? -16.132 14.533 -31.459 1.0 4.32 ? 47 A 7 +ATOM 716 H HE . ARG A1 1 47 ? -17.666 12.883 -32.97 1.0 51.12 ? 47 A 7 +ATOM 717 H HH11 . ARG A1 1 47 ? -16.869 16.268 -33.135 1.0 35.02 ? 47 A 7 +ATOM 718 H HH12 . ARG A1 1 47 ? -16.986 16.345 -34.862 1.0 42.25 ? 47 A 7 +ATOM 719 H HH21 . ARG A1 1 47 ? -17.824 12.972 -35.244 1.0 32.54 ? 47 A 7 +ATOM 720 H HH22 . ARG A1 1 47 ? -17.53 14.47 -36.06 1.0 51.04 ? 47 A 7 +ATOM 721 N N . LEU A1 1 48 ? -16.496 14.291 -26.241 1.0 13.42 ? 48 A 7 +ATOM 722 C CA . LEU A1 1 48 ? -16.262 15.015 -24.996 1.0 63.04 ? 48 A 7 +ATOM 723 C C . LEU A1 1 48 ? -15.955 16.484 -25.27 1.0 70.54 ? 48 A 7 +ATOM 724 O O . LEU A1 1 48 ? -15.359 16.823 -26.292 1.0 13.22 ? 48 A 7 +ATOM 725 C CB . LEU A1 1 48 ? -15.108 14.377 -24.22 1.0 73.22 ? 48 A 7 +ATOM 726 C CG . LEU A1 1 48 ? -14.991 12.856 -24.322 1.0 23.01 ? 48 A 7 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.368 12.21 -24.278 1.0 2.23 ? 48 A 7 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.256 12.462 -25.595 1.0 62.5 ? 48 A 7 +ATOM 729 H H . LEU A1 1 48 ? -15.73 14.045 -26.8 1.0 13.1 ? 48 A 7 +ATOM 730 H HA . LEU A1 1 48 ? -17.162 14.952 -24.403 1.0 5.14 ? 48 A 7 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.188 14.804 -24.587 1.0 14.35 ? 48 A 7 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.232 14.631 -23.177 1.0 62.22 ? 48 A 7 +ATOM 733 H HG . LEU A1 1 48 ? -14.423 12.487 -23.479 1.0 74.12 ? 48 A 7 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.057 12.867 -23.769 1.0 72.12 ? 48 A 7 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.308 11.271 -23.748 1.0 51.52 ? 48 A 7 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.715 12.033 -25.285 1.0 50.13 ? 48 A 7 +ATOM 737 H HD21 . LEU A1 1 48 ? -13.612 13.271 -25.904 1.0 32.51 ? 48 A 7 +ATOM 738 H HD22 . LEU A1 1 48 ? -14.974 12.254 -26.375 1.0 4.35 ? 48 A 7 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.662 11.578 -25.409 1.0 44.23 ? 48 A 7 +ATOM 740 N N . ILE A1 1 49 ? -16.364 17.35 -24.349 1.0 13.31 ? 49 A 7 +ATOM 741 C CA . ILE A1 1 49 ? -16.13 18.782 -24.489 1.0 13.25 ? 49 A 7 +ATOM 742 C C . ILE A1 1 49 ? -15.741 19.409 -23.155 1.0 73.24 ? 49 A 7 +ATOM 743 O O . ILE A1 1 49 ? -16.429 19.232 -22.15 1.0 20.41 ? 49 A 7 +ATOM 744 C CB . ILE A1 1 49 ? -17.373 19.504 -25.041 1.0 42.12 ? 49 A 7 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.475 19.307 -26.555 1.0 21.4 ? 49 A 7 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.322 20.985 -24.696 1.0 44.11 ? 49 A 7 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.74 18.6 -26.988 1.0 30.32 ? 49 A 7 +ATOM 748 H H . ILE A1 1 49 ? -16.834 17.018 -23.555 1.0 11.12 ? 49 A 7 +ATOM 749 H HA . ILE A1 1 49 ? -15.318 18.919 -25.19 1.0 31.54 ? 49 A 7 +ATOM 750 H HB . ILE A1 1 49 ? -18.247 19.08 -24.57 1.0 10.22 ? 49 A 7 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.452 20.27 -27.039 1.0 52.53 ? 49 A 7 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.633 18.719 -26.891 1.0 23.14 ? 49 A 7 +ATOM 753 H HG21 . ILE A1 1 49 ? -17.512 21.116 -23.641 1.0 54.41 ? 49 A 7 +ATOM 754 H HG22 . ILE A1 1 49 ? -16.344 21.376 -24.936 1.0 2.4 ? 49 A 7 +ATOM 755 H HG23 . ILE A1 1 49 ? -18.071 21.514 -25.265 1.0 53.42 ? 49 A 7 +ATOM 756 H HD11 . ILE A1 1 49 ? -18.516 17.934 -27.809 1.0 43.14 ? 49 A 7 +ATOM 757 H HD12 . ILE A1 1 49 ? -19.136 18.029 -26.161 1.0 61.33 ? 49 A 7 +ATOM 758 H HD13 . ILE A1 1 49 ? -19.47 19.329 -27.306 1.0 3.14 ? 49 A 7 +ATOM 759 N N . PHE A1 1 50 ? -14.635 20.145 -23.153 1.0 0.44 ? 50 A 7 +ATOM 760 C CA . PHE A1 1 50 ? -14.154 20.8 -21.943 1.0 63.4 ? 50 A 7 +ATOM 761 C C . PHE A1 1 50 ? -14.117 22.315 -22.122 1.0 34.31 ? 50 A 7 +ATOM 762 O O . PHE A1 1 50 ? -13.281 22.844 -22.853 1.0 24.03 ? 50 A 7 +ATOM 763 C CB . PHE A1 1 50 ? -12.761 20.284 -21.577 1.0 1.31 ? 50 A 7 +ATOM 764 C CG . PHE A1 1 50 ? -12.344 20.626 -20.175 1.0 63.44 ? 50 A 7 +ATOM 765 C CD1 . PHE A1 1 50 ? -13.088 20.189 -19.091 1.0 63.22 ? 50 A 7 +ATOM 766 C CD2 . PHE A1 1 50 ? -11.209 21.386 -19.941 1.0 31.12 ? 50 A 7 +ATOM 767 C CE1 . PHE A1 1 50 ? -12.707 20.502 -17.799 1.0 44.05 ? 50 A 7 +ATOM 768 C CE2 . PHE A1 1 50 ? -10.823 21.701 -18.652 1.0 53.14 ? 50 A 7 +ATOM 769 C CZ . PHE A1 1 50 ? -11.573 21.26 -17.58 1.0 64.24 ? 50 A 7 +ATOM 770 H H . PHE A1 1 50 ? -14.129 20.249 -23.987 1.0 32.43 ? 50 A 7 +ATOM 771 H HA . PHE A1 1 50 ? -14.839 20.561 -21.143 1.0 55.42 ? 50 A 7 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.746 19.209 -21.674 1.0 72.21 ? 50 A 7 +ATOM 773 H HB3 . PHE A1 1 50 ? -12.037 20.713 -22.253 1.0 52.42 ? 50 A 7 +ATOM 774 H HD1 . PHE A1 1 50 ? -13.975 19.596 -19.261 1.0 64.41 ? 50 A 7 +ATOM 775 H HD2 . PHE A1 1 50 ? -10.621 21.733 -20.779 1.0 25.0 ? 50 A 7 +ATOM 776 H HE1 . PHE A1 1 50 ? -13.296 20.155 -16.963 1.0 33.34 ? 50 A 7 +ATOM 777 H HE2 . PHE A1 1 50 ? -9.936 22.294 -18.484 1.0 34.14 ? 50 A 7 +ATOM 778 H HZ . PHE A1 1 50 ? -11.273 21.504 -16.572 1.0 42.2 ? 50 A 7 +ATOM 779 N N . GLY A1 1 51 ? -15.031 23.007 -21.449 1.0 53.44 ? 51 A 7 +ATOM 780 C CA . GLY A1 1 51 ? -15.087 24.454 -21.548 1.0 33.5 ? 51 A 7 +ATOM 781 C C . GLY A1 1 51 ? -15.652 24.923 -22.874 1.0 34.32 ? 51 A 7 +ATOM 782 O O . GLY A1 1 51 ? -15.829 26.121 -23.092 1.0 0.02 ? 51 A 7 +ATOM 783 H H . GLY A1 1 51 ? -15.673 22.532 -20.882 1.0 14.34 ? 51 A 7 +ATOM 784 H HA2 . GLY A1 1 51 ? -15.706 24.835 -20.75 1.0 71.3 ? 51 A 7 +ATOM 785 H HA3 . GLY A1 1 51 ? -14.088 24.85 -21.435 1.0 2.33 ? 51 A 7 +ATOM 786 N N . GLY A1 1 52 ? -15.934 23.977 -23.764 1.0 51.33 ? 52 A 7 +ATOM 787 C CA . GLY A1 1 52 ? -16.477 24.32 -25.065 1.0 70.11 ? 52 A 7 +ATOM 788 C C . GLY A1 1 52 ? -15.736 23.641 -26.2 1.0 64.35 ? 52 A 7 +ATOM 789 O O . GLY A1 1 52 ? -16.289 23.442 -27.282 1.0 21.12 ? 52 A 7 +ATOM 790 H H . GLY A1 1 52 ? -15.772 23.037 -23.535 1.0 52.33 ? 52 A 7 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.515 24.024 -25.099 1.0 34.31 ? 52 A 7 +ATOM 792 H HA3 . GLY A1 1 52 ? -16.413 25.39 -25.198 1.0 33.12 ? 52 A 7 +ATOM 793 N N . LYS A1 1 53 ? -14.479 23.286 -25.955 1.0 4.12 ? 53 A 7 +ATOM 794 C CA . LYS A1 1 53 ? -13.66 22.626 -26.965 1.0 20.15 ? 53 A 7 +ATOM 795 C C . LYS A1 1 53 ? -13.745 21.109 -26.828 1.0 12.34 ? 53 A 7 +ATOM 796 O O . LYS A1 1 53 ? -13.847 20.582 -25.721 1.0 53.3 ? 53 A 7 +ATOM 797 C CB . LYS A1 1 53 ? -12.203 23.078 -26.844 1.0 12.13 ? 53 A 7 +ATOM 798 C CG . LYS A1 1 53 ? -11.586 22.787 -25.486 1.0 34.42 ? 53 A 7 +ATOM 799 C CD . LYS A1 1 53 ? -10.872 21.446 -25.474 1.0 44.0 ? 53 A 7 +ATOM 800 C CE . LYS A1 1 53 ? -9.693 21.434 -26.435 1.0 75.53 ? 53 A 7 +ATOM 801 N NZ . LYS A1 1 53 ? -8.392 21.354 -25.715 1.0 61.53 ? 53 A 7 +ATOM 802 H H . LYS A1 1 53 ? -14.094 23.472 -25.073 1.0 32.12 ? 53 A 7 +ATOM 803 H HA . LYS A1 1 53 ? -14.036 22.91 -27.935 1.0 74.23 ? 53 A 7 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.618 22.573 -27.597 1.0 34.02 ? 53 A 7 +ATOM 805 H HB3 . LYS A1 1 53 ? -12.154 24.144 -27.017 1.0 32.22 ? 53 A 7 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.874 23.564 -25.25 1.0 24.24 ? 53 A 7 +ATOM 807 H HG3 . LYS A1 1 53 ? -12.369 22.775 -24.741 1.0 53.0 ? 53 A 7 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.511 21.25 -24.476 1.0 22.42 ? 53 A 7 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.571 20.674 -25.764 1.0 0.05 ? 53 A 7 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.787 20.579 -27.087 1.0 25.2 ? 53 A 7 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.716 22.339 -27.023 1.0 75.24 ? 53 A 7 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.676 20.903 -26.319 1.0 1.33 ? 53 A 7 +ATOM 813 H HZ2 . LYS A1 1 53 ? -8.499 20.795 -24.845 1.0 14.14 ? 53 A 7 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.065 22.308 -25.462 1.0 31.25 ? 53 A 7 +ATOM 815 N N . GLN A1 1 54 ? -13.702 20.414 -27.96 1.0 32.1 ? 54 A 7 +ATOM 816 C CA . GLN A1 1 54 ? -13.774 18.958 -27.966 1.0 3.14 ? 54 A 7 +ATOM 817 C C . GLN A1 1 54 ? -12.476 18.347 -27.448 1.0 14.5 ? 54 A 7 +ATOM 818 O O . GLN A1 1 54 ? -11.445 19.018 -27.38 1.0 22.04 ? 54 A 7 +ATOM 819 C CB . GLN A1 1 54 ? -14.065 18.446 -29.377 1.0 14.03 ? 54 A 7 +ATOM 820 C CG . GLN A1 1 54 ? -15.501 17.987 -29.574 1.0 52.41 ? 54 A 7 +ATOM 821 C CD . GLN A1 1 54 ? -16.46 19.142 -29.778 1.0 44.23 ? 54 A 7 +ATOM 822 O OE1 . GLN A1 1 54 ? -16.198 20.266 -29.348 1.0 25.33 ? 54 A 7 +ATOM 823 N NE2 . GLN A1 1 54 ? -17.58 18.872 -30.439 1.0 63.1 ? 54 A 7 +ATOM 824 H H . GLN A1 1 54 ? -13.62 20.892 -28.812 1.0 52.11 ? 54 A 7 +ATOM 825 H HA . GLN A1 1 54 ? -14.581 18.664 -27.312 1.0 62.04 ? 54 A 7 +ATOM 826 H HB2 . GLN A1 1 54 ? -13.863 19.237 -30.083 1.0 31.24 ? 54 A 7 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.412 17.612 -29.587 1.0 25.42 ? 54 A 7 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.545 17.345 -30.441 1.0 52.11 ? 54 A 7 +ATOM 829 H HG3 . GLN A1 1 54 ? -15.81 17.431 -28.7 1.0 53.52 ? 54 A 7 +ATOM 830 H HE21 . GLN A1 1 54 ? -17.723 17.954 -30.752 1.0 45.55 ? 54 A 7 +ATOM 831 H HE22 . GLN A1 1 54 ? -18.219 19.6 -30.585 1.0 62.42 ? 54 A 7 +ATOM 832 N N . LEU A1 1 55 ? -12.533 17.071 -27.084 1.0 51.34 ? 55 A 7 +ATOM 833 C CA . LEU A1 1 55 ? -11.361 16.369 -26.571 1.0 40.45 ? 55 A 7 +ATOM 834 C C . LEU A1 1 55 ? -10.943 15.246 -27.515 1.0 63.5 ? 55 A 7 +ATOM 835 O O . LEU A1 1 55 ? -11.757 14.401 -27.887 1.0 52.11 ? 55 A 7 +ATOM 836 C CB . LEU A1 1 55 ? -11.65 15.8 -25.181 1.0 25.03 ? 55 A 7 +ATOM 837 C CG . LEU A1 1 55 ? -12.203 16.789 -24.153 1.0 41.33 ? 55 A 7 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.328 16.127 -22.79 1.0 33.24 ? 55 A 7 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.318 18.023 -24.071 1.0 52.23 ? 55 A 7 +ATOM 840 H H . LEU A1 1 55 ? -13.382 16.589 -27.16 1.0 12.34 ? 55 A 7 +ATOM 841 H HA . LEU A1 1 55 ? -10.553 17.081 -26.499 1.0 22.21 ? 55 A 7 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.369 15.003 -25.292 1.0 55.1 ? 55 A 7 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.726 15.398 -24.79 1.0 51.11 ? 55 A 7 +ATOM 844 H HG . LEU A1 1 55 ? -13.191 17.104 -24.462 1.0 72.12 ? 55 A 7 +ATOM 845 H HD11 . LEU A1 1 55 ? -12.198 16.869 -22.017 1.0 32.04 ? 55 A 7 +ATOM 846 H HD12 . LEU A1 1 55 ? -11.569 15.365 -22.689 1.0 44.35 ? 55 A 7 +ATOM 847 H HD13 . LEU A1 1 55 ? -13.305 15.676 -22.696 1.0 32.21 ? 55 A 7 +ATOM 848 H HD21 . LEU A1 1 55 ? -10.339 17.741 -23.712 1.0 33.14 ? 55 A 7 +ATOM 849 H HD22 . LEU A1 1 55 ? -11.759 18.737 -23.391 1.0 72.01 ? 55 A 7 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.228 18.468 -25.051 1.0 74.33 ? 55 A 7 +ATOM 851 N N . GLU A1 1 56 ? -9.67 15.243 -27.897 1.0 12.02 ? 56 A 7 +ATOM 852 C CA . GLU A1 1 56 ? -9.145 14.223 -28.796 1.0 31.33 ? 56 A 7 +ATOM 853 C C . GLU A1 1 56 ? -9.161 12.85 -28.131 1.0 62.51 ? 56 A 7 +ATOM 854 O O . GLU A1 1 56 ? -9.572 12.712 -26.978 1.0 51.02 ? 56 A 7 +ATOM 855 C CB . GLU A1 1 56 ? -7.719 14.576 -29.227 1.0 62.01 ? 56 A 7 +ATOM 856 C CG . GLU A1 1 56 ? -7.578 15.991 -29.762 1.0 21.02 ? 56 A 7 +ATOM 857 C CD . GLU A1 1 56 ? -6.163 16.307 -30.207 1.0 1.0 ? 56 A 7 +ATOM 858 O OE1 . GLU A1 1 56 ? -5.31 15.396 -30.161 1.0 61.34 ? 56 A 7 +ATOM 859 O OE2 . GLU A1 1 56 ? -5.909 17.465 -30.599 1.0 22.01 ? 56 A 7 +ATOM 860 H H . GLU A1 1 56 ? -9.07 15.944 -27.566 1.0 72.43 ? 56 A 7 +ATOM 861 H HA . GLU A1 1 56 ? -9.778 14.194 -29.67 1.0 4.21 ? 56 A 7 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.062 14.467 -28.377 1.0 41.11 ? 56 A 7 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.41 13.888 -30.0 1.0 51.02 ? 56 A 7 +ATOM 864 H HG2 . GLU A1 1 56 ? -8.239 16.11 -30.607 1.0 71.31 ? 56 A 7 +ATOM 865 H HG3 . GLU A1 1 56 ? -7.859 16.686 -28.985 1.0 60.44 ? 56 A 7 +ATOM 866 N N . ASP A1 1 57 ? -8.713 11.838 -28.865 1.0 71.03 ? 57 A 7 +ATOM 867 C CA . ASP A1 1 57 ? -8.676 10.475 -28.346 1.0 63.41 ? 57 A 7 +ATOM 868 C C . ASP A1 1 57 ? -7.57 10.319 -27.307 1.0 21.4 ? 57 A 7 +ATOM 869 O O . ASP A1 1 57 ? -7.608 9.412 -26.476 1.0 43.31 ? 57 A 7 +ATOM 870 C CB . ASP A1 1 57 ? -8.465 9.478 -29.487 1.0 45.31 ? 57 A 7 +ATOM 871 C CG . ASP A1 1 57 ? -9.215 9.871 -30.745 1.0 55.43 ? 57 A 7 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.337 10.405 -30.624 1.0 72.35 ? 57 A 7 +ATOM 873 O OD2 . ASP A1 1 57 ? -8.68 9.644 -31.851 1.0 15.11 ? 57 A 7 +ATOM 874 H H . ASP A1 1 57 ? -8.399 12.011 -29.777 1.0 23.12 ? 57 A 7 +ATOM 875 H HA . ASP A1 1 57 ? -9.626 10.273 -27.875 1.0 62.14 ? 57 A 7 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.411 9.426 -29.721 1.0 24.44 ? 57 A 7 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.809 8.504 -29.173 1.0 64.03 ? 57 A 7 +ATOM 878 N N . SER A1 1 58 ? -6.584 11.209 -27.361 1.0 32.51 ? 58 A 7 +ATOM 879 C CA . SER A1 1 58 ? -5.465 11.168 -26.428 1.0 62.24 ? 58 A 7 +ATOM 880 C C . SER A1 1 58 ? -5.519 12.346 -25.46 1.0 2.12 ? 58 A 7 +ATOM 881 O O . SER A1 1 58 ? -4.624 12.53 -24.638 1.0 12.21 ? 58 A 7 +ATOM 882 C CB . SER A1 1 58 ? -4.138 11.179 -27.189 1.0 65.11 ? 58 A 7 +ATOM 883 O OG . SER A1 1 58 ? -3.052 10.886 -26.327 1.0 34.21 ? 58 A 7 +ATOM 884 H H . SER A1 1 58 ? -6.61 11.909 -28.047 1.0 21.03 ? 58 A 7 +ATOM 885 H HA . SER A1 1 58 ? -5.538 10.25 -25.863 1.0 33.55 ? 58 A 7 +ATOM 886 H HB2 . SER A1 1 58 ? -4.169 10.439 -27.973 1.0 31.42 ? 58 A 7 +ATOM 887 H HB3 . SER A1 1 58 ? -3.984 12.157 -27.623 1.0 40.4 ? 58 A 7 +ATOM 888 H HG . SER A1 1 58 ? -2.424 10.321 -26.783 1.0 10.23 ? 58 A 7 +ATOM 889 N N . ASN A1 1 59 ? -6.578 13.142 -25.567 1.0 35.41 ? 59 A 7 +ATOM 890 C CA . ASN A1 1 59 ? -6.751 14.304 -24.703 1.0 52.34 ? 59 A 7 +ATOM 891 C C . ASN A1 1 59 ? -7.307 13.893 -23.343 1.0 4.01 ? 59 A 7 +ATOM 892 O O . ASN A1 1 59 ? -8.517 13.919 -23.122 1.0 42.21 ? 59 A 7 +ATOM 893 C CB . ASN A1 1 59 ? -7.686 15.321 -25.361 1.0 21.1 ? 59 A 7 +ATOM 894 C CG . ASN A1 1 59 ? -7.249 16.752 -25.114 1.0 14.54 ? 59 A 7 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.06 17.032 -24.963 1.0 24.42 ? 59 A 7 +ATOM 896 N ND2 . ASN A1 1 59 ? -8.211 17.666 -25.073 1.0 14.44 ? 59 A 7 +ATOM 897 H H . ASN A1 1 59 ? -7.26 12.944 -26.243 1.0 5.51 ? 59 A 7 +ATOM 898 H HA . ASN A1 1 59 ? -5.782 14.758 -24.56 1.0 74.51 ? 59 A 7 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.701 15.149 -26.428 1.0 43.43 ? 59 A 7 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.682 15.195 -24.966 1.0 11.21 ? 59 A 7 +ATOM 901 H HD21 . ASN A1 1 59 ? -9.137 17.37 -25.202 1.0 21.33 ? 59 A 7 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.957 18.599 -24.915 1.0 12.0 ? 59 A 7 +ATOM 903 N N . ALA A1 1 60 ? -6.413 13.514 -22.435 1.0 13.11 ? 60 A 7 +ATOM 904 C CA . ALA A1 1 60 ? -6.814 13.099 -21.096 1.0 35.51 ? 60 A 7 +ATOM 905 C C . ALA A1 1 60 ? -5.596 12.807 -20.225 1.0 74.01 ? 60 A 7 +ATOM 906 O O . ALA A1 1 60 ? -5.098 13.686 -19.523 1.0 74.24 ? 60 A 7 +ATOM 907 C CB . ALA A1 1 60 ? -7.718 11.878 -21.169 1.0 64.13 ? 60 A 7 +ATOM 908 H H . ALA A1 1 60 ? -5.462 13.514 -22.671 1.0 31.12 ? 60 A 7 +ATOM 909 H HA . ALA A1 1 60 ? -7.376 13.907 -20.65 1.0 20.01 ? 60 A 7 +ATOM 910 H HB1 . ALA A1 1 60 ? -7.261 11.131 -21.802 1.0 72.33 ? 60 A 7 +ATOM 911 H HB2 . ALA A1 1 60 ? -7.859 11.475 -20.178 1.0 25.02 ? 60 A 7 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.674 12.163 -21.582 1.0 51.02 ? 60 A 7 +ATOM 913 N N . MET A1 1 61 ? -5.123 11.566 -20.275 1.0 21.52 ? 61 A 7 +ATOM 914 C CA . MET A1 1 61 ? -3.964 11.158 -19.491 1.0 32.03 ? 61 A 7 +ATOM 915 C C . MET A1 1 61 ? -2.798 12.118 -19.705 1.0 55.14 ? 61 A 7 +ATOM 916 O O . MET A1 1 61 ? -2.227 12.64 -18.747 1.0 73.23 ? 61 A 7 +ATOM 917 C CB . MET A1 1 61 ? -3.543 9.735 -19.864 1.0 33.12 ? 61 A 7 +ATOM 918 C CG . MET A1 1 61 ? -3.79 9.392 -21.324 1.0 10.31 ? 61 A 7 +ATOM 919 S SD . MET A1 1 61 ? -2.48 8.374 -22.029 1.0 3.45 ? 61 A 7 +ATOM 920 C CE . MET A1 1 61 ? -1.89 9.442 -23.341 1.0 11.34 ? 61 A 7 +ATOM 921 H H . MET A1 1 61 ? -5.563 10.909 -20.854 1.0 44.35 ? 61 A 7 +ATOM 922 H HA . MET A1 1 61 ? -4.245 11.179 -18.449 1.0 14.21 ? 61 A 7 +ATOM 923 H HB2 . MET A1 1 61 ? -2.489 9.62 -19.663 1.0 14.23 ? 61 A 7 +ATOM 924 H HB3 . MET A1 1 61 ? -4.097 9.037 -19.254 1.0 0.24 ? 61 A 7 +ATOM 925 H HG2 . MET A1 1 61 ? -4.724 8.855 -21.401 1.0 62.14 ? 61 A 7 +ATOM 926 H HG3 . MET A1 1 61 ? -3.858 10.31 -21.889 1.0 32.0 ? 61 A 7 +ATOM 927 H HE1 . MET A1 1 61 ? -1.615 8.842 -24.196 1.0 54.23 ? 61 A 7 +ATOM 928 H HE2 . MET A1 1 61 ? -2.671 10.132 -23.622 1.0 64.31 ? 61 A 7 +ATOM 929 H HE3 . MET A1 1 61 ? -1.028 9.993 -22.995 1.0 24.11 ? 61 A 7 +ATOM 930 N N . SER A1 1 62 ? -2.448 12.346 -20.967 1.0 73.15 ? 62 A 7 +ATOM 931 C CA . SER A1 1 62 ? -1.348 13.24 -21.306 1.0 12.22 ? 62 A 7 +ATOM 932 C C . SER A1 1 62 ? -1.765 14.699 -21.149 1.0 13.52 ? 62 A 7 +ATOM 933 O O . SER A1 1 62 ? -0.953 15.553 -20.792 1.0 42.51 ? 62 A 7 +ATOM 934 C CB . SER A1 1 62 ? -0.877 12.983 -22.739 1.0 62.33 ? 62 A 7 +ATOM 935 O OG . SER A1 1 62 ? -0.353 14.164 -23.323 1.0 14.13 ? 62 A 7 +ATOM 936 H H . SER A1 1 62 ? -2.942 11.9 -21.687 1.0 74.25 ? 62 A 7 +ATOM 937 H HA . SER A1 1 62 ? -0.533 13.036 -20.627 1.0 74.15 ? 62 A 7 +ATOM 938 H HB2 . SER A1 1 62 ? -0.107 12.227 -22.732 1.0 54.41 ? 62 A 7 +ATOM 939 H HB3 . SER A1 1 62 ? -1.712 12.642 -23.333 1.0 23.45 ? 62 A 7 +ATOM 940 H HG . SER A1 1 62 ? -0.832 14.36 -24.132 1.0 1.23 ? 62 A 7 +ATOM 941 N N . ASP A1 1 63 ? -3.036 14.977 -21.419 1.0 34.33 ? 63 A 7 +ATOM 942 C CA . ASP A1 1 63 ? -3.563 16.332 -21.308 1.0 10.21 ? 63 A 7 +ATOM 943 C C . ASP A1 1 63 ? -3.346 16.885 -19.903 1.0 63.54 ? 63 A 7 +ATOM 944 O O . ASP A1 1 63 ? -3.275 18.099 -19.707 1.0 31.33 ? 63 A 7 +ATOM 945 C CB . ASP A1 1 63 ? -5.052 16.352 -21.654 1.0 21.1 ? 63 A 7 +ATOM 946 C CG . ASP A1 1 63 ? -5.539 17.737 -22.033 1.0 12.2 ? 63 A 7 +ATOM 947 O OD1 . ASP A1 1 63 ? -4.781 18.471 -22.702 1.0 53.24 ? 63 A 7 +ATOM 948 O OD2 . ASP A1 1 63 ? -6.679 18.087 -21.662 1.0 3.13 ? 63 A 7 +ATOM 949 H H . ASP A1 1 63 ? -3.634 14.252 -21.7 1.0 14.4 ? 63 A 7 +ATOM 950 H HA . ASP A1 1 63 ? -3.031 16.954 -22.012 1.0 72.42 ? 63 A 7 +ATOM 951 H HB2 . ASP A1 1 63 ? -5.231 15.688 -22.487 1.0 63.34 ? 63 A 7 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.618 16.012 -20.799 1.0 44.51 ? 63 A 7 +ATOM 953 N N . TYR A1 1 64 ? -3.244 15.988 -18.929 1.0 43.15 ? 64 A 7 +ATOM 954 C CA . TYR A1 1 64 ? -3.039 16.386 -17.541 1.0 74.44 ? 64 A 7 +ATOM 955 C C . TYR A1 1 64 ? -4.328 16.935 -16.936 1.0 35.31 ? 64 A 7 +ATOM 956 O O . TYR A1 1 64 ? -4.304 17.632 -15.923 1.0 63.11 ? 64 A 7 +ATOM 957 C CB . TYR A1 1 64 ? -1.932 17.437 -17.448 1.0 41.31 ? 64 A 7 +ATOM 958 C CG . TYR A1 1 64 ? -1.237 17.468 -16.106 1.0 35.31 ? 64 A 7 +ATOM 959 C CD1 . TYR A1 1 64 ? -0.354 16.461 -15.736 1.0 10.21 ? 64 A 7 +ATOM 960 C CD2 . TYR A1 1 64 ? -1.464 18.503 -15.207 1.0 61.0 ? 64 A 7 +ATOM 961 C CE1 . TYR A1 1 64 ? 0.283 16.484 -14.51 1.0 31.32 ? 64 A 7 +ATOM 962 C CE2 . TYR A1 1 64 ? -0.831 18.535 -13.98 1.0 3.01 ? 64 A 7 +ATOM 963 C CZ . TYR A1 1 64 ? 0.041 17.523 -13.636 1.0 35.43 ? 64 A 7 +ATOM 964 O OH . TYR A1 1 64 ? 0.673 17.551 -12.413 1.0 23.32 ? 64 A 7 +ATOM 965 H H . TYR A1 1 64 ? -3.309 15.035 -19.147 1.0 10.22 ? 64 A 7 +ATOM 966 H HA . TYR A1 1 64 ? -2.738 15.51 -16.985 1.0 40.51 ? 64 A 7 +ATOM 967 H HB2 . TYR A1 1 64 ? -1.187 17.233 -18.202 1.0 75.32 ? 64 A 7 +ATOM 968 H HB3 . TYR A1 1 64 ? -2.357 18.415 -17.625 1.0 32.34 ? 64 A 7 +ATOM 969 H HD1 . TYR A1 1 64 ? -0.167 15.648 -16.422 1.0 1.35 ? 64 A 7 +ATOM 970 H HD2 . TYR A1 1 64 ? -2.148 19.293 -15.48 1.0 32.41 ? 64 A 7 +ATOM 971 H HE1 . TYR A1 1 64 ? 0.966 15.692 -14.24 1.0 52.21 ? 64 A 7 +ATOM 972 H HE2 . TYR A1 1 64 ? -1.02 19.348 -13.295 1.0 43.14 ? 64 A 7 +ATOM 973 H HH . TYR A1 1 64 ? 0.885 18.458 -12.184 1.0 23.33 ? 64 A 7 +ATOM 974 N N . ASN A1 1 65 ? -5.453 16.613 -17.566 1.0 61.21 ? 65 A 7 +ATOM 975 C CA . ASN A1 1 65 ? -6.753 17.072 -17.091 1.0 70.22 ? 65 A 7 +ATOM 976 C C . ASN A1 1 65 ? -7.554 15.918 -16.495 1.0 21.44 ? 65 A 7 +ATOM 977 O O . ASN A1 1 65 ? -8.765 16.022 -16.304 1.0 22.24 ? 65 A 7 +ATOM 978 C CB . ASN A1 1 65 ? -7.54 17.716 -18.235 1.0 30.31 ? 65 A 7 +ATOM 979 C CG . ASN A1 1 65 ? -8.783 18.435 -17.749 1.0 75.23 ? 65 A 7 +ATOM 980 O OD1 . ASN A1 1 65 ? -8.722 19.248 -16.827 1.0 74.2 ? 65 A 7 +ATOM 981 N ND2 . ASN A1 1 65 ? -9.919 18.139 -18.37 1.0 12.4 ? 65 A 7 +ATOM 982 H H . ASN A1 1 65 ? -5.409 16.053 -18.369 1.0 72.01 ? 65 A 7 +ATOM 983 H HA . ASN A1 1 65 ? -6.583 17.811 -16.323 1.0 43.44 ? 65 A 7 +ATOM 984 H HB2 . ASN A1 1 65 ? -6.907 18.431 -18.74 1.0 12.24 ? 65 A 7 +ATOM 985 H HB3 . ASN A1 1 65 ? -7.839 16.949 -18.934 1.0 73.02 ? 65 A 7 +ATOM 986 H HD21 . ASN A1 1 65 ? -9.891 17.481 -19.097 1.0 23.44 ? 65 A 7 +ATOM 987 H HD22 . ASN A1 1 65 ? -10.737 18.59 -18.077 1.0 32.24 ? 65 A 7 +ATOM 988 N N . VAL A1 1 66 ? -6.868 14.818 -16.203 1.0 11.4 ? 66 A 7 +ATOM 989 C CA . VAL A1 1 66 ? -7.513 13.644 -15.628 1.0 70.45 ? 66 A 7 +ATOM 990 C C . VAL A1 1 66 ? -7.239 13.544 -14.131 1.0 73.11 ? 66 A 7 +ATOM 991 O O . VAL A1 1 66 ? -6.303 12.868 -13.706 1.0 33.12 ? 66 A 7 +ATOM 992 C CB . VAL A1 1 66 ? -7.038 12.349 -16.313 1.0 40.11 ? 66 A 7 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.519 12.302 -16.371 1.0 32.21 ? 66 A 7 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.591 11.13 -15.59 1.0 25.13 ? 66 A 7 +ATOM 995 H H . VAL A1 1 66 ? -5.904 14.795 -16.379 1.0 25.31 ? 66 A 7 +ATOM 996 H HA . VAL A1 1 66 ? -8.578 13.739 -15.783 1.0 44.24 ? 66 A 7 +ATOM 997 H HB . VAL A1 1 66 ? -7.415 12.342 -17.325 1.0 65.05 ? 66 A 7 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.189 12.562 -17.365 1.0 62.5 ? 66 A 7 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.109 13.003 -15.658 1.0 4.5 ? 66 A 7 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.181 11.304 -16.129 1.0 12.32 ? 66 A 7 +ATOM 1001 H HG21 . VAL A1 1 66 ? -6.871 10.785 -14.863 1.0 23.4 ? 66 A 7 +ATOM 1002 H HG22 . VAL A1 1 66 ? -8.51 11.396 -15.088 1.0 64.2 ? 66 A 7 +ATOM 1003 H HG23 . VAL A1 1 66 ? -7.786 10.344 -16.305 1.0 74.31 ? 66 A 7 +ATOM 1004 N N . GLN A1 1 67 ? -8.062 14.222 -13.338 1.0 5.43 ? 67 A 7 +ATOM 1005 C CA . GLN A1 1 67 ? -7.907 14.21 -11.888 1.0 15.5 ? 67 A 7 +ATOM 1006 C C . GLN A1 1 67 ? -8.802 13.151 -11.254 1.0 62.54 ? 67 A 7 +ATOM 1007 O O . GLN A1 1 67 ? -9.491 12.405 -11.952 1.0 44.01 ? 67 A 7 +ATOM 1008 C CB . GLN A1 1 67 ? -8.235 15.586 -11.307 1.0 35.11 ? 67 A 7 +ATOM 1009 C CG . GLN A1 1 67 ? -9.607 16.104 -11.708 1.0 11.21 ? 67 A 7 +ATOM 1010 C CD . GLN A1 1 67 ? -9.947 17.427 -11.049 1.0 34.44 ? 67 A 7 +ATOM 1011 O OE1 . GLN A1 1 67 ? -9.556 17.685 -9.91 1.0 41.54 ? 67 A 7 +ATOM 1012 N NE2 . GLN A1 1 67 ? -10.679 18.274 -11.764 1.0 50.51 ? 67 A 7 +ATOM 1013 H H . GLN A1 1 67 ? -8.789 14.743 -13.736 1.0 54.23 ? 67 A 7 +ATOM 1014 H HA . GLN A1 1 67 ? -6.877 13.972 -11.667 1.0 21.13 ? 67 A 7 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.197 15.528 -10.23 1.0 61.05 ? 67 A 7 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.494 16.294 -11.648 1.0 21.05 ? 67 A 7 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.629 16.238 -12.779 1.0 63.24 ? 67 A 7 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.35 15.375 -11.422 1.0 63.02 ? 67 A 7 +ATOM 1019 H HE21 . GLN A1 1 67 ? -10.956 18.0 -12.664 1.0 0.12 ? 67 A 7 +ATOM 1020 H HE22 . GLN A1 1 67 ? -10.913 19.135 -11.362 1.0 72.41 ? 67 A 7 +ATOM 1021 N N . LYS A1 1 68 ? -8.789 13.089 -9.927 1.0 63.33 ? 68 A 7 +ATOM 1022 C CA . LYS A1 1 68 ? -9.6 12.121 -9.197 1.0 34.0 ? 68 A 7 +ATOM 1023 C C . LYS A1 1 68 ? -11.083 12.33 -9.483 1.0 33.21 ? 68 A 7 +ATOM 1024 O O . LYS A1 1 68 ? -11.866 11.38 -9.472 1.0 33.01 ? 68 A 7 +ATOM 1025 C CB . LYS A1 1 68 ? -9.338 12.236 -7.694 1.0 41.41 ? 68 A 7 +ATOM 1026 C CG . LYS A1 1 68 ? -9.867 11.059 -6.892 1.0 61.44 ? 68 A 7 +ATOM 1027 C CD . LYS A1 1 68 ? -9.097 9.785 -7.198 1.0 43.41 ? 68 A 7 +ATOM 1028 C CE . LYS A1 1 68 ? -7.779 9.736 -6.44 1.0 23.43 ? 68 A 7 +ATOM 1029 N NZ . LYS A1 1 68 ? -7.985 9.777 -4.965 1.0 52.05 ? 68 A 7 +ATOM 1030 H H . LYS A1 1 68 ? -8.219 13.71 -9.425 1.0 75.53 ? 68 A 7 +ATOM 1031 H HA . LYS A1 1 68 ? -9.317 11.134 -9.529 1.0 31.4 ? 68 A 7 +ATOM 1032 H HB2 . LYS A1 1 68 ? -8.272 12.306 -7.53 1.0 51.5 ? 68 A 7 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.809 13.136 -7.326 1.0 62.4 ? 68 A 7 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.773 11.28 -5.84 1.0 22.33 ? 68 A 7 +ATOM 1035 H HG3 . LYS A1 1 68 ? -10.908 10.907 -7.138 1.0 45.02 ? 68 A 7 +ATOM 1036 H HD2 . LYS A1 1 68 ? -9.696 8.935 -6.91 1.0 14.2 ? 68 A 7 +ATOM 1037 H HD3 . LYS A1 1 68 ? -8.894 9.743 -8.258 1.0 13.53 ? 68 A 7 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.265 8.823 -6.697 1.0 43.13 ? 68 A 7 +ATOM 1039 H HE3 . LYS A1 1 68 ? -7.177 10.583 -6.734 1.0 63.42 ? 68 A 7 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.624 10.672 -4.579 1.0 1.54 ? 68 A 7 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -7.481 8.988 -4.512 1.0 73.32 ? 68 A 7 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.998 9.699 -4.744 1.0 23.44 ? 68 A 7 +ATOM 1043 N N . GLU A1 1 69 ? -11.463 13.578 -9.738 1.0 51.1 ? 69 A 7 +ATOM 1044 C CA . GLU A1 1 69 ? -12.853 13.91 -10.027 1.0 15.41 ? 69 A 7 +ATOM 1045 C C . GLU A1 1 69 ? -12.942 15.1 -10.978 1.0 20.25 ? 69 A 7 +ATOM 1046 O O . GLU A1 1 69 ? -13.22 16.223 -10.559 1.0 55.15 ? 69 A 7 +ATOM 1047 C CB . GLU A1 1 69 ? -13.606 14.22 -8.732 1.0 42.14 ? 69 A 7 +ATOM 1048 C CG . GLU A1 1 69 ? -12.851 15.149 -7.796 1.0 32.44 ? 69 A 7 +ATOM 1049 C CD . GLU A1 1 69 ? -13.776 16.009 -6.957 1.0 60.3 ? 69 A 7 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.421 16.914 -7.526 1.0 52.11 ? 69 A 7 +ATOM 1051 O OE2 . GLU A1 1 69 ? -13.853 15.778 -5.732 1.0 33.22 ? 69 A 7 +ATOM 1052 H H . GLU A1 1 69 ? -10.792 14.293 -9.732 1.0 51.55 ? 69 A 7 +ATOM 1053 H HA . GLU A1 1 69 ? -13.307 13.052 -10.5 1.0 21.13 ? 69 A 7 +ATOM 1054 H HB2 . GLU A1 1 69 ? -14.55 14.682 -8.981 1.0 70.35 ? 69 A 7 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.796 13.294 -8.21 1.0 25.14 ? 69 A 7 +ATOM 1056 H HG2 . GLU A1 1 69 ? -12.24 14.554 -7.135 1.0 60.54 ? 69 A 7 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.218 15.796 -8.385 1.0 2.43 ? 69 A 7 +ATOM 1058 N N . SER A1 1 70 ? -12.704 14.844 -12.261 1.0 51.41 ? 70 A 7 +ATOM 1059 C CA . SER A1 1 70 ? -12.753 15.894 -13.271 1.0 50.24 ? 70 A 7 +ATOM 1060 C C . SER A1 1 70 ? -14.137 15.971 -13.909 1.0 72.1 ? 70 A 7 +ATOM 1061 O O . SER A1 1 70 ? -14.682 14.963 -14.36 1.0 13.02 ? 70 A 7 +ATOM 1062 C CB . SER A1 1 70 ? -11.696 15.645 -14.348 1.0 75.43 ? 70 A 7 +ATOM 1063 O OG . SER A1 1 70 ? -11.012 16.841 -14.679 1.0 45.33 ? 70 A 7 +ATOM 1064 H H . SER A1 1 70 ? -12.488 13.928 -12.533 1.0 42.55 ? 70 A 7 +ATOM 1065 H HA . SER A1 1 70 ? -12.542 16.834 -12.783 1.0 61.25 ? 70 A 7 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.979 14.924 -13.985 1.0 1.23 ? 70 A 7 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.175 15.26 -15.237 1.0 50.33 ? 70 A 7 +ATOM 1068 H HG . SER A1 1 70 ? -11.646 17.504 -14.962 1.0 14.24 ? 70 A 7 +ATOM 1069 N N . THR A1 1 71 ? -14.701 17.174 -13.942 1.0 52.55 ? 71 A 7 +ATOM 1070 C CA . THR A1 1 71 ? -16.021 17.384 -14.523 1.0 43.33 ? 71 A 7 +ATOM 1071 C C . THR A1 1 71 ? -15.918 17.806 -15.984 1.0 63.44 ? 71 A 7 +ATOM 1072 O O . THR A1 1 71 ? -15.306 18.826 -16.305 1.0 13.52 ? 71 A 7 +ATOM 1073 C CB . THR A1 1 71 ? -16.813 18.452 -13.746 1.0 4.41 ? 71 A 7 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.94 19.514 -13.344 1.0 4.41 ? 71 A 7 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.48 17.846 -12.52 1.0 4.35 ? 71 A 7 +ATOM 1076 H H . THR A1 1 71 ? -14.216 17.938 -13.567 1.0 14.04 ? 71 A 7 +ATOM 1077 H HA . THR A1 1 71 ? -16.563 16.451 -14.465 1.0 24.13 ? 71 A 7 +ATOM 1078 H HB . THR A1 1 71 ? -17.58 18.852 -14.394 1.0 70.41 ? 71 A 7 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.393 20.079 -12.714 1.0 53.11 ? 71 A 7 +ATOM 1080 H HG21 . THR A1 1 71 ? -18.462 17.486 -12.787 1.0 12.42 ? 71 A 7 +ATOM 1081 H HG22 . THR A1 1 71 ? -17.57 18.598 -11.75 1.0 75.2 ? 71 A 7 +ATOM 1082 H HG23 . THR A1 1 71 ? -16.882 17.025 -12.154 1.0 31.12 ? 71 A 7 +ATOM 1083 N N . LEU A1 1 72 ? -16.521 17.018 -16.867 1.0 74.32 ? 72 A 7 +ATOM 1084 C CA . LEU A1 1 72 ? -16.498 17.311 -18.296 1.0 62.12 ? 72 A 7 +ATOM 1085 C C . LEU A1 1 72 ? -17.891 17.172 -18.902 1.0 14.1 ? 72 A 7 +ATOM 1086 O O . LEU A1 1 72 ? -18.724 16.415 -18.404 1.0 22.33 ? 72 A 7 +ATOM 1087 C CB . LEU A1 1 72 ? -15.522 16.376 -19.012 1.0 54.24 ? 72 A 7 +ATOM 1088 C CG . LEU A1 1 72 ? -16.108 15.064 -19.534 1.0 12.34 ? 72 A 7 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.482 15.192 -21.002 1.0 71.53 ? 72 A 7 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.124 13.921 -19.329 1.0 45.31 ? 72 A 7 +ATOM 1091 H H . LEU A1 1 72 ? -16.993 16.219 -16.551 1.0 40.44 ? 72 A 7 +ATOM 1092 H HA . LEU A1 1 72 ? -16.165 18.33 -18.419 1.0 22.23 ? 72 A 7 +ATOM 1093 H HB2 . LEU A1 1 72 ? -15.11 16.911 -19.854 1.0 24.33 ? 72 A 7 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.729 16.134 -18.319 1.0 64.44 ? 72 A 7 +ATOM 1095 H HG . LEU A1 1 72 ? -17.009 14.835 -18.98 1.0 60.22 ? 72 A 7 +ATOM 1096 H HD11 . LEU A1 1 72 ? -15.907 15.988 -21.451 1.0 22.12 ? 72 A 7 +ATOM 1097 H HD12 . LEU A1 1 72 ? -17.535 15.416 -21.088 1.0 11.12 ? 72 A 7 +ATOM 1098 H HD13 . LEU A1 1 72 ? -16.269 14.263 -21.51 1.0 74.11 ? 72 A 7 +ATOM 1099 H HD21 . LEU A1 1 72 ? -15.403 13.089 -19.958 1.0 45.11 ? 72 A 7 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.142 13.613 -18.294 1.0 64.51 ? 72 A 7 +ATOM 1101 H HD23 . LEU A1 1 72 ? -14.129 14.253 -19.589 1.0 15.53 ? 72 A 7 +ATOM 1102 N N . HIS A1 1 73 ? -18.136 17.906 -19.983 1.0 22.1 ? 73 A 7 +ATOM 1103 C CA . HIS A1 1 73 ? -19.427 17.863 -20.66 1.0 43.22 ? 73 A 7 +ATOM 1104 C C . HIS A1 1 73 ? -19.386 16.905 -21.846 1.0 1.12 ? 73 A 7 +ATOM 1105 O O . HIS A1 1 73 ? -18.591 17.078 -22.771 1.0 41.41 ? 73 A 7 +ATOM 1106 C CB . HIS A1 1 73 ? -19.826 19.262 -21.132 1.0 34.11 ? 73 A 7 +ATOM 1107 C CG . HIS A1 1 73 ? -20.201 20.187 -20.016 1.0 25.31 ? 73 A 7 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.267 21.058 -20.087 1.0 22.31 ? 73 A 7 +ATOM 1109 C CD2 . HIS A1 1 73 ? -19.646 20.372 -18.795 1.0 30.12 ? 73 A 7 +ATOM 1110 C CE1 . HIS A1 1 73 ? -21.351 21.741 -18.959 1.0 74.03 ? 73 A 7 +ATOM 1111 N NE2 . HIS A1 1 73 ? -20.379 21.343 -18.158 1.0 22.32 ? 73 A 7 +ATOM 1112 H H . HIS A1 1 73 ? -17.432 18.491 -20.333 1.0 41.1 ? 73 A 7 +ATOM 1113 H HA . HIS A1 1 73 ? -20.161 17.509 -19.952 1.0 23.25 ? 73 A 7 +ATOM 1114 H HB2 . HIS A1 1 73 ? -18.997 19.704 -21.665 1.0 51.13 ? 73 A 7 +ATOM 1115 H HB3 . HIS A1 1 73 ? -20.674 19.182 -21.797 1.0 64.13 ? 73 A 7 +ATOM 1116 H HD1 . HIS A1 1 73 ? -21.872 21.162 -20.851 1.0 63.31 ? 73 A 7 +ATOM 1117 H HD2 . HIS A1 1 73 ? -18.786 19.853 -18.396 1.0 71.43 ? 73 A 7 +ATOM 1118 H HE1 . HIS A1 1 73 ? -22.088 22.495 -18.729 1.0 3.34 ? 73 A 7 +ATOM 1119 N N . LEU A1 1 74 ? -20.248 15.894 -21.814 1.0 31.4 ? 74 A 7 +ATOM 1120 C CA . LEU A1 1 74 ? -20.31 14.907 -22.886 1.0 41.22 ? 74 A 7 +ATOM 1121 C C . LEU A1 1 74 ? -21.574 15.089 -23.721 1.0 21.0 ? 74 A 7 +ATOM 1122 O O . LEU A1 1 74 ? -22.689 14.964 -23.214 1.0 70.53 ? 74 A 7 +ATOM 1123 C CB . LEU A1 1 74 ? -20.267 13.492 -22.307 1.0 42.32 ? 74 A 7 +ATOM 1124 C CG . LEU A1 1 74 ? -20.883 12.393 -23.174 1.0 13.02 ? 74 A 7 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.164 12.301 -24.51 1.0 50.12 ? 74 A 7 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.84 11.056 -22.449 1.0 22.4 ? 74 A 7 +ATOM 1127 H H . LEU A1 1 74 ? -20.856 15.808 -21.051 1.0 53.04 ? 74 A 7 +ATOM 1128 H HA . LEU A1 1 74 ? -19.449 15.053 -23.522 1.0 65.43 ? 74 A 7 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.233 13.236 -22.135 1.0 22.02 ? 74 A 7 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.795 13.506 -21.364 1.0 20.31 ? 74 A 7 +ATOM 1131 H HG . LEU A1 1 74 ? -21.919 12.635 -23.369 1.0 34.12 ? 74 A 7 +ATOM 1132 H HD11 . LEU A1 1 74 ? -20.154 11.274 -24.843 1.0 33.01 ? 74 A 7 +ATOM 1133 H HD12 . LEU A1 1 74 ? -19.149 12.653 -24.398 1.0 1.34 ? 74 A 7 +ATOM 1134 H HD13 . LEU A1 1 74 ? -20.678 12.912 -25.238 1.0 63.14 ? 74 A 7 +ATOM 1135 H HD21 . LEU A1 1 74 ? -19.828 10.681 -22.445 1.0 12.32 ? 74 A 7 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.483 10.351 -22.956 1.0 54.43 ? 74 A 7 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.181 11.186 -21.432 1.0 14.02 ? 74 A 7 +ATOM 1138 N N . VAL A1 1 75 ? -21.392 15.384 -25.004 1.0 43.5 ? 75 A 7 +ATOM 1139 C CA . VAL A1 1 75 ? -22.517 15.58 -25.911 1.0 52.32 ? 75 A 7 +ATOM 1140 C C . VAL A1 1 75 ? -22.567 14.483 -26.969 1.0 61.15 ? 75 A 7 +ATOM 1141 O O . VAL A1 1 75 ? -21.555 14.156 -27.589 1.0 54.31 ? 75 A 7 +ATOM 1142 C CB . VAL A1 1 75 ? -22.442 16.95 -26.61 1.0 24.5 ? 75 A 7 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.649 17.156 -27.513 1.0 55.3 ? 75 A 7 +ATOM 1144 C CG2 . VAL A1 1 75 ? -22.337 18.067 -25.583 1.0 64.14 ? 75 A 7 +ATOM 1145 H H . VAL A1 1 75 ? -20.479 15.471 -25.35 1.0 70.11 ? 75 A 7 +ATOM 1146 H HA . VAL A1 1 75 ? -23.425 15.546 -25.327 1.0 60.52 ? 75 A 7 +ATOM 1147 H HB . VAL A1 1 75 ? -21.553 16.97 -27.224 1.0 44.41 ? 75 A 7 +ATOM 1148 H HG11 . VAL A1 1 75 ? -23.85 18.213 -27.609 1.0 31.54 ? 75 A 7 +ATOM 1149 H HG12 . VAL A1 1 75 ? -23.446 16.736 -28.487 1.0 61.34 ? 75 A 7 +ATOM 1150 H HG13 . VAL A1 1 75 ? -24.509 16.665 -27.081 1.0 54.52 ? 75 A 7 +ATOM 1151 H HG21 . VAL A1 1 75 ? -22.289 17.642 -24.592 1.0 5.24 ? 75 A 7 +ATOM 1152 H HG22 . VAL A1 1 75 ? -21.446 18.646 -25.772 1.0 61.35 ? 75 A 7 +ATOM 1153 H HG23 . VAL A1 1 75 ? -23.205 18.708 -25.658 1.0 24.43 ? 75 A 7 +ATOM 1154 N N . LEU A1 1 76 ? -23.753 13.919 -27.171 1.0 35.1 ? 76 A 7 +ATOM 1155 C CA . LEU A1 1 76 ? -23.937 12.858 -28.155 1.0 22.53 ? 76 A 7 +ATOM 1156 C C . LEU A1 1 76 ? -24.901 13.295 -29.253 1.0 2.14 ? 76 A 7 +ATOM 1157 O O . LEU A1 1 76 ? -25.926 13.921 -28.98 1.0 21.5 ? 76 A 7 +ATOM 1158 C CB . LEU A1 1 76 ? -24.46 11.591 -27.477 1.0 73.12 ? 76 A 7 +ATOM 1159 C CG . LEU A1 1 76 ? -24.23 11.493 -25.968 1.0 64.45 ? 76 A 7 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.42 12.059 -25.21 1.0 24.13 ? 76 A 7 +ATOM 1161 C CD2 . LEU A1 1 76 ? -23.972 10.05 -25.56 1.0 22.03 ? 76 A 7 +ATOM 1162 H H . LEU A1 1 76 ? -24.523 14.221 -26.647 1.0 44.32 ? 76 A 7 +ATOM 1163 H HA . LEU A1 1 76 ? -22.975 12.648 -28.6 1.0 53.04 ? 76 A 7 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.523 11.536 -27.653 1.0 71.31 ? 76 A 7 +ATOM 1165 H HB3 . LEU A1 1 76 ? -23.975 10.744 -27.942 1.0 62.14 ? 76 A 7 +ATOM 1166 H HG . LEU A1 1 76 ? -23.359 12.077 -25.705 1.0 42.11 ? 76 A 7 +ATOM 1167 H HD11 . LEU A1 1 76 ? -25.415 11.682 -24.198 1.0 12.14 ? 76 A 7 +ATOM 1168 H HD12 . LEU A1 1 76 ? -26.335 11.761 -25.7 1.0 23.21 ? 76 A 7 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.357 13.137 -25.193 1.0 40.2 ? 76 A 7 +ATOM 1170 H HD21 . LEU A1 1 76 ? -24.557 9.814 -24.684 1.0 53.24 ? 76 A 7 +ATOM 1171 H HD22 . LEU A1 1 76 ? -22.923 9.922 -25.339 1.0 72.02 ? 76 A 7 +ATOM 1172 H HD23 . LEU A1 1 76 ? -24.252 9.392 -26.37 1.0 63.4 ? 76 A 7 +ATOM 1173 N N . ARG A1 1 77 ? -24.567 12.961 -30.495 1.0 50.44 ? 77 A 7 +ATOM 1174 C CA . ARG A1 1 77 ? -25.404 13.318 -31.634 1.0 12.4 ? 77 A 7 +ATOM 1175 C C . ARG A1 1 77 ? -26.52 12.297 -31.83 1.0 10.32 ? 77 A 7 +ATOM 1176 O O . ARG A1 1 77 ? -26.672 11.727 -32.912 1.0 12.43 ? 77 A 7 +ATOM 1177 C CB . ARG A1 1 77 ? -24.558 13.415 -32.905 1.0 55.35 ? 77 A 7 +ATOM 1178 C CG . ARG A1 1 77 ? -23.165 13.976 -32.669 1.0 12.22 ? 77 A 7 +ATOM 1179 C CD . ARG A1 1 77 ? -23.216 15.296 -31.916 1.0 60.22 ? 77 A 7 +ATOM 1180 N NE . ARG A1 1 77 ? -24.244 16.188 -32.445 1.0 64.33 ? 77 A 7 +ATOM 1181 C CZ . ARG A1 1 77 ? -24.098 16.9 -33.557 1.0 13.31 ? 77 A 7 +ATOM 1182 N NH1 . ARG A1 1 77 ? -22.972 16.825 -34.253 1.0 63.3 ? 77 A 7 +ATOM 1183 N NH2 . ARG A1 1 77 ? -25.079 17.69 -33.974 1.0 70.54 ? 77 A 7 +ATOM 1184 H H . ARG A1 1 77 ? -23.737 12.462 -30.65 1.0 2.41 ? 77 A 7 +ATOM 1185 H HA . ARG A1 1 77 ? -25.845 14.283 -31.432 1.0 53.23 ? 77 A 7 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.456 12.428 -33.333 1.0 41.04 ? 77 A 7 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.064 14.054 -33.613 1.0 23.23 ? 77 A 7 +ATOM 1188 H HG2 . ARG A1 1 77 ? -22.594 13.265 -32.089 1.0 3.21 ? 77 A 7 +ATOM 1189 H HG3 . ARG A1 1 77 ? -22.684 14.133 -33.623 1.0 45.32 ? 77 A 7 +ATOM 1190 H HD2 . ARG A1 1 77 ? -23.429 15.094 -30.877 1.0 24.22 ? 77 A 7 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.255 15.78 -31.999 1.0 55.12 ? 77 A 7 +ATOM 1192 H HE . ARG A1 1 77 ? -25.084 16.259 -31.946 1.0 41.44 ? 77 A 7 +ATOM 1193 H HH11 . ARG A1 1 77 ? -22.232 16.23 -33.941 1.0 31.24 ? 77 A 7 +ATOM 1194 H HH12 . ARG A1 1 77 ? -22.865 17.361 -35.091 1.0 72.5 ? 77 A 7 +ATOM 1195 H HH21 . ARG A1 1 77 ? -25.929 17.749 -33.452 1.0 71.34 ? 77 A 7 +ATOM 1196 H HH22 . ARG A1 1 77 ? -24.968 18.225 -34.811 1.0 1.44 ? 77 A 7 +ATOM 1197 N N . LEU A1 1 78 ? -27.299 12.07 -30.778 1.0 31.03 ? 78 A 7 +ATOM 1198 C CA . LEU A1 1 78 ? -28.402 11.118 -30.834 1.0 51.32 ? 78 A 7 +ATOM 1199 C C . LEU A1 1 78 ? -29.675 11.787 -31.342 1.0 14.11 ? 78 A 7 +ATOM 1200 O O . LEU A1 1 78 ? -30.289 11.325 -32.304 1.0 12.31 ? 78 A 7 +ATOM 1201 C CB . LEU A1 1 78 ? -28.649 10.512 -29.451 1.0 42.51 ? 78 A 7 +ATOM 1202 C CG . LEU A1 1 78 ? -27.889 9.222 -29.138 1.0 51.45 ? 78 A 7 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.397 9.414 -29.359 1.0 14.44 ? 78 A 7 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.165 8.774 -27.71 1.0 25.32 ? 78 A 7 +ATOM 1205 H H . LEU A1 1 78 ? -27.129 12.555 -29.944 1.0 75.31 ? 78 A 7 +ATOM 1206 H HA . LEU A1 1 78 ? -28.125 10.33 -31.518 1.0 64.2 ? 78 A 7 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.368 11.248 -28.713 1.0 61.14 ? 78 A 7 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.706 10.304 -29.365 1.0 62.32 ? 78 A 7 +ATOM 1209 H HG . LEU A1 1 78 ? -28.228 8.442 -29.806 1.0 53.42 ? 78 A 7 +ATOM 1210 H HD11 . LEU A1 1 78 ? -25.848 8.811 -28.652 1.0 3.24 ? 78 A 7 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.143 10.454 -29.219 1.0 74.14 ? 78 A 7 +ATOM 1212 H HD13 . LEU A1 1 78 ? -26.141 9.114 -30.365 1.0 11.41 ? 78 A 7 +ATOM 1213 H HD21 . LEU A1 1 78 ? -28.539 9.609 -27.136 1.0 65.32 ? 78 A 7 +ATOM 1214 H HD22 . LEU A1 1 78 ? -27.251 8.41 -27.264 1.0 65.43 ? 78 A 7 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.901 7.983 -27.717 1.0 34.04 ? 78 A 7 +ATOM 1216 N N . ARG A1 1 79 ? -30.064 12.879 -30.692 1.0 44.5 ? 79 A 7 +ATOM 1217 C CA . ARG A1 1 79 ? -31.263 13.612 -31.079 1.0 54.44 ? 79 A 7 +ATOM 1218 C C . ARG A1 1 79 ? -32.505 12.739 -30.932 1.0 43.43 ? 79 A 7 +ATOM 1219 O O . ARG A1 1 79 ? -33.389 12.75 -31.788 1.0 24.23 ? 79 A 7 +ATOM 1220 C CB . ARG A1 1 79 ? -31.141 14.106 -32.522 1.0 53.1 ? 79 A 7 +ATOM 1221 C CG . ARG A1 1 79 ? -32.179 15.15 -32.899 1.0 62.42 ? 79 A 7 +ATOM 1222 C CD . ARG A1 1 79 ? -31.555 16.528 -33.047 1.0 15.2 ? 79 A 7 +ATOM 1223 N NE . ARG A1 1 79 ? -31.466 16.942 -34.445 1.0 22.21 ? 79 A 7 +ATOM 1224 C CZ . ARG A1 1 79 ? -31.287 18.201 -34.829 1.0 43.33 ? 79 A 7 +ATOM 1225 N NH1 . ARG A1 1 79 ? -31.177 19.164 -33.924 1.0 51.34 ? 79 A 7 +ATOM 1226 N NH2 . ARG A1 1 79 ? -31.216 18.498 -36.12 1.0 24.34 ? 79 A 7 +ATOM 1227 H H . ARG A1 1 79 ? -29.532 13.198 -29.933 1.0 30.43 ? 79 A 7 +ATOM 1228 H HA . ARG A1 1 79 ? -31.356 14.465 -30.423 1.0 75.12 ? 79 A 7 +ATOM 1229 H HB2 . ARG A1 1 79 ? -30.161 14.538 -32.661 1.0 72.51 ? 79 A 7 +ATOM 1230 H HB3 . ARG A1 1 79 ? -31.251 13.263 -33.188 1.0 62.3 ? 79 A 7 +ATOM 1231 H HG2 . ARG A1 1 79 ? -32.633 14.87 -33.838 1.0 34.21 ? 79 A 7 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.934 15.187 -32.128 1.0 51.44 ? 79 A 7 +ATOM 1233 H HD2 . ARG A1 1 79 ? -32.159 17.242 -32.508 1.0 21.42 ? 79 A 7 +ATOM 1234 H HD3 . ARG A1 1 79 ? -30.561 16.506 -32.624 1.0 24.22 ? 79 A 7 +ATOM 1235 H HE . ARG A1 1 79 ? -31.544 16.246 -35.13 1.0 63.2 ? 79 A 7 +ATOM 1236 H HH11 . ARG A1 1 79 ? -31.229 18.943 -32.951 1.0 0.03 ? 79 A 7 +ATOM 1237 H HH12 . ARG A1 1 79 ? -31.041 20.111 -34.216 1.0 54.33 ? 79 A 7 +ATOM 1238 H HH21 . ARG A1 1 79 ? -31.298 17.774 -36.805 1.0 72.3 ? 79 A 7 +ATOM 1239 H HH22 . ARG A1 1 79 ? -31.082 19.446 -36.408 1.0 2.44 ? 79 A 7 +ATOM 1240 N N . GLY A1 1 80 ? -32.566 11.983 -29.84 1.0 11.03 ? 80 A 7 +ATOM 1241 C CA . GLY A1 1 80 ? -33.703 11.115 -29.601 1.0 3.12 ? 80 A 7 +ATOM 1242 C C . GLY A1 1 80 ? -33.571 10.328 -28.312 1.0 52.34 ? 80 A 7 +ATOM 1243 O O . GLY A1 1 80 ? -34.547 10.143 -27.586 1.0 43.44 ? 80 A 7 +ATOM 1244 H H . GLY A1 1 80 ? -31.832 12.016 -29.191 1.0 0.24 ? 80 A 7 +ATOM 1245 H HA2 . GLY A1 1 80 ? -34.598 11.717 -29.553 1.0 71.24 ? 80 A 7 +ATOM 1246 H HA3 . GLY A1 1 80 ? -33.792 10.422 -30.424 1.0 43.14 ? 80 A 7 +ATOM 1247 N N . GLY A1 1 81 ? -32.359 9.861 -28.027 1.0 43.34 ? 81 A 7 +ATOM 1248 C CA . GLY A1 1 81 ? -32.126 9.093 -26.818 1.0 20.2 ? 81 A 7 +ATOM 1249 C C . GLY A1 1 81 ? -31.794 7.642 -27.107 1.0 63.23 ? 81 A 7 +ATOM 1250 O O . GLY A1 1 81 ? -31.766 7.223 -28.264 1.0 30.24 ? 81 A 7 +ATOM 1251 H H . GLY A1 1 81 ? -31.618 10.039 -28.643 1.0 11.33 ? 81 A 7 +ATOM 1252 H HA2 . GLY A1 1 81 ? -31.305 9.537 -26.275 1.0 30.51 ? 81 A 7 +ATOM 1253 H HA3 . GLY A1 1 81 ? -33.014 9.131 -26.204 1.0 55.14 ? 81 A 7 +ATOM 1254 N N . VAL A1 1 82 ? -31.541 6.873 -26.053 1.0 30.52 ? 82 A 7 +ATOM 1255 C CA . VAL A1 1 82 ? -31.209 5.461 -26.199 1.0 4.45 ? 82 A 7 +ATOM 1256 C C . VAL A1 1 82 ? -32.332 4.702 -26.899 1.0 63.52 ? 82 A 7 +ATOM 1257 O O . VAL A1 1 82 ? -33.308 5.298 -27.353 1.0 12.52 ? 82 A 7 +ATOM 1258 C CB . VAL A1 1 82 ? -30.935 4.804 -24.833 1.0 53.54 ? 82 A 7 +ATOM 1259 C CG1 . VAL A1 1 82 ? -29.684 5.395 -24.199 1.0 33.31 ? 82 A 7 +ATOM 1260 C CG2 . VAL A1 1 82 ? -32.136 4.966 -23.914 1.0 1.13 ? 82 A 7 +ATOM 1261 H H . VAL A1 1 82 ? -31.58 7.264 -25.156 1.0 42.11 ? 82 A 7 +ATOM 1262 H HA . VAL A1 1 82 ? -30.312 5.389 -26.797 1.0 65.12 ? 82 A 7 +ATOM 1263 H HB . VAL A1 1 82 ? -30.768 3.749 -24.991 1.0 3.02 ? 82 A 7 +ATOM 1264 H HG11 . VAL A1 1 82 ? -29.66 6.46 -24.376 1.0 71.54 ? 82 A 7 +ATOM 1265 H HG12 . VAL A1 1 82 ? -29.696 5.205 -23.136 1.0 43.52 ? 82 A 7 +ATOM 1266 H HG13 . VAL A1 1 82 ? -28.809 4.938 -24.637 1.0 60.31 ? 82 A 7 +ATOM 1267 H HG21 . VAL A1 1 82 ? -31.939 4.472 -22.974 1.0 51.1 ? 82 A 7 +ATOM 1268 H HG22 . VAL A1 1 82 ? -32.316 6.016 -23.739 1.0 43.42 ? 82 A 7 +ATOM 1269 H HG23 . VAL A1 1 82 ? -33.006 4.524 -24.377 1.0 61.21 ? 82 A 7 +ATOM 1 N N . GLY A1 1 1 ? -14.994 2.906 -5.788 1.0 13.0 ? 1 A 8 +ATOM 2 C CA . GLY A1 1 1 ? -13.766 2.647 -6.517 1.0 45.03 ? 1 A 8 +ATOM 3 C C . GLY A1 1 1 ? -12.638 2.195 -5.61 1.0 65.21 ? 1 A 8 +ATOM 4 O O . GLY A1 1 1 ? -11.701 2.943 -5.33 1.0 33.34 ? 1 A 8 +ATOM 5 H H1 . GLY A1 1 1 ? -15.137 3.779 -5.367 1.0 52.4 ? 1 A 8 +ATOM 6 H HA2 . GLY A1 1 1 ? -13.952 1.879 -7.253 1.0 14.15 ? 1 A 8 +ATOM 7 H HA3 . GLY A1 1 1 ? -13.464 3.552 -7.023 1.0 34.23 ? 1 A 8 +ATOM 8 N N . PRO A1 1 2 ? -12.721 0.945 -5.133 1.0 55.32 ? 2 A 8 +ATOM 9 C CA . PRO A1 1 2 ? -11.708 0.367 -4.245 1.0 21.43 ? 2 A 8 +ATOM 10 C C . PRO A1 1 2 ? -10.387 0.11 -4.961 1.0 41.45 ? 2 A 8 +ATOM 11 O O . PRO A1 1 2 ? -9.331 0.037 -4.331 1.0 62.42 ? 2 A 8 +ATOM 12 C CB . PRO A1 1 2 ? -12.34 -0.954 -3.799 1.0 51.45 ? 2 A 8 +ATOM 13 C CG . PRO A1 1 2 ? -13.29 -1.308 -4.89 1.0 43.11 ? 2 A 8 +ATOM 14 C CD . PRO A1 1 2 ? -13.81 -0.002 -5.425 1.0 64.14 ? 2 A 8 +ATOM 15 H HA . PRO A1 1 2 ? -11.533 0.993 -3.383 1.0 31.54 ? 2 A 8 +ATOM 16 H HB2 . PRO A1 1 2 ? -11.57 -1.704 -3.686 1.0 42.4 ? 2 A 8 +ATOM 17 H HB3 . PRO A1 1 2 ? -12.853 -0.813 -2.859 1.0 62.54 ? 2 A 8 +ATOM 18 H HG2 . PRO A1 1 2 ? -12.772 -1.851 -5.666 1.0 3.22 ? 2 A 8 +ATOM 19 H HG3 . PRO A1 1 2 ? -14.101 -1.9 -4.493 1.0 51.14 ? 2 A 8 +ATOM 20 H HD2 . PRO A1 1 2 ? -13.985 -0.073 -6.489 1.0 11.0 ? 2 A 8 +ATOM 21 H HD3 . PRO A1 1 2 ? -14.716 0.282 -4.91 1.0 24.12 ? 2 A 8 +ATOM 22 N N . LEU A1 1 3 ? -10.452 -0.026 -6.281 1.0 34.12 ? 3 A 8 +ATOM 23 C CA . LEU A1 1 3 ? -9.26 -0.274 -7.084 1.0 54.03 ? 3 A 8 +ATOM 24 C C . LEU A1 1 3 ? -9.241 0.619 -8.321 1.0 63.21 ? 3 A 8 +ATOM 25 O O . LEU A1 1 3 ? -10.205 0.659 -9.085 1.0 11.24 ? 3 A 8 +ATOM 26 C CB . LEU A1 1 3 ? -9.199 -1.744 -7.501 1.0 60.12 ? 3 A 8 +ATOM 27 C CG . LEU A1 1 3 ? -7.97 -2.162 -8.311 1.0 64.13 ? 3 A 8 +ATOM 28 C CD1 . LEU A1 1 3 ? -6.911 -2.765 -7.402 1.0 62.25 ? 3 A 8 +ATOM 29 C CD2 . LEU A1 1 3 ? -8.361 -3.146 -9.404 1.0 0.12 ? 3 A 8 +ATOM 30 H H . LEU A1 1 3 ? -11.322 0.042 -6.727 1.0 52.35 ? 3 A 8 +ATOM 31 H HA . LEU A1 1 3 ? -8.397 -0.044 -6.477 1.0 43.13 ? 3 A 8 +ATOM 32 H HB2 . LEU A1 1 3 ? -9.222 -2.343 -6.604 1.0 74.24 ? 3 A 8 +ATOM 33 H HB3 . LEU A1 1 3 ? -10.076 -1.955 -8.096 1.0 72.41 ? 3 A 8 +ATOM 34 H HG . LEU A1 1 3 ? -7.545 -1.287 -8.784 1.0 43.5 ? 3 A 8 +ATOM 35 H HD11 . LEU A1 1 3 ? -6.884 -3.835 -7.541 1.0 50.45 ? 3 A 8 +ATOM 36 H HD12 . LEU A1 1 3 ? -7.151 -2.541 -6.373 1.0 4.34 ? 3 A 8 +ATOM 37 H HD13 . LEU A1 1 3 ? -5.946 -2.345 -7.646 1.0 54.42 ? 3 A 8 +ATOM 38 H HD21 . LEU A1 1 3 ? -7.497 -3.375 -10.008 1.0 23.33 ? 3 A 8 +ATOM 39 H HD22 . LEU A1 1 3 ? -9.13 -2.709 -10.024 1.0 1.01 ? 3 A 8 +ATOM 40 H HD23 . LEU A1 1 3 ? -8.737 -4.054 -8.953 1.0 75.24 ? 3 A 8 +ATOM 41 N N . GLY A1 1 4 ? -8.135 1.332 -8.514 1.0 4.21 ? 4 A 8 +ATOM 42 C CA . GLY A1 1 4 ? -8.011 2.212 -9.661 1.0 43.34 ? 4 A 8 +ATOM 43 C C . GLY A1 1 4 ? -7.108 3.398 -9.386 1.0 32.24 ? 4 A 8 +ATOM 44 O O . GLY A1 1 4 ? -6.836 3.725 -8.231 1.0 73.31 ? 4 A 8 +ATOM 45 H H . GLY A1 1 4 ? -7.398 1.259 -7.872 1.0 2.13 ? 4 A 8 +ATOM 46 H HA2 . GLY A1 1 4 ? -7.607 1.65 -10.49 1.0 53.5 ? 4 A 8 +ATOM 47 H HA3 . GLY A1 1 4 ? -8.992 2.576 -9.929 1.0 61.41 ? 4 A 8 +ATOM 48 N N . SER A1 1 5 ? -6.642 4.044 -10.45 1.0 14.33 ? 5 A 8 +ATOM 49 C CA . SER A1 1 5 ? -5.76 5.198 -10.318 1.0 12.42 ? 5 A 8 +ATOM 50 C C . SER A1 1 5 ? -6.545 6.437 -9.898 1.0 43.22 ? 5 A 8 +ATOM 51 O O . SER A1 1 5 ? -6.487 6.86 -8.744 1.0 33.52 ? 5 A 8 +ATOM 52 C CB . SER A1 1 5 ? -5.032 5.464 -11.637 1.0 72.02 ? 5 A 8 +ATOM 53 O OG . SER A1 1 5 ? -4.703 6.836 -11.77 1.0 21.35 ? 5 A 8 +ATOM 54 H H . SER A1 1 5 ? -6.895 3.735 -11.345 1.0 31.12 ? 5 A 8 +ATOM 55 H HA . SER A1 1 5 ? -5.031 4.972 -9.554 1.0 12.32 ? 5 A 8 +ATOM 56 H HB2 . SER A1 1 5 ? -4.123 4.884 -11.667 1.0 41.01 ? 5 A 8 +ATOM 57 H HB3 . SER A1 1 5 ? -5.67 5.177 -12.461 1.0 74.13 ? 5 A 8 +ATOM 58 H HG . SER A1 1 5 ? -3.91 7.026 -11.264 1.0 33.45 ? 5 A 8 +ATOM 59 N N . MET A1 1 6 ? -7.279 7.013 -10.844 1.0 14.01 ? 6 A 8 +ATOM 60 C CA . MET A1 1 6 ? -8.077 8.203 -10.573 1.0 54.33 ? 6 A 8 +ATOM 61 C C . MET A1 1 6 ? -9.509 8.021 -11.066 1.0 31.44 ? 6 A 8 +ATOM 62 O O . MET A1 1 6 ? -9.881 6.945 -11.534 1.0 1.11 ? 6 A 8 +ATOM 63 C CB . MET A1 1 6 ? -7.448 9.428 -11.24 1.0 70.21 ? 6 A 8 +ATOM 64 C CG . MET A1 1 6 ? -7.524 9.4 -12.758 1.0 25.05 ? 6 A 8 +ATOM 65 S SD . MET A1 1 6 ? -5.927 9.071 -13.527 1.0 3.44 ? 6 A 8 +ATOM 66 C CE . MET A1 1 6 ? -4.948 10.416 -12.864 1.0 13.21 ? 6 A 8 +ATOM 67 H H . MET A1 1 6 ? -7.284 6.63 -11.746 1.0 2.32 ? 6 A 8 +ATOM 68 H HA . MET A1 1 6 ? -8.093 8.355 -9.504 1.0 5.22 ? 6 A 8 +ATOM 69 H HB2 . MET A1 1 6 ? -7.958 10.314 -10.892 1.0 62.43 ? 6 A 8 +ATOM 70 H HB3 . MET A1 1 6 ? -6.408 9.485 -10.954 1.0 63.34 ? 6 A 8 +ATOM 71 H HG2 . MET A1 1 6 ? -8.217 8.628 -13.057 1.0 33.13 ? 6 A 8 +ATOM 72 H HG3 . MET A1 1 6 ? -7.884 10.357 -13.104 1.0 12.41 ? 6 A 8 +ATOM 73 H HE1 . MET A1 1 6 ? -4.068 10.556 -13.476 1.0 12.23 ? 6 A 8 +ATOM 74 H HE2 . MET A1 1 6 ? -5.534 11.322 -12.863 1.0 52.54 ? 6 A 8 +ATOM 75 H HE3 . MET A1 1 6 ? -4.649 10.179 -11.853 1.0 2.41 ? 6 A 8 +ATOM 76 N N . GLN A1 1 7 ? -10.307 9.078 -10.956 1.0 13.12 ? 7 A 8 +ATOM 77 C CA . GLN A1 1 7 ? -11.698 9.033 -11.39 1.0 13.2 ? 7 A 8 +ATOM 78 C C . GLN A1 1 7 ? -12.086 10.319 -12.111 1.0 42.42 ? 7 A 8 +ATOM 79 O O . GLN A1 1 7 ? -11.481 11.37 -11.895 1.0 71.33 ? 7 A 8 +ATOM 80 C CB . GLN A1 1 7 ? -12.621 8.808 -10.191 1.0 42.01 ? 7 A 8 +ATOM 81 C CG . GLN A1 1 7 ? -14.015 8.338 -10.576 1.0 12.34 ? 7 A 8 +ATOM 82 C CD . GLN A1 1 7 ? -14.338 6.961 -10.029 1.0 44.31 ? 7 A 8 +ATOM 83 O OE1 . GLN A1 1 7 ? -14.814 6.088 -10.756 1.0 33.44 ? 7 A 8 +ATOM 84 N NE2 . GLN A1 1 7 ? -14.081 6.76 -8.742 1.0 73.32 ? 7 A 8 +ATOM 85 H H . GLN A1 1 7 ? -9.952 9.907 -10.575 1.0 71.21 ? 7 A 8 +ATOM 86 H HA . GLN A1 1 7 ? -11.805 8.205 -12.075 1.0 62.03 ? 7 A 8 +ATOM 87 H HB2 . GLN A1 1 7 ? -12.179 8.063 -9.546 1.0 13.25 ? 7 A 8 +ATOM 88 H HB3 . GLN A1 1 7 ? -12.716 9.735 -9.646 1.0 41.42 ? 7 A 8 +ATOM 89 H HG2 . GLN A1 1 7 ? -14.738 9.041 -10.189 1.0 43.33 ? 7 A 8 +ATOM 90 H HG3 . GLN A1 1 7 ? -14.086 8.307 -11.653 1.0 33.21 ? 7 A 8 +ATOM 91 H HE21 . GLN A1 1 7 ? -13.703 7.502 -8.225 1.0 52.01 ? 7 A 8 +ATOM 92 H HE22 . GLN A1 1 7 ? -14.281 5.88 -8.362 1.0 55.43 ? 7 A 8 +ATOM 93 N N . ILE A1 1 8 ? -13.098 10.23 -12.968 1.0 12.12 ? 8 A 8 +ATOM 94 C CA . ILE A1 1 8 ? -13.566 11.387 -13.72 1.0 64.2 ? 8 A 8 +ATOM 95 C C . ILE A1 1 8 ? -15.09 11.435 -13.762 1.0 0.33 ? 8 A 8 +ATOM 96 O O . ILE A1 1 8 ? -15.757 10.404 -13.682 1.0 11.35 ? 8 A 8 +ATOM 97 C CB . ILE A1 1 8 ? -13.024 11.38 -15.161 1.0 65.34 ? 8 A 8 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.068 10.202 -15.363 1.0 72.33 ? 8 A 8 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.325 12.695 -15.471 1.0 55.24 ? 8 A 8 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.617 10.029 -16.796 1.0 11.02 ? 8 A 8 +ATOM 101 H H . ILE A1 1 8 ? -13.54 9.365 -13.096 1.0 43.45 ? 8 A 8 +ATOM 102 H HA . ILE A1 1 8 ? -13.203 12.276 -13.224 1.0 41.41 ? 8 A 8 +ATOM 103 H HB . ILE A1 1 8 ? -13.859 11.276 -15.836 1.0 13.24 ? 8 A 8 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.189 10.352 -14.755 1.0 4.11 ? 8 A 8 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.561 9.291 -15.057 1.0 33.41 ? 8 A 8 +ATOM 106 H HG21 . ILE A1 1 8 ? -13.064 13.453 -15.686 1.0 12.11 ? 8 A 8 +ATOM 107 H HG22 . ILE A1 1 8 ? -11.737 13.0 -14.618 1.0 14.43 ? 8 A 8 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.68 12.568 -16.326 1.0 53.13 ? 8 A 8 +ATOM 109 H HD11 . ILE A1 1 8 ? -11.908 10.896 -17.372 1.0 4.51 ? 8 A 8 +ATOM 110 H HD12 . ILE A1 1 8 ? -10.542 9.924 -16.826 1.0 22.53 ? 8 A 8 +ATOM 111 H HD13 . ILE A1 1 8 ? -12.078 9.148 -17.215 1.0 32.23 ? 8 A 8 +ATOM 112 N N . PHE A1 1 9 ? -15.635 12.64 -13.892 1.0 44.42 ? 9 A 8 +ATOM 113 C CA . PHE A1 1 9 ? -17.081 12.824 -13.946 1.0 45.42 ? 9 A 8 +ATOM 114 C C . PHE A1 1 9 ? -17.524 13.234 -15.348 1.0 62.05 ? 9 A 8 +ATOM 115 O O . PHE A1 1 9 ? -17.014 14.2 -15.915 1.0 33.13 ? 9 A 8 +ATOM 116 C CB . PHE A1 1 9 ? -17.521 13.88 -12.931 1.0 42.3 ? 9 A 8 +ATOM 117 C CG . PHE A1 1 9 ? -18.317 13.317 -11.788 1.0 44.44 ? 9 A 8 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.464 12.575 -12.024 1.0 24.21 ? 9 A 8 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.92 13.53 -10.478 1.0 24.11 ? 9 A 8 +ATOM 120 C CE1 . PHE A1 1 9 ? -20.199 12.056 -10.975 1.0 54.33 ? 9 A 8 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.65 13.013 -9.425 1.0 62.43 ? 9 A 8 +ATOM 122 C CZ . PHE A1 1 9 ? -19.792 12.276 -9.674 1.0 72.21 ? 9 A 8 +ATOM 123 H H . PHE A1 1 9 ? -15.051 13.426 -13.951 1.0 15.35 ? 9 A 8 +ATOM 124 H HA . PHE A1 1 9 ? -17.543 11.881 -13.697 1.0 72.15 ? 9 A 8 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.646 14.36 -12.52 1.0 13.22 ? 9 A 8 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.131 14.617 -13.43 1.0 20.44 ? 9 A 8 +ATOM 127 H HD1 . PHE A1 1 9 ? -19.783 12.403 -13.042 1.0 63.23 ? 9 A 8 +ATOM 128 H HD2 . PHE A1 1 9 ? -17.028 14.107 -10.282 1.0 43.5 ? 9 A 8 +ATOM 129 H HE1 . PHE A1 1 9 ? -21.09 11.48 -11.173 1.0 53.21 ? 9 A 8 +ATOM 130 H HE2 . PHE A1 1 9 ? -18.33 13.187 -8.408 1.0 61.25 ? 9 A 8 +ATOM 131 H HZ . PHE A1 1 9 ? -20.364 11.87 -8.853 1.0 11.33 ? 9 A 8 +ATOM 132 N N . VAL A1 1 10 ? -18.478 12.491 -15.901 1.0 35.51 ? 10 A 8 +ATOM 133 C CA . VAL A1 1 10 ? -18.992 12.776 -17.235 1.0 51.35 ? 10 A 8 +ATOM 134 C C . VAL A1 1 10 ? -20.446 13.232 -17.179 1.0 20.3 ? 10 A 8 +ATOM 135 O O . VAL A1 1 10 ? -21.29 12.578 -16.566 1.0 33.54 ? 10 A 8 +ATOM 136 C CB . VAL A1 1 10 ? -18.887 11.543 -18.152 1.0 1.24 ? 10 A 8 +ATOM 137 C CG1 . VAL A1 1 10 ? -18.92 11.961 -19.615 1.0 43.55 ? 10 A 8 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.623 10.755 -17.843 1.0 70.41 ? 10 A 8 +ATOM 139 H H . VAL A1 1 10 ? -18.846 11.734 -15.399 1.0 13.11 ? 10 A 8 +ATOM 140 H HA . VAL A1 1 10 ? -18.393 13.568 -17.662 1.0 52.2 ? 10 A 8 +ATOM 141 H HB . VAL A1 1 10 ? -19.739 10.906 -17.964 1.0 21.21 ? 10 A 8 +ATOM 142 H HG11 . VAL A1 1 10 ? -18.491 11.177 -20.222 1.0 75.22 ? 10 A 8 +ATOM 143 H HG12 . VAL A1 1 10 ? -19.942 12.135 -19.917 1.0 54.41 ? 10 A 8 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.347 12.868 -19.743 1.0 61.31 ? 10 A 8 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.239 10.318 -18.752 1.0 13.24 ? 10 A 8 +ATOM 146 H HG22 . VAL A1 1 10 ? -16.882 11.417 -17.42 1.0 62.44 ? 10 A 8 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.852 9.972 -17.135 1.0 2.35 ? 10 A 8 +ATOM 148 N N . LYS A1 1 11 ? -20.732 14.359 -17.822 1.0 23.3 ? 11 A 8 +ATOM 149 C CA . LYS A1 1 11 ? -22.085 14.903 -17.848 1.0 10.31 ? 11 A 8 +ATOM 150 C C . LYS A1 1 11 ? -22.72 14.717 -19.222 1.0 22.12 ? 11 A 8 +ATOM 151 O O . LYS A1 1 11 ? -22.291 15.324 -20.204 1.0 63.21 ? 11 A 8 +ATOM 152 C CB . LYS A1 1 11 ? -22.066 16.388 -17.48 1.0 34.41 ? 11 A 8 +ATOM 153 C CG . LYS A1 1 11 ? -23.377 17.102 -17.763 1.0 63.11 ? 11 A 8 +ATOM 154 C CD . LYS A1 1 11 ? -23.3 18.575 -17.399 1.0 3.15 ? 11 A 8 +ATOM 155 C CE . LYS A1 1 11 ? -22.963 19.432 -18.609 1.0 2.52 ? 11 A 8 +ATOM 156 N NZ . LYS A1 1 11 ? -23.086 20.885 -18.311 1.0 51.12 ? 11 A 8 +ATOM 157 H H . LYS A1 1 11 ? -20.016 14.836 -18.293 1.0 4.15 ? 11 A 8 +ATOM 158 H HA . LYS A1 1 11 ? -22.672 14.367 -17.118 1.0 44.21 ? 11 A 8 +ATOM 159 H HB2 . LYS A1 1 11 ? -21.849 16.483 -16.426 1.0 75.01 ? 11 A 8 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.285 16.877 -18.045 1.0 15.43 ? 11 A 8 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.604 17.014 -18.815 1.0 73.24 ? 11 A 8 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.161 16.637 -17.183 1.0 30.03 ? 11 A 8 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.254 18.889 -17.004 1.0 63.51 ? 11 A 8 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.535 18.711 -16.647 1.0 61.22 ? 11 A 8 +ATOM 165 H HE2 . LYS A1 1 11 ? -21.949 19.22 -18.913 1.0 70.24 ? 11 A 8 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.64 19.179 -19.412 1.0 3.13 ? 11 A 8 +ATOM 167 H HZ1 . LYS A1 1 11 ? -23.942 21.064 -17.748 1.0 1.34 ? 11 A 8 +ATOM 168 H HZ2 . LYS A1 1 11 ? -23.146 21.428 -19.197 1.0 61.44 ? 11 A 8 +ATOM 169 H HZ3 . LYS A1 1 11 ? -22.256 21.211 -17.775 1.0 12.11 ? 11 A 8 +ATOM 170 N N . THR A1 1 12 ? -23.746 13.874 -19.285 1.0 60.33 ? 12 A 8 +ATOM 171 C CA . THR A1 1 12 ? -24.441 13.608 -20.539 1.0 63.11 ? 12 A 8 +ATOM 172 C C . THR A1 1 12 ? -25.332 14.78 -20.933 1.0 63.2 ? 12 A 8 +ATOM 173 O O . THR A1 1 12 ? -25.657 15.632 -20.104 1.0 23.14 ? 12 A 8 +ATOM 174 C CB . THR A1 1 12 ? -25.3 12.333 -20.445 1.0 13.53 ? 12 A 8 +ATOM 175 O OG1 . THR A1 1 12 ? -26.385 12.539 -19.534 1.0 44.22 ? 12 A 8 +ATOM 176 C CG2 . THR A1 1 12 ? -24.464 11.149 -19.986 1.0 44.25 ? 12 A 8 +ATOM 177 H H . THR A1 1 12 ? -24.041 13.42 -18.469 1.0 50.31 ? 12 A 8 +ATOM 178 H HA . THR A1 1 12 ? -23.696 13.46 -21.308 1.0 15.31 ? 12 A 8 +ATOM 179 H HB . THR A1 1 12 ? -25.7 12.114 -21.425 1.0 3.11 ? 12 A 8 +ATOM 180 H HG1 . THR A1 1 12 ? -26.977 11.784 -19.564 1.0 54.01 ? 12 A 8 +ATOM 181 H HG21 . THR A1 1 12 ? -23.417 11.372 -20.126 1.0 54.24 ? 12 A 8 +ATOM 182 H HG22 . THR A1 1 12 ? -24.726 10.276 -20.565 1.0 51.32 ? 12 A 8 +ATOM 183 H HG23 . THR A1 1 12 ? -24.654 10.958 -18.94 1.0 74.05 ? 12 A 8 +ATOM 184 N N . LEU A1 1 13 ? -25.725 14.819 -22.201 1.0 74.21 ? 13 A 8 +ATOM 185 C CA . LEU A1 1 13 ? -26.58 15.887 -22.705 1.0 74.52 ? 13 A 8 +ATOM 186 C C . LEU A1 1 13 ? -27.897 15.939 -21.937 1.0 25.21 ? 13 A 8 +ATOM 187 O O . LEU A1 1 13 ? -28.598 16.951 -21.951 1.0 11.35 ? 13 A 8 +ATOM 188 C CB . LEU A1 1 13 ? -26.854 15.687 -24.197 1.0 31.51 ? 13 A 8 +ATOM 189 C CG . LEU A1 1 13 ? -27.511 16.862 -24.922 1.0 30.32 ? 13 A 8 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.677 17.283 -26.122 1.0 44.31 ? 13 A 8 +ATOM 191 C CD2 . LEU A1 1 13 ? -28.925 16.499 -25.354 1.0 64.01 ? 13 A 8 +ATOM 192 H H . LEU A1 1 13 ? -25.433 14.112 -22.814 1.0 42.02 ? 13 A 8 +ATOM 193 H HA . LEU A1 1 13 ? -26.059 16.823 -22.566 1.0 34.1 ? 13 A 8 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.911 15.485 -24.682 1.0 62.11 ? 13 A 8 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.502 14.828 -24.301 1.0 43.21 ? 13 A 8 +ATOM 196 H HG . LEU A1 1 13 ? -27.573 17.705 -24.247 1.0 45.4 ? 13 A 8 +ATOM 197 H HD11 . LEU A1 1 13 ? -26.822 18.336 -26.309 1.0 62.23 ? 13 A 8 +ATOM 198 H HD12 . LEU A1 1 13 ? -26.983 16.717 -26.989 1.0 23.44 ? 13 A 8 +ATOM 199 H HD13 . LEU A1 1 13 ? -25.633 17.093 -25.919 1.0 25.55 ? 13 A 8 +ATOM 200 H HD21 . LEU A1 1 13 ? -29.312 15.727 -24.706 1.0 62.14 ? 13 A 8 +ATOM 201 H HD22 . LEU A1 1 13 ? -28.908 16.14 -26.373 1.0 41.34 ? 13 A 8 +ATOM 202 H HD23 . LEU A1 1 13 ? -29.556 17.373 -25.291 1.0 51.42 ? 13 A 8 +ATOM 203 N N . THR A1 1 14 ? -28.227 14.841 -21.265 1.0 31.41 ? 14 A 8 +ATOM 204 C CA . THR A1 1 14 ? -29.459 14.761 -20.49 1.0 30.33 ? 14 A 8 +ATOM 205 C C . THR A1 1 14 ? -29.217 15.136 -19.032 1.0 22.13 ? 14 A 8 +ATOM 206 O O . THR A1 1 14 ? -30.064 14.902 -18.171 1.0 5.31 ? 14 A 8 +ATOM 207 C CB . THR A1 1 14 ? -30.069 13.348 -20.549 1.0 34.54 ? 14 A 8 +ATOM 208 O OG1 . THR A1 1 14 ? -29.196 12.41 -19.91 1.0 3.22 ? 14 A 8 +ATOM 209 C CG2 . THR A1 1 14 ? -30.312 12.923 -21.99 1.0 34.11 ? 14 A 8 +ATOM 210 H H . THR A1 1 14 ? -27.627 14.066 -21.292 1.0 2.31 ? 14 A 8 +ATOM 211 H HA . THR A1 1 14 ? -30.168 15.455 -20.917 1.0 25.44 ? 14 A 8 +ATOM 212 H HB . THR A1 1 14 ? -31.016 13.359 -20.028 1.0 55.24 ? 14 A 8 +ATOM 213 H HG1 . THR A1 1 14 ? -29.603 11.54 -19.914 1.0 24.42 ? 14 A 8 +ATOM 214 H HG21 . THR A1 1 14 ? -29.537 12.238 -22.298 1.0 1.02 ? 14 A 8 +ATOM 215 H HG22 . THR A1 1 14 ? -30.297 13.793 -22.629 1.0 12.23 ? 14 A 8 +ATOM 216 H HG23 . THR A1 1 14 ? -31.273 12.437 -22.065 1.0 12.42 ? 14 A 8 +ATOM 217 N N . GLY A1 1 15 ? -28.054 15.722 -18.762 1.0 61.2 ? 15 A 8 +ATOM 218 C CA . GLY A1 1 15 ? -27.722 16.121 -17.407 1.0 25.44 ? 15 A 8 +ATOM 219 C C . GLY A1 1 15 ? -27.572 14.936 -16.473 1.0 2.34 ? 15 A 8 +ATOM 220 O O . GLY A1 1 15 ? -28.265 14.842 -15.46 1.0 24.03 ? 15 A 8 +ATOM 221 H H . GLY A1 1 15 ? -27.416 15.884 -19.489 1.0 73.22 ? 15 A 8 +ATOM 222 H HA2 . GLY A1 1 15 ? -26.794 16.673 -17.423 1.0 10.15 ? 15 A 8 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.504 16.764 -17.031 1.0 23.53 ? 15 A 8 +ATOM 224 N N . LYS A1 1 16 ? -26.665 14.027 -16.815 1.0 11.21 ? 16 A 8 +ATOM 225 C CA . LYS A1 1 16 ? -26.425 12.841 -16.001 1.0 34.13 ? 16 A 8 +ATOM 226 C C . LYS A1 1 16 ? -24.968 12.772 -15.556 1.0 15.24 ? 16 A 8 +ATOM 227 O O . LYS A1 1 16 ? -24.057 12.71 -16.383 1.0 50.04 ? 16 A 8 +ATOM 228 C CB . LYS A1 1 16 ? -26.791 11.578 -16.784 1.0 31.42 ? 16 A 8 +ATOM 229 C CG . LYS A1 1 16 ? -27.351 10.465 -15.915 1.0 73.35 ? 16 A 8 +ATOM 230 C CD . LYS A1 1 16 ? -26.252 9.544 -15.412 1.0 50.3 ? 16 A 8 +ATOM 231 C CE . LYS A1 1 16 ? -25.633 8.743 -16.547 1.0 52.44 ? 16 A 8 +ATOM 232 N NZ . LYS A1 1 16 ? -25.993 7.301 -16.47 1.0 2.53 ? 16 A 8 +ATOM 233 H H . LYS A1 1 16 ? -26.143 14.158 -17.635 1.0 52.54 ? 16 A 8 +ATOM 234 H HA . LYS A1 1 16 ? -27.054 12.907 -15.126 1.0 34.34 ? 16 A 8 +ATOM 235 H HB2 . LYS A1 1 16 ? -27.531 11.832 -17.528 1.0 44.24 ? 16 A 8 +ATOM 236 H HB3 . LYS A1 1 16 ? -25.906 11.208 -17.28 1.0 12.13 ? 16 A 8 +ATOM 237 H HG2 . LYS A1 1 16 ? -27.855 10.902 -15.066 1.0 3.41 ? 16 A 8 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.055 9.887 -16.496 1.0 74.14 ? 16 A 8 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.481 10.139 -14.944 1.0 63.23 ? 16 A 8 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.671 8.86 -14.687 1.0 14.51 ? 16 A 8 +ATOM 241 H HE2 . LYS A1 1 16 ? -25.985 9.143 -17.486 1.0 44.12 ? 16 A 8 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.558 8.841 -16.495 1.0 75.31 ? 16 A 8 +ATOM 243 H HZ1 . LYS A1 1 16 ? -25.461 6.84 -15.704 1.0 61.55 ? 16 A 8 +ATOM 244 H HZ2 . LYS A1 1 16 ? -25.768 6.827 -17.368 1.0 23.15 ? 16 A 8 +ATOM 245 H HZ3 . LYS A1 1 16 ? -27.01 7.196 -16.281 1.0 43.23 ? 16 A 8 +ATOM 246 N N . THR A1 1 17 ? -24.753 12.781 -14.244 1.0 33.03 ? 17 A 8 +ATOM 247 C CA . THR A1 1 17 ? -23.407 12.719 -13.689 1.0 61.21 ? 17 A 8 +ATOM 248 C C . THR A1 1 17 ? -22.991 11.279 -13.416 1.0 13.11 ? 17 A 8 +ATOM 249 O O . THR A1 1 17 ? -23.624 10.579 -12.625 1.0 32.24 ? 17 A 8 +ATOM 250 C CB . THR A1 1 17 ? -23.3 13.529 -12.383 1.0 22.54 ? 17 A 8 +ATOM 251 O OG1 . THR A1 1 17 ? -24.603 13.737 -11.827 1.0 24.32 ? 17 A 8 +ATOM 252 C CG2 . THR A1 1 17 ? -22.629 14.871 -12.632 1.0 72.42 ? 17 A 8 +ATOM 253 H H . THR A1 1 17 ? -25.52 12.832 -13.636 1.0 63.53 ? 17 A 8 +ATOM 254 H HA . THR A1 1 17 ? -22.729 13.15 -14.411 1.0 15.15 ? 17 A 8 +ATOM 255 H HB . THR A1 1 17 ? -22.702 12.969 -11.678 1.0 61.22 ? 17 A 8 +ATOM 256 H HG1 . THR A1 1 17 ? -25.04 14.453 -12.295 1.0 54.0 ? 17 A 8 +ATOM 257 H HG21 . THR A1 1 17 ? -22.925 15.569 -11.863 1.0 31.34 ? 17 A 8 +ATOM 258 H HG22 . THR A1 1 17 ? -22.93 15.251 -13.597 1.0 12.24 ? 17 A 8 +ATOM 259 H HG23 . THR A1 1 17 ? -21.557 14.746 -12.612 1.0 74.01 ? 17 A 8 +ATOM 260 N N . ILE A1 1 18 ? -21.923 10.841 -14.076 1.0 21.15 ? 18 A 8 +ATOM 261 C CA . ILE A1 1 18 ? -21.422 9.484 -13.902 1.0 42.23 ? 18 A 8 +ATOM 262 C C . ILE A1 1 18 ? -19.938 9.486 -13.551 1.0 2.02 ? 18 A 8 +ATOM 263 O O . ILE A1 1 18 ? -19.17 10.305 -14.057 1.0 34.24 ? 18 A 8 +ATOM 264 C CB . ILE A1 1 18 ? -21.636 8.638 -15.171 1.0 20.13 ? 18 A 8 +ATOM 265 C CG1 . ILE A1 1 18 ? -20.911 7.296 -15.045 1.0 0.43 ? 18 A 8 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.153 9.394 -16.4 1.0 34.34 ? 18 A 8 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.195 6.346 -16.187 1.0 41.12 ? 18 A 8 +ATOM 268 H H . ILE A1 1 18 ? -21.462 11.446 -14.693 1.0 72.35 ? 18 A 8 +ATOM 269 H HA . ILE A1 1 18 ? -21.972 9.027 -13.092 1.0 33.1 ? 18 A 8 +ATOM 270 H HB . ILE A1 1 18 ? -22.695 8.458 -15.283 1.0 55.23 ? 18 A 8 +ATOM 271 H HG12 . ILE A1 1 18 ? -19.847 7.471 -15.017 1.0 35.45 ? 18 A 8 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.218 6.815 -14.128 1.0 15.51 ? 18 A 8 +ATOM 273 H HG21 . ILE A1 1 18 ? -21.323 8.794 -17.282 1.0 31.24 ? 18 A 8 +ATOM 274 H HG22 . ILE A1 1 18 ? -21.696 10.323 -16.487 1.0 60.32 ? 18 A 8 +ATOM 275 H HG23 . ILE A1 1 18 ? -20.098 9.601 -16.303 1.0 71.44 ? 18 A 8 +ATOM 276 H HD11 . ILE A1 1 18 ? -20.266 6.065 -16.661 1.0 32.31 ? 18 A 8 +ATOM 277 H HD12 . ILE A1 1 18 ? -21.685 5.462 -15.807 1.0 60.24 ? 18 A 8 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.835 6.831 -16.909 1.0 25.35 ? 18 A 8 +ATOM 279 N N . THR A1 1 19 ? -19.54 8.563 -12.682 1.0 42.32 ? 19 A 8 +ATOM 280 C CA . THR A1 1 19 ? -18.148 8.457 -12.263 1.0 41.24 ? 19 A 8 +ATOM 281 C C . THR A1 1 19 ? -17.492 7.209 -12.842 1.0 70.21 ? 19 A 8 +ATOM 282 O O . THR A1 1 19 ? -18.113 6.148 -12.916 1.0 44.42 ? 19 A 8 +ATOM 283 C CB . THR A1 1 19 ? -18.024 8.423 -10.728 1.0 2.4 ? 19 A 8 +ATOM 284 O OG1 . THR A1 1 19 ? -19.325 8.445 -10.131 1.0 22.32 ? 19 A 8 +ATOM 285 C CG2 . THR A1 1 19 ? -17.209 9.604 -10.224 1.0 13.14 ? 19 A 8 +ATOM 286 H H . THR A1 1 19 ? -20.199 7.938 -12.314 1.0 1.15 ? 19 A 8 +ATOM 287 H HA . THR A1 1 19 ? -17.623 9.329 -12.626 1.0 65.43 ? 19 A 8 +ATOM 288 H HB . THR A1 1 19 ? -17.521 7.51 -10.443 1.0 44.24 ? 19 A 8 +ATOM 289 H HG1 . THR A1 1 19 ? -19.717 7.569 -10.184 1.0 60.25 ? 19 A 8 +ATOM 290 H HG21 . THR A1 1 19 ? -17.851 10.466 -10.123 1.0 73.33 ? 19 A 8 +ATOM 291 H HG22 . THR A1 1 19 ? -16.42 9.824 -10.928 1.0 23.45 ? 19 A 8 +ATOM 292 H HG23 . THR A1 1 19 ? -16.779 9.361 -9.264 1.0 51.03 ? 19 A 8 +ATOM 293 N N . ILE A1 1 20 ? -16.235 7.342 -13.252 1.0 2.13 ? 20 A 8 +ATOM 294 C CA . ILE A1 1 20 ? -15.496 6.224 -13.824 1.0 23.24 ? 20 A 8 +ATOM 295 C C . ILE A1 1 20 ? -14.024 6.279 -13.428 1.0 21.51 ? 20 A 8 +ATOM 296 O O . ILE A1 1 20 ? -13.38 7.323 -13.536 1.0 3.54 ? 20 A 8 +ATOM 297 C CB . ILE A1 1 20 ? -15.603 6.204 -15.36 1.0 55.55 ? 20 A 8 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.662 7.632 -15.907 1.0 1.5 ? 20 A 8 +ATOM 299 C CG2 . ILE A1 1 20 ? -16.827 5.413 -15.796 1.0 1.32 ? 20 A 8 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.011 7.787 -17.264 1.0 2.4 ? 20 A 8 +ATOM 301 H H . ILE A1 1 20 ? -15.795 8.213 -13.168 1.0 32.52 ? 20 A 8 +ATOM 302 H HA . ILE A1 1 20 ? -15.927 5.31 -13.441 1.0 40.32 ? 20 A 8 +ATOM 303 H HB . ILE A1 1 20 ? -14.727 5.712 -15.753 1.0 75.22 ? 20 A 8 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.693 7.934 -15.998 1.0 4.24 ? 20 A 8 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.157 8.294 -15.219 1.0 20.02 ? 20 A 8 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.631 6.095 -16.03 1.0 41.11 ? 20 A 8 +ATOM 307 H HG22 . ILE A1 1 20 ? -16.585 4.829 -16.671 1.0 51.34 ? 20 A 8 +ATOM 308 H HG23 . ILE A1 1 20 ? -17.134 4.755 -14.997 1.0 74.34 ? 20 A 8 +ATOM 309 H HD11 . ILE A1 1 20 ? -15.516 8.566 -17.818 1.0 44.23 ? 20 A 8 +ATOM 310 H HD12 . ILE A1 1 20 ? -13.972 8.052 -17.137 1.0 43.31 ? 20 A 8 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.083 6.856 -17.806 1.0 23.14 ? 20 A 8 +ATOM 312 N N . ASP A1 1 21 ? -13.497 5.148 -12.972 1.0 44.41 ? 21 A 8 +ATOM 313 C CA . ASP A1 1 21 ? -12.1 5.066 -12.563 1.0 13.43 ? 21 A 8 +ATOM 314 C C . ASP A1 1 21 ? -11.193 4.839 -13.768 1.0 74.52 ? 21 A 8 +ATOM 315 O O . ASP A1 1 21 ? -11.41 3.918 -14.557 1.0 3.25 ? 21 A 8 +ATOM 316 C CB . ASP A1 1 21 ? -11.909 3.939 -11.546 1.0 40.32 ? 21 A 8 +ATOM 317 C CG . ASP A1 1 21 ? -12.341 2.59 -12.089 1.0 70.32 ? 21 A 8 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.563 2.339 -12.147 1.0 34.41 ? 21 A 8 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.458 1.787 -12.455 1.0 4.34 ? 21 A 8 +ATOM 320 H H . ASP A1 1 21 ? -14.062 4.349 -12.909 1.0 61.24 ? 21 A 8 +ATOM 321 H HA . ASP A1 1 21 ? -11.834 6.004 -12.1 1.0 0.1 ? 21 A 8 +ATOM 322 H HB2 . ASP A1 1 21 ? -10.865 3.879 -11.276 1.0 73.15 ? 21 A 8 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.493 4.156 -10.664 1.0 61.23 ? 21 A 8 +ATOM 324 N N . VAL A1 1 22 ? -10.177 5.685 -13.906 1.0 30.34 ? 22 A 8 +ATOM 325 C CA . VAL A1 1 22 ? -9.238 5.577 -15.015 1.0 1.34 ? 22 A 8 +ATOM 326 C C . VAL A1 1 22 ? -7.818 5.908 -14.568 1.0 61.2 ? 22 A 8 +ATOM 327 O O . VAL A1 1 22 ? -7.613 6.491 -13.503 1.0 34.03 ? 22 A 8 +ATOM 328 C CB . VAL A1 1 22 ? -9.629 6.511 -16.176 1.0 60.13 ? 22 A 8 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.109 6.855 -16.108 1.0 14.0 ? 22 A 8 +ATOM 330 C CG2 . VAL A1 1 22 ? -8.779 7.772 -16.155 1.0 61.12 ? 22 A 8 +ATOM 331 H H . VAL A1 1 22 ? -10.057 6.398 -13.245 1.0 71.0 ? 22 A 8 +ATOM 332 H HA . VAL A1 1 22 ? -9.262 4.559 -15.376 1.0 41.13 ? 22 A 8 +ATOM 333 H HB . VAL A1 1 22 ? -9.446 5.993 -17.106 1.0 23.42 ? 22 A 8 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.28 7.552 -15.301 1.0 3.13 ? 22 A 8 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.419 7.301 -17.042 1.0 11.12 ? 22 A 8 +ATOM 336 H HG13 . VAL A1 1 22 ? -11.68 5.955 -15.931 1.0 2.3 ? 22 A 8 +ATOM 337 H HG21 . VAL A1 1 22 ? -9.189 8.494 -16.844 1.0 43.3 ? 22 A 8 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.775 8.186 -15.158 1.0 71.52 ? 22 A 8 +ATOM 339 H HG23 . VAL A1 1 22 ? -7.767 7.529 -16.448 1.0 24.41 ? 22 A 8 +ATOM 340 N N . ASP A1 1 23 ? -6.843 5.533 -15.388 1.0 73.14 ? 23 A 8 +ATOM 341 C CA . ASP A1 1 23 ? -5.442 5.792 -15.077 1.0 0.33 ? 23 A 8 +ATOM 342 C C . ASP A1 1 23 ? -4.826 6.744 -16.098 1.0 62.12 ? 23 A 8 +ATOM 343 O O . ASP A1 1 23 ? -5.266 6.81 -17.246 1.0 35.34 ? 23 A 8 +ATOM 344 C CB . ASP A1 1 23 ? -4.654 4.482 -15.044 1.0 24.44 ? 23 A 8 +ATOM 345 C CG . ASP A1 1 23 ? -5.463 3.335 -14.47 1.0 11.25 ? 23 A 8 +ATOM 346 O OD1 . ASP A1 1 23 ? -6.329 2.8 -15.193 1.0 71.52 ? 23 A 8 +ATOM 347 O OD2 . ASP A1 1 23 ? -5.228 2.972 -13.299 1.0 54.12 ? 23 A 8 +ATOM 348 H H . ASP A1 1 23 ? -7.07 5.072 -16.222 1.0 71.31 ? 23 A 8 +ATOM 349 H HA . ASP A1 1 23 ? -5.398 6.253 -14.102 1.0 62.03 ? 23 A 8 +ATOM 350 H HB2 . ASP A1 1 23 ? -4.358 4.221 -16.05 1.0 75.32 ? 23 A 8 +ATOM 351 H HB3 . ASP A1 1 23 ? -3.771 4.615 -14.437 1.0 32.1 ? 23 A 8 +ATOM 352 N N . HIS A1 1 24 ? -3.805 7.482 -15.672 1.0 3.42 ? 24 A 8 +ATOM 353 C CA . HIS A1 1 24 ? -3.129 8.431 -16.549 1.0 64.1 ? 24 A 8 +ATOM 354 C C . HIS A1 1 24 ? -2.514 7.719 -17.749 1.0 13.22 ? 24 A 8 +ATOM 355 O O . HIS A1 1 24 ? -2.157 8.351 -18.742 1.0 40.32 ? 24 A 8 +ATOM 356 C CB . HIS A1 1 24 ? -2.046 9.187 -15.778 1.0 43.52 ? 24 A 8 +ATOM 357 C CG . HIS A1 1 24 ? -0.902 8.321 -15.349 1.0 63.23 ? 24 A 8 +ATOM 358 N ND1 . HIS A1 1 24 ? -0.802 7.777 -14.086 1.0 33.23 ? 24 A 8 +ATOM 359 C CD2 . HIS A1 1 24 ? 0.195 7.903 -16.024 1.0 70.35 ? 24 A 8 +ATOM 360 C CE1 . HIS A1 1 24 ? 0.307 7.064 -14.002 1.0 52.22 ? 24 A 8 +ATOM 361 N NE2 . HIS A1 1 24 ? 0.93 7.124 -15.165 1.0 51.1 ? 24 A 8 +ATOM 362 H H . HIS A1 1 24 ? -3.5 7.385 -14.746 1.0 35.01 ? 24 A 8 +ATOM 363 H HA . HIS A1 1 24 ? -3.865 9.137 -16.903 1.0 52.33 ? 24 A 8 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.65 9.972 -16.405 1.0 74.33 ? 24 A 8 +ATOM 365 H HB3 . HIS A1 1 24 ? -2.482 9.625 -14.892 1.0 2.24 ? 24 A 8 +ATOM 366 H HD1 . HIS A1 1 24 ? -1.448 7.897 -13.359 1.0 61.24 ? 24 A 8 +ATOM 367 H HD2 . HIS A1 1 24 ? 0.446 8.14 -17.049 1.0 14.35 ? 24 A 8 +ATOM 368 H HE1 . HIS A1 1 24 ? 0.647 6.523 -13.131 1.0 73.24 ? 24 A 8 +ATOM 369 N N . ALA A1 1 25 ? -2.392 6.399 -17.649 1.0 63.43 ? 25 A 8 +ATOM 370 C CA . ALA A1 1 25 ? -1.821 5.601 -18.727 1.0 43.32 ? 25 A 8 +ATOM 371 C C . ALA A1 1 25 ? -2.886 5.212 -19.746 1.0 33.54 ? 25 A 8 +ATOM 372 O O . ALA A1 1 25 ? -2.627 4.431 -20.662 1.0 12.23 ? 25 A 8 +ATOM 373 C CB . ALA A1 1 25 ? -1.148 4.358 -18.164 1.0 51.34 ? 25 A 8 +ATOM 374 H H . ALA A1 1 25 ? -2.695 5.952 -16.832 1.0 55.41 ? 25 A 8 +ATOM 375 H HA . ALA A1 1 25 ? -1.066 6.197 -19.22 1.0 23.12 ? 25 A 8 +ATOM 376 H HB1 . ALA A1 1 25 ? -1.843 3.832 -17.525 1.0 42.21 ? 25 A 8 +ATOM 377 H HB2 . ALA A1 1 25 ? -0.846 3.713 -18.975 1.0 3.14 ? 25 A 8 +ATOM 378 H HB3 . ALA A1 1 25 ? -0.28 4.647 -17.591 1.0 44.44 ? 25 A 8 +ATOM 379 N N . ASP A1 1 26 ? -4.085 5.761 -19.581 1.0 53.31 ? 26 A 8 +ATOM 380 C CA . ASP A1 1 26 ? -5.19 5.472 -20.488 1.0 71.32 ? 26 A 8 +ATOM 381 C C . ASP A1 1 26 ? -5.366 6.595 -21.505 1.0 31.24 ? 26 A 8 +ATOM 382 O O . ASP A1 1 26 ? -4.5 7.459 -21.65 1.0 53.43 ? 26 A 8 +ATOM 383 C CB . ASP A1 1 26 ? -6.485 5.274 -19.699 1.0 21.1 ? 26 A 8 +ATOM 384 C CG . ASP A1 1 26 ? -6.343 4.238 -18.602 1.0 73.54 ? 26 A 8 +ATOM 385 O OD1 . ASP A1 1 26 ? -5.321 3.52 -18.592 1.0 73.22 ? 26 A 8 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.252 4.146 -17.751 1.0 2.02 ? 26 A 8 +ATOM 387 H H . ASP A1 1 26 ? -4.229 6.377 -18.832 1.0 73.33 ? 26 A 8 +ATOM 388 H HA . ASP A1 1 26 ? -4.957 4.56 -21.014 1.0 35.3 ? 26 A 8 +ATOM 389 H HB2 . ASP A1 1 26 ? -6.772 6.213 -19.248 1.0 71.15 ? 26 A 8 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.264 4.952 -20.375 1.0 51.4 ? 26 A 8 +ATOM 391 N N . THR A1 1 27 ? -6.493 6.577 -22.211 1.0 11.22 ? 27 A 8 +ATOM 392 C CA . THR A1 1 27 ? -6.781 7.591 -23.216 1.0 12.11 ? 27 A 8 +ATOM 393 C C . THR A1 1 27 ? -8.276 7.879 -23.293 1.0 24.55 ? 27 A 8 +ATOM 394 O O . THR A1 1 27 ? -9.092 7.126 -22.762 1.0 14.34 ? 27 A 8 +ATOM 395 C CB . THR A1 1 27 ? -6.281 7.161 -24.608 1.0 24.42 ? 27 A 8 +ATOM 396 O OG1 . THR A1 1 27 ? -6.262 5.732 -24.702 1.0 51.41 ? 27 A 8 +ATOM 397 C CG2 . THR A1 1 27 ? -4.888 7.71 -24.876 1.0 72.22 ? 27 A 8 +ATOM 398 H H . THR A1 1 27 ? -7.144 5.863 -22.05 1.0 1.33 ? 27 A 8 +ATOM 399 H HA . THR A1 1 27 ? -6.264 8.497 -22.935 1.0 54.42 ? 27 A 8 +ATOM 400 H HB . THR A1 1 27 ? -6.957 7.554 -25.354 1.0 51.23 ? 27 A 8 +ATOM 401 H HG1 . THR A1 1 27 ? -6.388 5.469 -25.617 1.0 23.44 ? 27 A 8 +ATOM 402 H HG21 . THR A1 1 27 ? -4.214 7.373 -24.104 1.0 20.21 ? 27 A 8 +ATOM 403 H HG22 . THR A1 1 27 ? -4.921 8.79 -24.878 1.0 40.31 ? 27 A 8 +ATOM 404 H HG23 . THR A1 1 27 ? -4.541 7.359 -25.836 1.0 53.14 ? 27 A 8 +ATOM 405 N N . VAL A1 1 28 ? -8.63 8.974 -23.959 1.0 70.04 ? 28 A 8 +ATOM 406 C CA . VAL A1 1 28 ? -10.028 9.361 -24.107 1.0 40.12 ? 28 A 8 +ATOM 407 C C . VAL A1 1 28 ? -10.843 8.241 -24.743 1.0 43.3 ? 28 A 8 +ATOM 408 O O . VAL A1 1 28 ? -11.907 7.874 -24.246 1.0 51.44 ? 28 A 8 +ATOM 409 C CB . VAL A1 1 28 ? -10.17 10.635 -24.961 1.0 70.14 ? 28 A 8 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.591 11.172 -24.886 1.0 13.41 ? 28 A 8 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.168 11.689 -24.516 1.0 73.55 ? 28 A 8 +ATOM 412 H H . VAL A1 1 28 ? -7.934 9.535 -24.36 1.0 50.23 ? 28 A 8 +ATOM 413 H HA . VAL A1 1 28 ? -10.423 9.567 -23.123 1.0 62.42 ? 28 A 8 +ATOM 414 H HB . VAL A1 1 28 ? -9.96 10.38 -25.989 1.0 52.41 ? 28 A 8 +ATOM 415 H HG11 . VAL A1 1 28 ? -12.291 10.355 -24.986 1.0 72.32 ? 28 A 8 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.742 11.661 -23.935 1.0 75.12 ? 28 A 8 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.75 11.881 -25.685 1.0 43.12 ? 28 A 8 +ATOM 418 H HG21 . VAL A1 1 28 ? -8.563 11.989 -25.358 1.0 22.23 ? 28 A 8 +ATOM 419 H HG22 . VAL A1 1 28 ? -9.698 12.547 -24.129 1.0 21.24 ? 28 A 8 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.533 11.28 -23.744 1.0 51.43 ? 28 A 8 +ATOM 421 N N . GLY A1 1 29 ? -10.336 7.701 -25.848 1.0 51.02 ? 29 A 8 +ATOM 422 C CA . GLY A1 1 29 ? -11.03 6.628 -26.535 1.0 24.21 ? 29 A 8 +ATOM 423 C C . GLY A1 1 29 ? -11.441 5.51 -25.598 1.0 62.32 ? 29 A 8 +ATOM 424 O O . GLY A1 1 29 ? -12.595 5.082 -25.599 1.0 1.41 ? 29 A 8 +ATOM 425 H H . GLY A1 1 29 ? -9.484 8.035 -26.199 1.0 25.44 ? 29 A 8 +ATOM 426 H HA2 . GLY A1 1 29 ? -11.914 7.03 -27.008 1.0 33.14 ? 29 A 8 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.38 6.223 -27.296 1.0 61.11 ? 29 A 8 +ATOM 428 N N . ALA A1 1 30 ? -10.494 5.034 -24.796 1.0 0.3 ? 30 A 8 +ATOM 429 C CA . ALA A1 1 30 ? -10.764 3.958 -23.85 1.0 24.42 ? 30 A 8 +ATOM 430 C C . ALA A1 1 30 ? -11.844 4.363 -22.853 1.0 23.15 ? 30 A 8 +ATOM 431 O O . ALA A1 1 30 ? -12.723 3.568 -22.517 1.0 23.32 ? 30 A 8 +ATOM 432 C CB . ALA A1 1 30 ? -9.488 3.567 -23.119 1.0 4.23 ? 30 A 8 +ATOM 433 H H . ALA A1 1 30 ? -9.593 5.415 -24.842 1.0 13.0 ? 30 A 8 +ATOM 434 H HA . ALA A1 1 30 ? -11.107 3.1 -24.409 1.0 42.35 ? 30 A 8 +ATOM 435 H HB1 . ALA A1 1 30 ? -9.658 2.656 -22.563 1.0 24.3 ? 30 A 8 +ATOM 436 H HB2 . ALA A1 1 30 ? -8.696 3.409 -23.836 1.0 15.25 ? 30 A 8 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.206 4.357 -22.438 1.0 54.13 ? 30 A 8 +ATOM 438 N N . VAL A1 1 31 ? -11.773 5.604 -22.381 1.0 44.02 ? 31 A 8 +ATOM 439 C CA . VAL A1 1 31 ? -12.746 6.114 -21.422 1.0 44.43 ? 31 A 8 +ATOM 440 C C . VAL A1 1 31 ? -14.153 6.103 -22.008 1.0 22.33 ? 31 A 8 +ATOM 441 O O . VAL A1 1 31 ? -15.113 5.719 -21.34 1.0 41.34 ? 31 A 8 +ATOM 442 C CB . VAL A1 1 31 ? -12.398 7.547 -20.978 1.0 42.01 ? 31 A 8 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.459 8.085 -20.03 1.0 61.22 ? 31 A 8 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.023 7.584 -20.329 1.0 34.2 ? 31 A 8 +ATOM 445 H H . VAL A1 1 31 ? -11.05 6.19 -22.686 1.0 33.11 ? 31 A 8 +ATOM 446 H HA . VAL A1 1 31 ? -12.724 5.475 -20.551 1.0 53.53 ? 31 A 8 +ATOM 447 H HB . VAL A1 1 31 ? -12.376 8.178 -21.854 1.0 34.14 ? 31 A 8 +ATOM 448 H HG11 . VAL A1 1 31 ? -12.984 8.659 -19.248 1.0 24.43 ? 31 A 8 +ATOM 449 H HG12 . VAL A1 1 31 ? -14.144 8.717 -20.577 1.0 62.24 ? 31 A 8 +ATOM 450 H HG13 . VAL A1 1 31 ? -14.001 7.26 -19.592 1.0 4.44 ? 31 A 8 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.63 6.581 -20.258 1.0 32.4 ? 31 A 8 +ATOM 452 H HG22 . VAL A1 1 31 ? -10.359 8.189 -20.928 1.0 31.51 ? 31 A 8 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.103 8.01 -19.339 1.0 2.41 ? 31 A 8 +ATOM 454 N N . LYS A1 1 32 ? -14.269 6.526 -23.262 1.0 44.33 ? 32 A 8 +ATOM 455 C CA . LYS A1 1 32 ? -15.559 6.564 -23.941 1.0 33.41 ? 32 A 8 +ATOM 456 C C . LYS A1 1 32 ? -16.227 5.192 -23.918 1.0 33.52 ? 32 A 8 +ATOM 457 O O . LYS A1 1 32 ? -17.427 5.08 -23.669 1.0 55.22 ? 32 A 8 +ATOM 458 C CB . LYS A1 1 32 ? -15.384 7.032 -25.387 1.0 21.43 ? 32 A 8 +ATOM 459 C CG . LYS A1 1 32 ? -16.056 8.362 -25.682 1.0 62.04 ? 32 A 8 +ATOM 460 C CD . LYS A1 1 32 ? -15.045 9.494 -25.758 1.0 13.3 ? 32 A 8 +ATOM 461 C CE . LYS A1 1 32 ? -14.614 9.76 -27.192 1.0 61.02 ? 32 A 8 +ATOM 462 N NZ . LYS A1 1 32 ? -14.191 8.512 -27.885 1.0 10.13 ? 32 A 8 +ATOM 463 H H . LYS A1 1 32 ? -13.467 6.82 -23.744 1.0 0.43 ? 32 A 8 +ATOM 464 H HA . LYS A1 1 32 ? -16.189 7.267 -23.418 1.0 20.21 ? 32 A 8 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.329 7.132 -25.595 1.0 31.13 ? 32 A 8 +ATOM 466 H HB3 . LYS A1 1 32 ? -15.803 6.287 -26.048 1.0 51.43 ? 32 A 8 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.574 8.292 -26.627 1.0 34.55 ? 32 A 8 +ATOM 468 H HG3 . LYS A1 1 32 ? -16.766 8.578 -24.895 1.0 75.31 ? 32 A 8 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.49 10.391 -25.355 1.0 62.53 ? 32 A 8 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.175 9.228 -25.173 1.0 34.24 ? 32 A 8 +ATOM 471 H HE2 . LYS A1 1 32 ? -15.443 10.196 -27.728 1.0 32.35 ? 32 A 8 +ATOM 472 H HE3 . LYS A1 1 32 ? -13.787 10.455 -27.182 1.0 31.14 ? 32 A 8 +ATOM 473 H HZ1 . LYS A1 1 32 ? -13.636 7.915 -27.24 1.0 3.34 ? 32 A 8 +ATOM 474 H HZ2 . LYS A1 1 32 ? -13.608 8.745 -28.714 1.0 11.13 ? 32 A 8 +ATOM 475 H HZ3 . LYS A1 1 32 ? -15.026 7.979 -28.202 1.0 13.55 ? 32 A 8 +ATOM 476 N N . ALA A1 1 33 ? -15.441 4.152 -24.176 1.0 34.21 ? 33 A 8 +ATOM 477 C CA . ALA A1 1 33 ? -15.955 2.788 -24.181 1.0 60.31 ? 33 A 8 +ATOM 478 C C . ALA A1 1 33 ? -16.452 2.384 -22.797 1.0 31.03 ? 33 A 8 +ATOM 479 O O . ALA A1 1 33 ? -17.466 1.698 -22.665 1.0 31.32 ? 33 A 8 +ATOM 480 C CB . ALA A1 1 33 ? -14.884 1.822 -24.662 1.0 54.24 ? 33 A 8 +ATOM 481 H H . ALA A1 1 33 ? -14.492 4.306 -24.367 1.0 43.1 ? 33 A 8 +ATOM 482 H HA . ALA A1 1 33 ? -16.782 2.746 -24.875 1.0 53.01 ? 33 A 8 +ATOM 483 H HB1 . ALA A1 1 33 ? -13.991 1.95 -24.068 1.0 2.33 ? 33 A 8 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.242 0.808 -24.561 1.0 61.23 ? 33 A 8 +ATOM 485 H HB3 . ALA A1 1 33 ? -14.658 2.022 -25.699 1.0 53.23 ? 33 A 8 +ATOM 486 N N . LYS A1 1 34 ? -15.731 2.813 -21.766 1.0 30.14 ? 34 A 8 +ATOM 487 C CA . LYS A1 1 34 ? -16.098 2.497 -20.391 1.0 3.41 ? 34 A 8 +ATOM 488 C C . LYS A1 1 34 ? -17.487 3.034 -20.061 1.0 51.04 ? 34 A 8 +ATOM 489 O O . LYS A1 1 34 ? -18.295 2.349 -19.433 1.0 30.3 ? 34 A 8 +ATOM 490 C CB . LYS A1 1 34 ? -15.069 3.081 -19.42 1.0 63.02 ? 34 A 8 +ATOM 491 C CG . LYS A1 1 34 ? -15.328 2.716 -17.968 1.0 24.43 ? 34 A 8 +ATOM 492 C CD . LYS A1 1 34 ? -15.131 1.229 -17.724 1.0 44.42 ? 34 A 8 +ATOM 493 C CE . LYS A1 1 34 ? -13.677 0.822 -17.906 1.0 34.12 ? 34 A 8 +ATOM 494 N NZ . LYS A1 1 34 ? -13.306 -0.319 -17.023 1.0 13.0 ? 34 A 8 +ATOM 495 H H . LYS A1 1 34 ? -14.933 3.357 -21.935 1.0 65.25 ? 34 A 8 +ATOM 496 H HA . LYS A1 1 34 ? -16.108 1.422 -20.289 1.0 3.22 ? 34 A 8 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.089 2.718 -19.692 1.0 71.03 ? 34 A 8 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.082 4.158 -19.506 1.0 71.12 ? 34 A 8 +ATOM 499 H HG2 . LYS A1 1 34 ? -14.643 3.266 -17.34 1.0 24.23 ? 34 A 8 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.344 2.981 -17.715 1.0 22.21 ? 34 A 8 +ATOM 501 H HD2 . LYS A1 1 34 ? -15.434 0.995 -16.714 1.0 63.43 ? 34 A 8 +ATOM 502 H HD3 . LYS A1 1 34 ? -15.741 0.674 -18.422 1.0 75.33 ? 34 A 8 +ATOM 503 H HE2 . LYS A1 1 34 ? -13.523 0.534 -18.935 1.0 34.14 ? 34 A 8 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.048 1.668 -17.671 1.0 0.12 ? 34 A 8 +ATOM 505 H HZ1 . LYS A1 1 34 ? -13.038 0.031 -16.081 1.0 62.42 ? 34 A 8 +ATOM 506 H HZ2 . LYS A1 1 34 ? -12.502 -0.838 -17.43 1.0 14.2 ? 34 A 8 +ATOM 507 H HZ3 . LYS A1 1 34 ? -14.11 -0.97 -16.924 1.0 65.2 ? 34 A 8 +ATOM 508 N N . ILE A1 1 35 ? -17.758 4.263 -20.488 1.0 14.42 ? 35 A 8 +ATOM 509 C CA . ILE A1 1 35 ? -19.05 4.89 -20.24 1.0 22.32 ? 35 A 8 +ATOM 510 C C . ILE A1 1 35 ? -20.162 4.179 -21.003 1.0 74.31 ? 35 A 8 +ATOM 511 O O . ILE A1 1 35 ? -21.288 4.066 -20.518 1.0 33.23 ? 35 A 8 +ATOM 512 C CB . ILE A1 1 35 ? -19.039 6.378 -20.638 1.0 42.5 ? 35 A 8 +ATOM 513 C CG1 . ILE A1 1 35 ? -17.865 7.099 -19.972 1.0 22.04 ? 35 A 8 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.357 7.037 -20.259 1.0 45.14 ? 35 A 8 +ATOM 515 C CD1 . ILE A1 1 35 ? -17.852 6.967 -18.465 1.0 11.1 ? 35 A 8 +ATOM 516 H H . ILE A1 1 35 ? -17.073 4.759 -20.983 1.0 54.44 ? 35 A 8 +ATOM 517 H HA . ILE A1 1 35 ? -19.254 4.823 -19.181 1.0 30.01 ? 35 A 8 +ATOM 518 H HB . ILE A1 1 35 ? -18.929 6.44 -21.71 1.0 2.44 ? 35 A 8 +ATOM 519 H HG12 . ILE A1 1 35 ? -16.94 6.691 -20.348 1.0 3.24 ? 35 A 8 +ATOM 520 H HG13 . ILE A1 1 35 ? -17.914 8.151 -20.214 1.0 0.11 ? 35 A 8 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.429 8.001 -20.741 1.0 65.32 ? 35 A 8 +ATOM 522 H HG22 . ILE A1 1 35 ? -21.177 6.413 -20.58 1.0 43.1 ? 35 A 8 +ATOM 523 H HG23 . ILE A1 1 35 ? -20.399 7.167 -19.188 1.0 75.41 ? 35 A 8 +ATOM 524 H HD11 . ILE A1 1 35 ? -16.997 6.379 -18.163 1.0 43.52 ? 35 A 8 +ATOM 525 H HD12 . ILE A1 1 35 ? -17.788 7.948 -18.018 1.0 71.15 ? 35 A 8 +ATOM 526 H HD13 . ILE A1 1 35 ? -18.757 6.479 -18.138 1.0 74.3 ? 35 A 8 +ATOM 527 N N . TYR A1 1 36 ? -19.838 3.699 -22.199 1.0 62.53 ? 36 A 8 +ATOM 528 C CA . TYR A1 1 36 ? -20.81 2.999 -23.03 1.0 64.44 ? 36 A 8 +ATOM 529 C C . TYR A1 1 36 ? -21.408 1.81 -22.284 1.0 53.42 ? 36 A 8 +ATOM 530 O O . TYR A1 1 36 ? -22.622 1.607 -22.29 1.0 34.33 ? 36 A 8 +ATOM 531 C CB . TYR A1 1 36 ? -20.154 2.523 -24.327 1.0 74.42 ? 36 A 8 +ATOM 532 C CG . TYR A1 1 36 ? -20.667 1.186 -24.811 1.0 43.51 ? 36 A 8 +ATOM 533 C CD1 . TYR A1 1 36 ? -21.999 1.019 -25.169 1.0 62.31 ? 36 A 8 +ATOM 534 C CD2 . TYR A1 1 36 ? -19.82 0.089 -24.91 1.0 22.21 ? 36 A 8 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.472 -0.201 -25.611 1.0 25.24 ? 36 A 8 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.284 -1.135 -25.352 1.0 24.41 ? 36 A 8 +ATOM 537 C CZ . TYR A1 1 36 ? -21.611 -1.275 -25.7 1.0 51.0 ? 36 A 8 +ATOM 538 O OH . TYR A1 1 36 ? -22.079 -2.492 -26.141 1.0 31.41 ? 36 A 8 +ATOM 539 H H . TYR A1 1 36 ? -18.924 3.82 -22.531 1.0 42.53 ? 36 A 8 +ATOM 540 H HA . TYR A1 1 36 ? -21.601 3.693 -23.272 1.0 45.34 ? 36 A 8 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.339 3.249 -25.104 1.0 32.41 ? 36 A 8 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.088 2.434 -24.172 1.0 73.31 ? 36 A 8 +ATOM 543 H HD1 . TYR A1 1 36 ? -22.671 1.863 -25.098 1.0 14.41 ? 36 A 8 +ATOM 544 H HD2 . TYR A1 1 36 ? -18.781 0.202 -24.636 1.0 73.43 ? 36 A 8 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.511 -0.311 -25.884 1.0 30.0 ? 36 A 8 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.61 -1.976 -25.422 1.0 11.1 ? 36 A 8 +ATOM 547 H HH . TYR A1 1 36 ? -21.414 -3.166 -25.982 1.0 20.21 ? 36 A 8 +ATOM 548 N N . ASP A1 1 37 ? -20.547 1.029 -21.642 1.0 31.31 ? 37 A 8 +ATOM 549 C CA . ASP A1 1 37 ? -20.989 -0.139 -20.889 1.0 4.3 ? 37 A 8 +ATOM 550 C C . ASP A1 1 37 ? -21.646 0.277 -19.577 1.0 30.32 ? 37 A 8 +ATOM 551 O O . ASP A1 1 37 ? -22.561 -0.388 -19.09 1.0 62.0 ? 37 A 8 +ATOM 552 C CB . ASP A1 1 37 ? -19.807 -1.069 -20.61 1.0 35.43 ? 37 A 8 +ATOM 553 C CG . ASP A1 1 37 ? -20.213 -2.53 -20.588 1.0 34.32 ? 37 A 8 +ATOM 554 O OD1 . ASP A1 1 37 ? -20.874 -2.977 -21.548 1.0 31.12 ? 37 A 8 +ATOM 555 O OD2 . ASP A1 1 37 ? -19.87 -3.227 -19.609 1.0 3.2 ? 37 A 8 +ATOM 556 H H . ASP A1 1 37 ? -19.591 1.243 -21.675 1.0 51.42 ? 37 A 8 +ATOM 557 H HA . ASP A1 1 37 ? -21.715 -0.666 -21.49 1.0 32.24 ? 37 A 8 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.061 -0.934 -21.379 1.0 43.14 ? 37 A 8 +ATOM 559 H HB3 . ASP A1 1 37 ? -19.379 -0.818 -19.651 1.0 34.23 ? 37 A 8 +ATOM 560 N N . LYS A1 1 38 ? -21.174 1.38 -19.008 1.0 33.03 ? 38 A 8 +ATOM 561 C CA . LYS A1 1 38 ? -21.715 1.887 -17.753 1.0 33.5 ? 38 A 8 +ATOM 562 C C . LYS A1 1 38 ? -23.223 2.092 -17.853 1.0 62.1 ? 38 A 8 +ATOM 563 O O . LYS A1 1 38 ? -23.973 1.689 -16.966 1.0 13.24 ? 38 A 8 +ATOM 564 C CB . LYS A1 1 38 ? -21.034 3.204 -17.374 1.0 32.13 ? 38 A 8 +ATOM 565 C CG . LYS A1 1 38 ? -20.164 3.104 -16.133 1.0 11.13 ? 38 A 8 +ATOM 566 C CD . LYS A1 1 38 ? -18.715 2.813 -16.489 1.0 55.11 ? 38 A 8 +ATOM 567 C CE . LYS A1 1 38 ? -18.485 1.328 -16.721 1.0 12.13 ? 38 A 8 +ATOM 568 N NZ . LYS A1 1 38 ? -18.058 0.632 -15.476 1.0 62.42 ? 38 A 8 +ATOM 569 H H . LYS A1 1 38 ? -20.443 1.868 -19.445 1.0 40.1 ? 38 A 8 +ATOM 570 H HA . LYS A1 1 38 ? -21.514 1.154 -16.986 1.0 13.43 ? 38 A 8 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.413 3.524 -18.198 1.0 53.44 ? 38 A 8 +ATOM 572 H HB3 . LYS A1 1 38 ? -21.794 3.95 -17.196 1.0 74.35 ? 38 A 8 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.21 4.039 -15.595 1.0 72.35 ? 38 A 8 +ATOM 574 H HG3 . LYS A1 1 38 ? -20.537 2.307 -15.506 1.0 65.33 ? 38 A 8 +ATOM 575 H HD2 . LYS A1 1 38 ? -18.46 3.351 -17.391 1.0 31.44 ? 38 A 8 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.081 3.145 -15.679 1.0 51.13 ? 38 A 8 +ATOM 577 H HE2 . LYS A1 1 38 ? -19.405 0.885 -17.073 1.0 72.24 ? 38 A 8 +ATOM 578 H HE3 . LYS A1 1 38 ? -17.718 1.209 -17.472 1.0 52.14 ? 38 A 8 +ATOM 579 H HZ1 . LYS A1 1 38 ? -17.358 1.208 -14.967 1.0 12.21 ? 38 A 8 +ATOM 580 H HZ2 . LYS A1 1 38 ? -17.63 -0.287 -15.71 1.0 31.3 ? 38 A 8 +ATOM 581 H HZ3 . LYS A1 1 38 ? -18.877 0.472 -14.857 1.0 72.13 ? 38 A 8 +ATOM 582 N N . GLU A1 1 39 ? -23.658 2.721 -18.941 1.0 74.33 ? 39 A 8 +ATOM 583 C CA . GLU A1 1 39 ? -25.077 2.979 -19.156 1.0 31.43 ? 39 A 8 +ATOM 584 C C . GLU A1 1 39 ? -25.602 2.175 -20.342 1.0 55.55 ? 39 A 8 +ATOM 585 O O . GLU A1 1 39 ? -26.528 1.377 -20.203 1.0 44.25 ? 39 A 8 +ATOM 586 C CB . GLU A1 1 39 ? -25.317 4.472 -19.392 1.0 31.12 ? 39 A 8 +ATOM 587 C CG . GLU A1 1 39 ? -24.052 5.247 -19.722 1.0 22.34 ? 39 A 8 +ATOM 588 C CD . GLU A1 1 39 ? -24.311 6.727 -19.927 1.0 34.02 ? 39 A 8 +ATOM 589 O OE1 . GLU A1 1 39 ? -25.329 7.068 -20.565 1.0 60.52 ? 39 A 8 +ATOM 590 O OE2 . GLU A1 1 39 ? -23.497 7.544 -19.449 1.0 24.54 ? 39 A 8 +ATOM 591 H H . GLU A1 1 39 ? -23.01 3.019 -19.613 1.0 53.12 ? 39 A 8 +ATOM 592 H HA . GLU A1 1 39 ? -25.608 2.676 -18.267 1.0 24.23 ? 39 A 8 +ATOM 593 H HB2 . GLU A1 1 39 ? -26.01 4.588 -20.213 1.0 13.32 ? 39 A 8 +ATOM 594 H HB3 . GLU A1 1 39 ? -25.753 4.899 -18.502 1.0 53.15 ? 39 A 8 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.351 5.129 -18.909 1.0 73.51 ? 39 A 8 +ATOM 596 H HG3 . GLU A1 1 39 ? -23.623 4.843 -20.627 1.0 55.55 ? 39 A 8 +ATOM 597 N N . GLY A1 1 40 ? -25.004 2.392 -21.509 1.0 41.31 ? 40 A 8 +ATOM 598 C CA . GLY A1 1 40 ? -25.424 1.681 -22.702 1.0 23.2 ? 40 A 8 +ATOM 599 C C . GLY A1 1 40 ? -25.699 2.613 -23.865 1.0 54.31 ? 40 A 8 +ATOM 600 O O . GLY A1 1 40 ? -26.769 2.558 -24.473 1.0 62.35 ? 40 A 8 +ATOM 601 H H . GLY A1 1 40 ? -24.27 3.04 -21.56 1.0 1.31 ? 40 A 8 +ATOM 602 H HA2 . GLY A1 1 40 ? -24.648 0.986 -22.986 1.0 42.33 ? 40 A 8 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.325 1.128 -22.479 1.0 42.25 ? 40 A 8 +ATOM 604 N N . ILE A1 1 41 ? -24.733 3.471 -24.175 1.0 11.45 ? 41 A 8 +ATOM 605 C CA . ILE A1 1 41 ? -24.878 4.419 -25.273 1.0 13.21 ? 41 A 8 +ATOM 606 C C . ILE A1 1 41 ? -23.673 4.366 -26.207 1.0 73.14 ? 41 A 8 +ATOM 607 O O . ILE A1 1 41 ? -22.565 4.003 -25.811 1.0 54.03 ? 41 A 8 +ATOM 608 C CB . ILE A1 1 41 ? -25.048 5.859 -24.754 1.0 13.54 ? 41 A 8 +ATOM 609 C CG1 . ILE A1 1 41 ? -23.704 6.415 -24.278 1.0 35.25 ? 41 A 8 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.072 5.9 -23.63 1.0 15.54 ? 41 A 8 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.271 5.878 -22.933 1.0 51.21 ? 41 A 8 +ATOM 612 H H . ILE A1 1 41 ? -23.904 3.466 -23.653 1.0 10.31 ? 41 A 8 +ATOM 613 H HA . ILE A1 1 41 ? -25.764 4.151 -25.83 1.0 22.4 ? 41 A 8 +ATOM 614 H HB . ILE A1 1 41 ? -25.415 6.469 -25.566 1.0 2.22 ? 41 A 8 +ATOM 615 H HG12 . ILE A1 1 41 ? -22.942 6.162 -24.997 1.0 53.25 ? 41 A 8 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.776 7.491 -24.199 1.0 73.21 ? 41 A 8 +ATOM 617 H HG21 . ILE A1 1 41 ? -27.058 5.721 -24.035 1.0 41.34 ? 41 A 8 +ATOM 618 H HG22 . ILE A1 1 41 ? -25.839 5.137 -22.903 1.0 35.01 ? 41 A 8 +ATOM 619 H HG23 . ILE A1 1 41 ? -26.049 6.869 -23.156 1.0 24.24 ? 41 A 8 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.919 5.063 -22.645 1.0 13.35 ? 41 A 8 +ATOM 621 H HD12 . ILE A1 1 41 ? -22.253 5.521 -22.998 1.0 5.02 ? 41 A 8 +ATOM 622 H HD13 . ILE A1 1 41 ? -23.331 6.663 -22.194 1.0 73.01 ? 41 A 8 +ATOM 623 N N . PRO A1 1 42 ? -23.892 4.738 -27.477 1.0 42.01 ? 42 A 8 +ATOM 624 C CA . PRO A1 1 42 ? -22.836 4.744 -28.493 1.0 63.34 ? 42 A 8 +ATOM 625 C C . PRO A1 1 42 ? -21.802 5.837 -28.248 1.0 4.23 ? 42 A 8 +ATOM 626 O O . PRO A1 1 42 ? -22.103 7.03 -28.29 1.0 21.54 ? 42 A 8 +ATOM 627 C CB . PRO A1 1 42 ? -23.598 5.009 -29.794 1.0 63.45 ? 42 A 8 +ATOM 628 C CG . PRO A1 1 42 ? -24.83 5.731 -29.371 1.0 31.23 ? 42 A 8 +ATOM 629 C CD . PRO A1 1 42 ? -25.188 5.182 -28.018 1.0 52.22 ? 42 A 8 +ATOM 630 H HA . PRO A1 1 42 ? -22.339 3.787 -28.554 1.0 60.32 ? 42 A 8 +ATOM 631 H HB2 . PRO A1 1 42 ? -22.99 5.615 -30.452 1.0 50.23 ? 42 A 8 +ATOM 632 H HB3 . PRO A1 1 42 ? -23.835 4.072 -30.275 1.0 64.01 ? 42 A 8 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.631 6.79 -29.305 1.0 0.11 ? 42 A 8 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.627 5.54 -30.075 1.0 1.1 ? 42 A 8 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.62 5.954 -27.399 1.0 11.32 ? 42 A 8 +ATOM 636 H HD3 . PRO A1 1 42 ? -25.869 4.35 -28.116 1.0 34.03 ? 42 A 8 +ATOM 637 N N . PRO A1 1 43 ? -20.553 5.424 -27.988 1.0 1.41 ? 43 A 8 +ATOM 638 C CA . PRO A1 1 43 ? -19.448 6.353 -27.732 1.0 62.53 ? 43 A 8 +ATOM 639 C C . PRO A1 1 43 ? -19.037 7.123 -28.983 1.0 21.35 ? 43 A 8 +ATOM 640 O O . PRO A1 1 43 ? -18.574 8.26 -28.899 1.0 73.42 ? 43 A 8 +ATOM 641 C CB . PRO A1 1 43 ? -18.313 5.436 -27.271 1.0 74.43 ? 43 A 8 +ATOM 642 C CG . PRO A1 1 43 ? -18.622 4.113 -27.881 1.0 42.11 ? 43 A 8 +ATOM 643 C CD . PRO A1 1 43 ? -20.122 4.017 -27.922 1.0 32.53 ? 43 A 8 +ATOM 644 H HA . PRO A1 1 43 ? -19.692 7.052 -26.945 1.0 3.1 ? 43 A 8 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.368 5.824 -27.624 1.0 1.2 ? 43 A 8 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.305 5.381 -26.193 1.0 52.2 ? 43 A 8 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.216 4.065 -28.88 1.0 21.5 ? 43 A 8 +ATOM 648 H HG3 . PRO A1 1 43 ? -18.213 3.322 -27.27 1.0 41.32 ? 43 A 8 +ATOM 649 H HD2 . PRO A1 1 43 ? -20.442 3.475 -28.8 1.0 55.24 ? 43 A 8 +ATOM 650 H HD3 . PRO A1 1 43 ? -20.495 3.542 -27.027 1.0 31.14 ? 43 A 8 +ATOM 651 N N . ASP A1 1 44 ? -19.21 6.495 -30.141 1.0 54.12 ? 44 A 8 +ATOM 652 C CA . ASP A1 1 44 ? -18.858 7.122 -31.41 1.0 51.34 ? 44 A 8 +ATOM 653 C C . ASP A1 1 44 ? -19.87 8.202 -31.781 1.0 65.34 ? 44 A 8 +ATOM 654 O O . ASP A1 1 44 ? -19.605 9.044 -32.638 1.0 41.23 ? 44 A 8 +ATOM 655 C CB . ASP A1 1 44 ? -18.784 6.072 -32.519 1.0 23.35 ? 44 A 8 +ATOM 656 C CG . ASP A1 1 44 ? -17.975 6.545 -33.711 1.0 52.14 ? 44 A 8 +ATOM 657 O OD1 . ASP A1 1 44 ? -16.794 6.903 -33.521 1.0 70.43 ? 44 A 8 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.523 6.557 -34.833 1.0 15.14 ? 44 A 8 +ATOM 659 H H . ASP A1 1 44 ? -19.583 5.589 -30.143 1.0 64.31 ? 44 A 8 +ATOM 660 H HA . ASP A1 1 44 ? -17.887 7.581 -31.295 1.0 72.42 ? 44 A 8 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.323 5.176 -32.127 1.0 64.21 ? 44 A 8 +ATOM 662 H HB3 . ASP A1 1 44 ? -19.784 5.84 -32.854 1.0 74.33 ? 44 A 8 +ATOM 663 N N . GLN A1 1 45 ? -21.028 8.169 -31.131 1.0 24.51 ? 45 A 8 +ATOM 664 C CA . GLN A1 1 45 ? -22.08 9.143 -31.396 1.0 55.1 ? 45 A 8 +ATOM 665 C C . GLN A1 1 45 ? -22.002 10.308 -30.414 1.0 65.33 ? 45 A 8 +ATOM 666 O O . GLN A1 1 45 ? -22.652 11.336 -30.604 1.0 0.12 ? 45 A 8 +ATOM 667 C CB . GLN A1 1 45 ? -23.455 8.478 -31.307 1.0 3.33 ? 45 A 8 +ATOM 668 C CG . GLN A1 1 45 ? -23.931 7.889 -32.625 1.0 71.05 ? 45 A 8 +ATOM 669 C CD . GLN A1 1 45 ? -25.032 6.863 -32.442 1.0 50.21 ? 45 A 8 +ATOM 670 O OE1 . GLN A1 1 45 ? -24.809 5.662 -32.593 1.0 30.33 ? 45 A 8 +ATOM 671 N NE2 . GLN A1 1 45 ? -26.23 7.332 -32.113 1.0 54.11 ? 45 A 8 +ATOM 672 H H . GLN A1 1 45 ? -21.18 7.473 -30.459 1.0 33.14 ? 45 A 8 +ATOM 673 H HA . GLN A1 1 45 ? -21.937 9.522 -32.396 1.0 54.13 ? 45 A 8 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.411 7.685 -30.577 1.0 72.22 ? 45 A 8 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.177 9.214 -30.986 1.0 51.24 ? 45 A 8 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.305 8.688 -33.248 1.0 11.31 ? 45 A 8 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.094 7.414 -33.115 1.0 33.23 ? 45 A 8 +ATOM 678 H HE21 . GLN A1 1 45 ? -26.334 8.302 -32.01 1.0 35.4 ? 45 A 8 +ATOM 679 H HE22 . GLN A1 1 45 ? -26.96 6.692 -31.988 1.0 53.4 ? 45 A 8 +ATOM 680 N N . GLN A1 1 46 ? -21.203 10.139 -29.366 1.0 5.34 ? 46 A 8 +ATOM 681 C CA . GLN A1 1 46 ? -21.041 11.177 -28.354 1.0 54.21 ? 46 A 8 +ATOM 682 C C . GLN A1 1 46 ? -19.619 11.727 -28.361 1.0 23.33 ? 46 A 8 +ATOM 683 O O . GLN A1 1 46 ? -18.679 11.04 -28.762 1.0 42.0 ? 46 A 8 +ATOM 684 C CB . GLN A1 1 46 ? -21.38 10.626 -26.968 1.0 54.1 ? 46 A 8 +ATOM 685 C CG . GLN A1 1 46 ? -20.57 9.397 -26.587 1.0 63.33 ? 46 A 8 +ATOM 686 C CD . GLN A1 1 46 ? -20.561 9.144 -25.093 1.0 73.34 ? 46 A 8 +ATOM 687 O OE1 . GLN A1 1 46 ? -19.533 9.292 -24.432 1.0 62.34 ? 46 A 8 +ATOM 688 N NE2 . GLN A1 1 46 ? -21.711 8.76 -24.551 1.0 52.51 ? 46 A 8 +ATOM 689 H H . GLN A1 1 46 ? -20.711 9.298 -29.27 1.0 61.13 ? 46 A 8 +ATOM 690 H HA . GLN A1 1 46 ? -21.725 11.979 -28.59 1.0 1.54 ? 46 A 8 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.196 11.394 -26.233 1.0 70.34 ? 46 A 8 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.427 10.36 -26.946 1.0 24.41 ? 46 A 8 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.993 8.535 -27.08 1.0 71.34 ? 46 A 8 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.552 9.537 -26.92 1.0 12.44 ? 46 A 8 +ATOM 695 H HE21 . GLN A1 1 46 ? -22.489 8.662 -25.139 1.0 61.21 ? 46 A 8 +ATOM 696 H HE22 . GLN A1 1 46 ? -21.734 8.589 -23.587 1.0 54.41 ? 46 A 8 +ATOM 697 N N . ARG A1 1 47 ? -19.468 12.971 -27.916 1.0 11.31 ? 47 A 8 +ATOM 698 C CA . ARG A1 1 47 ? -18.16 13.613 -27.873 1.0 74.42 ? 47 A 8 +ATOM 699 C C . ARG A1 1 47 ? -17.949 14.327 -26.541 1.0 0.05 ? 47 A 8 +ATOM 700 O O . ARG A1 1 47 ? -18.901 14.575 -25.799 1.0 62.43 ? 47 A 8 +ATOM 701 C CB . ARG A1 1 47 ? -18.02 14.61 -29.025 1.0 53.24 ? 47 A 8 +ATOM 702 C CG . ARG A1 1 47 ? -17.111 14.125 -30.143 1.0 25.13 ? 47 A 8 +ATOM 703 C CD . ARG A1 1 47 ? -17.857 13.228 -31.118 1.0 74.31 ? 47 A 8 +ATOM 704 N NE . ARG A1 1 47 ? -17.25 11.903 -31.217 1.0 72.02 ? 47 A 8 +ATOM 705 C CZ . ARG A1 1 47 ? -16.113 11.662 -31.859 1.0 4.33 ? 47 A 8 +ATOM 706 N NH1 . ARG A1 1 47 ? -15.461 12.651 -32.455 1.0 22.33 ? 47 A 8 +ATOM 707 N NH2 . ARG A1 1 47 ? -15.624 10.429 -31.905 1.0 24.44 ? 47 A 8 +ATOM 708 H H . ARG A1 1 47 ? -20.255 13.468 -27.61 1.0 14.32 ? 47 A 8 +ATOM 709 H HA . ARG A1 1 47 ? -17.409 12.845 -27.98 1.0 52.1 ? 47 A 8 +ATOM 710 H HB2 . ARG A1 1 47 ? -18.998 14.799 -29.443 1.0 12.43 ? 47 A 8 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.617 15.534 -28.639 1.0 31.22 ? 47 A 8 +ATOM 712 H HG2 . ARG A1 1 47 ? -16.727 14.98 -30.679 1.0 2.15 ? 47 A 8 +ATOM 713 H HG3 . ARG A1 1 47 ? -16.291 13.57 -29.711 1.0 3.22 ? 47 A 8 +ATOM 714 H HD2 . ARG A1 1 47 ? -18.877 13.122 -30.781 1.0 62.34 ? 47 A 8 +ATOM 715 H HD3 . ARG A1 1 47 ? -17.847 13.693 -32.093 1.0 4.32 ? 47 A 8 +ATOM 716 H HE . ARG A1 1 47 ? -17.715 11.158 -30.784 1.0 51.12 ? 47 A 8 +ATOM 717 H HH11 . ARG A1 1 47 ? -15.826 13.581 -32.421 1.0 35.02 ? 47 A 8 +ATOM 718 H HH12 . ARG A1 1 47 ? -14.604 12.467 -32.936 1.0 42.25 ? 47 A 8 +ATOM 719 H HH21 . ARG A1 1 47 ? -16.112 9.681 -31.457 1.0 32.54 ? 47 A 8 +ATOM 720 H HH22 . ARG A1 1 47 ? -14.768 10.249 -32.388 1.0 51.04 ? 47 A 8 +ATOM 721 N N . LEU A1 1 48 ? -16.696 14.654 -26.243 1.0 13.42 ? 48 A 8 +ATOM 722 C CA . LEU A1 1 48 ? -16.359 15.338 -25.0 1.0 63.04 ? 48 A 8 +ATOM 723 C C . LEU A1 1 48 ? -16.074 16.816 -25.251 1.0 70.54 ? 48 A 8 +ATOM 724 O O . LEU A1 1 48 ? -15.571 17.189 -26.311 1.0 13.22 ? 48 A 8 +ATOM 725 C CB . LEU A1 1 48 ? -15.145 14.678 -24.344 1.0 73.22 ? 48 A 8 +ATOM 726 C CG . LEU A1 1 48 ? -15.069 13.155 -24.454 1.0 23.01 ? 48 A 8 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.443 12.535 -24.255 1.0 2.23 ? 48 A 8 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.488 12.746 -25.799 1.0 62.5 ? 48 A 8 +ATOM 729 H H . LEU A1 1 48 ? -15.981 14.43 -26.873 1.0 13.1 ? 48 A 8 +ATOM 730 H HA . LEU A1 1 48 ? -17.207 15.256 -24.336 1.0 5.14 ? 48 A 8 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.258 15.087 -24.802 1.0 14.35 ? 48 A 8 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.157 14.935 -23.294 1.0 62.22 ? 48 A 8 +ATOM 733 H HG . LEU A1 1 48 ? -14.417 12.776 -23.678 1.0 74.12 ? 48 A 8 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.056 13.201 -23.666 1.0 72.12 ? 48 A 8 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.342 11.591 -23.741 1.0 51.52 ? 48 A 8 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.908 12.374 -25.216 1.0 50.13 ? 48 A 8 +ATOM 737 H HD21 . LEU A1 1 48 ? -15.288 12.619 -26.513 1.0 32.51 ? 48 A 8 +ATOM 738 H HD22 . LEU A1 1 48 ? -13.95 11.815 -25.691 1.0 4.35 ? 48 A 8 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.811 13.513 -26.148 1.0 44.23 ? 48 A 8 +ATOM 740 N N . ILE A1 1 49 ? -16.398 17.651 -24.27 1.0 13.31 ? 49 A 8 +ATOM 741 C CA . ILE A1 1 49 ? -16.174 19.087 -24.384 1.0 13.25 ? 49 A 8 +ATOM 742 C C . ILE A1 1 49 ? -15.663 19.669 -23.071 1.0 73.24 ? 49 A 8 +ATOM 743 O O . ILE A1 1 49 ? -16.302 19.533 -22.028 1.0 20.41 ? 49 A 8 +ATOM 744 C CB . ILE A1 1 49 ? -17.461 19.826 -24.795 1.0 42.12 ? 49 A 8 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.497 20.03 -26.311 1.0 21.4 ? 49 A 8 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.557 21.162 -24.073 1.0 44.11 ? 49 A 8 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.76 19.508 -26.96 1.0 30.32 ? 49 A 8 +ATOM 748 H H . ILE A1 1 49 ? -16.797 17.293 -23.45 1.0 11.12 ? 49 A 8 +ATOM 749 H HA . ILE A1 1 49 ? -15.43 19.247 -25.151 1.0 31.54 ? 49 A 8 +ATOM 750 H HB . ILE A1 1 49 ? -18.306 19.224 -24.499 1.0 10.22 ? 49 A 8 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.424 21.083 -26.528 1.0 52.53 ? 49 A 8 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.658 19.515 -26.755 1.0 23.14 ? 49 A 8 +ATOM 753 H HG21 . ILE A1 1 49 ? -17.771 20.993 -23.028 1.0 54.41 ? 49 A 8 +ATOM 754 H HG22 . ILE A1 1 49 ? -16.619 21.689 -24.166 1.0 2.4 ? 49 A 8 +ATOM 755 H HG23 . ILE A1 1 49 ? -18.347 21.753 -24.511 1.0 53.42 ? 49 A 8 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.365 19.006 -26.219 1.0 43.14 ? 49 A 8 +ATOM 757 H HD12 . ILE A1 1 49 ? -19.317 20.333 -27.379 1.0 61.33 ? 49 A 8 +ATOM 758 H HD13 . ILE A1 1 49 ? -18.501 18.813 -27.744 1.0 3.14 ? 49 A 8 +ATOM 759 N N . PHE A1 1 50 ? -14.506 20.321 -23.13 1.0 0.44 ? 50 A 8 +ATOM 760 C CA . PHE A1 1 50 ? -13.909 20.927 -21.946 1.0 63.4 ? 50 A 8 +ATOM 761 C C . PHE A1 1 50 ? -13.563 22.391 -22.199 1.0 34.31 ? 50 A 8 +ATOM 762 O O . PHE A1 1 50 ? -12.823 22.714 -23.127 1.0 24.03 ? 50 A 8 +ATOM 763 C CB . PHE A1 1 50 ? -12.652 20.158 -21.533 1.0 1.31 ? 50 A 8 +ATOM 764 C CG . PHE A1 1 50 ? -12.142 20.529 -20.17 1.0 63.44 ? 50 A 8 +ATOM 765 C CD1 . PHE A1 1 50 ? -11.456 21.717 -19.972 1.0 63.22 ? 50 A 8 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.349 19.691 -19.087 1.0 31.12 ? 50 A 8 +ATOM 767 C CE1 . PHE A1 1 50 ? -10.986 22.06 -18.719 1.0 44.05 ? 50 A 8 +ATOM 768 C CE2 . PHE A1 1 50 ? -11.881 20.03 -17.831 1.0 53.14 ? 50 A 8 +ATOM 769 C CZ . PHE A1 1 50 ? -11.2 21.217 -17.647 1.0 64.24 ? 50 A 8 +ATOM 770 H H . PHE A1 1 50 ? -14.044 20.397 -23.991 1.0 32.43 ? 50 A 8 +ATOM 771 H HA . PHE A1 1 50 ? -14.632 20.873 -21.147 1.0 55.42 ? 50 A 8 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.87 19.101 -21.529 1.0 72.21 ? 50 A 8 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.867 20.356 -22.248 1.0 52.42 ? 50 A 8 +ATOM 774 H HD1 . PHE A1 1 50 ? -11.289 22.378 -20.81 1.0 64.41 ? 50 A 8 +ATOM 775 H HD2 . PHE A1 1 50 ? -12.883 18.762 -19.23 1.0 25.0 ? 50 A 8 +ATOM 776 H HE1 . PHE A1 1 50 ? -10.453 22.989 -18.578 1.0 33.34 ? 50 A 8 +ATOM 777 H HE2 . PHE A1 1 50 ? -12.051 19.367 -16.995 1.0 34.14 ? 50 A 8 +ATOM 778 H HZ . PHE A1 1 50 ? -10.833 21.483 -16.667 1.0 42.2 ? 50 A 8 +ATOM 779 N N . GLY A1 1 51 ? -14.105 23.274 -21.365 1.0 53.44 ? 51 A 8 +ATOM 780 C CA . GLY A1 1 51 ? -13.843 24.693 -21.515 1.0 33.5 ? 51 A 8 +ATOM 781 C C . GLY A1 1 51 ? -14.419 25.257 -22.8 1.0 34.32 ? 51 A 8 +ATOM 782 O O . GLY A1 1 51 ? -14.127 26.392 -23.173 1.0 0.02 ? 51 A 8 +ATOM 783 H H . GLY A1 1 51 ? -14.687 22.958 -20.643 1.0 14.34 ? 51 A 8 +ATOM 784 H HA2 . GLY A1 1 51 ? -14.277 25.219 -20.678 1.0 71.3 ? 51 A 8 +ATOM 785 H HA3 . GLY A1 1 51 ? -12.775 24.853 -21.513 1.0 2.33 ? 51 A 8 +ATOM 786 N N . GLY A1 1 52 ? -15.239 24.46 -23.478 1.0 51.33 ? 52 A 8 +ATOM 787 C CA . GLY A1 1 52 ? -15.842 24.902 -24.722 1.0 70.11 ? 52 A 8 +ATOM 788 C C . GLY A1 1 52 ? -15.308 24.15 -25.925 1.0 64.35 ? 52 A 8 +ATOM 789 O O . GLY A1 1 52 ? -16.016 23.964 -26.915 1.0 21.12 ? 52 A 8 +ATOM 790 H H . GLY A1 1 52 ? -15.436 23.564 -23.132 1.0 52.33 ? 52 A 8 +ATOM 791 H HA2 . GLY A1 1 52 ? -16.91 24.755 -24.663 1.0 34.31 ? 52 A 8 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.641 25.955 -24.852 1.0 33.12 ? 52 A 8 +ATOM 793 N N . LYS A1 1 53 ? -14.055 23.718 -25.842 1.0 4.12 ? 53 A 8 +ATOM 794 C CA . LYS A1 1 53 ? -13.425 22.982 -26.932 1.0 20.15 ? 53 A 8 +ATOM 795 C C . LYS A1 1 53 ? -13.564 21.478 -26.725 1.0 12.34 ? 53 A 8 +ATOM 796 O O . LYS A1 1 53 ? -13.563 20.996 -25.593 1.0 53.3 ? 53 A 8 +ATOM 797 C CB . LYS A1 1 53 ? -11.945 23.358 -27.04 1.0 12.13 ? 53 A 8 +ATOM 798 C CG . LYS A1 1 53 ? -11.185 23.22 -25.732 1.0 34.42 ? 53 A 8 +ATOM 799 C CD . LYS A1 1 53 ? -10.567 21.84 -25.59 1.0 44.0 ? 53 A 8 +ATOM 800 C CE . LYS A1 1 53 ? -9.478 21.607 -26.626 1.0 75.53 ? 53 A 8 +ATOM 801 N NZ . LYS A1 1 53 ? -8.118 21.644 -26.02 1.0 61.53 ? 53 A 8 +ATOM 802 H H . LYS A1 1 53 ? -13.541 23.897 -25.026 1.0 32.12 ? 53 A 8 +ATOM 803 H HA . LYS A1 1 53 ? -13.925 23.255 -27.849 1.0 74.23 ? 53 A 8 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.476 22.719 -27.774 1.0 34.02 ? 53 A 8 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.87 24.385 -27.369 1.0 32.22 ? 53 A 8 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.399 23.96 -25.703 1.0 24.24 ? 53 A 8 +ATOM 807 H HG3 . LYS A1 1 53 ? -11.868 23.386 -24.911 1.0 53.0 ? 53 A 8 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.135 21.748 -24.604 1.0 22.42 ? 53 A 8 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.339 21.094 -25.717 1.0 0.05 ? 53 A 8 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.634 20.642 -27.082 1.0 25.2 ? 53 A 8 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.548 22.377 -27.381 1.0 75.24 ? 53 A 8 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.683 22.576 -26.175 1.0 1.33 ? 53 A 8 +ATOM 813 H HZ2 . LYS A1 1 53 ? -7.515 20.915 -26.452 1.0 14.14 ? 53 A 8 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.178 21.467 -24.997 1.0 31.25 ? 53 A 8 +ATOM 815 N N . GLN A1 1 54 ? -13.682 20.742 -27.826 1.0 32.1 ? 54 A 8 +ATOM 816 C CA . GLN A1 1 54 ? -13.821 19.292 -27.763 1.0 3.14 ? 54 A 8 +ATOM 817 C C . GLN A1 1 54 ? -12.519 18.639 -27.311 1.0 14.5 ? 54 A 8 +ATOM 818 O O . GLN A1 1 54 ? -11.467 19.279 -27.289 1.0 22.04 ? 54 A 8 +ATOM 819 C CB . GLN A1 1 54 ? -14.236 18.739 -29.128 1.0 14.03 ? 54 A 8 +ATOM 820 C CG . GLN A1 1 54 ? -15.551 17.976 -29.101 1.0 52.41 ? 54 A 8 +ATOM 821 C CD . GLN A1 1 54 ? -16.378 18.194 -30.352 1.0 44.23 ? 54 A 8 +ATOM 822 O OE1 . GLN A1 1 54 ? -17.494 18.71 -30.291 1.0 25.33 ? 54 A 8 +ATOM 823 N NE2 . GLN A1 1 54 ? -15.833 17.801 -31.498 1.0 63.1 ? 54 A 8 +ATOM 824 H H . GLN A1 1 54 ? -13.676 21.184 -28.699 1.0 52.11 ? 54 A 8 +ATOM 825 H HA . GLN A1 1 54 ? -14.592 19.064 -27.043 1.0 62.04 ? 54 A 8 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.336 19.561 -29.821 1.0 31.24 ? 54 A 8 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.465 18.071 -29.482 1.0 25.42 ? 54 A 8 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.339 16.921 -29.007 1.0 52.11 ? 54 A 8 +ATOM 829 H HG3 . GLN A1 1 54 ? -16.124 18.304 -28.246 1.0 53.52 ? 54 A 8 +ATOM 830 H HE21 . GLN A1 1 54 ? -14.94 17.396 -31.47 1.0 45.55 ? 54 A 8 +ATOM 831 H HE22 . GLN A1 1 54 ? -16.346 17.929 -32.322 1.0 62.42 ? 54 A 8 +ATOM 832 N N . LEU A1 1 55 ? -12.597 17.363 -26.952 1.0 51.34 ? 55 A 8 +ATOM 833 C CA . LEU A1 1 55 ? -11.424 16.622 -26.5 1.0 40.45 ? 55 A 8 +ATOM 834 C C . LEU A1 1 55 ? -11.089 15.49 -27.466 1.0 63.5 ? 55 A 8 +ATOM 835 O O . LEU A1 1 55 ? -11.945 14.672 -27.798 1.0 52.11 ? 55 A 8 +ATOM 836 C CB . LEU A1 1 55 ? -11.661 16.058 -25.098 1.0 25.03 ? 55 A 8 +ATOM 837 C CG . LEU A1 1 55 ? -12.266 17.025 -24.079 1.0 41.33 ? 55 A 8 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.309 16.388 -22.699 1.0 33.24 ? 55 A 8 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.476 18.325 -24.044 1.0 52.23 ? 55 A 8 +ATOM 840 H H . LEU A1 1 55 ? -13.462 16.906 -26.991 1.0 12.34 ? 55 A 8 +ATOM 841 H HA . LEU A1 1 55 ? -10.591 17.309 -26.467 1.0 22.21 ? 55 A 8 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.328 15.215 -25.19 1.0 55.1 ? 55 A 8 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.709 15.722 -24.712 1.0 51.11 ? 55 A 8 +ATOM 844 H HG . LEU A1 1 55 ? -13.281 17.257 -24.371 1.0 72.12 ? 55 A 8 +ATOM 845 H HD11 . LEU A1 1 55 ? -12.173 17.149 -21.947 1.0 32.04 ? 55 A 8 +ATOM 846 H HD12 . LEU A1 1 55 ? -11.52 15.655 -22.616 1.0 44.35 ? 55 A 8 +ATOM 847 H HD13 . LEU A1 1 55 ? -13.264 15.905 -22.555 1.0 32.21 ? 55 A 8 +ATOM 848 H HD21 . LEU A1 1 55 ? -12.079 19.123 -24.451 1.0 33.14 ? 55 A 8 +ATOM 849 H HD22 . LEU A1 1 55 ? -10.578 18.216 -24.633 1.0 72.01 ? 55 A 8 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.211 18.558 -23.023 1.0 74.33 ? 55 A 8 +ATOM 851 N N . GLU A1 1 56 ? -9.837 15.45 -27.912 1.0 12.02 ? 56 A 8 +ATOM 852 C CA . GLU A1 1 56 ? -9.389 14.417 -28.838 1.0 31.33 ? 56 A 8 +ATOM 853 C C . GLU A1 1 56 ? -9.393 13.046 -28.168 1.0 62.51 ? 56 A 8 +ATOM 854 O O . GLU A1 1 56 ? -9.828 12.903 -27.025 1.0 51.02 ? 56 A 8 +ATOM 855 C CB . GLU A1 1 56 ? -7.986 14.739 -29.357 1.0 62.01 ? 56 A 8 +ATOM 856 C CG . GLU A1 1 56 ? -7.895 14.792 -30.873 1.0 21.02 ? 56 A 8 +ATOM 857 C CD . GLU A1 1 56 ? -6.521 15.207 -31.361 1.0 1.0 ? 56 A 8 +ATOM 858 O OE1 . GLU A1 1 56 ? -6.161 16.39 -31.184 1.0 61.34 ? 56 A 8 +ATOM 859 O OE2 . GLU A1 1 56 ? -5.805 14.35 -31.918 1.0 22.01 ? 56 A 8 +ATOM 860 H H . GLU A1 1 56 ? -9.2 16.131 -27.61 1.0 72.43 ? 56 A 8 +ATOM 861 H HA . GLU A1 1 56 ? -10.075 14.399 -29.671 1.0 4.21 ? 56 A 8 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.682 15.698 -28.965 1.0 41.11 ? 56 A 8 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.302 13.982 -29.003 1.0 51.02 ? 56 A 8 +ATOM 864 H HG2 . GLU A1 1 56 ? -8.12 13.814 -31.269 1.0 71.31 ? 56 A 8 +ATOM 865 H HG3 . GLU A1 1 56 ? -8.621 15.503 -31.24 1.0 60.44 ? 56 A 8 +ATOM 866 N N . ASP A1 1 57 ? -8.907 12.041 -28.888 1.0 71.03 ? 57 A 8 +ATOM 867 C CA . ASP A1 1 57 ? -8.853 10.681 -28.364 1.0 63.41 ? 57 A 8 +ATOM 868 C C . ASP A1 1 57 ? -7.76 10.548 -27.309 1.0 21.4 ? 57 A 8 +ATOM 869 O O . ASP A1 1 57 ? -7.824 9.678 -26.44 1.0 43.31 ? 57 A 8 +ATOM 870 C CB . ASP A1 1 57 ? -8.61 9.684 -29.498 1.0 45.31 ? 57 A 8 +ATOM 871 C CG . ASP A1 1 57 ? -9.717 9.702 -30.533 1.0 55.43 ? 57 A 8 +ATOM 872 O OD1 . ASP A1 1 57 ? -10.895 9.552 -30.144 1.0 72.35 ? 57 A 8 +ATOM 873 O OD2 . ASP A1 1 57 ? -9.407 9.867 -31.731 1.0 15.11 ? 57 A 8 +ATOM 874 H H . ASP A1 1 57 ? -8.575 12.218 -29.793 1.0 23.12 ? 57 A 8 +ATOM 875 H HA . ASP A1 1 57 ? -9.806 10.465 -27.906 1.0 62.14 ? 57 A 8 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.679 9.929 -29.99 1.0 24.44 ? 57 A 8 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.543 8.689 -29.085 1.0 64.03 ? 57 A 8 +ATOM 878 N N . SER A1 1 58 ? -6.756 11.415 -27.392 1.0 32.51 ? 58 A 8 +ATOM 879 C CA . SER A1 1 58 ? -5.645 11.391 -26.448 1.0 62.24 ? 58 A 8 +ATOM 880 C C . SER A1 1 58 ? -5.684 12.61 -25.532 1.0 2.12 ? 58 A 8 +ATOM 881 O O . SER A1 1 58 ? -4.791 12.813 -24.711 1.0 12.21 ? 58 A 8 +ATOM 882 C CB . SER A1 1 58 ? -4.312 11.345 -27.197 1.0 65.11 ? 58 A 8 +ATOM 883 O OG . SER A1 1 58 ? -3.226 11.201 -26.297 1.0 34.21 ? 58 A 8 +ATOM 884 H H . SER A1 1 58 ? -6.761 12.085 -28.108 1.0 21.03 ? 58 A 8 +ATOM 885 H HA . SER A1 1 58 ? -5.741 10.5 -25.846 1.0 33.55 ? 58 A 8 +ATOM 886 H HB2 . SER A1 1 58 ? -4.313 10.507 -27.877 1.0 31.42 ? 58 A 8 +ATOM 887 H HB3 . SER A1 1 58 ? -4.183 12.261 -27.754 1.0 40.4 ? 58 A 8 +ATOM 888 H HG . SER A1 1 58 ? -2.462 10.862 -26.769 1.0 10.23 ? 58 A 8 +ATOM 889 N N . ASN A1 1 59 ? -6.728 13.42 -25.679 1.0 35.41 ? 59 A 8 +ATOM 890 C CA . ASN A1 1 59 ? -6.885 14.62 -24.866 1.0 52.34 ? 59 A 8 +ATOM 891 C C . ASN A1 1 59 ? -7.578 14.296 -23.546 1.0 4.01 ? 59 A 8 +ATOM 892 O O . ASN A1 1 59 ? -8.779 14.517 -23.393 1.0 42.21 ? 59 A 8 +ATOM 893 C CB . ASN A1 1 59 ? -7.686 15.677 -25.629 1.0 21.1 ? 59 A 8 +ATOM 894 C CG . ASN A1 1 59 ? -7.604 17.045 -24.98 1.0 14.54 ? 59 A 8 +ATOM 895 O OD1 . ASN A1 1 59 ? -7.754 17.178 -23.765 1.0 24.42 ? 59 A 8 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.366 18.071 -25.789 1.0 14.44 ? 59 A 8 +ATOM 897 H H . ASN A1 1 59 ? -7.409 13.205 -26.351 1.0 5.51 ? 59 A 8 +ATOM 898 H HA . ASN A1 1 59 ? -5.901 15.01 -24.657 1.0 74.51 ? 59 A 8 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.301 15.754 -26.636 1.0 43.43 ? 59 A 8 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.723 15.378 -25.667 1.0 11.21 ? 59 A 8 +ATOM 901 H HD21 . ASN A1 1 59 ? -7.258 17.89 -26.747 1.0 21.33 ? 59 A 8 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.308 18.966 -25.396 1.0 12.0 ? 59 A 8 +ATOM 903 N N . ALA A1 1 60 ? -6.812 13.773 -22.595 1.0 13.11 ? 60 A 8 +ATOM 904 C CA . ALA A1 1 60 ? -7.35 13.421 -21.287 1.0 35.51 ? 60 A 8 +ATOM 905 C C . ALA A1 1 60 ? -6.24 12.995 -20.332 1.0 74.01 ? 60 A 8 +ATOM 906 O O . ALA A1 1 60 ? -5.789 13.782 -19.5 1.0 74.24 ? 60 A 8 +ATOM 907 C CB . ALA A1 1 60 ? -8.385 12.314 -21.423 1.0 64.13 ? 60 A 8 +ATOM 908 H H . ALA A1 1 60 ? -5.861 13.621 -22.777 1.0 31.12 ? 60 A 8 +ATOM 909 H HA . ALA A1 1 60 ? -7.844 14.294 -20.883 1.0 20.01 ? 60 A 8 +ATOM 910 H HB1 . ALA A1 1 60 ? -7.928 11.449 -21.881 1.0 72.33 ? 60 A 8 +ATOM 911 H HB2 . ALA A1 1 60 ? -8.759 12.049 -20.445 1.0 25.02 ? 60 A 8 +ATOM 912 H HB3 . ALA A1 1 60 ? -9.202 12.659 -22.04 1.0 51.02 ? 60 A 8 +ATOM 913 N N . MET A1 1 61 ? -5.804 11.746 -20.458 1.0 21.52 ? 61 A 8 +ATOM 914 C CA . MET A1 1 61 ? -4.746 11.217 -19.606 1.0 32.03 ? 61 A 8 +ATOM 915 C C . MET A1 1 61 ? -3.389 11.784 -20.009 1.0 55.14 ? 61 A 8 +ATOM 916 O O . MET A1 1 61 ? -2.715 12.434 -19.21 1.0 73.23 ? 61 A 8 +ATOM 917 C CB . MET A1 1 61 ? -4.716 9.689 -19.682 1.0 33.12 ? 61 A 8 +ATOM 918 C CG . MET A1 1 61 ? -6.098 9.056 -19.714 1.0 10.31 ? 61 A 8 +ATOM 919 S SD . MET A1 1 61 ? -7.178 9.679 -18.411 1.0 3.45 ? 61 A 8 +ATOM 920 C CE . MET A1 1 61 ? -8.764 9.646 -19.243 1.0 11.34 ? 61 A 8 +ATOM 921 H H . MET A1 1 61 ? -6.203 11.166 -21.141 1.0 44.35 ? 61 A 8 +ATOM 922 H HA . MET A1 1 61 ? -4.96 11.514 -18.59 1.0 14.21 ? 61 A 8 +ATOM 923 H HB2 . MET A1 1 61 ? -4.189 9.395 -20.577 1.0 14.23 ? 61 A 8 +ATOM 924 H HB3 . MET A1 1 61 ? -4.189 9.307 -18.821 1.0 0.24 ? 61 A 8 +ATOM 925 H HG2 . MET A1 1 61 ? -6.554 9.264 -20.67 1.0 62.14 ? 61 A 8 +ATOM 926 H HG3 . MET A1 1 61 ? -5.991 7.988 -19.594 1.0 32.0 ? 61 A 8 +ATOM 927 H HE1 . MET A1 1 61 ? -9.24 10.611 -19.147 1.0 54.23 ? 61 A 8 +ATOM 928 H HE2 . MET A1 1 61 ? -8.618 9.419 -20.288 1.0 64.31 ? 61 A 8 +ATOM 929 H HE3 . MET A1 1 61 ? -9.39 8.889 -18.794 1.0 24.11 ? 61 A 8 +ATOM 930 N N . SER A1 1 62 ? -2.993 11.533 -21.253 1.0 73.15 ? 62 A 8 +ATOM 931 C CA . SER A1 1 62 ? -1.714 12.015 -21.761 1.0 12.22 ? 62 A 8 +ATOM 932 C C . SER A1 1 62 ? -1.625 13.535 -21.654 1.0 13.52 ? 62 A 8 +ATOM 933 O O . SER A1 1 62 ? -0.552 14.09 -21.417 1.0 42.51 ? 62 A 8 +ATOM 934 C CB . SER A1 1 62 ? -1.523 11.583 -23.216 1.0 62.33 ? 62 A 8 +ATOM 935 O OG . SER A1 1 62 ? -0.885 12.599 -23.97 1.0 14.13 ? 62 A 8 +ATOM 936 H H . SER A1 1 62 ? -3.575 11.009 -21.843 1.0 74.25 ? 62 A 8 +ATOM 937 H HA . SER A1 1 62 ? -0.932 11.578 -21.158 1.0 74.15 ? 62 A 8 +ATOM 938 H HB2 . SER A1 1 62 ? -0.914 10.692 -23.247 1.0 54.41 ? 62 A 8 +ATOM 939 H HB3 . SER A1 1 62 ? -2.487 11.375 -23.656 1.0 23.45 ? 62 A 8 +ATOM 940 H HG . SER A1 1 62 ? -1.545 13.095 -24.46 1.0 1.23 ? 62 A 8 +ATOM 941 N N . ASP A1 1 63 ? -2.761 14.201 -21.83 1.0 34.33 ? 63 A 8 +ATOM 942 C CA . ASP A1 1 63 ? -2.814 15.656 -21.753 1.0 10.21 ? 63 A 8 +ATOM 943 C C . ASP A1 1 63 ? -2.322 16.147 -20.395 1.0 63.54 ? 63 A 8 +ATOM 944 O O . ASP A1 1 63 ? -1.86 17.281 -20.263 1.0 31.33 ? 63 A 8 +ATOM 945 C CB . ASP A1 1 63 ? -4.24 16.15 -22.002 1.0 21.1 ? 63 A 8 +ATOM 946 C CG . ASP A1 1 63 ? -4.283 17.605 -22.425 1.0 12.2 ? 63 A 8 +ATOM 947 O OD1 . ASP A1 1 63 ? -4.236 18.483 -21.538 1.0 53.24 ? 63 A 8 +ATOM 948 O OD2 . ASP A1 1 63 ? -4.362 17.866 -23.643 1.0 3.13 ? 63 A 8 +ATOM 949 H H . ASP A1 1 63 ? -3.584 13.702 -22.016 1.0 14.4 ? 63 A 8 +ATOM 950 H HA . ASP A1 1 63 ? -2.166 16.053 -22.521 1.0 72.42 ? 63 A 8 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.689 15.554 -22.783 1.0 63.34 ? 63 A 8 +ATOM 952 H HB3 . ASP A1 1 63 ? -4.815 16.04 -21.095 1.0 44.51 ? 63 A 8 +ATOM 953 N N . TYR A1 1 64 ? -2.424 15.286 -19.389 1.0 43.15 ? 64 A 8 +ATOM 954 C CA . TYR A1 1 64 ? -1.993 15.633 -18.04 1.0 74.44 ? 64 A 8 +ATOM 955 C C . TYR A1 1 64 ? -3.036 16.5 -17.341 1.0 35.31 ? 64 A 8 +ATOM 956 O O . TYR A1 1 64 ? -2.725 17.222 -16.394 1.0 63.11 ? 64 A 8 +ATOM 957 C CB . TYR A1 1 64 ? -0.651 16.365 -18.083 1.0 41.31 ? 64 A 8 +ATOM 958 C CG . TYR A1 1 64 ? 0.176 16.187 -16.83 1.0 35.31 ? 64 A 8 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.744 14.959 -16.517 1.0 10.21 ? 64 A 8 +ATOM 960 C CD2 . TYR A1 1 64 ? 0.389 17.248 -15.958 1.0 61.0 ? 64 A 8 +ATOM 961 C CE1 . TYR A1 1 64 ? 1.5 14.792 -15.372 1.0 31.32 ? 64 A 8 +ATOM 962 C CE2 . TYR A1 1 64 ? 1.144 17.091 -14.812 1.0 3.01 ? 64 A 8 +ATOM 963 C CZ . TYR A1 1 64 ? 1.697 15.861 -14.524 1.0 35.43 ? 64 A 8 +ATOM 964 O OH . TYR A1 1 64 ? 2.449 15.7 -13.383 1.0 23.32 ? 64 A 8 +ATOM 965 H H . TYR A1 1 64 ? -2.801 14.397 -19.556 1.0 10.22 ? 64 A 8 +ATOM 966 H HA . TYR A1 1 64 ? -1.874 14.715 -17.483 1.0 40.51 ? 64 A 8 +ATOM 967 H HB2 . TYR A1 1 64 ? -0.073 15.994 -18.916 1.0 75.32 ? 64 A 8 +ATOM 968 H HB3 . TYR A1 1 64 ? -0.829 17.422 -18.217 1.0 32.34 ? 64 A 8 +ATOM 969 H HD1 . TYR A1 1 64 ? 0.588 14.123 -17.183 1.0 1.35 ? 64 A 8 +ATOM 970 H HD2 . TYR A1 1 64 ? -0.046 18.21 -16.187 1.0 32.41 ? 64 A 8 +ATOM 971 H HE1 . TYR A1 1 64 ? 1.934 13.829 -15.146 1.0 52.21 ? 64 A 8 +ATOM 972 H HE2 . TYR A1 1 64 ? 1.299 17.928 -14.147 1.0 43.14 ? 64 A 8 +ATOM 973 H HH . TYR A1 1 64 ? 3.372 15.586 -13.621 1.0 23.33 ? 64 A 8 +ATOM 974 N N . ASN A1 1 65 ? -4.275 16.423 -17.815 1.0 61.21 ? 65 A 8 +ATOM 975 C CA . ASN A1 1 65 ? -5.365 17.2 -17.237 1.0 70.22 ? 65 A 8 +ATOM 976 C C . ASN A1 1 65 ? -6.359 16.292 -16.52 1.0 21.44 ? 65 A 8 +ATOM 977 O O . ASN A1 1 65 ? -7.449 16.723 -16.142 1.0 22.24 ? 65 A 8 +ATOM 978 C CB . ASN A1 1 65 ? -6.082 18.001 -18.326 1.0 30.31 ? 65 A 8 +ATOM 979 C CG . ASN A1 1 65 ? -7.105 17.17 -19.076 1.0 75.23 ? 65 A 8 +ATOM 980 O OD1 . ASN A1 1 65 ? -6.757 16.208 -19.761 1.0 74.2 ? 65 A 8 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.374 17.539 -18.95 1.0 12.4 ? 65 A 8 +ATOM 982 H H . ASN A1 1 65 ? -4.461 15.829 -18.573 1.0 72.01 ? 65 A 8 +ATOM 983 H HA . ASN A1 1 65 ? -4.939 17.886 -16.52 1.0 43.44 ? 65 A 8 +ATOM 984 H HB2 . ASN A1 1 65 ? -6.59 18.839 -17.872 1.0 12.24 ? 65 A 8 +ATOM 985 H HB3 . ASN A1 1 65 ? -5.353 18.368 -19.033 1.0 73.02 ? 65 A 8 +ATOM 986 H HD21 . ASN A1 1 65 ? -8.577 18.316 -18.388 1.0 23.44 ? 65 A 8 +ATOM 987 H HD22 . ASN A1 1 65 ? -9.056 17.019 -19.424 1.0 32.24 ? 65 A 8 +ATOM 988 N N . VAL A1 1 66 ? -5.976 15.033 -16.334 1.0 11.4 ? 66 A 8 +ATOM 989 C CA . VAL A1 1 66 ? -6.832 14.064 -15.661 1.0 70.45 ? 66 A 8 +ATOM 990 C C . VAL A1 1 66 ? -6.594 14.073 -14.155 1.0 73.11 ? 66 A 8 +ATOM 991 O O . VAL A1 1 66 ? -5.469 13.884 -13.694 1.0 33.12 ? 66 A 8 +ATOM 992 C CB . VAL A1 1 66 ? -6.599 12.64 -16.198 1.0 40.11 ? 66 A 8 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.161 12.207 -15.957 1.0 32.21 ? 66 A 8 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.573 11.663 -15.557 1.0 25.13 ? 66 A 8 +ATOM 995 H H . VAL A1 1 66 ? -5.095 14.749 -16.657 1.0 25.31 ? 66 A 8 +ATOM 996 H HA . VAL A1 1 66 ? -7.86 14.336 -15.855 1.0 44.24 ? 66 A 8 +ATOM 997 H HB . VAL A1 1 66 ? -6.776 12.645 -17.263 1.0 65.05 ? 66 A 8 +ATOM 998 H HG11 . VAL A1 1 66 ? -4.952 11.316 -16.531 1.0 62.5 ? 66 A 8 +ATOM 999 H HG12 . VAL A1 1 66 ? -4.491 12.998 -16.261 1.0 4.5 ? 66 A 8 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.019 11.999 -14.906 1.0 12.32 ? 66 A 8 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.568 11.846 -15.934 1.0 23.4 ? 66 A 8 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.277 10.652 -15.795 1.0 64.2 ? 66 A 8 +ATOM 1003 H HG23 . VAL A1 1 66 ? -7.565 11.797 -14.484 1.0 74.31 ? 66 A 8 +ATOM 1004 N N . GLN A1 1 67 ? -7.661 14.295 -13.394 1.0 5.43 ? 67 A 8 +ATOM 1005 C CA . GLN A1 1 67 ? -7.567 14.329 -11.939 1.0 15.5 ? 67 A 8 +ATOM 1006 C C . GLN A1 1 67 ? -8.503 13.303 -11.309 1.0 62.54 ? 67 A 8 +ATOM 1007 O O . GLN A1 1 67 ? -9.222 12.59 -12.01 1.0 44.01 ? 67 A 8 +ATOM 1008 C CB . GLN A1 1 67 ? -7.9 15.728 -11.418 1.0 35.11 ? 67 A 8 +ATOM 1009 C CG . GLN A1 1 67 ? -9.322 16.169 -11.725 1.0 11.21 ? 67 A 8 +ATOM 1010 C CD . GLN A1 1 67 ? -9.394 17.595 -12.235 1.0 34.44 ? 67 A 8 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.131 18.422 -11.698 1.0 41.54 ? 67 A 8 +ATOM 1012 N NE2 . GLN A1 1 67 ? -8.626 17.89 -13.277 1.0 50.51 ? 67 A 8 +ATOM 1013 H H . GLN A1 1 67 ? -8.531 14.439 -13.82 1.0 54.23 ? 67 A 8 +ATOM 1014 H HA . GLN A1 1 67 ? -6.551 14.085 -11.667 1.0 21.13 ? 67 A 8 +ATOM 1015 H HB2 . GLN A1 1 67 ? -7.765 15.742 -10.347 1.0 61.05 ? 67 A 8 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.221 16.437 -11.868 1.0 21.05 ? 67 A 8 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.735 15.513 -12.477 1.0 63.24 ? 67 A 8 +ATOM 1018 H HG3 . GLN A1 1 67 ? -9.911 16.095 -10.822 1.0 63.02 ? 67 A 8 +ATOM 1019 H HE21 . GLN A1 1 67 ? -8.064 17.18 -13.654 1.0 0.12 ? 67 A 8 +ATOM 1020 H HE22 . GLN A1 1 67 ? -8.653 18.804 -13.628 1.0 72.41 ? 67 A 8 +ATOM 1021 N N . LYS A1 1 68 ? -8.49 13.232 -9.983 1.0 63.33 ? 68 A 8 +ATOM 1022 C CA . LYS A1 1 68 ? -9.338 12.294 -9.257 1.0 34.0 ? 68 A 8 +ATOM 1023 C C . LYS A1 1 68 ? -10.813 12.627 -9.457 1.0 33.21 ? 68 A 8 +ATOM 1024 O O . LYS A1 1 68 ? -11.668 11.743 -9.416 1.0 33.01 ? 68 A 8 +ATOM 1025 C CB . LYS A1 1 68 ? -8.997 12.317 -7.765 1.0 41.41 ? 68 A 8 +ATOM 1026 C CG . LYS A1 1 68 ? -9.835 11.359 -6.935 1.0 61.44 ? 68 A 8 +ATOM 1027 C CD . LYS A1 1 68 ? -9.584 9.913 -7.329 1.0 43.41 ? 68 A 8 +ATOM 1028 C CE . LYS A1 1 68 ? -8.613 9.237 -6.373 1.0 23.43 ? 68 A 8 +ATOM 1029 N NZ . LYS A1 1 68 ? -9.154 9.169 -4.988 1.0 52.05 ? 68 A 8 +ATOM 1030 H H . LYS A1 1 68 ? -7.894 13.827 -9.479 1.0 75.53 ? 68 A 8 +ATOM 1031 H HA . LYS A1 1 68 ? -9.148 11.306 -9.646 1.0 31.4 ? 68 A 8 +ATOM 1032 H HB2 . LYS A1 1 68 ? -7.957 12.052 -7.641 1.0 51.5 ? 68 A 8 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.152 13.317 -7.387 1.0 62.4 ? 68 A 8 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.585 11.486 -5.893 1.0 22.33 ? 68 A 8 +ATOM 1035 H HG3 . LYS A1 1 68 ? -10.881 11.587 -7.087 1.0 45.02 ? 68 A 8 +ATOM 1036 H HD2 . LYS A1 1 68 ? -10.52 9.376 -7.312 1.0 14.2 ? 68 A 8 +ATOM 1037 H HD3 . LYS A1 1 68 ? -9.17 9.888 -8.327 1.0 13.53 ? 68 A 8 +ATOM 1038 H HE2 . LYS A1 1 68 ? -8.421 8.235 -6.725 1.0 43.13 ? 68 A 8 +ATOM 1039 H HE3 . LYS A1 1 68 ? -7.689 9.797 -6.363 1.0 63.42 ? 68 A 8 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -10.044 9.703 -4.925 1.0 1.54 ? 68 A 8 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -8.471 9.576 -4.317 1.0 73.32 ? 68 A 8 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.335 8.181 -4.722 1.0 23.44 ? 68 A 8 +ATOM 1043 N N . GLU A1 1 69 ? -11.102 13.906 -9.676 1.0 51.1 ? 69 A 8 +ATOM 1044 C CA . GLU A1 1 69 ? -12.474 14.353 -9.884 1.0 15.41 ? 69 A 8 +ATOM 1045 C C . GLU A1 1 69 ? -12.534 15.451 -10.942 1.0 20.25 ? 69 A 8 +ATOM 1046 O O . GLU A1 1 69 ? -12.669 16.632 -10.62 1.0 55.15 ? 69 A 8 +ATOM 1047 C CB . GLU A1 1 69 ? -13.073 14.862 -8.571 1.0 42.14 ? 69 A 8 +ATOM 1048 C CG . GLU A1 1 69 ? -12.162 15.816 -7.816 1.0 32.44 ? 69 A 8 +ATOM 1049 C CD . GLU A1 1 69 ? -12.931 16.803 -6.96 1.0 60.3 ? 69 A 8 +ATOM 1050 O OE1 . GLU A1 1 69 ? -13.66 16.358 -6.05 1.0 52.11 ? 69 A 8 +ATOM 1051 O OE2 . GLU A1 1 69 ? -12.803 18.022 -7.202 1.0 33.22 ? 69 A 8 +ATOM 1052 H H . GLU A1 1 69 ? -10.376 14.564 -9.698 1.0 51.55 ? 69 A 8 +ATOM 1053 H HA . GLU A1 1 69 ? -13.05 13.507 -10.227 1.0 21.13 ? 69 A 8 +ATOM 1054 H HB2 . GLU A1 1 69 ? -13.998 15.375 -8.786 1.0 70.35 ? 69 A 8 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.281 14.016 -7.933 1.0 25.14 ? 69 A 8 +ATOM 1056 H HG2 . GLU A1 1 69 ? -11.51 15.24 -7.175 1.0 60.54 ? 69 A 8 +ATOM 1057 H HG3 . GLU A1 1 69 ? -11.567 16.366 -8.53 1.0 2.43 ? 69 A 8 +ATOM 1058 N N . SER A1 1 70 ? -12.433 15.053 -12.206 1.0 51.41 ? 70 A 8 +ATOM 1059 C CA . SER A1 1 70 ? -12.471 16.002 -13.312 1.0 50.24 ? 70 A 8 +ATOM 1060 C C . SER A1 1 70 ? -13.877 16.098 -13.897 1.0 72.1 ? 70 A 8 +ATOM 1061 O O . SER A1 1 70 ? -14.464 15.094 -14.302 1.0 13.02 ? 70 A 8 +ATOM 1062 C CB . SER A1 1 70 ? -11.48 15.588 -14.402 1.0 75.43 ? 70 A 8 +ATOM 1063 O OG . SER A1 1 70 ? -10.619 16.661 -14.742 1.0 45.33 ? 70 A 8 +ATOM 1064 H H . SER A1 1 70 ? -12.327 14.097 -12.399 1.0 42.55 ? 70 A 8 +ATOM 1065 H HA . SER A1 1 70 ? -12.187 16.97 -12.928 1.0 61.25 ? 70 A 8 +ATOM 1066 H HB2 . SER A1 1 70 ? -10.883 14.762 -14.047 1.0 1.23 ? 70 A 8 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.025 15.285 -15.284 1.0 50.33 ? 70 A 8 +ATOM 1068 H HG . SER A1 1 70 ? -11.121 17.344 -15.194 1.0 14.24 ? 70 A 8 +ATOM 1069 N N . THR A1 1 71 ? -14.412 17.314 -13.939 1.0 52.55 ? 71 A 8 +ATOM 1070 C CA . THR A1 1 71 ? -15.748 17.544 -14.473 1.0 43.33 ? 71 A 8 +ATOM 1071 C C . THR A1 1 71 ? -15.693 17.937 -15.945 1.0 63.44 ? 71 A 8 +ATOM 1072 O O . THR A1 1 71 ? -15.169 18.996 -16.295 1.0 13.52 ? 71 A 8 +ATOM 1073 C CB . THR A1 1 71 ? -16.486 18.643 -13.687 1.0 4.41 ? 71 A 8 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.55 19.613 -13.204 1.0 4.41 ? 71 A 8 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.256 18.049 -12.517 1.0 4.35 ? 71 A 8 +ATOM 1076 H H . THR A1 1 71 ? -13.894 18.075 -13.602 1.0 14.04 ? 71 A 8 +ATOM 1077 H HA . THR A1 1 71 ? -16.308 16.624 -14.377 1.0 24.13 ? 71 A 8 +ATOM 1078 H HB . THR A1 1 71 ? -17.188 19.13 -14.35 1.0 70.41 ? 71 A 8 +ATOM 1079 H HG1 . THR A1 1 71 ? -15.951 20.121 -12.495 1.0 53.11 ? 71 A 8 +ATOM 1080 H HG21 . THR A1 1 71 ? -16.706 17.212 -12.113 1.0 12.42 ? 71 A 8 +ATOM 1081 H HG22 . THR A1 1 71 ? -18.224 17.712 -12.857 1.0 75.2 ? 71 A 8 +ATOM 1082 H HG23 . THR A1 1 71 ? -17.384 18.799 -11.751 1.0 31.12 ? 71 A 8 +ATOM 1083 N N . LEU A1 1 72 ? -16.235 17.08 -16.802 1.0 74.32 ? 72 A 8 +ATOM 1084 C CA . LEU A1 1 72 ? -16.248 17.339 -18.238 1.0 62.12 ? 72 A 8 +ATOM 1085 C C . LEU A1 1 72 ? -17.667 17.26 -18.793 1.0 14.1 ? 72 A 8 +ATOM 1086 O O . LEU A1 1 72 ? -18.521 16.564 -18.244 1.0 22.33 ? 72 A 8 +ATOM 1087 C CB . LEU A1 1 72 ? -15.348 16.338 -18.965 1.0 54.24 ? 72 A 8 +ATOM 1088 C CG . LEU A1 1 72 ? -16.04 15.094 -19.522 1.0 12.34 ? 72 A 8 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.411 15.299 -20.983 1.0 71.53 ? 72 A 8 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.149 13.871 -19.362 1.0 45.31 ? 72 A 8 +ATOM 1091 H H . LEU A1 1 72 ? -16.637 16.253 -16.463 1.0 40.44 ? 72 A 8 +ATOM 1092 H HA . LEU A1 1 72 ? -15.866 18.336 -18.398 1.0 22.23 ? 72 A 8 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.879 16.853 -19.789 1.0 24.33 ? 72 A 8 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.588 16.011 -18.268 1.0 64.44 ? 72 A 8 +ATOM 1095 H HG . LEU A1 1 72 ? -16.953 14.919 -18.969 1.0 60.22 ? 72 A 8 +ATOM 1096 H HD11 . LEU A1 1 72 ? -16.052 14.464 -21.566 1.0 22.12 ? 72 A 8 +ATOM 1097 H HD12 . LEU A1 1 72 ? -15.959 16.211 -21.344 1.0 11.12 ? 72 A 8 +ATOM 1098 H HD13 . LEU A1 1 72 ? -17.485 15.369 -21.075 1.0 74.11 ? 72 A 8 +ATOM 1099 H HD21 . LEU A1 1 72 ? -15.481 13.093 -20.034 1.0 45.11 ? 72 A 8 +ATOM 1100 H HD22 . LEU A1 1 72 ? -15.206 13.515 -18.344 1.0 64.51 ? 72 A 8 +ATOM 1101 H HD23 . LEU A1 1 72 ? -14.128 14.137 -19.595 1.0 15.53 ? 72 A 8 +ATOM 1102 N N . HIS A1 1 73 ? -17.91 17.977 -19.885 1.0 22.1 ? 73 A 8 +ATOM 1103 C CA . HIS A1 1 73 ? -19.225 17.987 -20.517 1.0 43.22 ? 73 A 8 +ATOM 1104 C C . HIS A1 1 73 ? -19.276 16.999 -21.679 1.0 1.12 ? 73 A 8 +ATOM 1105 O O . HIS A1 1 73 ? -18.515 17.116 -22.64 1.0 41.41 ? 73 A 8 +ATOM 1106 C CB . HIS A1 1 73 ? -19.566 19.393 -21.011 1.0 34.11 ? 73 A 8 +ATOM 1107 C CG . HIS A1 1 73 ? -19.401 20.452 -19.966 1.0 25.31 ? 73 A 8 +ATOM 1108 N ND1 . HIS A1 1 73 ? -19.119 21.768 -20.266 1.0 22.31 ? 73 A 8 +ATOM 1109 C CD2 . HIS A1 1 73 ? -19.48 20.384 -18.616 1.0 30.12 ? 73 A 8 +ATOM 1110 C CE1 . HIS A1 1 73 ? -19.031 22.464 -19.146 1.0 74.03 ? 73 A 8 +ATOM 1111 N NE2 . HIS A1 1 73 ? -19.246 21.647 -18.13 1.0 22.32 ? 73 A 8 +ATOM 1112 H H . HIS A1 1 73 ? -17.188 18.513 -20.276 1.0 41.1 ? 73 A 8 +ATOM 1113 H HA . HIS A1 1 73 ? -19.951 17.689 -19.775 1.0 23.25 ? 73 A 8 +ATOM 1114 H HB2 . HIS A1 1 73 ? -18.921 19.642 -21.841 1.0 51.13 ? 73 A 8 +ATOM 1115 H HB3 . HIS A1 1 73 ? -20.594 19.411 -21.343 1.0 64.13 ? 73 A 8 +ATOM 1116 H HD1 . HIS A1 1 73 ? -19.0 22.137 -21.165 1.0 63.31 ? 73 A 8 +ATOM 1117 H HD2 . HIS A1 1 73 ? -19.689 19.501 -18.029 1.0 71.43 ? 73 A 8 +ATOM 1118 H HE1 . HIS A1 1 73 ? -18.819 23.52 -19.073 1.0 3.34 ? 73 A 8 +ATOM 1119 N N . LEU A1 1 74 ? -20.178 16.028 -21.584 1.0 31.4 ? 74 A 8 +ATOM 1120 C CA . LEU A1 1 74 ? -20.328 15.019 -22.627 1.0 41.22 ? 74 A 8 +ATOM 1121 C C . LEU A1 1 74 ? -21.638 15.211 -23.384 1.0 21.0 ? 74 A 8 +ATOM 1122 O O . LEU A1 1 74 ? -22.721 15.108 -22.809 1.0 70.53 ? 74 A 8 +ATOM 1123 C CB . LEU A1 1 74 ? -20.278 13.617 -22.018 1.0 42.32 ? 74 A 8 +ATOM 1124 C CG . LEU A1 1 74 ? -20.749 12.476 -22.922 1.0 13.02 ? 74 A 8 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.015 12.513 -24.253 1.0 50.12 ? 74 A 8 +ATOM 1126 C CD2 . LEU A1 1 74 ? -20.545 11.134 -22.235 1.0 22.4 ? 74 A 8 +ATOM 1127 H H . LEU A1 1 74 ? -20.756 15.987 -20.794 1.0 53.04 ? 74 A 8 +ATOM 1128 H HA . LEU A1 1 74 ? -19.506 15.133 -23.318 1.0 65.43 ? 74 A 8 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.257 13.415 -21.736 1.0 22.02 ? 74 A 8 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.901 13.618 -21.134 1.0 20.31 ? 74 A 8 +ATOM 1131 H HG . LEU A1 1 74 ? -21.805 12.595 -23.12 1.0 34.12 ? 74 A 8 +ATOM 1132 H HD11 . LEU A1 1 74 ? -19.014 12.887 -24.102 1.0 33.01 ? 74 A 8 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.543 13.161 -24.937 1.0 1.34 ? 74 A 8 +ATOM 1134 H HD13 . LEU A1 1 74 ? -19.969 11.516 -24.666 1.0 63.14 ? 74 A 8 +ATOM 1135 H HD21 . LEU A1 1 74 ? -21.057 11.134 -21.284 1.0 12.32 ? 74 A 8 +ATOM 1136 H HD22 . LEU A1 1 74 ? -19.49 10.968 -22.076 1.0 54.43 ? 74 A 8 +ATOM 1137 H HD23 . LEU A1 1 74 ? -20.943 10.346 -22.859 1.0 14.02 ? 74 A 8 +ATOM 1138 N N . VAL A1 1 75 ? -21.531 15.489 -24.68 1.0 43.5 ? 75 A 8 +ATOM 1139 C CA . VAL A1 1 75 ? -22.707 15.691 -25.518 1.0 52.32 ? 75 A 8 +ATOM 1140 C C . VAL A1 1 75 ? -22.857 14.566 -26.535 1.0 61.15 ? 75 A 8 +ATOM 1141 O O . VAL A1 1 75 ? -21.882 14.138 -27.153 1.0 54.31 ? 75 A 8 +ATOM 1142 C CB . VAL A1 1 75 ? -22.639 17.037 -26.264 1.0 24.5 ? 75 A 8 +ATOM 1143 C CG1 . VAL A1 1 75 ? -22.725 18.197 -25.284 1.0 55.3 ? 75 A 8 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.366 17.123 -27.093 1.0 64.14 ? 75 A 8 +ATOM 1145 H H . VAL A1 1 75 ? -20.64 15.558 -25.082 1.0 70.11 ? 75 A 8 +ATOM 1146 H HA . VAL A1 1 75 ? -23.576 15.703 -24.877 1.0 60.52 ? 75 A 8 +ATOM 1147 H HB . VAL A1 1 75 ? -23.484 17.098 -26.934 1.0 44.41 ? 75 A 8 +ATOM 1148 H HG11 . VAL A1 1 75 ? -21.939 18.105 -24.548 1.0 31.54 ? 75 A 8 +ATOM 1149 H HG12 . VAL A1 1 75 ? -22.614 19.129 -25.817 1.0 61.34 ? 75 A 8 +ATOM 1150 H HG13 . VAL A1 1 75 ? -23.684 18.178 -24.788 1.0 54.52 ? 75 A 8 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.304 18.095 -27.558 1.0 5.24 ? 75 A 8 +ATOM 1152 H HG22 . VAL A1 1 75 ? -20.51 16.973 -26.453 1.0 61.35 ? 75 A 8 +ATOM 1153 H HG23 . VAL A1 1 75 ? -21.382 16.359 -27.857 1.0 24.43 ? 75 A 8 +ATOM 1154 N N . LEU A1 1 76 ? -24.086 14.09 -26.705 1.0 35.1 ? 76 A 8 +ATOM 1155 C CA . LEU A1 1 76 ? -24.366 13.013 -27.649 1.0 22.53 ? 76 A 8 +ATOM 1156 C C . LEU A1 1 76 ? -25.433 13.434 -28.654 1.0 2.14 ? 76 A 8 +ATOM 1157 O O . LEU A1 1 76 ? -26.432 14.056 -28.291 1.0 21.5 ? 76 A 8 +ATOM 1158 C CB . LEU A1 1 76 ? -24.82 11.758 -26.901 1.0 73.12 ? 76 A 8 +ATOM 1159 C CG . LEU A1 1 76 ? -24.572 11.75 -25.392 1.0 64.45 ? 76 A 8 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.713 12.441 -24.66 1.0 24.13 ? 76 A 8 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.399 10.325 -24.888 1.0 22.03 ? 76 A 8 +ATOM 1162 H H . LEU A1 1 76 ? -24.823 14.471 -26.184 1.0 44.32 ? 76 A 8 +ATOM 1163 H HA . LEU A1 1 76 ? -23.453 12.794 -28.182 1.0 53.04 ? 76 A 8 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.881 11.643 -27.062 1.0 71.31 ? 76 A 8 +ATOM 1165 H HB3 . LEU A1 1 76 ? -24.298 10.913 -27.328 1.0 62.14 ? 76 A 8 +ATOM 1166 H HG . LEU A1 1 76 ? -23.662 12.294 -25.18 1.0 42.11 ? 76 A 8 +ATOM 1167 H HD11 . LEU A1 1 76 ? -26.645 12.224 -25.16 1.0 12.14 ? 76 A 8 +ATOM 1168 H HD12 . LEU A1 1 76 ? -25.545 13.507 -24.658 1.0 23.21 ? 76 A 8 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.757 12.081 -23.642 1.0 40.2 ? 76 A 8 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.644 10.305 -24.116 1.0 53.24 ? 76 A 8 +ATOM 1171 H HD22 . LEU A1 1 76 ? -24.093 9.689 -25.706 1.0 72.02 ? 76 A 8 +ATOM 1172 H HD23 . LEU A1 1 76 ? -25.336 9.968 -24.486 1.0 63.4 ? 76 A 8 +ATOM 1173 N N . ARG A1 1 77 ? -25.216 13.089 -29.919 1.0 50.44 ? 77 A 8 +ATOM 1174 C CA . ARG A1 1 77 ? -26.159 13.43 -30.977 1.0 12.4 ? 77 A 8 +ATOM 1175 C C . ARG A1 1 77 ? -26.994 12.216 -31.373 1.0 10.32 ? 77 A 8 +ATOM 1176 O O . ARG A1 1 77 ? -27.248 11.982 -32.555 1.0 12.43 ? 77 A 8 +ATOM 1177 C CB . ARG A1 1 77 ? -25.415 13.971 -32.199 1.0 55.35 ? 77 A 8 +ATOM 1178 C CG . ARG A1 1 77 ? -24.853 15.369 -32.0 1.0 12.22 ? 77 A 8 +ATOM 1179 C CD . ARG A1 1 77 ? -23.388 15.329 -31.594 1.0 60.22 ? 77 A 8 +ATOM 1180 N NE . ARG A1 1 77 ? -22.694 16.569 -31.929 1.0 64.33 ? 77 A 8 +ATOM 1181 C CZ . ARG A1 1 77 ? -21.376 16.719 -31.847 1.0 13.31 ? 77 A 8 +ATOM 1182 N NH1 . ARG A1 1 77 ? -20.615 15.711 -31.444 1.0 63.3 ? 77 A 8 +ATOM 1183 N NH2 . ARG A1 1 77 ? -20.818 17.879 -32.169 1.0 70.54 ? 77 A 8 +ATOM 1184 H H . ARG A1 1 77 ? -24.401 12.594 -30.147 1.0 2.41 ? 77 A 8 +ATOM 1185 H HA . ARG A1 1 77 ? -26.818 14.197 -30.599 1.0 53.23 ? 77 A 8 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.594 13.307 -32.429 1.0 41.04 ? 77 A 8 +ATOM 1187 H HB3 . ARG A1 1 77 ? -26.094 13.994 -33.038 1.0 23.23 ? 77 A 8 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.944 15.918 -32.926 1.0 3.21 ? 77 A 8 +ATOM 1189 H HG3 . ARG A1 1 77 ? -25.419 15.867 -31.227 1.0 45.32 ? 77 A 8 +ATOM 1190 H HD2 . ARG A1 1 77 ? -23.328 15.171 -30.528 1.0 24.22 ? 77 A 8 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.909 14.509 -32.107 1.0 55.12 ? 77 A 8 +ATOM 1192 H HE . ARG A1 1 77 ? -23.237 17.327 -32.229 1.0 41.44 ? 77 A 8 +ATOM 1193 H HH11 . ARG A1 1 77 ? -21.033 14.836 -31.202 1.0 31.24 ? 77 A 8 +ATOM 1194 H HH12 . ARG A1 1 77 ? -19.623 15.826 -31.384 1.0 72.5 ? 77 A 8 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.388 18.641 -32.474 1.0 71.34 ? 77 A 8 +ATOM 1196 H HH22 . ARG A1 1 77 ? -19.826 17.99 -32.107 1.0 1.44 ? 77 A 8 +ATOM 1197 N N . LEU A1 1 78 ? -27.418 11.445 -30.377 1.0 31.03 ? 78 A 8 +ATOM 1198 C CA . LEU A1 1 78 ? -28.224 10.254 -30.62 1.0 51.32 ? 78 A 8 +ATOM 1199 C C . LEU A1 1 78 ? -29.516 10.611 -31.348 1.0 14.11 ? 78 A 8 +ATOM 1200 O O . LEU A1 1 78 ? -29.887 9.964 -32.328 1.0 12.31 ? 78 A 8 +ATOM 1201 C CB . LEU A1 1 78 ? -28.546 9.553 -29.299 1.0 42.51 ? 78 A 8 +ATOM 1202 C CG . LEU A1 1 78 ? -27.626 8.394 -28.913 1.0 51.45 ? 78 A 8 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.376 8.913 -28.219 1.0 14.44 ? 78 A 8 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.362 7.405 -28.02 1.0 25.32 ? 78 A 8 +ATOM 1205 H H . LEU A1 1 78 ? -27.183 11.682 -29.456 1.0 75.31 ? 78 A 8 +ATOM 1206 H HA . LEU A1 1 78 ? -27.647 9.585 -31.242 1.0 64.2 ? 78 A 8 +ATOM 1207 H HB2 . LEU A1 1 78 ? -28.496 10.291 -28.513 1.0 61.14 ? 78 A 8 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.554 9.169 -29.367 1.0 62.32 ? 78 A 8 +ATOM 1209 H HG . LEU A1 1 78 ? -27.318 7.873 -29.809 1.0 53.42 ? 78 A 8 +ATOM 1210 H HD11 . LEU A1 1 78 ? -26.032 8.182 -27.504 1.0 3.24 ? 78 A 8 +ATOM 1211 H HD12 . LEU A1 1 78 ? -26.605 9.837 -27.708 1.0 74.14 ? 78 A 8 +ATOM 1212 H HD13 . LEU A1 1 78 ? -25.605 9.091 -28.954 1.0 11.41 ? 78 A 8 +ATOM 1213 H HD21 . LEU A1 1 78 ? -27.689 7.037 -27.26 1.0 65.32 ? 78 A 8 +ATOM 1214 H HD22 . LEU A1 1 78 ? -28.717 6.578 -28.617 1.0 65.43 ? 78 A 8 +ATOM 1215 H HD23 . LEU A1 1 78 ? -29.201 7.898 -27.552 1.0 34.04 ? 78 A 8 +ATOM 1216 N N . ARG A1 1 79 ? -30.196 11.645 -30.864 1.0 44.5 ? 79 A 8 +ATOM 1217 C CA . ARG A1 1 79 ? -31.446 12.088 -31.469 1.0 54.44 ? 79 A 8 +ATOM 1218 C C . ARG A1 1 79 ? -32.553 11.062 -31.245 1.0 43.43 ? 79 A 8 +ATOM 1219 O O . ARG A1 1 79 ? -33.433 11.258 -30.408 1.0 24.23 ? 79 A 8 +ATOM 1220 C CB . ARG A1 1 79 ? -31.255 12.328 -32.968 1.0 53.1 ? 79 A 8 +ATOM 1221 C CG . ARG A1 1 79 ? -31.417 13.783 -33.378 1.0 62.42 ? 79 A 8 +ATOM 1222 C CD . ARG A1 1 79 ? -32.87 14.119 -33.676 1.0 15.2 ? 79 A 8 +ATOM 1223 N NE . ARG A1 1 79 ? -33.02 15.466 -34.219 1.0 22.21 ? 79 A 8 +ATOM 1224 C CZ . ARG A1 1 79 ? -34.084 15.868 -34.904 1.0 43.33 ? 79 A 8 +ATOM 1225 N NH1 . ARG A1 1 79 ? -35.087 15.03 -35.128 1.0 51.34 ? 79 A 8 +ATOM 1226 N NH2 . ARG A1 1 79 ? -34.147 17.11 -35.366 1.0 24.34 ? 79 A 8 +ATOM 1227 H H . ARG A1 1 79 ? -29.849 12.121 -30.081 1.0 30.43 ? 79 A 8 +ATOM 1228 H HA . ARG A1 1 79 ? -31.731 13.017 -30.999 1.0 75.12 ? 79 A 8 +ATOM 1229 H HB2 . ARG A1 1 79 ? -30.262 12.007 -33.249 1.0 72.51 ? 79 A 8 +ATOM 1230 H HB3 . ARG A1 1 79 ? -31.981 11.741 -33.51 1.0 62.3 ? 79 A 8 +ATOM 1231 H HG2 . ARG A1 1 79 ? -31.071 14.414 -32.574 1.0 34.21 ? 79 A 8 +ATOM 1232 H HG3 . ARG A1 1 79 ? -30.825 13.966 -34.263 1.0 51.44 ? 79 A 8 +ATOM 1233 H HD2 . ARG A1 1 79 ? -33.25 13.407 -34.393 1.0 21.42 ? 79 A 8 +ATOM 1234 H HD3 . ARG A1 1 79 ? -33.437 14.044 -32.76 1.0 24.22 ? 79 A 8 +ATOM 1235 H HE . ARG A1 1 79 ? -32.29 16.101 -34.065 1.0 63.2 ? 79 A 8 +ATOM 1236 H HH11 . ARG A1 1 79 ? -35.043 14.094 -34.78 1.0 0.03 ? 79 A 8 +ATOM 1237 H HH12 . ARG A1 1 79 ? -35.889 15.336 -35.643 1.0 54.33 ? 79 A 8 +ATOM 1238 H HH21 . ARG A1 1 79 ? -33.393 17.745 -35.199 1.0 72.3 ? 79 A 8 +ATOM 1239 H HH22 . ARG A1 1 79 ? -34.949 17.412 -35.882 1.0 2.44 ? 79 A 8 +ATOM 1240 N N . GLY A1 1 80 ? -32.5 9.968 -31.998 1.0 11.03 ? 80 A 8 +ATOM 1241 C CA . GLY A1 1 80 ? -33.504 8.928 -31.866 1.0 3.12 ? 80 A 8 +ATOM 1242 C C . GLY A1 1 80 ? -33.158 7.684 -32.66 1.0 52.34 ? 80 A 8 +ATOM 1243 O O . GLY A1 1 80 ? -33.717 7.446 -33.73 1.0 43.44 ? 80 A 8 +ATOM 1244 H H . GLY A1 1 80 ? -31.775 9.866 -32.649 1.0 0.24 ? 80 A 8 +ATOM 1245 H HA2 . GLY A1 1 80 ? -33.597 8.663 -30.824 1.0 71.24 ? 80 A 8 +ATOM 1246 H HA3 . GLY A1 1 80 ? -34.451 9.312 -32.216 1.0 43.14 ? 80 A 8 +ATOM 1247 N N . GLY A1 1 81 ? -32.23 6.889 -32.136 1.0 43.34 ? 81 A 8 +ATOM 1248 C CA . GLY A1 1 81 ? -31.824 5.673 -32.817 1.0 20.2 ? 81 A 8 +ATOM 1249 C C . GLY A1 1 81 ? -30.48 5.814 -33.504 1.0 63.23 ? 81 A 8 +ATOM 1250 O O . GLY A1 1 81 ? -29.743 6.767 -33.251 1.0 30.24 ? 81 A 8 +ATOM 1251 H H . GLY A1 1 81 ? -31.818 7.129 -31.28 1.0 11.33 ? 81 A 8 +ATOM 1252 H HA2 . GLY A1 1 81 ? -31.766 4.872 -32.096 1.0 30.51 ? 81 A 8 +ATOM 1253 H HA3 . GLY A1 1 81 ? -32.569 5.424 -33.558 1.0 55.14 ? 81 A 8 +ATOM 1254 N N . VAL A1 1 82 ? -30.159 4.863 -34.375 1.0 30.52 ? 82 A 8 +ATOM 1255 C CA . VAL A1 1 82 ? -28.894 4.885 -35.099 1.0 4.45 ? 82 A 8 +ATOM 1256 C C . VAL A1 1 82 ? -29.119 4.746 -36.601 1.0 63.52 ? 82 A 8 +ATOM 1257 O O . VAL A1 1 82 ? -28.817 5.657 -37.371 1.0 12.52 ? 82 A 8 +ATOM 1258 C CB . VAL A1 1 82 ? -27.956 3.759 -34.626 1.0 53.54 ? 82 A 8 +ATOM 1259 C CG1 . VAL A1 1 82 ? -28.554 2.397 -34.943 1.0 33.31 ? 82 A 8 +ATOM 1260 C CG2 . VAL A1 1 82 ? -26.582 3.909 -35.26 1.0 1.13 ? 82 A 8 +ATOM 1261 H H . VAL A1 1 82 ? -30.789 4.129 -34.534 1.0 42.11 ? 82 A 8 +ATOM 1262 H HA . VAL A1 1 82 ? -28.413 5.832 -34.903 1.0 65.12 ? 82 A 8 +ATOM 1263 H HB . VAL A1 1 82 ? -27.845 3.837 -33.554 1.0 3.02 ? 82 A 8 +ATOM 1264 H HG11 . VAL A1 1 82 ? -28.322 2.132 -35.965 1.0 71.54 ? 82 A 8 +ATOM 1265 H HG12 . VAL A1 1 82 ? -28.139 1.656 -34.275 1.0 43.52 ? 82 A 8 +ATOM 1266 H HG13 . VAL A1 1 82 ? -29.626 2.436 -34.817 1.0 60.31 ? 82 A 8 +ATOM 1267 H HG21 . VAL A1 1 82 ? -26.663 4.499 -36.16 1.0 51.1 ? 82 A 8 +ATOM 1268 H HG22 . VAL A1 1 82 ? -25.917 4.4 -34.565 1.0 43.42 ? 82 A 8 +ATOM 1269 H HG23 . VAL A1 1 82 ? -26.189 2.932 -35.505 1.0 61.21 ? 82 A 8 +ATOM 1 N N . GLY A1 1 1 ? 1.791 -0.636 -0.883 1.0 13.0 ? 1 A 9 +ATOM 2 C CA . GLY A1 1 1 ? 0.525 0.057 -1.032 1.0 45.03 ? 1 A 9 +ATOM 3 C C . GLY A1 1 1 ? 0.514 0.995 -2.223 1.0 65.21 ? 1 A 9 +ATOM 4 O O . GLY A1 1 1 ? 0.457 2.216 -2.078 1.0 33.34 ? 1 A 9 +ATOM 5 H H1 . GLY A1 1 1 ? 2.271 -0.598 -0.029 1.0 52.4 ? 1 A 9 +ATOM 6 H HA2 . GLY A1 1 1 ? -0.26 -0.674 -1.155 1.0 14.15 ? 1 A 9 +ATOM 7 H HA3 . GLY A1 1 1 ? 0.333 0.629 -0.136 1.0 34.23 ? 1 A 9 +ATOM 8 N N . PRO A1 1 2 ? 0.571 0.42 -3.434 1.0 55.32 ? 2 A 9 +ATOM 9 C CA . PRO A1 1 2 ? 0.57 1.195 -4.678 1.0 21.43 ? 2 A 9 +ATOM 10 C C . PRO A1 1 2 ? -0.777 1.858 -4.947 1.0 41.45 ? 2 A 9 +ATOM 11 O O . PRO A1 1 2 ? -1.824 1.343 -4.552 1.0 62.42 ? 2 A 9 +ATOM 12 C CB . PRO A1 1 2 ? 0.873 0.145 -5.75 1.0 51.45 ? 2 A 9 +ATOM 13 C CG . PRO A1 1 2 ? 0.406 -1.142 -5.163 1.0 43.11 ? 2 A 9 +ATOM 14 C CD . PRO A1 1 2 ? 0.64 -1.03 -3.681 1.0 64.14 ? 2 A 9 +ATOM 15 H HA . PRO A1 1 2 ? 1.345 1.947 -4.678 1.0 31.54 ? 2 A 9 +ATOM 16 H HB2 . PRO A1 1 2 ? 0.334 0.386 -6.656 1.0 42.4 ? 2 A 9 +ATOM 17 H HB3 . PRO A1 1 2 ? 1.934 0.126 -5.95 1.0 62.54 ? 2 A 9 +ATOM 18 H HG2 . PRO A1 1 2 ? -0.645 -1.279 -5.367 1.0 3.22 ? 2 A 9 +ATOM 19 H HG3 . PRO A1 1 2 ? 0.98 -1.961 -5.571 1.0 51.14 ? 2 A 9 +ATOM 20 H HD2 . PRO A1 1 2 ? -0.133 -1.551 -3.137 1.0 11.0 ? 2 A 9 +ATOM 21 H HD3 . PRO A1 1 2 ? 1.614 -1.418 -3.423 1.0 24.12 ? 2 A 9 +ATOM 22 N N . LEU A1 1 3 ? -0.744 3.001 -5.622 1.0 34.12 ? 3 A 9 +ATOM 23 C CA . LEU A1 1 3 ? -1.964 3.734 -5.945 1.0 54.03 ? 3 A 9 +ATOM 24 C C . LEU A1 1 3 ? -1.856 4.392 -7.317 1.0 63.21 ? 3 A 9 +ATOM 25 O O . LEU A1 1 3 ? -0.824 4.304 -7.98 1.0 11.24 ? 3 A 9 +ATOM 26 C CB . LEU A1 1 3 ? -2.242 4.795 -4.879 1.0 60.12 ? 3 A 9 +ATOM 27 C CG . LEU A1 1 3 ? -1.111 5.789 -4.61 1.0 64.13 ? 3 A 9 +ATOM 28 C CD1 . LEU A1 1 3 ? -1.589 7.215 -4.834 1.0 62.25 ? 3 A 9 +ATOM 29 C CD2 . LEU A1 1 3 ? -0.578 5.619 -3.195 1.0 0.12 ? 3 A 9 +ATOM 30 H H . LEU A1 1 3 ? 0.119 3.362 -5.911 1.0 52.35 ? 3 A 9 +ATOM 31 H HA . LEU A1 1 3 ? -2.78 3.028 -5.961 1.0 43.13 ? 3 A 9 +ATOM 32 H HB2 . LEU A1 1 3 ? -3.109 5.358 -5.19 1.0 74.24 ? 3 A 9 +ATOM 33 H HB3 . LEU A1 1 3 ? -2.461 4.283 -3.953 1.0 72.41 ? 3 A 9 +ATOM 34 H HG . LEU A1 1 3 ? -0.3 5.597 -5.299 1.0 43.5 ? 3 A 9 +ATOM 35 H HD11 . LEU A1 1 3 ? -0.746 7.888 -4.794 1.0 50.45 ? 3 A 9 +ATOM 36 H HD12 . LEU A1 1 3 ? -2.299 7.482 -4.065 1.0 4.34 ? 3 A 9 +ATOM 37 H HD13 . LEU A1 1 3 ? -2.064 7.288 -5.801 1.0 54.42 ? 3 A 9 +ATOM 38 H HD21 . LEU A1 1 3 ? 0.022 6.478 -2.931 1.0 23.33 ? 3 A 9 +ATOM 39 H HD22 . LEU A1 1 3 ? 0.028 4.727 -3.143 1.0 1.01 ? 3 A 9 +ATOM 40 H HD23 . LEU A1 1 3 ? -1.406 5.532 -2.506 1.0 75.24 ? 3 A 9 +ATOM 41 N N . GLY A1 1 4 ? -2.93 5.054 -7.736 1.0 4.21 ? 4 A 9 +ATOM 42 C CA . GLY A1 1 4 ? -2.936 5.719 -9.026 1.0 43.34 ? 4 A 9 +ATOM 43 C C . GLY A1 1 4 ? -4.322 5.792 -9.636 1.0 32.24 ? 4 A 9 +ATOM 44 O O . GLY A1 1 4 ? -4.716 6.825 -10.176 1.0 73.31 ? 4 A 9 +ATOM 45 H H . GLY A1 1 4 ? -3.726 5.091 -7.165 1.0 2.13 ? 4 A 9 +ATOM 46 H HA2 . GLY A1 1 4 ? -2.555 6.722 -8.904 1.0 53.5 ? 4 A 9 +ATOM 47 H HA3 . GLY A1 1 4 ? -2.287 5.178 -9.7 1.0 61.41 ? 4 A 9 +ATOM 48 N N . SER A1 1 5 ? -5.062 4.691 -9.552 1.0 14.33 ? 5 A 9 +ATOM 49 C CA . SER A1 1 5 ? -6.41 4.632 -10.104 1.0 12.42 ? 5 A 9 +ATOM 50 C C . SER A1 1 5 ? -7.245 5.816 -9.627 1.0 43.22 ? 5 A 9 +ATOM 51 O O . SER A1 1 5 ? -6.952 6.42 -8.595 1.0 33.52 ? 5 A 9 +ATOM 52 C CB . SER A1 1 5 ? -7.09 3.32 -9.707 1.0 72.02 ? 5 A 9 +ATOM 53 O OG . SER A1 1 5 ? -6.341 2.202 -10.151 1.0 21.35 ? 5 A 9 +ATOM 54 H H . SER A1 1 5 ? -4.691 3.898 -9.109 1.0 31.12 ? 5 A 9 +ATOM 55 H HA . SER A1 1 5 ? -6.329 4.674 -11.18 1.0 12.32 ? 5 A 9 +ATOM 56 H HB2 . SER A1 1 5 ? -7.178 3.275 -8.632 1.0 41.01 ? 5 A 9 +ATOM 57 H HB3 . SER A1 1 5 ? -8.074 3.279 -10.151 1.0 74.13 ? 5 A 9 +ATOM 58 H HG . SER A1 1 5 ? -6.341 1.526 -9.47 1.0 33.45 ? 5 A 9 +ATOM 59 N N . MET A1 1 6 ? -8.286 6.142 -10.386 1.0 14.01 ? 6 A 9 +ATOM 60 C CA . MET A1 1 6 ? -9.165 7.253 -10.04 1.0 54.33 ? 6 A 9 +ATOM 61 C C . MET A1 1 6 ? -10.487 7.156 -10.796 1.0 31.44 ? 6 A 9 +ATOM 62 O O . MET A1 1 6 ? -10.782 6.136 -11.418 1.0 1.11 ? 6 A 9 +ATOM 63 C CB . MET A1 1 6 ? -8.483 8.587 -10.352 1.0 70.21 ? 6 A 9 +ATOM 64 C CG . MET A1 1 6 ? -8.089 8.741 -11.812 1.0 25.05 ? 6 A 9 +ATOM 65 S SD . MET A1 1 6 ? -6.463 9.493 -12.016 1.0 3.44 ? 6 A 9 +ATOM 66 C CE . MET A1 1 6 ? -5.55 8.133 -12.741 1.0 13.21 ? 6 A 9 +ATOM 67 H H . MET A1 1 6 ? -8.469 5.623 -11.197 1.0 2.32 ? 6 A 9 +ATOM 68 H HA . MET A1 1 6 ? -9.365 7.2 -8.981 1.0 5.22 ? 6 A 9 +ATOM 69 H HB2 . MET A1 1 6 ? -9.157 9.39 -10.096 1.0 62.43 ? 6 A 9 +ATOM 70 H HB3 . MET A1 1 6 ? -7.591 8.671 -9.75 1.0 63.34 ? 6 A 9 +ATOM 71 H HG2 . MET A1 1 6 ? -8.079 7.765 -12.274 1.0 33.13 ? 6 A 9 +ATOM 72 H HG3 . MET A1 1 6 ? -8.822 9.363 -12.304 1.0 12.41 ? 6 A 9 +ATOM 73 H HE1 . MET A1 1 6 ? -4.648 7.961 -12.173 1.0 12.23 ? 6 A 9 +ATOM 74 H HE2 . MET A1 1 6 ? -6.16 7.241 -12.726 1.0 52.54 ? 6 A 9 +ATOM 75 H HE3 . MET A1 1 6 ? -5.293 8.376 -13.761 1.0 2.41 ? 6 A 9 +ATOM 76 N N . GLN A1 1 7 ? -11.278 8.222 -10.735 1.0 13.12 ? 7 A 9 +ATOM 77 C CA . GLN A1 1 7 ? -12.568 8.255 -11.413 1.0 13.2 ? 7 A 9 +ATOM 78 C C . GLN A1 1 7 ? -12.823 9.625 -12.032 1.0 42.42 ? 7 A 9 +ATOM 79 O O . GLN A1 1 7 ? -12.23 10.623 -11.62 1.0 71.33 ? 7 A 9 +ATOM 80 C CB . GLN A1 1 7 ? -13.691 7.907 -10.434 1.0 42.01 ? 7 A 9 +ATOM 81 C CG . GLN A1 1 7 ? -13.365 6.732 -9.527 1.0 12.34 ? 7 A 9 +ATOM 82 C CD . GLN A1 1 7 ? -12.835 7.168 -8.175 1.0 44.31 ? 7 A 9 +ATOM 83 O OE1 . GLN A1 1 7 ? -12.662 8.359 -7.918 1.0 33.44 ? 7 A 9 +ATOM 84 N NE2 . GLN A1 1 7 ? -12.573 6.202 -7.302 1.0 73.32 ? 7 A 9 +ATOM 85 H H . GLN A1 1 7 ? -10.987 9.005 -10.223 1.0 71.21 ? 7 A 9 +ATOM 86 H HA . GLN A1 1 7 ? -12.548 7.517 -12.2 1.0 62.03 ? 7 A 9 +ATOM 87 H HB2 . GLN A1 1 7 ? -13.892 8.768 -9.814 1.0 13.25 ? 7 A 9 +ATOM 88 H HB3 . GLN A1 1 7 ? -14.58 7.664 -10.997 1.0 41.42 ? 7 A 9 +ATOM 89 H HG2 . GLN A1 1 7 ? -14.263 6.152 -9.374 1.0 43.33 ? 7 A 9 +ATOM 90 H HG3 . GLN A1 1 7 ? -12.619 6.118 -10.01 1.0 33.21 ? 7 A 9 +ATOM 91 H HE21 . GLN A1 1 7 ? -12.734 5.274 -7.577 1.0 52.01 ? 7 A 9 +ATOM 92 H HE22 . GLN A1 1 7 ? -12.229 6.455 -6.422 1.0 55.43 ? 7 A 9 +ATOM 93 N N . ILE A1 1 8 ? -13.708 9.666 -13.022 1.0 12.12 ? 8 A 9 +ATOM 94 C CA . ILE A1 1 8 ? -14.042 10.915 -13.697 1.0 64.2 ? 8 A 9 +ATOM 95 C C . ILE A1 1 8 ? -15.552 11.119 -13.761 1.0 0.33 ? 8 A 9 +ATOM 96 O O . ILE A1 1 8 ? -16.324 10.177 -13.581 1.0 11.35 ? 8 A 9 +ATOM 97 C CB . ILE A1 1 8 ? -13.469 10.953 -15.126 1.0 65.34 ? 8 A 9 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.683 9.673 -15.418 1.0 72.33 ? 8 A 9 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.585 12.177 -15.31 1.0 55.24 ? 8 A 9 +ATOM 100 C CD1 . ILE A1 1 8 ? -12.249 9.546 -16.862 1.0 11.02 ? 8 A 9 +ATOM 101 H H . ILE A1 1 8 ? -14.148 8.838 -13.305 1.0 43.45 ? 8 A 9 +ATOM 102 H HA . ILE A1 1 8 ? -13.603 11.725 -13.133 1.0 41.41 ? 8 A 9 +ATOM 103 H HB . ILE A1 1 8 ? -14.293 11.027 -15.819 1.0 13.24 ? 8 A 9 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.798 9.653 -14.803 1.0 4.11 ? 8 A 9 +ATOM 105 H HG13 . ILE A1 1 8 ? -13.301 8.818 -15.181 1.0 33.41 ? 8 A 9 +ATOM 106 H HG21 . ILE A1 1 8 ? -13.202 13.04 -15.51 1.0 12.11 ? 8 A 9 +ATOM 107 H HG22 . ILE A1 1 8 ? -12.013 12.346 -14.41 1.0 14.43 ? 8 A 9 +ATOM 108 H HG23 . ILE A1 1 8 ? -11.912 12.015 -16.139 1.0 53.13 ? 8 A 9 +ATOM 109 H HD11 . ILE A1 1 8 ? -11.186 9.355 -16.902 1.0 4.51 ? 8 A 9 +ATOM 110 H HD12 . ILE A1 1 8 ? -12.779 8.728 -17.327 1.0 22.53 ? 8 A 9 +ATOM 111 H HD13 . ILE A1 1 8 ? -12.469 10.464 -17.386 1.0 32.23 ? 8 A 9 +ATOM 112 N N . PHE A1 1 9 ? -15.966 12.354 -14.021 1.0 44.42 ? 9 A 9 +ATOM 113 C CA . PHE A1 1 9 ? -17.384 12.683 -14.11 1.0 45.42 ? 9 A 9 +ATOM 114 C C . PHE A1 1 9 ? -17.747 13.145 -15.517 1.0 62.05 ? 9 A 9 +ATOM 115 O O . PHE A1 1 9 ? -17.135 14.066 -16.058 1.0 33.13 ? 9 A 9 +ATOM 116 C CB . PHE A1 1 9 ? -17.742 13.77 -13.095 1.0 42.3 ? 9 A 9 +ATOM 117 C CG . PHE A1 1 9 ? -18.493 13.253 -11.901 1.0 44.44 ? 9 A 9 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.757 12.705 -12.046 1.0 24.21 ? 9 A 9 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.934 13.313 -10.635 1.0 24.11 ? 9 A 9 +ATOM 120 C CE1 . PHE A1 1 9 ? -20.451 12.229 -10.949 1.0 54.33 ? 9 A 9 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.622 12.838 -9.534 1.0 62.43 ? 9 A 9 +ATOM 122 C CZ . PHE A1 1 9 ? -19.882 12.294 -9.692 1.0 72.21 ? 9 A 9 +ATOM 123 H H . PHE A1 1 9 ? -15.301 13.063 -14.155 1.0 15.35 ? 9 A 9 +ATOM 124 H HA . PHE A1 1 9 ? -17.945 11.79 -13.881 1.0 72.15 ? 9 A 9 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.834 14.234 -12.739 1.0 13.22 ? 9 A 9 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.356 14.515 -13.578 1.0 20.44 ? 9 A 9 +ATOM 127 H HD1 . PHE A1 1 9 ? -20.203 12.652 -13.029 1.0 63.23 ? 9 A 9 +ATOM 128 H HD2 . PHE A1 1 9 ? -16.948 13.738 -10.51 1.0 43.5 ? 9 A 9 +ATOM 129 H HE1 . PHE A1 1 9 ? -21.435 11.804 -11.075 1.0 53.21 ? 9 A 9 +ATOM 130 H HE2 . PHE A1 1 9 ? -18.175 12.891 -8.553 1.0 61.25 ? 9 A 9 +ATOM 131 H HZ . PHE A1 1 9 ? -20.422 11.923 -8.834 1.0 11.33 ? 9 A 9 +ATOM 132 N N . VAL A1 1 10 ? -18.749 12.499 -16.106 1.0 35.51 ? 10 A 9 +ATOM 133 C CA . VAL A1 1 10 ? -19.196 12.843 -17.45 1.0 51.35 ? 10 A 9 +ATOM 134 C C . VAL A1 1 10 ? -20.636 13.343 -17.44 1.0 20.3 ? 10 A 9 +ATOM 135 O O . VAL A1 1 10 ? -21.52 12.713 -16.858 1.0 33.54 ? 10 A 9 +ATOM 136 C CB . VAL A1 1 10 ? -19.089 11.638 -18.403 1.0 1.24 ? 10 A 9 +ATOM 137 C CG1 . VAL A1 1 10 ? -19.041 12.103 -19.85 1.0 43.55 ? 10 A 9 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.868 10.797 -18.063 1.0 70.41 ? 10 A 9 +ATOM 139 H H . VAL A1 1 10 ? -19.199 11.774 -15.624 1.0 13.11 ? 10 A 9 +ATOM 140 H HA . VAL A1 1 10 ? -18.555 13.629 -17.824 1.0 52.2 ? 10 A 9 +ATOM 141 H HB . VAL A1 1 10 ? -19.969 11.025 -18.275 1.0 21.21 ? 10 A 9 +ATOM 142 H HG11 . VAL A1 1 10 ? -18.478 13.023 -19.913 1.0 75.22 ? 10 A 9 +ATOM 143 H HG12 . VAL A1 1 10 ? -18.565 11.346 -20.457 1.0 54.41 ? 10 A 9 +ATOM 144 H HG13 . VAL A1 1 10 ? -20.046 12.272 -20.208 1.0 61.31 ? 10 A 9 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.026 11.445 -17.872 1.0 13.24 ? 10 A 9 +ATOM 146 H HG22 . VAL A1 1 10 ? -18.074 10.203 -17.185 1.0 62.44 ? 10 A 9 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.638 10.144 -18.893 1.0 2.35 ? 10 A 9 +ATOM 148 N N . LYS A1 1 11 ? -20.867 14.48 -18.087 1.0 23.3 ? 11 A 9 +ATOM 149 C CA . LYS A1 1 11 ? -22.2 15.066 -18.155 1.0 10.31 ? 11 A 9 +ATOM 150 C C . LYS A1 1 11 ? -22.787 14.921 -19.555 1.0 22.12 ? 11 A 9 +ATOM 151 O O . LYS A1 1 11 ? -22.294 15.52 -20.512 1.0 63.21 ? 11 A 9 +ATOM 152 C CB . LYS A1 1 11 ? -22.151 16.544 -17.761 1.0 34.41 ? 11 A 9 +ATOM 153 C CG . LYS A1 1 11 ? -23.425 17.304 -18.09 1.0 63.11 ? 11 A 9 +ATOM 154 C CD . LYS A1 1 11 ? -23.327 18.762 -17.675 1.0 3.15 ? 11 A 9 +ATOM 155 C CE . LYS A1 1 11 ? -22.891 19.643 -18.836 1.0 2.52 ? 11 A 9 +ATOM 156 N NZ . LYS A1 1 11 ? -22.898 21.087 -18.469 1.0 51.12 ? 11 A 9 +ATOM 157 H H . LYS A1 1 11 ? -20.121 14.937 -18.531 1.0 4.15 ? 11 A 9 +ATOM 158 H HA . LYS A1 1 11 ? -22.831 14.537 -17.456 1.0 44.21 ? 11 A 9 +ATOM 159 H HB2 . LYS A1 1 11 ? -21.979 16.615 -16.697 1.0 75.01 ? 11 A 9 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.331 17.016 -18.282 1.0 15.43 ? 11 A 9 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.598 17.254 -19.154 1.0 73.24 ? 11 A 9 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.252 16.845 -17.567 1.0 30.03 ? 11 A 9 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.294 19.095 -17.329 1.0 63.51 ? 11 A 9 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.606 18.852 -16.875 1.0 61.22 ? 11 A 9 +ATOM 165 H HE2 . LYS A1 1 11 ? -21.892 19.36 -19.13 1.0 70.24 ? 11 A 9 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.567 19.487 -19.663 1.0 3.13 ? 11 A 9 +ATOM 167 H HZ1 . LYS A1 1 11 ? -22.82 21.194 -17.438 1.0 1.34 ? 11 A 9 +ATOM 168 H HZ2 . LYS A1 1 11 ? -23.783 21.531 -18.788 1.0 61.44 ? 11 A 9 +ATOM 169 H HZ3 . LYS A1 1 11 ? -22.097 21.574 -18.92 1.0 12.11 ? 11 A 9 +ATOM 170 N N . THR A1 1 12 ? -23.845 14.124 -19.669 1.0 60.33 ? 12 A 9 +ATOM 171 C CA . THR A1 1 12 ? -24.5 13.901 -20.952 1.0 63.11 ? 12 A 9 +ATOM 172 C C . THR A1 1 12 ? -25.306 15.123 -21.377 1.0 63.2 ? 12 A 9 +ATOM 173 O O . THR A1 1 12 ? -25.643 15.975 -20.554 1.0 23.14 ? 12 A 9 +ATOM 174 C CB . THR A1 1 12 ? -25.433 12.677 -20.901 1.0 13.53 ? 12 A 9 +ATOM 175 O OG1 . THR A1 1 12 ? -26.579 12.967 -20.094 1.0 44.22 ? 12 A 9 +ATOM 176 C CG2 . THR A1 1 12 ? -24.705 11.464 -20.34 1.0 44.25 ? 12 A 9 +ATOM 177 H H . THR A1 1 12 ? -24.192 13.674 -18.87 1.0 50.31 ? 12 A 9 +ATOM 178 H HA . THR A1 1 12 ? -23.733 13.713 -21.689 1.0 15.31 ? 12 A 9 +ATOM 179 H HB . THR A1 1 12 ? -25.758 12.449 -21.907 1.0 3.11 ? 12 A 9 +ATOM 180 H HG1 . THR A1 1 12 ? -27.314 12.416 -20.371 1.0 54.01 ? 12 A 9 +ATOM 181 H HG21 . THR A1 1 12 ? -24.326 11.696 -19.357 1.0 54.24 ? 12 A 9 +ATOM 182 H HG22 . THR A1 1 12 ? -23.883 11.205 -20.991 1.0 51.32 ? 12 A 9 +ATOM 183 H HG23 . THR A1 1 12 ? -25.39 10.632 -20.275 1.0 74.05 ? 12 A 9 +ATOM 184 N N . LEU A1 1 13 ? -25.613 15.203 -22.667 1.0 74.21 ? 13 A 9 +ATOM 185 C CA . LEU A1 1 13 ? -26.381 16.322 -23.203 1.0 74.52 ? 13 A 9 +ATOM 186 C C . LEU A1 1 13 ? -27.742 16.423 -22.522 1.0 25.21 ? 13 A 9 +ATOM 187 O O . LEU A1 1 13 ? -28.393 17.468 -22.561 1.0 11.35 ? 13 A 9 +ATOM 188 C CB . LEU A1 1 13 ? -26.564 16.165 -24.713 1.0 31.51 ? 13 A 9 +ATOM 189 C CG . LEU A1 1 13 ? -27.106 17.387 -25.455 1.0 30.32 ? 13 A 9 +ATOM 190 C CD1 . LEU A1 1 13 ? -25.996 18.397 -25.702 1.0 44.31 ? 13 A 9 +ATOM 191 C CD2 . LEU A1 1 13 ? -27.753 16.97 -26.768 1.0 64.01 ? 13 A 9 +ATOM 192 H H . LEU A1 1 13 ? -25.316 14.495 -23.275 1.0 42.02 ? 13 A 9 +ATOM 193 H HA . LEU A1 1 13 ? -25.827 17.228 -23.008 1.0 34.1 ? 13 A 9 +ATOM 194 H HB2 . LEU A1 1 13 ? -25.603 15.919 -25.138 1.0 62.11 ? 13 A 9 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.248 15.345 -24.879 1.0 43.21 ? 13 A 9 +ATOM 196 H HG . LEU A1 1 13 ? -27.861 17.864 -24.845 1.0 45.4 ? 13 A 9 +ATOM 197 H HD11 . LEU A1 1 13 ? -25.894 18.567 -26.763 1.0 62.23 ? 13 A 9 +ATOM 198 H HD12 . LEU A1 1 13 ? -25.066 18.014 -25.308 1.0 23.44 ? 13 A 9 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.239 19.327 -25.209 1.0 25.55 ? 13 A 9 +ATOM 200 H HD21 . LEU A1 1 13 ? -28.784 16.703 -26.592 1.0 62.14 ? 13 A 9 +ATOM 201 H HD22 . LEU A1 1 13 ? -27.224 16.121 -27.175 1.0 41.34 ? 13 A 9 +ATOM 202 H HD23 . LEU A1 1 13 ? -27.708 17.792 -27.468 1.0 51.42 ? 13 A 9 +ATOM 203 N N . THR A1 1 14 ? -28.168 15.33 -21.896 1.0 31.41 ? 14 A 9 +ATOM 204 C CA . THR A1 1 14 ? -29.451 15.295 -21.206 1.0 30.33 ? 14 A 9 +ATOM 205 C C . THR A1 1 14 ? -29.312 15.768 -19.763 1.0 22.13 ? 14 A 9 +ATOM 206 O O . THR A1 1 14 ? -30.262 15.702 -18.984 1.0 5.31 ? 14 A 9 +ATOM 207 C CB . THR A1 1 14 ? -30.055 13.878 -21.214 1.0 34.54 ? 14 A 9 +ATOM 208 O OG1 . THR A1 1 14 ? -29.013 12.901 -21.111 1.0 3.22 ? 14 A 9 +ATOM 209 C CG2 . THR A1 1 14 ? -30.857 13.639 -22.484 1.0 34.11 ? 14 A 9 +ATOM 210 H H . THR A1 1 14 ? -27.604 14.528 -21.901 1.0 2.31 ? 14 A 9 +ATOM 211 H HA . THR A1 1 14 ? -30.128 15.955 -21.728 1.0 25.44 ? 14 A 9 +ATOM 212 H HB . THR A1 1 14 ? -30.715 13.78 -20.364 1.0 55.24 ? 14 A 9 +ATOM 213 H HG1 . THR A1 1 14 ? -28.678 12.696 -21.987 1.0 24.42 ? 14 A 9 +ATOM 214 H HG21 . THR A1 1 14 ? -31.545 12.822 -22.326 1.0 1.02 ? 14 A 9 +ATOM 215 H HG22 . THR A1 1 14 ? -30.186 13.392 -23.293 1.0 12.23 ? 14 A 9 +ATOM 216 H HG23 . THR A1 1 14 ? -31.41 14.532 -22.733 1.0 12.42 ? 14 A 9 +ATOM 217 N N . GLY A1 1 15 ? -28.121 16.245 -19.414 1.0 61.2 ? 15 A 9 +ATOM 218 C CA . GLY A1 1 15 ? -27.881 16.723 -18.065 1.0 25.44 ? 15 A 9 +ATOM 219 C C . GLY A1 1 15 ? -27.848 15.598 -17.049 1.0 2.34 ? 15 A 9 +ATOM 220 O O . GLY A1 1 15 ? -28.591 15.616 -16.067 1.0 24.03 ? 15 A 9 +ATOM 221 H H . GLY A1 1 15 ? -27.4 16.273 -20.077 1.0 73.22 ? 15 A 9 +ATOM 222 H HA2 . GLY A1 1 15 ? -26.934 17.242 -18.042 1.0 10.15 ? 15 A 9 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.666 17.413 -17.794 1.0 23.53 ? 15 A 9 +ATOM 224 N N . LYS A1 1 16 ? -26.985 14.616 -17.284 1.0 11.21 ? 16 A 9 +ATOM 225 C CA . LYS A1 1 16 ? -26.858 13.477 -16.383 1.0 34.13 ? 16 A 9 +ATOM 226 C C . LYS A1 1 16 ? -25.413 13.304 -15.925 1.0 15.24 ? 16 A 9 +ATOM 227 O O . LYS A1 1 16 ? -24.503 13.169 -16.743 1.0 50.04 ? 16 A 9 +ATOM 228 C CB . LYS A1 1 16 ? -27.342 12.198 -17.071 1.0 31.42 ? 16 A 9 +ATOM 229 C CG . LYS A1 1 16 ? -27.943 11.183 -16.115 1.0 73.35 ? 16 A 9 +ATOM 230 C CD . LYS A1 1 16 ? -26.898 10.195 -15.622 1.0 50.3 ? 16 A 9 +ATOM 231 C CE . LYS A1 1 16 ? -26.419 9.285 -16.742 1.0 52.44 ? 16 A 9 +ATOM 232 N NZ . LYS A1 1 16 ? -26.906 7.888 -16.568 1.0 2.53 ? 16 A 9 +ATOM 233 H H . LYS A1 1 16 ? -26.419 14.658 -18.084 1.0 52.54 ? 16 A 9 +ATOM 234 H HA . LYS A1 1 16 ? -27.476 13.666 -15.519 1.0 34.34 ? 16 A 9 +ATOM 235 H HB2 . LYS A1 1 16 ? -28.091 12.46 -17.803 1.0 44.24 ? 16 A 9 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.505 11.736 -17.575 1.0 12.13 ? 16 A 9 +ATOM 237 H HG2 . LYS A1 1 16 ? -28.359 11.704 -15.265 1.0 3.41 ? 16 A 9 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.725 10.64 -16.626 1.0 74.14 ? 16 A 9 +ATOM 239 H HD2 . LYS A1 1 16 ? -26.053 10.743 -15.232 1.0 63.23 ? 16 A 9 +ATOM 240 H HD3 . LYS A1 1 16 ? -27.33 9.59 -14.837 1.0 14.51 ? 16 A 9 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.784 9.669 -17.682 1.0 44.12 ? 16 A 9 +ATOM 242 H HE3 . LYS A1 1 16 ? -25.339 9.283 -16.749 1.0 75.31 ? 16 A 9 +ATOM 243 H HZ1 . LYS A1 1 16 ? -27.943 7.86 -16.634 1.0 61.55 ? 16 A 9 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.618 7.523 -15.638 1.0 23.15 ? 16 A 9 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.505 7.276 -17.307 1.0 43.23 ? 16 A 9 +ATOM 246 N N . THR A1 1 17 ? -25.208 13.308 -14.611 1.0 33.03 ? 17 A 9 +ATOM 247 C CA . THR A1 1 17 ? -23.875 13.152 -14.045 1.0 61.21 ? 17 A 9 +ATOM 248 C C . THR A1 1 17 ? -23.551 11.683 -13.798 1.0 13.11 ? 17 A 9 +ATOM 249 O O . THR A1 1 17 ? -24.229 11.01 -13.021 1.0 32.24 ? 17 A 9 +ATOM 250 C CB . THR A1 1 17 ? -23.732 13.927 -12.721 1.0 22.54 ? 17 A 9 +ATOM 251 O OG1 . THR A1 1 17 ? -24.999 13.997 -12.056 1.0 24.32 ? 17 A 9 +ATOM 252 C CG2 . THR A1 1 17 ? -23.205 15.332 -12.97 1.0 72.42 ? 17 A 9 +ATOM 253 H H . THR A1 1 17 ? -25.974 13.42 -14.01 1.0 63.53 ? 17 A 9 +ATOM 254 H HA . THR A1 1 17 ? -23.163 13.554 -14.751 1.0 15.15 ? 17 A 9 +ATOM 255 H HB . THR A1 1 17 ? -23.031 13.402 -12.088 1.0 61.22 ? 17 A 9 +ATOM 256 H HG1 . THR A1 1 17 ? -25.26 13.119 -11.77 1.0 54.0 ? 17 A 9 +ATOM 257 H HG21 . THR A1 1 17 ? -23.993 16.048 -12.792 1.0 31.34 ? 17 A 9 +ATOM 258 H HG22 . THR A1 1 17 ? -22.869 15.414 -13.993 1.0 12.24 ? 17 A 9 +ATOM 259 H HG23 . THR A1 1 17 ? -22.381 15.53 -12.302 1.0 74.01 ? 17 A 9 +ATOM 260 N N . ILE A1 1 18 ? -22.511 11.192 -14.463 1.0 21.15 ? 18 A 9 +ATOM 261 C CA . ILE A1 1 18 ? -22.097 9.802 -14.314 1.0 42.23 ? 18 A 9 +ATOM 262 C C . ILE A1 1 18 ? -20.642 9.707 -13.866 1.0 2.02 ? 18 A 9 +ATOM 263 O O . ILE A1 1 18 ? -19.798 10.499 -14.286 1.0 34.24 ? 18 A 9 +ATOM 264 C CB . ILE A1 1 18 ? -22.269 9.019 -15.629 1.0 20.13 ? 18 A 9 +ATOM 265 C CG1 . ILE A1 1 18 ? -21.58 7.656 -15.53 1.0 0.43 ? 18 A 9 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.711 9.817 -16.798 1.0 34.34 ? 18 A 9 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.881 6.741 -16.697 1.0 41.12 ? 18 A 9 +ATOM 268 H H . ILE A1 1 18 ? -22.01 11.777 -15.068 1.0 72.35 ? 18 A 9 +ATOM 269 H HA . ILE A1 1 18 ? -22.724 9.346 -13.562 1.0 33.1 ? 18 A 9 +ATOM 270 H HB . ILE A1 1 18 ? -23.324 8.87 -15.797 1.0 55.23 ? 18 A 9 +ATOM 271 H HG12 . ILE A1 1 18 ? -20.512 7.801 -15.49 1.0 35.45 ? 18 A 9 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.906 7.161 -14.627 1.0 15.51 ? 18 A 9 +ATOM 273 H HG21 . ILE A1 1 18 ? -20.76 10.247 -16.519 1.0 31.24 ? 18 A 9 +ATOM 274 H HG22 . ILE A1 1 18 ? -21.575 9.164 -17.646 1.0 60.32 ? 18 A 9 +ATOM 275 H HG23 . ILE A1 1 18 ? -22.4 10.606 -17.057 1.0 71.44 ? 18 A 9 +ATOM 276 H HD11 . ILE A1 1 18 ? -22.314 7.317 -17.503 1.0 32.31 ? 18 A 9 +ATOM 277 H HD12 . ILE A1 1 18 ? -20.966 6.279 -17.037 1.0 60.24 ? 18 A 9 +ATOM 278 H HD13 . ILE A1 1 18 ? -22.577 5.978 -16.386 1.0 25.35 ? 18 A 9 +ATOM 279 N N . THR A1 1 19 ? -20.355 8.731 -13.009 1.0 42.32 ? 19 A 9 +ATOM 280 C CA . THR A1 1 19 ? -19.003 8.532 -12.504 1.0 41.24 ? 19 A 9 +ATOM 281 C C . THR A1 1 19 ? -18.421 7.211 -12.997 1.0 70.21 ? 19 A 9 +ATOM 282 O O . THR A1 1 19 ? -19.111 6.192 -13.029 1.0 44.42 ? 19 A 9 +ATOM 283 C CB . THR A1 1 19 ? -18.97 8.551 -10.964 1.0 2.4 ? 19 A 9 +ATOM 284 O OG1 . THR A1 1 19 ? -20.155 9.174 -10.457 1.0 22.32 ? 19 A 9 +ATOM 285 C CG2 . THR A1 1 19 ? -17.744 9.296 -10.459 1.0 13.14 ? 19 A 9 +ATOM 286 H H . THR A1 1 19 ? -21.071 8.133 -12.711 1.0 1.15 ? 19 A 9 +ATOM 287 H HA . THR A1 1 19 ? -18.388 9.343 -12.867 1.0 65.43 ? 19 A 9 +ATOM 288 H HB . THR A1 1 19 ? -18.926 7.532 -10.607 1.0 44.24 ? 19 A 9 +ATOM 289 H HG1 . THR A1 1 19 ? -20.63 8.552 -9.899 1.0 60.25 ? 19 A 9 +ATOM 290 H HG21 . THR A1 1 19 ? -18.054 10.104 -9.813 1.0 73.33 ? 19 A 9 +ATOM 291 H HG22 . THR A1 1 19 ? -17.195 9.697 -11.298 1.0 23.45 ? 19 A 9 +ATOM 292 H HG23 . THR A1 1 19 ? -17.112 8.616 -9.906 1.0 51.03 ? 19 A 9 +ATOM 293 N N . ILE A1 1 20 ? -17.149 7.237 -13.379 1.0 2.13 ? 20 A 9 +ATOM 294 C CA . ILE A1 1 20 ? -16.475 6.041 -13.868 1.0 23.24 ? 20 A 9 +ATOM 295 C C . ILE A1 1 20 ? -15.025 5.995 -13.396 1.0 21.51 ? 20 A 9 +ATOM 296 O O . ILE A1 1 20 ? -14.295 6.98 -13.504 1.0 3.54 ? 20 A 9 +ATOM 297 C CB . ILE A1 1 20 ? -16.505 5.967 -15.406 1.0 55.55 ? 20 A 9 +ATOM 298 C CG1 . ILE A1 1 20 ? -16.397 7.369 -16.008 1.0 1.5 ? 20 A 9 +ATOM 299 C CG2 . ILE A1 1 20 ? -17.776 5.277 -15.878 1.0 1.32 ? 20 A 9 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.649 7.407 -17.322 1.0 2.4 ? 20 A 9 +ATOM 301 H H . ILE A1 1 20 ? -16.651 8.079 -13.33 1.0 32.52 ? 20 A 9 +ATOM 302 H HA . ILE A1 1 20 ? -16.997 5.18 -13.476 1.0 40.32 ? 20 A 9 +ATOM 303 H HB . ILE A1 1 20 ? -15.662 5.377 -15.732 1.0 75.22 ? 20 A 9 +ATOM 304 H HG12 . ILE A1 1 20 ? -17.389 7.757 -16.181 1.0 4.24 ? 20 A 9 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.88 8.013 -15.311 1.0 20.02 ? 20 A 9 +ATOM 306 H HG21 . ILE A1 1 20 ? -18.088 4.553 -15.141 1.0 41.11 ? 20 A 9 +ATOM 307 H HG22 . ILE A1 1 20 ? -18.555 6.012 -16.012 1.0 51.34 ? 20 A 9 +ATOM 308 H HG23 . ILE A1 1 20 ? -17.588 4.778 -16.817 1.0 74.34 ? 20 A 9 +ATOM 309 H HD11 . ILE A1 1 20 ? -16.002 8.24 -17.913 1.0 44.23 ? 20 A 9 +ATOM 310 H HD12 . ILE A1 1 20 ? -14.592 7.525 -17.131 1.0 43.31 ? 20 A 9 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.818 6.487 -17.86 1.0 23.14 ? 20 A 9 +ATOM 312 N N . ASP A1 1 21 ? -14.615 4.844 -12.875 1.0 44.41 ? 21 A 9 +ATOM 313 C CA . ASP A1 1 21 ? -13.251 4.667 -12.389 1.0 13.43 ? 21 A 9 +ATOM 314 C C . ASP A1 1 21 ? -12.304 4.337 -13.538 1.0 74.52 ? 21 A 9 +ATOM 315 O O . ASP A1 1 21 ? -12.501 3.358 -14.258 1.0 3.25 ? 21 A 9 +ATOM 316 C CB . ASP A1 1 21 ? -13.202 3.559 -11.336 1.0 40.32 ? 21 A 9 +ATOM 317 C CG . ASP A1 1 21 ? -13.876 2.285 -11.804 1.0 70.32 ? 21 A 9 +ATOM 318 O OD1 . ASP A1 1 21 ? -15.124 2.251 -11.836 1.0 34.41 ? 21 A 9 +ATOM 319 O OD2 . ASP A1 1 21 ? -13.156 1.32 -12.138 1.0 4.34 ? 21 A 9 +ATOM 320 H H . ASP A1 1 21 ? -15.244 4.094 -12.816 1.0 61.24 ? 21 A 9 +ATOM 321 H HA . ASP A1 1 21 ? -12.938 5.596 -11.936 1.0 0.1 ? 21 A 9 +ATOM 322 H HB2 . ASP A1 1 21 ? -12.17 3.335 -11.106 1.0 73.15 ? 21 A 9 +ATOM 323 H HB3 . ASP A1 1 21 ? -13.699 3.901 -10.44 1.0 61.23 ? 21 A 9 +ATOM 324 N N . VAL A1 1 22 ? -11.274 5.161 -13.704 1.0 30.34 ? 22 A 9 +ATOM 325 C CA . VAL A1 1 22 ? -10.295 4.956 -14.765 1.0 1.34 ? 22 A 9 +ATOM 326 C C . VAL A1 1 22 ? -8.875 5.172 -14.253 1.0 61.2 ? 22 A 9 +ATOM 327 O O . VAL A1 1 22 ? -8.671 5.76 -13.19 1.0 34.03 ? 22 A 9 +ATOM 328 C CB . VAL A1 1 22 ? -10.549 5.903 -15.953 1.0 60.13 ? 22 A 9 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.998 6.367 -15.966 1.0 14.0 ? 22 A 9 +ATOM 330 C CG2 . VAL A1 1 22 ? -9.601 7.091 -15.9 1.0 61.12 ? 22 A 9 +ATOM 331 H H . VAL A1 1 22 ? -11.169 5.924 -13.098 1.0 71.0 ? 22 A 9 +ATOM 332 H HA . VAL A1 1 22 ? -10.39 3.939 -15.116 1.0 41.13 ? 22 A 9 +ATOM 333 H HB . VAL A1 1 22 ? -10.36 5.36 -16.867 1.0 23.42 ? 22 A 9 +ATOM 334 H HG11 . VAL A1 1 22 ? -12.2 6.888 -16.89 1.0 3.13 ? 22 A 9 +ATOM 335 H HG12 . VAL A1 1 22 ? -12.651 5.51 -15.884 1.0 11.12 ? 22 A 9 +ATOM 336 H HG13 . VAL A1 1 22 ? -12.17 7.032 -15.133 1.0 2.3 ? 22 A 9 +ATOM 337 H HG21 . VAL A1 1 22 ? -9.569 7.482 -14.893 1.0 43.3 ? 22 A 9 +ATOM 338 H HG22 . VAL A1 1 22 ? -8.612 6.775 -16.196 1.0 71.52 ? 22 A 9 +ATOM 339 H HG23 . VAL A1 1 22 ? -9.949 7.861 -16.573 1.0 24.41 ? 22 A 9 +ATOM 340 N N . ASP A1 1 23 ? -7.898 4.693 -15.015 1.0 73.14 ? 23 A 9 +ATOM 341 C CA . ASP A1 1 23 ? -6.496 4.835 -14.639 1.0 0.33 ? 23 A 9 +ATOM 342 C C . ASP A1 1 23 ? -5.765 5.759 -15.607 1.0 62.12 ? 23 A 9 +ATOM 343 O O . ASP A1 1 23 ? -6.136 5.87 -16.776 1.0 35.34 ? 23 A 9 +ATOM 344 C CB . ASP A1 1 23 ? -5.814 3.466 -14.606 1.0 24.44 ? 23 A 9 +ATOM 345 C CG . ASP A1 1 23 ? -4.96 3.274 -13.369 1.0 11.25 ? 23 A 9 +ATOM 346 O OD1 . ASP A1 1 23 ? -4.352 4.263 -12.908 1.0 71.52 ? 23 A 9 +ATOM 347 O OD2 . ASP A1 1 23 ? -4.899 2.135 -12.861 1.0 54.12 ? 23 A 9 +ATOM 348 H H . ASP A1 1 23 ? -8.125 4.234 -15.85 1.0 71.31 ? 23 A 9 +ATOM 349 H HA . ASP A1 1 23 ? -6.46 5.268 -13.651 1.0 62.03 ? 23 A 9 +ATOM 350 H HB2 . ASP A1 1 23 ? -6.57 2.694 -14.623 1.0 75.32 ? 23 A 9 +ATOM 351 H HB3 . ASP A1 1 23 ? -5.183 3.365 -15.477 1.0 32.1 ? 23 A 9 +ATOM 352 N N . HIS A1 1 24 ? -4.724 6.422 -15.112 1.0 3.42 ? 24 A 9 +ATOM 353 C CA . HIS A1 1 24 ? -3.94 7.338 -15.934 1.0 64.1 ? 24 A 9 +ATOM 354 C C . HIS A1 1 24 ? -3.298 6.602 -17.106 1.0 13.22 ? 24 A 9 +ATOM 355 O O . HIS A1 1 24 ? -2.84 7.222 -18.065 1.0 40.32 ? 24 A 9 +ATOM 356 C CB . HIS A1 1 24 ? -2.861 8.017 -15.09 1.0 43.52 ? 24 A 9 +ATOM 357 C CG . HIS A1 1 24 ? -1.968 7.053 -14.371 1.0 63.23 ? 24 A 9 +ATOM 358 N ND1 . HIS A1 1 24 ? -1.013 6.291 -15.01 1.0 33.23 ? 24 A 9 +ATOM 359 C CD2 . HIS A1 1 24 ? -1.888 6.73 -13.059 1.0 70.35 ? 24 A 9 +ATOM 360 C CE1 . HIS A1 1 24 ? -0.385 5.541 -14.123 1.0 52.22 ? 24 A 9 +ATOM 361 N NE2 . HIS A1 1 24 ? -0.897 5.788 -12.931 1.0 51.1 ? 24 A 9 +ATOM 362 H H . HIS A1 1 24 ? -4.477 6.292 -14.173 1.0 35.01 ? 24 A 9 +ATOM 363 H HA . HIS A1 1 24 ? -4.609 8.091 -16.321 1.0 52.33 ? 24 A 9 +ATOM 364 H HB2 . HIS A1 1 24 ? -2.242 8.626 -15.732 1.0 74.33 ? 24 A 9 +ATOM 365 H HB3 . HIS A1 1 24 ? -3.334 8.647 -14.351 1.0 2.24 ? 24 A 9 +ATOM 366 H HD1 . HIS A1 1 24 ? -0.824 6.299 -15.972 1.0 61.24 ? 24 A 9 +ATOM 367 H HD2 . HIS A1 1 24 ? -2.492 7.137 -12.26 1.0 14.35 ? 24 A 9 +ATOM 368 H HE1 . HIS A1 1 24 ? 0.411 4.843 -14.335 1.0 73.24 ? 24 A 9 +ATOM 369 N N . ALA A1 1 25 ? -3.269 5.276 -17.022 1.0 63.43 ? 25 A 9 +ATOM 370 C CA . ALA A1 1 25 ? -2.685 4.456 -18.076 1.0 43.32 ? 25 A 9 +ATOM 371 C C . ALA A1 1 25 ? -3.71 4.144 -19.16 1.0 33.54 ? 25 A 9 +ATOM 372 O O . ALA A1 1 25 ? -3.447 3.354 -20.068 1.0 12.23 ? 25 A 9 +ATOM 373 C CB . ALA A1 1 25 ? -2.122 3.168 -17.492 1.0 51.34 ? 25 A 9 +ATOM 374 H H . ALA A1 1 25 ? -3.651 4.839 -16.232 1.0 55.41 ? 25 A 9 +ATOM 375 H HA . ALA A1 1 25 ? -1.868 5.01 -18.515 1.0 23.12 ? 25 A 9 +ATOM 376 H HB1 . ALA A1 1 25 ? -2.882 2.681 -16.899 1.0 42.21 ? 25 A 9 +ATOM 377 H HB2 . ALA A1 1 25 ? -1.815 2.514 -18.294 1.0 3.14 ? 25 A 9 +ATOM 378 H HB3 . ALA A1 1 25 ? -1.271 3.398 -16.868 1.0 44.44 ? 25 A 9 +ATOM 379 N N . ASP A1 1 26 ? -4.878 4.768 -19.061 1.0 53.31 ? 26 A 9 +ATOM 380 C CA . ASP A1 1 26 ? -5.944 4.556 -20.034 1.0 71.32 ? 26 A 9 +ATOM 381 C C . ASP A1 1 26 ? -6.008 5.711 -21.028 1.0 31.24 ? 26 A 9 +ATOM 382 O O . ASP A1 1 26 ? -5.091 6.53 -21.107 1.0 53.43 ? 26 A 9 +ATOM 383 C CB . ASP A1 1 26 ? -7.29 4.403 -19.324 1.0 21.1 ? 26 A 9 +ATOM 384 C CG . ASP A1 1 26 ? -7.249 3.359 -18.225 1.0 73.54 ? 26 A 9 +ATOM 385 O OD1 . ASP A1 1 26 ? -6.278 2.575 -18.189 1.0 73.22 ? 26 A 9 +ATOM 386 O OD2 . ASP A1 1 26 ? -8.188 3.326 -17.403 1.0 2.02 ? 26 A 9 +ATOM 387 H H . ASP A1 1 26 ? -5.028 5.386 -18.315 1.0 73.33 ? 26 A 9 +ATOM 388 H HA . ASP A1 1 26 ? -5.725 3.646 -20.572 1.0 35.3 ? 26 A 9 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.567 5.35 -18.884 1.0 71.15 ? 26 A 9 +ATOM 390 H HB3 . ASP A1 1 26 ? -8.039 4.112 -20.045 1.0 51.4 ? 26 A 9 +ATOM 391 N N . THR A1 1 27 ? -7.097 5.772 -21.788 1.0 11.22 ? 27 A 9 +ATOM 392 C CA . THR A1 1 27 ? -7.28 6.824 -22.779 1.0 12.11 ? 27 A 9 +ATOM 393 C C . THR A1 1 27 ? -8.753 7.187 -22.93 1.0 24.55 ? 27 A 9 +ATOM 394 O O . THR A1 1 27 ? -9.63 6.494 -22.414 1.0 14.34 ? 27 A 9 +ATOM 395 C CB . THR A1 1 27 ? -6.723 6.406 -24.153 1.0 24.42 ? 27 A 9 +ATOM 396 O OG1 . THR A1 1 27 ? -6.719 4.978 -24.266 1.0 51.41 ? 27 A 9 +ATOM 397 C CG2 . THR A1 1 27 ? -5.312 6.939 -24.35 1.0 72.22 ? 27 A 9 +ATOM 398 H H . THR A1 1 27 ? -7.793 5.091 -21.679 1.0 1.33 ? 27 A 9 +ATOM 399 H HA . THR A1 1 27 ? -6.737 7.696 -22.444 1.0 54.42 ? 27 A 9 +ATOM 400 H HB . THR A1 1 27 ? -7.359 6.818 -24.923 1.0 51.23 ? 27 A 9 +ATOM 401 H HG1 . THR A1 1 27 ? -5.901 4.631 -23.902 1.0 23.44 ? 27 A 9 +ATOM 402 H HG21 . THR A1 1 27 ? -4.926 6.594 -25.297 1.0 20.21 ? 27 A 9 +ATOM 403 H HG22 . THR A1 1 27 ? -4.678 6.583 -23.551 1.0 40.31 ? 27 A 9 +ATOM 404 H HG23 . THR A1 1 27 ? -5.331 8.019 -24.341 1.0 53.14 ? 27 A 9 +ATOM 405 N N . VAL A1 1 28 ? -9.019 8.278 -23.641 1.0 70.04 ? 28 A 9 +ATOM 406 C CA . VAL A1 1 28 ? -10.387 8.732 -23.862 1.0 40.12 ? 28 A 9 +ATOM 407 C C . VAL A1 1 28 ? -11.216 7.661 -24.562 1.0 43.3 ? 28 A 9 +ATOM 408 O O . VAL A1 1 28 ? -12.326 7.343 -24.137 1.0 51.44 ? 28 A 9 +ATOM 409 C CB . VAL A1 1 28 ? -10.422 10.022 -24.702 1.0 70.14 ? 28 A 9 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.809 10.645 -24.669 1.0 13.41 ? 28 A 9 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.374 11.008 -24.208 1.0 73.55 ? 28 A 9 +ATOM 412 H H . VAL A1 1 28 ? -8.278 8.79 -24.028 1.0 50.23 ? 28 A 9 +ATOM 413 H HA . VAL A1 1 28 ? -10.829 8.943 -22.899 1.0 62.42 ? 28 A 9 +ATOM 414 H HB . VAL A1 1 28 ? -10.191 9.768 -25.726 1.0 52.41 ? 28 A 9 +ATOM 415 H HG11 . VAL A1 1 28 ? -11.879 11.408 -25.43 1.0 72.32 ? 28 A 9 +ATOM 416 H HG12 . VAL A1 1 28 ? -12.551 9.882 -24.853 1.0 75.12 ? 28 A 9 +ATOM 417 H HG13 . VAL A1 1 28 ? -11.982 11.088 -23.699 1.0 43.12 ? 28 A 9 +ATOM 418 H HG21 . VAL A1 1 28 ? -9.862 11.9 -23.844 1.0 22.23 ? 28 A 9 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.805 10.557 -23.409 1.0 21.24 ? 28 A 9 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.711 11.267 -25.02 1.0 51.43 ? 28 A 9 +ATOM 421 N N . GLY A1 1 29 ? -10.667 7.105 -25.638 1.0 51.02 ? 29 A 9 +ATOM 422 C CA . GLY A1 1 29 ? -11.369 6.074 -26.38 1.0 24.21 ? 29 A 9 +ATOM 423 C C . GLY A1 1 29 ? -11.912 4.981 -25.482 1.0 62.32 ? 29 A 9 +ATOM 424 O O . GLY A1 1 29 ? -13.092 4.639 -25.552 1.0 1.41 ? 29 A 9 +ATOM 425 H H . GLY A1 1 29 ? -9.779 7.398 -25.931 1.0 25.44 ? 29 A 9 +ATOM 426 H HA2 . GLY A1 1 29 ? -12.191 6.527 -26.915 1.0 33.14 ? 29 A 9 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.688 5.633 -27.093 1.0 61.11 ? 29 A 9 +ATOM 428 N N . ALA A1 1 30 ? -11.048 4.429 -24.636 1.0 0.3 ? 30 A 9 +ATOM 429 C CA . ALA A1 1 30 ? -11.447 3.368 -23.72 1.0 24.42 ? 30 A 9 +ATOM 430 C C . ALA A1 1 30 ? -12.554 3.839 -22.783 1.0 23.15 ? 30 A 9 +ATOM 431 O O . ALA A1 1 30 ? -13.501 3.104 -22.505 1.0 23.32 ? 30 A 9 +ATOM 432 C CB . ALA A1 1 30 ? -10.247 2.882 -22.92 1.0 4.23 ? 30 A 9 +ATOM 433 H H . ALA A1 1 30 ? -10.12 4.744 -24.627 1.0 13.0 ? 30 A 9 +ATOM 434 H HA . ALA A1 1 30 ? -11.816 2.54 -24.308 1.0 42.35 ? 30 A 9 +ATOM 435 H HB1 . ALA A1 1 30 ? -10.209 1.803 -22.95 1.0 24.3 ? 30 A 9 +ATOM 436 H HB2 . ALA A1 1 30 ? -9.342 3.287 -23.347 1.0 15.25 ? 30 A 9 +ATOM 437 H HB3 . ALA A1 1 30 ? -10.341 3.211 -21.895 1.0 54.13 ? 30 A 9 +ATOM 438 N N . VAL A1 1 31 ? -12.429 5.071 -22.298 1.0 44.02 ? 31 A 9 +ATOM 439 C CA . VAL A1 1 31 ? -13.419 5.64 -21.392 1.0 44.43 ? 31 A 9 +ATOM 440 C C . VAL A1 1 31 ? -14.786 5.735 -22.062 1.0 22.33 ? 31 A 9 +ATOM 441 O O . VAL A1 1 31 ? -15.81 5.427 -21.453 1.0 41.34 ? 31 A 9 +ATOM 442 C CB . VAL A1 1 31 ? -12.998 7.041 -20.909 1.0 42.01 ? 31 A 9 +ATOM 443 C CG1 . VAL A1 1 31 ? -14.101 7.671 -20.072 1.0 61.22 ? 31 A 9 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.698 6.964 -20.123 1.0 34.2 ? 31 A 9 +ATOM 445 H H . VAL A1 1 31 ? -11.652 5.609 -22.556 1.0 33.11 ? 31 A 9 +ATOM 446 H HA . VAL A1 1 31 ? -13.495 4.993 -20.531 1.0 53.53 ? 31 A 9 +ATOM 447 H HB . VAL A1 1 31 ? -12.834 7.664 -21.776 1.0 34.14 ? 31 A 9 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.662 8.365 -20.681 1.0 24.43 ? 31 A 9 +ATOM 449 H HG12 . VAL A1 1 31 ? -14.759 6.899 -19.703 1.0 62.24 ? 31 A 9 +ATOM 450 H HG13 . VAL A1 1 31 ? -13.662 8.199 -19.238 1.0 4.44 ? 31 A 9 +ATOM 451 H HG21 . VAL A1 1 31 ? -10.895 7.381 -20.713 1.0 32.4 ? 31 A 9 +ATOM 452 H HG22 . VAL A1 1 31 ? -11.799 7.525 -19.206 1.0 31.51 ? 31 A 9 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.477 5.932 -19.892 1.0 2.41 ? 31 A 9 +ATOM 454 N N . LYS A1 1 32 ? -14.794 6.163 -23.319 1.0 44.33 ? 32 A 9 +ATOM 455 C CA . LYS A1 1 32 ? -16.034 6.298 -24.074 1.0 33.41 ? 32 A 9 +ATOM 456 C C . LYS A1 1 32 ? -16.802 4.98 -24.098 1.0 33.52 ? 32 A 9 +ATOM 457 O O . LYS A1 1 32 ? -18.023 4.96 -23.946 1.0 55.22 ? 32 A 9 +ATOM 458 C CB . LYS A1 1 32 ? -15.737 6.753 -25.505 1.0 21.43 ? 32 A 9 +ATOM 459 C CG . LYS A1 1 32 ? -16.306 8.121 -25.839 1.0 62.04 ? 32 A 9 +ATOM 460 C CD . LYS A1 1 32 ? -15.228 9.192 -25.826 1.0 13.3 ? 32 A 9 +ATOM 461 C CE . LYS A1 1 32 ? -14.681 9.449 -27.221 1.0 61.02 ? 32 A 9 +ATOM 462 N NZ . LYS A1 1 32 ? -14.291 8.185 -27.906 1.0 10.13 ? 32 A 9 +ATOM 463 H H . LYS A1 1 32 ? -13.944 6.394 -23.751 1.0 0.43 ? 32 A 9 +ATOM 464 H HA . LYS A1 1 32 ? -16.64 7.046 -23.586 1.0 20.21 ? 32 A 9 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.667 6.787 -25.644 1.0 31.13 ? 32 A 9 +ATOM 466 H HB3 . LYS A1 1 32 ? -16.158 6.033 -26.193 1.0 51.43 ? 32 A 9 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.751 8.085 -26.822 1.0 34.55 ? 32 A 9 +ATOM 468 H HG3 . LYS A1 1 32 ? -17.062 8.374 -25.109 1.0 75.31 ? 32 A 9 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.649 10.109 -25.442 1.0 62.53 ? 32 A 9 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.42 8.868 -25.185 1.0 34.24 ? 32 A 9 +ATOM 471 H HE2 . LYS A1 1 32 ? -15.441 9.944 -27.806 1.0 32.35 ? 32 A 9 +ATOM 472 H HE3 . LYS A1 1 32 ? -13.814 10.088 -27.142 1.0 31.14 ? 32 A 9 +ATOM 473 H HZ1 . LYS A1 1 32 ? -15.132 7.713 -28.293 1.0 3.34 ? 32 A 9 +ATOM 474 H HZ2 . LYS A1 1 32 ? -13.825 7.544 -27.232 1.0 11.13 ? 32 A 9 +ATOM 475 H HZ3 . LYS A1 1 32 ? -13.632 8.389 -28.684 1.0 13.55 ? 32 A 9 +ATOM 476 N N . ALA A1 1 33 ? -16.078 3.882 -24.287 1.0 34.21 ? 33 A 9 +ATOM 477 C CA . ALA A1 1 33 ? -16.692 2.56 -24.326 1.0 60.31 ? 33 A 9 +ATOM 478 C C . ALA A1 1 33 ? -17.324 2.208 -22.984 1.0 31.03 ? 33 A 9 +ATOM 479 O O . ALA A1 1 33 ? -18.411 1.634 -22.929 1.0 31.32 ? 33 A 9 +ATOM 480 C CB . ALA A1 1 33 ? -15.662 1.511 -24.718 1.0 54.24 ? 33 A 9 +ATOM 481 H H . ALA A1 1 33 ? -15.109 3.962 -24.402 1.0 43.1 ? 33 A 9 +ATOM 482 H HA . ALA A1 1 33 ? -17.463 2.573 -25.083 1.0 53.01 ? 33 A 9 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.745 1.688 -24.176 1.0 2.33 ? 33 A 9 +ATOM 484 H HB2 . ALA A1 1 33 ? -16.039 0.529 -24.478 1.0 61.23 ? 33 A 9 +ATOM 485 H HB3 . ALA A1 1 33 ? -15.471 1.574 -25.779 1.0 53.23 ? 33 A 9 +ATOM 486 N N . LYS A1 1 34 ? -16.635 2.555 -21.902 1.0 30.14 ? 34 A 9 +ATOM 487 C CA . LYS A1 1 34 ? -17.128 2.277 -20.558 1.0 3.41 ? 34 A 9 +ATOM 488 C C . LYS A1 1 34 ? -18.467 2.966 -20.316 1.0 51.04 ? 34 A 9 +ATOM 489 O O . LYS A1 1 34 ? -19.396 2.366 -19.776 1.0 30.3 ? 34 A 9 +ATOM 490 C CB . LYS A1 1 34 ? -16.109 2.737 -19.513 1.0 63.02 ? 34 A 9 +ATOM 491 C CG . LYS A1 1 34 ? -16.517 2.422 -18.085 1.0 24.43 ? 34 A 9 +ATOM 492 C CD . LYS A1 1 34 ? -16.54 0.924 -17.829 1.0 44.42 ? 34 A 9 +ATOM 493 C CE . LYS A1 1 34 ? -15.146 0.322 -17.918 1.0 34.12 ? 34 A 9 +ATOM 494 N NZ . LYS A1 1 34 ? -14.183 1.02 -17.022 1.0 13.0 ? 34 A 9 +ATOM 495 H H . LYS A1 1 34 ? -15.773 3.011 -22.01 1.0 65.25 ? 34 A 9 +ATOM 496 H HA . LYS A1 1 34 ? -17.265 1.21 -20.47 1.0 3.22 ? 34 A 9 +ATOM 497 H HB2 . LYS A1 1 34 ? -15.164 2.252 -19.711 1.0 71.03 ? 34 A 9 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.979 3.806 -19.601 1.0 71.12 ? 34 A 9 +ATOM 499 H HG2 . LYS A1 1 34 ? -15.812 2.881 -17.408 1.0 24.23 ? 34 A 9 +ATOM 500 H HG3 . LYS A1 1 34 ? -17.505 2.823 -17.906 1.0 22.21 ? 34 A 9 +ATOM 501 H HD2 . LYS A1 1 34 ? -16.936 0.742 -16.841 1.0 63.43 ? 34 A 9 +ATOM 502 H HD3 . LYS A1 1 34 ? -17.174 0.451 -18.566 1.0 75.33 ? 34 A 9 +ATOM 503 H HE2 . LYS A1 1 34 ? -15.198 -0.718 -17.635 1.0 34.14 ? 34 A 9 +ATOM 504 H HE3 . LYS A1 1 34 ? -14.798 0.401 -18.937 1.0 0.12 ? 34 A 9 +ATOM 505 H HZ1 . LYS A1 1 34 ? -13.835 1.888 -17.477 1.0 62.42 ? 34 A 9 +ATOM 506 H HZ2 . LYS A1 1 34 ? -13.373 0.401 -16.817 1.0 14.2 ? 34 A 9 +ATOM 507 H HZ3 . LYS A1 1 34 ? -14.646 1.273 -16.126 1.0 65.2 ? 34 A 9 +ATOM 508 N N . ILE A1 1 35 ? -18.558 4.229 -20.72 1.0 14.42 ? 35 A 9 +ATOM 509 C CA . ILE A1 1 35 ? -19.785 4.998 -20.549 1.0 22.32 ? 35 A 9 +ATOM 510 C C . ILE A1 1 35 ? -20.916 4.425 -21.396 1.0 74.31 ? 35 A 9 +ATOM 511 O O . ILE A1 1 35 ? -22.075 4.419 -20.981 1.0 33.23 ? 35 A 9 +ATOM 512 C CB . ILE A1 1 35 ? -19.578 6.478 -20.922 1.0 42.5 ? 35 A 9 +ATOM 513 C CG1 . ILE A1 1 35 ? -18.407 7.067 -20.133 1.0 22.04 ? 35 A 9 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.85 7.272 -20.665 1.0 45.14 ? 35 A 9 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.563 6.937 -18.634 1.0 11.1 ? 35 A 9 +ATOM 516 H H . ILE A1 1 35 ? -17.783 4.653 -21.144 1.0 54.44 ? 35 A 9 +ATOM 517 H HA . ILE A1 1 35 ? -20.068 4.946 -19.508 1.0 30.01 ? 35 A 9 +ATOM 518 H HB . ILE A1 1 35 ? -19.355 6.532 -21.977 1.0 2.44 ? 35 A 9 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.498 6.56 -20.417 1.0 3.24 ? 35 A 9 +ATOM 520 H HG13 . ILE A1 1 35 ? -18.316 8.117 -20.368 1.0 0.11 ? 35 A 9 +ATOM 521 H HG21 . ILE A1 1 35 ? -21.644 6.597 -20.382 1.0 65.32 ? 35 A 9 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.678 7.978 -19.867 1.0 43.1 ? 35 A 9 +ATOM 523 H HG23 . ILE A1 1 35 ? -21.131 7.803 -21.562 1.0 75.41 ? 35 A 9 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.795 6.281 -18.248 1.0 43.52 ? 35 A 9 +ATOM 525 H HD12 . ILE A1 1 35 ? -18.466 7.91 -18.176 1.0 71.15 ? 35 A 9 +ATOM 526 H HD13 . ILE A1 1 35 ? -19.534 6.525 -18.407 1.0 74.3 ? 35 A 9 +ATOM 527 N N . TYR A1 1 36 ? -20.571 3.942 -22.585 1.0 62.53 ? 36 A 9 +ATOM 528 C CA . TYR A1 1 36 ? -21.557 3.366 -23.491 1.0 64.44 ? 36 A 9 +ATOM 529 C C . TYR A1 1 36 ? -22.313 2.223 -22.82 1.0 53.42 ? 36 A 9 +ATOM 530 O O . TYR A1 1 36 ? -23.538 2.137 -22.91 1.0 34.33 ? 36 A 9 +ATOM 531 C CB . TYR A1 1 36 ? -20.877 2.863 -24.766 1.0 74.42 ? 36 A 9 +ATOM 532 C CG . TYR A1 1 36 ? -21.317 1.478 -25.181 1.0 43.51 ? 36 A 9 +ATOM 533 C CD1 . TYR A1 1 36 ? -22.583 1.259 -25.709 1.0 62.31 ? 36 A 9 +ATOM 534 C CD2 . TYR A1 1 36 ? -20.467 0.387 -25.043 1.0 22.21 ? 36 A 9 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.99 -0.006 -26.089 1.0 25.24 ? 36 A 9 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.865 -0.881 -25.421 1.0 24.41 ? 36 A 9 +ATOM 537 C CZ . TYR A1 1 36 ? -22.127 -1.072 -25.944 1.0 51.0 ? 36 A 9 +ATOM 538 O OH . TYR A1 1 36 ? -22.528 -2.333 -26.32 1.0 31.41 ? 36 A 9 +ATOM 539 H H . TYR A1 1 36 ? -19.631 3.974 -22.86 1.0 42.53 ? 36 A 9 +ATOM 540 H HA . TYR A1 1 36 ? -22.26 4.143 -23.753 1.0 45.34 ? 36 A 9 +ATOM 541 H HB2 . TYR A1 1 36 ? -21.103 3.539 -25.576 1.0 32.41 ? 36 A 9 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.808 2.84 -24.61 1.0 73.31 ? 36 A 9 +ATOM 543 H HD1 . TYR A1 1 36 ? -23.257 2.096 -25.822 1.0 14.41 ? 36 A 9 +ATOM 544 H HD2 . TYR A1 1 36 ? -19.48 0.54 -24.633 1.0 73.43 ? 36 A 9 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.978 -0.156 -26.498 1.0 30.0 ? 36 A 9 +ATOM 546 H HE2 . TYR A1 1 36 ? -20.19 -1.716 -25.307 1.0 11.1 ? 36 A 9 +ATOM 547 H HH . TYR A1 1 36 ? -22.202 -2.975 -25.685 1.0 20.21 ? 36 A 9 +ATOM 548 N N . ASP A1 1 37 ? -21.573 1.349 -22.147 1.0 31.31 ? 37 A 9 +ATOM 549 C CA . ASP A1 1 37 ? -22.172 0.212 -21.458 1.0 4.3 ? 37 A 9 +ATOM 550 C C . ASP A1 1 37 ? -22.862 0.657 -20.172 1.0 30.32 ? 37 A 9 +ATOM 551 O O . ASP A1 1 37 ? -23.851 0.059 -19.747 1.0 62.0 ? 37 A 9 +ATOM 552 C CB . ASP A1 1 37 ? -21.106 -0.839 -21.142 1.0 35.43 ? 37 A 9 +ATOM 553 C CG . ASP A1 1 37 ? -21.689 -2.232 -21.008 1.0 34.32 ? 37 A 9 +ATOM 554 O OD1 . ASP A1 1 37 ? -22.923 -2.347 -20.857 1.0 31.12 ? 37 A 9 +ATOM 555 O OD2 . ASP A1 1 37 ? -20.91 -3.208 -21.052 1.0 3.2 ? 37 A 9 +ATOM 556 H H . ASP A1 1 37 ? -20.601 1.472 -22.112 1.0 51.42 ? 37 A 9 +ATOM 557 H HA . ASP A1 1 37 ? -22.909 -0.224 -22.115 1.0 32.24 ? 37 A 9 +ATOM 558 H HB2 . ASP A1 1 37 ? -20.374 -0.85 -21.936 1.0 43.14 ? 37 A 9 +ATOM 559 H HB3 . ASP A1 1 37 ? -20.619 -0.58 -20.213 1.0 34.23 ? 37 A 9 +ATOM 560 N N . LYS A1 1 38 ? -22.334 1.709 -19.557 1.0 33.03 ? 38 A 9 +ATOM 561 C CA . LYS A1 1 38 ? -22.898 2.236 -18.32 1.0 33.5 ? 38 A 9 +ATOM 562 C C . LYS A1 1 38 ? -24.382 2.544 -18.487 1.0 62.1 ? 38 A 9 +ATOM 563 O O . LYS A1 1 38 ? -25.198 2.185 -17.638 1.0 13.24 ? 38 A 9 +ATOM 564 C CB . LYS A1 1 38 ? -22.149 3.5 -17.891 1.0 32.13 ? 38 A 9 +ATOM 565 C CG . LYS A1 1 38 ? -21.39 3.343 -16.585 1.0 11.13 ? 38 A 9 +ATOM 566 C CD . LYS A1 1 38 ? -19.954 2.907 -16.824 1.0 55.11 ? 38 A 9 +ATOM 567 C CE . LYS A1 1 38 ? -19.846 1.397 -16.963 1.0 12.13 ? 38 A 9 +ATOM 568 N NZ . LYS A1 1 38 ? -19.274 0.767 -15.74 1.0 62.42 ? 38 A 9 +ATOM 569 H H . LYS A1 1 38 ? -21.545 2.143 -19.946 1.0 40.1 ? 38 A 9 +ATOM 570 H HA . LYS A1 1 38 ? -22.782 1.482 -17.556 1.0 13.43 ? 38 A 9 +ATOM 571 H HB2 . LYS A1 1 38 ? -21.443 3.765 -18.665 1.0 53.44 ? 38 A 9 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.862 4.304 -17.775 1.0 74.35 ? 38 A 9 +ATOM 573 H HG2 . LYS A1 1 38 ? -21.385 4.29 -16.066 1.0 72.35 ? 38 A 9 +ATOM 574 H HG3 . LYS A1 1 38 ? -21.886 2.6 -15.978 1.0 65.33 ? 38 A 9 +ATOM 575 H HD2 . LYS A1 1 38 ? -19.593 3.367 -17.732 1.0 31.44 ? 38 A 9 +ATOM 576 H HD3 . LYS A1 1 38 ? -19.346 3.228 -15.99 1.0 51.13 ? 38 A 9 +ATOM 577 H HE2 . LYS A1 1 38 ? -20.831 0.993 -17.138 1.0 72.24 ? 38 A 9 +ATOM 578 H HE3 . LYS A1 1 38 ? -19.209 1.17 -17.805 1.0 52.14 ? 38 A 9 +ATOM 579 H HZ1 . LYS A1 1 38 ? -19.995 0.717 -14.993 1.0 12.21 ? 38 A 9 +ATOM 580 H HZ2 . LYS A1 1 38 ? -18.468 1.327 -15.394 1.0 31.3 ? 38 A 9 +ATOM 581 H HZ3 . LYS A1 1 38 ? -18.945 -0.196 -15.955 1.0 72.13 ? 38 A 9 +ATOM 582 N N . GLU A1 1 39 ? -24.725 3.208 -19.586 1.0 74.33 ? 39 A 9 +ATOM 583 C CA . GLU A1 1 39 ? -26.112 3.563 -19.863 1.0 31.43 ? 39 A 9 +ATOM 584 C C . GLU A1 1 39 ? -26.625 2.828 -21.098 1.0 55.55 ? 39 A 9 +ATOM 585 O O . GLU A1 1 39 ? -27.656 2.157 -21.05 1.0 44.25 ? 39 A 9 +ATOM 586 C CB . GLU A1 1 39 ? -26.245 5.074 -20.063 1.0 31.12 ? 39 A 9 +ATOM 587 C CG . GLU A1 1 39 ? -25.117 5.681 -20.88 1.0 22.34 ? 39 A 9 +ATOM 588 C CD . GLU A1 1 39 ? -25.138 7.197 -20.867 1.0 34.02 ? 39 A 9 +ATOM 589 O OE1 . GLU A1 1 39 ? -26.034 7.784 -21.509 1.0 60.52 ? 39 A 9 +ATOM 590 O OE2 . GLU A1 1 39 ? -24.258 7.797 -20.214 1.0 24.54 ? 39 A 9 +ATOM 591 H H . GLU A1 1 39 ? -24.028 3.466 -20.225 1.0 53.12 ? 39 A 9 +ATOM 592 H HA . GLU A1 1 39 ? -26.706 3.269 -19.011 1.0 24.23 ? 39 A 9 +ATOM 593 H HB2 . GLU A1 1 39 ? -27.178 5.277 -20.568 1.0 13.32 ? 39 A 9 +ATOM 594 H HB3 . GLU A1 1 39 ? -26.258 5.553 -19.095 1.0 53.15 ? 39 A 9 +ATOM 595 H HG2 . GLU A1 1 39 ? -24.174 5.346 -20.474 1.0 73.51 ? 39 A 9 +ATOM 596 H HG3 . GLU A1 1 39 ? -25.208 5.344 -21.902 1.0 55.55 ? 39 A 9 +ATOM 597 N N . GLY A1 1 40 ? -25.898 2.96 -22.203 1.0 41.31 ? 40 A 9 +ATOM 598 C CA . GLY A1 1 40 ? -26.295 2.304 -23.435 1.0 23.2 ? 40 A 9 +ATOM 599 C C . GLY A1 1 40 ? -26.41 3.271 -24.596 1.0 54.31 ? 40 A 9 +ATOM 600 O O . GLY A1 1 40 ? -27.408 3.269 -25.318 1.0 62.35 ? 40 A 9 +ATOM 601 H H . GLY A1 1 40 ? -25.085 3.507 -22.182 1.0 1.31 ? 40 A 9 +ATOM 602 H HA2 . GLY A1 1 40 ? -25.564 1.548 -23.68 1.0 42.33 ? 40 A 9 +ATOM 603 H HA3 . GLY A1 1 40 ? -27.253 1.827 -23.283 1.0 42.25 ? 40 A 9 +ATOM 604 N N . ILE A1 1 41 ? -25.388 4.101 -24.776 1.0 11.45 ? 41 A 9 +ATOM 605 C CA . ILE A1 1 41 ? -25.379 5.078 -25.857 1.0 13.21 ? 41 A 9 +ATOM 606 C C . ILE A1 1 41 ? -24.204 4.844 -26.8 1.0 73.14 ? 41 A 9 +ATOM 607 O O . ILE A1 1 41 ? -23.177 4.279 -26.424 1.0 54.03 ? 41 A 9 +ATOM 608 C CB . ILE A1 1 41 ? -25.308 6.518 -25.314 1.0 13.54 ? 41 A 9 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.214 6.632 -24.251 1.0 35.25 ? 41 A 9 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.655 6.935 -24.743 1.0 15.54 ? 41 A 9 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.269 7.791 -24.478 1.0 51.21 ? 41 A 9 +ATOM 612 H H . ILE A1 1 41 ? -24.621 4.054 -24.167 1.0 10.31 ? 41 A 9 +ATOM 613 H HA . ILE A1 1 41 ? -26.3 4.969 -26.412 1.0 22.4 ? 41 A 9 +ATOM 614 H HB . ILE A1 1 41 ? -25.073 7.178 -26.135 1.0 2.22 ? 41 A 9 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.673 6.764 -23.284 1.0 53.25 ? 41 A 9 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.631 5.723 -24.247 1.0 73.21 ? 41 A 9 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.529 7.814 -24.128 1.0 41.34 ? 41 A 9 +ATOM 618 H HG22 . ILE A1 1 41 ? -27.335 7.158 -25.551 1.0 35.01 ? 41 A 9 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.058 6.132 -24.144 1.0 24.24 ? 41 A 9 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.426 8.194 -25.469 1.0 13.35 ? 41 A 9 +ATOM 621 H HD12 . ILE A1 1 41 ? -23.458 8.56 -23.744 1.0 5.02 ? 41 A 9 +ATOM 622 H HD13 . ILE A1 1 41 ? -22.25 7.448 -24.387 1.0 73.01 ? 41 A 9 +ATOM 623 N N . PRO A1 1 42 ? -24.355 5.291 -28.056 1.0 42.01 ? 42 A 9 +ATOM 624 C CA . PRO A1 1 42 ? -23.315 5.144 -29.079 1.0 63.34 ? 42 A 9 +ATOM 625 C C . PRO A1 1 42 ? -22.104 6.029 -28.805 1.0 4.23 ? 42 A 9 +ATOM 626 O O . PRO A1 1 42 ? -22.189 7.257 -28.806 1.0 21.54 ? 42 A 9 +ATOM 627 C CB . PRO A1 1 42 ? -24.019 5.583 -30.365 1.0 63.45 ? 42 A 9 +ATOM 628 C CG . PRO A1 1 42 ? -25.104 6.497 -29.911 1.0 31.23 ? 42 A 9 +ATOM 629 C CD . PRO A1 1 42 ? -25.552 5.975 -28.574 1.0 52.22 ? 42 A 9 +ATOM 630 H HA . PRO A1 1 42 ? -22.995 4.117 -29.174 1.0 60.32 ? 42 A 9 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.315 6.094 -31.007 1.0 50.23 ? 42 A 9 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.418 4.719 -30.875 1.0 64.01 ? 42 A 9 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.721 7.501 -29.812 1.0 0.11 ? 42 A 9 +ATOM 634 H HG3 . PRO A1 1 42 ? -25.922 6.474 -30.615 1.0 1.1 ? 42 A 9 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.84 6.791 -27.927 1.0 11.32 ? 42 A 9 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.37 5.28 -28.695 1.0 34.03 ? 42 A 9 +ATOM 637 N N . PRO A1 1 43 ? -20.947 5.393 -28.566 1.0 1.41 ? 43 A 9 +ATOM 638 C CA . PRO A1 1 43 ? -19.696 6.103 -28.287 1.0 62.53 ? 43 A 9 +ATOM 639 C C . PRO A1 1 43 ? -19.156 6.829 -29.515 1.0 21.35 ? 43 A 9 +ATOM 640 O O . PRO A1 1 43 ? -18.471 7.845 -29.396 1.0 73.42 ? 43 A 9 +ATOM 641 C CB . PRO A1 1 43 ? -18.74 4.986 -27.863 1.0 74.43 ? 43 A 9 +ATOM 642 C CG . PRO A1 1 43 ? -19.279 3.759 -28.514 1.0 42.11 ? 43 A 9 +ATOM 643 C CD . PRO A1 1 43 ? -20.773 3.931 -28.549 1.0 32.53 ? 43 A 9 +ATOM 644 H HA . PRO A1 1 43 ? -19.811 6.808 -27.477 1.0 3.1 ? 43 A 9 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.741 5.212 -28.21 1.0 1.2 ? 43 A 9 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.742 4.895 -26.787 1.0 52.2 ? 43 A 9 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.888 3.673 -29.516 1.0 21.5 ? 43 A 9 +ATOM 648 H HG3 . PRO A1 1 43 ? -19.016 2.889 -27.931 1.0 41.32 ? 43 A 9 +ATOM 649 H HD2 . PRO A1 1 43 ? -21.183 3.483 -29.442 1.0 55.24 ? 43 A 9 +ATOM 650 H HD3 . PRO A1 1 43 ? -21.223 3.499 -27.667 1.0 31.14 ? 43 A 9 +ATOM 651 N N . ASP A1 1 44 ? -19.468 6.301 -30.693 1.0 54.12 ? 44 A 9 +ATOM 652 C CA . ASP A1 1 44 ? -19.015 6.899 -31.944 1.0 51.34 ? 44 A 9 +ATOM 653 C C . ASP A1 1 44 ? -19.864 8.115 -32.303 1.0 65.34 ? 44 A 9 +ATOM 654 O O . ASP A1 1 44 ? -19.477 8.926 -33.144 1.0 41.23 ? 44 A 9 +ATOM 655 C CB . ASP A1 1 44 ? -19.069 5.872 -33.075 1.0 23.35 ? 44 A 9 +ATOM 656 C CG . ASP A1 1 44 ? -18.28 6.31 -34.293 1.0 52.14 ? 44 A 9 +ATOM 657 O OD1 . ASP A1 1 44 ? -17.464 7.247 -34.167 1.0 70.43 ? 44 A 9 +ATOM 658 O OD2 . ASP A1 1 44 ? -18.479 5.715 -35.373 1.0 15.14 ? 44 A 9 +ATOM 659 H H . ASP A1 1 44 ? -20.017 5.489 -30.723 1.0 64.31 ? 44 A 9 +ATOM 660 H HA . ASP A1 1 44 ? -17.993 7.218 -31.808 1.0 72.42 ? 44 A 9 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.66 4.936 -32.722 1.0 64.21 ? 44 A 9 +ATOM 662 H HB3 . ASP A1 1 44 ? -20.098 5.722 -33.368 1.0 74.33 ? 44 A 9 +ATOM 663 N N . GLN A1 1 45 ? -21.022 8.232 -31.662 1.0 24.51 ? 45 A 9 +ATOM 664 C CA . GLN A1 1 45 ? -21.926 9.348 -31.916 1.0 55.1 ? 45 A 9 +ATOM 665 C C . GLN A1 1 45 ? -21.797 10.411 -30.831 1.0 65.33 ? 45 A 9 +ATOM 666 O O . GLN A1 1 45 ? -22.301 11.524 -30.977 1.0 0.12 ? 45 A 9 +ATOM 667 C CB . GLN A1 1 45 ? -23.372 8.853 -31.992 1.0 3.33 ? 45 A 9 +ATOM 668 C CG . GLN A1 1 45 ? -23.775 8.364 -33.373 1.0 71.05 ? 45 A 9 +ATOM 669 C CD . GLN A1 1 45 ? -24.746 7.2 -33.32 1.0 50.21 ? 45 A 9 +ATOM 670 O OE1 . GLN A1 1 45 ? -25.895 7.354 -32.906 1.0 30.33 ? 45 A 9 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.287 6.027 -33.739 1.0 54.11 ? 45 A 9 +ATOM 672 H H . GLN A1 1 45 ? -21.275 7.553 -31.003 1.0 33.14 ? 45 A 9 +ATOM 673 H HA . GLN A1 1 45 ? -21.655 9.784 -32.865 1.0 54.13 ? 45 A 9 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.498 8.039 -31.294 1.0 72.22 ? 45 A 9 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.031 9.662 -31.714 1.0 51.24 ? 45 A 9 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.243 9.178 -33.907 1.0 11.31 ? 45 A 9 +ATOM 677 H HG3 . GLN A1 1 45 ? -22.888 8.05 -33.903 1.0 33.23 ? 45 A 9 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.359 5.979 -34.054 1.0 35.4 ? 45 A 9 +ATOM 679 H HE22 . GLN A1 1 45 ? -24.892 5.257 -33.715 1.0 53.4 ? 45 A 9 +ATOM 680 N N . GLN A1 1 46 ? -21.119 10.06 -29.743 1.0 5.34 ? 46 A 9 +ATOM 681 C CA . GLN A1 1 46 ? -20.924 10.985 -28.633 1.0 54.21 ? 46 A 9 +ATOM 682 C C . GLN A1 1 46 ? -19.504 11.541 -28.629 1.0 23.33 ? 46 A 9 +ATOM 683 O O . GLN A1 1 46 ? -18.57 10.885 -29.091 1.0 42.0 ? 46 A 9 +ATOM 684 C CB . GLN A1 1 46 ? -21.216 10.288 -27.303 1.0 54.1 ? 46 A 9 +ATOM 685 C CG . GLN A1 1 46 ? -20.174 9.249 -26.92 1.0 63.33 ? 46 A 9 +ATOM 686 C CD . GLN A1 1 46 ? -19.273 9.714 -25.793 1.0 73.34 ? 46 A 9 +ATOM 687 O OE1 . GLN A1 1 46 ? -18.27 10.391 -26.023 1.0 62.34 ? 46 A 9 +ATOM 688 N NE2 . GLN A1 1 46 ? -19.626 9.353 -24.565 1.0 52.51 ? 46 A 9 +ATOM 689 H H . GLN A1 1 46 ? -20.741 9.159 -29.685 1.0 61.13 ? 46 A 9 +ATOM 690 H HA . GLN A1 1 46 ? -21.617 11.804 -28.759 1.0 1.54 ? 46 A 9 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.256 11.032 -26.521 1.0 70.34 ? 46 A 9 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.175 9.796 -27.371 1.0 24.41 ? 46 A 9 +ATOM 693 H HG2 . GLN A1 1 46 ? -20.681 8.348 -26.606 1.0 71.34 ? 46 A 9 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.564 9.035 -27.785 1.0 12.44 ? 46 A 9 +ATOM 695 H HE21 . GLN A1 1 46 ? -20.437 8.812 -24.457 1.0 61.21 ? 46 A 9 +ATOM 696 H HE22 . GLN A1 1 46 ? -19.061 9.639 -23.818 1.0 54.41 ? 46 A 9 +ATOM 697 N N . ARG A1 1 47 ? -19.349 12.752 -28.105 1.0 11.31 ? 47 A 9 +ATOM 698 C CA . ARG A1 1 47 ? -18.042 13.396 -28.042 1.0 74.42 ? 47 A 9 +ATOM 699 C C . ARG A1 1 47 ? -17.858 14.124 -26.714 1.0 0.05 ? 47 A 9 +ATOM 700 O O . ARG A1 1 47 ? -18.829 14.433 -26.023 1.0 62.43 ? 47 A 9 +ATOM 701 C CB . ARG A1 1 47 ? -17.878 14.379 -29.202 1.0 53.24 ? 47 A 9 +ATOM 702 C CG . ARG A1 1 47 ? -18.814 15.575 -29.124 1.0 25.13 ? 47 A 9 +ATOM 703 C CD . ARG A1 1 47 ? -19.812 15.578 -30.271 1.0 74.31 ? 47 A 9 +ATOM 704 N NE . ARG A1 1 47 ? -20.696 16.739 -30.224 1.0 72.02 ? 47 A 9 +ATOM 705 C CZ . ARG A1 1 47 ? -20.3 17.976 -30.499 1.0 4.33 ? 47 A 9 +ATOM 706 N NH1 . ARG A1 1 47 ? -19.04 18.212 -30.84 1.0 22.33 ? 47 A 9 +ATOM 707 N NH2 . ARG A1 1 47 ? -21.164 18.981 -30.435 1.0 24.44 ? 47 A 9 +ATOM 708 H H . ARG A1 1 47 ? -20.131 13.224 -27.752 1.0 14.32 ? 47 A 9 +ATOM 709 H HA . ARG A1 1 47 ? -17.289 12.627 -28.125 1.0 52.1 ? 47 A 9 +ATOM 710 H HB2 . ARG A1 1 47 ? -16.862 14.745 -29.208 1.0 12.43 ? 47 A 9 +ATOM 711 H HB3 . ARG A1 1 47 ? -18.071 13.859 -30.129 1.0 31.22 ? 47 A 9 +ATOM 712 H HG2 . ARG A1 1 47 ? -19.356 15.535 -28.19 1.0 2.15 ? 47 A 9 +ATOM 713 H HG3 . ARG A1 1 47 ? -18.228 16.481 -29.164 1.0 3.22 ? 47 A 9 +ATOM 714 H HD2 . ARG A1 1 47 ? -19.268 15.59 -31.204 1.0 62.34 ? 47 A 9 +ATOM 715 H HD3 . ARG A1 1 47 ? -20.408 14.68 -30.214 1.0 4.32 ? 47 A 9 +ATOM 716 H HE . ARG A1 1 47 ? -21.631 16.587 -29.974 1.0 51.12 ? 47 A 9 +ATOM 717 H HH11 . ARG A1 1 47 ? -18.387 17.457 -30.891 1.0 35.02 ? 47 A 9 +ATOM 718 H HH12 . ARG A1 1 47 ? -18.745 19.145 -31.048 1.0 42.25 ? 47 A 9 +ATOM 719 H HH21 . ARG A1 1 47 ? -22.115 18.807 -30.178 1.0 32.54 ? 47 A 9 +ATOM 720 H HH22 . ARG A1 1 47 ? -20.865 19.912 -30.642 1.0 51.04 ? 47 A 9 +ATOM 721 N N . LEU A1 1 48 ? -16.605 14.395 -26.363 1.0 13.42 ? 48 A 9 +ATOM 722 C CA . LEU A1 1 48 ? -16.293 15.086 -25.117 1.0 63.04 ? 48 A 9 +ATOM 723 C C . LEU A1 1 48 ? -15.887 16.532 -25.384 1.0 70.54 ? 48 A 9 +ATOM 724 O O . LEU A1 1 48 ? -15.272 16.836 -26.406 1.0 13.22 ? 48 A 9 +ATOM 725 C CB . LEU A1 1 48 ? -15.171 14.359 -24.374 1.0 73.22 ? 48 A 9 +ATOM 726 C CG . LEU A1 1 48 ? -15.164 12.834 -24.496 1.0 23.01 ? 48 A 9 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.578 12.285 -24.397 1.0 2.23 ? 48 A 9 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.514 12.407 -25.803 1.0 62.5 ? 48 A 9 +ATOM 729 H H . LEU A1 1 48 ? -15.873 14.124 -26.954 1.0 13.1 ? 48 A 9 +ATOM 730 H HA . LEU A1 1 48 ? -17.182 15.082 -24.504 1.0 5.14 ? 48 A 9 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.23 14.725 -24.756 1.0 14.35 ? 48 A 9 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.254 14.608 -23.326 1.0 62.22 ? 48 A 9 +ATOM 733 H HG . LEU A1 1 48 ? -14.587 12.417 -23.682 1.0 74.12 ? 48 A 9 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.187 12.96 -23.815 1.0 72.12 ? 48 A 9 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.556 11.317 -23.919 1.0 51.52 ? 48 A 9 +ATOM 736 H HD13 . LEU A1 1 48 ? -16.996 12.186 -25.388 1.0 50.13 ? 48 A 9 +ATOM 737 H HD21 . LEU A1 1 48 ? -15.269 12.319 -26.569 1.0 32.51 ? 48 A 9 +ATOM 738 H HD22 . LEU A1 1 48 ? -14.026 11.453 -25.667 1.0 4.35 ? 48 A 9 +ATOM 739 H HD23 . LEU A1 1 48 ? -13.783 13.145 -26.1 1.0 44.23 ? 48 A 9 +ATOM 740 N N . ILE A1 1 49 ? -16.234 17.419 -24.457 1.0 13.31 ? 49 A 9 +ATOM 741 C CA . ILE A1 1 49 ? -15.903 18.832 -24.592 1.0 13.25 ? 49 A 9 +ATOM 742 C C . ILE A1 1 49 ? -15.481 19.428 -23.252 1.0 73.24 ? 49 A 9 +ATOM 743 O O . ILE A1 1 49 ? -16.184 19.292 -22.251 1.0 20.41 ? 49 A 9 +ATOM 744 C CB . ILE A1 1 49 ? -17.092 19.639 -25.147 1.0 42.12 ? 49 A 9 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.199 19.453 -26.662 1.0 21.4 ? 49 A 9 +ATOM 746 C CG2 . ILE A1 1 49 ? -16.941 21.112 -24.798 1.0 44.11 ? 49 A 9 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.497 18.813 -27.102 1.0 30.32 ? 49 A 9 +ATOM 748 H H . ILE A1 1 49 ? -16.724 17.116 -23.665 1.0 11.12 ? 49 A 9 +ATOM 749 H HA . ILE A1 1 49 ? -15.08 18.917 -25.286 1.0 31.54 ? 49 A 9 +ATOM 750 H HB . ILE A1 1 49 ? -17.994 19.274 -24.682 1.0 10.22 ? 49 A 9 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.124 20.415 -27.143 1.0 52.53 ? 49 A 9 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.387 18.823 -26.998 1.0 23.14 ? 49 A 9 +ATOM 753 H HG21 . ILE A1 1 49 ? -15.893 21.374 -24.784 1.0 54.41 ? 49 A 9 +ATOM 754 H HG22 . ILE A1 1 49 ? -17.451 21.711 -25.539 1.0 2.4 ? 49 A 9 +ATOM 755 H HG23 . ILE A1 1 49 ? -17.372 21.298 -23.826 1.0 53.42 ? 49 A 9 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.18 19.58 -27.439 1.0 43.14 ? 49 A 9 +ATOM 757 H HD12 . ILE A1 1 49 ? -18.304 18.125 -27.911 1.0 61.33 ? 49 A 9 +ATOM 758 H HD13 . ILE A1 1 49 ? -18.936 18.281 -26.272 1.0 3.14 ? 49 A 9 +ATOM 759 N N . PHE A1 1 50 ? -14.329 20.089 -23.242 1.0 0.44 ? 50 A 9 +ATOM 760 C CA . PHE A1 1 50 ? -13.812 20.707 -22.026 1.0 63.4 ? 50 A 9 +ATOM 761 C C . PHE A1 1 50 ? -13.673 22.217 -22.2 1.0 34.31 ? 50 A 9 +ATOM 762 O O . PHE A1 1 50 ? -12.801 22.691 -22.927 1.0 24.03 ? 50 A 9 +ATOM 763 C CB . PHE A1 1 50 ? -12.459 20.098 -21.654 1.0 1.31 ? 50 A 9 +ATOM 764 C CG . PHE A1 1 50 ? -12.022 20.418 -20.254 1.0 63.44 ? 50 A 9 +ATOM 765 C CD1 . PHE A1 1 50 ? -12.494 19.68 -19.181 1.0 63.22 ? 50 A 9 +ATOM 766 C CD2 . PHE A1 1 50 ? -11.139 21.458 -20.01 1.0 31.12 ? 50 A 9 +ATOM 767 C CE1 . PHE A1 1 50 ? -12.094 19.973 -17.891 1.0 44.05 ? 50 A 9 +ATOM 768 C CE2 . PHE A1 1 50 ? -10.735 21.755 -18.722 1.0 53.14 ? 50 A 9 +ATOM 769 C CZ . PHE A1 1 50 ? -11.212 21.011 -17.661 1.0 64.24 ? 50 A 9 +ATOM 770 H H . PHE A1 1 50 ? -13.813 20.164 -24.073 1.0 32.43 ? 50 A 9 +ATOM 771 H HA . PHE A1 1 50 ? -14.516 20.512 -21.232 1.0 55.42 ? 50 A 9 +ATOM 772 H HB2 . PHE A1 1 50 ? -12.519 19.024 -21.745 1.0 72.21 ? 50 A 9 +ATOM 773 H HB3 . PHE A1 1 50 ? -11.706 20.471 -22.332 1.0 52.42 ? 50 A 9 +ATOM 774 H HD1 . PHE A1 1 50 ? -13.183 18.867 -19.358 1.0 64.41 ? 50 A 9 +ATOM 775 H HD2 . PHE A1 1 50 ? -10.764 22.04 -20.84 1.0 25.0 ? 50 A 9 +ATOM 776 H HE1 . PHE A1 1 50 ? -12.469 19.39 -17.063 1.0 33.34 ? 50 A 9 +ATOM 777 H HE2 . PHE A1 1 50 ? -10.045 22.568 -18.546 1.0 34.14 ? 50 A 9 +ATOM 778 H HZ . PHE A1 1 50 ? -10.899 21.243 -16.654 1.0 42.2 ? 50 A 9 +ATOM 779 N N . GLY A1 1 51 ? -14.54 22.967 -21.527 1.0 53.44 ? 51 A 9 +ATOM 780 C CA . GLY A1 1 51 ? -14.498 24.414 -21.62 1.0 33.5 ? 51 A 9 +ATOM 781 C C . GLY A1 1 51 ? -15.032 24.926 -22.943 1.0 34.32 ? 51 A 9 +ATOM 782 O O . GLY A1 1 51 ? -15.13 26.134 -23.156 1.0 0.02 ? 51 A 9 +ATOM 783 H H . GLY A1 1 51 ? -15.214 22.533 -20.962 1.0 14.34 ? 51 A 9 +ATOM 784 H HA2 . GLY A1 1 51 ? -15.089 24.833 -20.819 1.0 71.3 ? 51 A 9 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.475 24.741 -21.508 1.0 2.33 ? 51 A 9 +ATOM 786 N N . GLY A1 1 52 ? -15.378 24.004 -23.837 1.0 51.33 ? 52 A 9 +ATOM 787 C CA . GLY A1 1 52 ? -15.899 24.388 -25.136 1.0 70.11 ? 52 A 9 +ATOM 788 C C . GLY A1 1 52 ? -15.202 23.67 -26.275 1.0 64.35 ? 52 A 9 +ATOM 789 O O . GLY A1 1 52 ? -15.769 23.509 -27.356 1.0 21.12 ? 52 A 9 +ATOM 790 H H . GLY A1 1 52 ? -15.278 23.055 -23.612 1.0 52.33 ? 52 A 9 +ATOM 791 H HA2 . GLY A1 1 52 ? -16.953 24.159 -25.17 1.0 34.31 ? 52 A 9 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.767 25.452 -25.263 1.0 33.12 ? 52 A 9 +ATOM 793 N N . LYS A1 1 53 ? -13.969 23.237 -26.034 1.0 4.12 ? 53 A 9 +ATOM 794 C CA . LYS A1 1 53 ? -13.194 22.533 -27.048 1.0 20.15 ? 53 A 9 +ATOM 795 C C . LYS A1 1 53 ? -13.362 21.023 -26.909 1.0 12.34 ? 53 A 9 +ATOM 796 O O . LYS A1 1 53 ? -13.503 20.505 -25.802 1.0 53.3 ? 53 A 9 +ATOM 797 C CB . LYS A1 1 53 ? -11.713 22.904 -26.936 1.0 12.13 ? 53 A 9 +ATOM 798 C CG . LYS A1 1 53 ? -11.112 22.602 -25.574 1.0 34.42 ? 53 A 9 +ATOM 799 C CD . LYS A1 1 53 ? -10.483 21.219 -25.537 1.0 44.0 ? 53 A 9 +ATOM 800 C CE . LYS A1 1 53 ? -9.31 21.114 -26.499 1.0 75.53 ? 53 A 9 +ATOM 801 N NZ . LYS A1 1 53 ? -8.114 20.506 -25.851 1.0 61.53 ? 53 A 9 +ATOM 802 H H . LYS A1 1 53 ? -13.572 23.395 -25.152 1.0 32.12 ? 53 A 9 +ATOM 803 H HA . LYS A1 1 53 ? -13.56 22.836 -28.016 1.0 74.23 ? 53 A 9 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.159 22.353 -27.681 1.0 34.02 ? 53 A 9 +ATOM 805 H HB3 . LYS A1 1 53 ? -11.604 23.962 -27.127 1.0 32.22 ? 53 A 9 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.351 23.337 -25.355 1.0 24.24 ? 53 A 9 +ATOM 807 H HG3 . LYS A1 1 53 ? -11.891 22.654 -24.827 1.0 53.0 ? 53 A 9 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.132 21.02 -24.535 1.0 22.42 ? 53 A 9 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.229 20.487 -25.811 1.0 0.05 ? 53 A 9 +ATOM 810 H HE2 . LYS A1 1 53 ? -9.603 20.503 -27.338 1.0 25.2 ? 53 A 9 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.056 22.105 -26.846 1.0 75.24 ? 53 A 9 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.288 20.589 -26.477 1.0 1.33 ? 53 A 9 +ATOM 813 H HZ2 . LYS A1 1 53 ? -8.288 19.5 -25.654 1.0 14.14 ? 53 A 9 +ATOM 814 H HZ3 . LYS A1 1 53 ? -7.908 20.992 -24.955 1.0 31.25 ? 53 A 9 +ATOM 815 N N . GLN A1 1 54 ? -13.343 20.324 -28.04 1.0 32.1 ? 54 A 9 +ATOM 816 C CA . GLN A1 1 54 ? -13.493 18.874 -28.043 1.0 3.14 ? 54 A 9 +ATOM 817 C C . GLN A1 1 54 ? -12.248 18.197 -27.48 1.0 14.5 ? 54 A 9 +ATOM 818 O O . GLN A1 1 54 ? -11.187 18.814 -27.373 1.0 22.04 ? 54 A 9 +ATOM 819 C CB . GLN A1 1 54 ? -13.763 18.371 -29.463 1.0 14.03 ? 54 A 9 +ATOM 820 C CG . GLN A1 1 54 ? -15.232 18.092 -29.74 1.0 52.41 ? 54 A 9 +ATOM 821 C CD . GLN A1 1 54 ? -15.837 19.073 -30.724 1.0 44.23 ? 54 A 9 +ATOM 822 O OE1 . GLN A1 1 54 ? -16.302 18.687 -31.797 1.0 25.33 ? 54 A 9 +ATOM 823 N NE2 . GLN A1 1 54 ? -15.834 20.351 -30.364 1.0 63.1 ? 54 A 9 +ATOM 824 H H . GLN A1 1 54 ? -13.227 20.795 -28.891 1.0 52.11 ? 54 A 9 +ATOM 825 H HA . GLN A1 1 54 ? -14.337 18.626 -27.417 1.0 62.04 ? 54 A 9 +ATOM 826 H HB2 . GLN A1 1 54 ? -13.421 19.115 -30.166 1.0 31.24 ? 54 A 9 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.21 17.457 -29.619 1.0 25.42 ? 54 A 9 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.326 17.096 -30.145 1.0 52.11 ? 54 A 9 +ATOM 829 H HG3 . GLN A1 1 54 ? -15.778 18.154 -28.81 1.0 53.52 ? 54 A 9 +ATOM 830 H HE21 . GLN A1 1 54 ? -15.445 20.586 -29.495 1.0 45.55 ? 54 A 9 +ATOM 831 H HE22 . GLN A1 1 54 ? -16.218 21.007 -30.981 1.0 62.42 ? 54 A 9 +ATOM 832 N N . LEU A1 1 55 ? -12.384 16.925 -27.121 1.0 51.34 ? 55 A 9 +ATOM 833 C CA . LEU A1 1 55 ? -11.269 16.163 -26.567 1.0 40.45 ? 55 A 9 +ATOM 834 C C . LEU A1 1 55 ? -10.938 14.965 -27.45 1.0 63.5 ? 55 A 9 +ATOM 835 O O . LEU A1 1 55 ? -11.812 14.164 -27.781 1.0 52.11 ? 55 A 9 +ATOM 836 C CB . LEU A1 1 55 ? -11.602 15.691 -25.151 1.0 25.03 ? 55 A 9 +ATOM 837 C CG . LEU A1 1 55 ? -12.194 16.744 -24.214 1.0 41.33 ? 55 A 9 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.34 16.186 -22.807 1.0 33.24 ? 55 A 9 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.33 17.997 -24.206 1.0 52.23 ? 55 A 9 +ATOM 840 H H . LEU A1 1 55 ? -13.253 16.487 -27.229 1.0 12.34 ? 55 A 9 +ATOM 841 H HA . LEU A1 1 55 ? -10.409 16.815 -26.528 1.0 22.21 ? 55 A 9 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.312 14.883 -25.23 1.0 55.1 ? 55 A 9 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.689 15.324 -24.703 1.0 51.11 ? 55 A 9 +ATOM 844 H HG . LEU A1 1 55 ? -13.179 17.019 -24.568 1.0 72.12 ? 55 A 9 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.632 15.384 -22.663 1.0 32.04 ? 55 A 9 +ATOM 846 H HD12 . LEU A1 1 55 ? -13.343 15.809 -22.672 1.0 44.35 ? 55 A 9 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.15 16.969 -22.088 1.0 32.21 ? 55 A 9 +ATOM 848 H HD21 . LEU A1 1 55 ? -10.351 17.762 -24.595 1.0 33.14 ? 55 A 9 +ATOM 849 H HD22 . LEU A1 1 55 ? -11.238 18.363 -23.194 1.0 72.01 ? 55 A 9 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.791 18.756 -24.822 1.0 74.33 ? 55 A 9 +ATOM 851 N N . GLU A1 1 56 ? -9.668 14.847 -27.827 1.0 12.02 ? 56 A 9 +ATOM 852 C CA . GLU A1 1 56 ? -9.221 13.744 -28.671 1.0 31.33 ? 56 A 9 +ATOM 853 C C . GLU A1 1 56 ? -9.236 12.428 -27.899 1.0 62.51 ? 56 A 9 +ATOM 854 O O . GLU A1 1 56 ? -9.697 12.37 -26.759 1.0 51.02 ? 56 A 9 +ATOM 855 C CB . GLU A1 1 56 ? -7.814 14.02 -29.205 1.0 62.01 ? 56 A 9 +ATOM 856 C CG . GLU A1 1 56 ? -6.805 14.35 -28.119 1.0 21.02 ? 56 A 9 +ATOM 857 C CD . GLU A1 1 56 ? -5.451 13.713 -28.367 1.0 1.0 ? 56 A 9 +ATOM 858 O OE1 . GLU A1 1 56 ? -5.416 12.571 -28.87 1.0 61.34 ? 56 A 9 +ATOM 859 O OE2 . GLU A1 1 56 ? -4.427 14.358 -28.059 1.0 22.01 ? 56 A 9 +ATOM 860 H H . GLU A1 1 56 ? -9.017 15.517 -27.532 1.0 72.43 ? 56 A 9 +ATOM 861 H HA . GLU A1 1 56 ? -9.904 13.667 -29.504 1.0 4.21 ? 56 A 9 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.467 13.146 -29.738 1.0 41.11 ? 56 A 9 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.86 14.853 -29.891 1.0 51.02 ? 56 A 9 +ATOM 864 H HG2 . GLU A1 1 56 ? -6.678 15.422 -28.077 1.0 71.31 ? 56 A 9 +ATOM 865 H HG3 . GLU A1 1 56 ? -7.185 13.996 -27.172 1.0 60.44 ? 56 A 9 +ATOM 866 N N . ASP A1 1 57 ? -8.728 11.374 -28.529 1.0 71.03 ? 57 A 9 +ATOM 867 C CA . ASP A1 1 57 ? -8.682 10.058 -27.902 1.0 63.41 ? 57 A 9 +ATOM 868 C C . ASP A1 1 57 ? -7.6 10.006 -26.828 1.0 21.4 ? 57 A 9 +ATOM 869 O O . ASP A1 1 57 ? -7.6 9.118 -25.975 1.0 43.31 ? 57 A 9 +ATOM 870 C CB . ASP A1 1 57 ? -8.427 8.978 -28.954 1.0 45.31 ? 57 A 9 +ATOM 871 C CG . ASP A1 1 57 ? -7.329 9.364 -29.926 1.0 55.43 ? 57 A 9 +ATOM 872 O OD1 . ASP A1 1 57 ? -6.201 9.641 -29.468 1.0 72.35 ? 57 A 9 +ATOM 873 O OD2 . ASP A1 1 57 ? -7.599 9.39 -31.145 1.0 15.11 ? 57 A 9 +ATOM 874 H H . ASP A1 1 57 ? -8.376 11.484 -29.437 1.0 23.12 ? 57 A 9 +ATOM 875 H HA . ASP A1 1 57 ? -9.64 9.878 -27.439 1.0 62.14 ? 57 A 9 +ATOM 876 H HB2 . ASP A1 1 57 ? -8.136 8.063 -28.458 1.0 24.44 ? 57 A 9 +ATOM 877 H HB3 . ASP A1 1 57 ? -9.335 8.807 -29.513 1.0 64.03 ? 57 A 9 +ATOM 878 N N . SER A1 1 58 ? -6.678 10.962 -26.877 1.0 32.51 ? 58 A 9 +ATOM 879 C CA . SER A1 1 58 ? -5.587 11.022 -25.911 1.0 62.24 ? 58 A 9 +ATOM 880 C C . SER A1 1 58 ? -5.769 12.2 -24.958 1.0 2.12 ? 58 A 9 +ATOM 881 O O . SER A1 1 58 ? -4.897 12.492 -24.141 1.0 12.21 ? 58 A 9 +ATOM 882 C CB . SER A1 1 58 ? -4.244 11.139 -26.634 1.0 65.11 ? 58 A 9 +ATOM 883 O OG . SER A1 1 58 ? -3.174 10.759 -25.786 1.0 34.21 ? 58 A 9 +ATOM 884 H H . SER A1 1 58 ? -6.731 11.642 -27.581 1.0 21.03 ? 58 A 9 +ATOM 885 H HA . SER A1 1 58 ? -5.6 10.106 -25.339 1.0 33.55 ? 58 A 9 +ATOM 886 H HB2 . SER A1 1 58 ? -4.247 10.496 -27.5 1.0 31.42 ? 58 A 9 +ATOM 887 H HB3 . SER A1 1 58 ? -4.094 12.163 -26.946 1.0 40.4 ? 58 A 9 +ATOM 888 H HG . SER A1 1 58 ? -2.813 9.92 -26.083 1.0 10.23 ? 58 A 9 +ATOM 889 N N . ASN A1 1 59 ? -6.909 12.873 -25.071 1.0 35.41 ? 59 A 9 +ATOM 890 C CA . ASN A1 1 59 ? -7.207 14.02 -24.22 1.0 52.34 ? 59 A 9 +ATOM 891 C C . ASN A1 1 59 ? -7.942 13.584 -22.957 1.0 4.01 ? 59 A 9 +ATOM 892 O O . ASN A1 1 59 ? -9.15 13.784 -22.829 1.0 42.21 ? 59 A 9 +ATOM 893 C CB . ASN A1 1 59 ? -8.048 15.044 -24.986 1.0 21.1 ? 59 A 9 +ATOM 894 C CG . ASN A1 1 59 ? -7.201 16.134 -25.613 1.0 14.54 ? 59 A 9 +ATOM 895 O OD1 . ASN A1 1 59 ? -6.008 15.947 -25.856 1.0 24.42 ? 59 A 9 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.815 17.282 -25.878 1.0 14.44 ? 59 A 9 +ATOM 897 H H . ASN A1 1 59 ? -7.566 12.592 -25.742 1.0 5.51 ? 59 A 9 +ATOM 898 H HA . ASN A1 1 59 ? -6.27 14.476 -23.939 1.0 74.51 ? 59 A 9 +ATOM 899 H HB2 . ASN A1 1 59 ? -8.59 14.54 -25.772 1.0 43.43 ? 59 A 9 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.75 15.504 -24.307 1.0 11.21 ? 59 A 9 +ATOM 901 H HD21 . ASN A1 1 59 ? -8.766 17.36 -25.657 1.0 21.33 ? 59 A 9 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.291 18.003 -26.284 1.0 12.0 ? 59 A 9 +ATOM 903 N N . ALA A1 1 60 ? -7.205 12.988 -22.025 1.0 13.11 ? 60 A 9 +ATOM 904 C CA . ALA A1 1 60 ? -7.786 12.527 -20.771 1.0 35.51 ? 60 A 9 +ATOM 905 C C . ALA A1 1 60 ? -6.703 12.074 -19.798 1.0 74.01 ? 60 A 9 +ATOM 906 O O . ALA A1 1 60 ? -6.297 12.826 -18.913 1.0 74.24 ? 60 A 9 +ATOM 907 C CB . ALA A1 1 60 ? -8.771 11.396 -21.03 1.0 64.13 ? 60 A 9 +ATOM 908 H H . ALA A1 1 60 ? -6.247 12.858 -22.185 1.0 31.12 ? 60 A 9 +ATOM 909 H HA . ALA A1 1 60 ? -8.329 13.351 -20.331 1.0 20.01 ? 60 A 9 +ATOM 910 H HB1 . ALA A1 1 60 ? -9.177 11.051 -20.09 1.0 72.33 ? 60 A 9 +ATOM 911 H HB2 . ALA A1 1 60 ? -9.573 11.755 -21.658 1.0 25.02 ? 60 A 9 +ATOM 912 H HB3 . ALA A1 1 60 ? -8.263 10.582 -21.524 1.0 51.02 ? 60 A 9 +ATOM 913 N N . MET A1 1 61 ? -6.24 10.84 -19.968 1.0 21.52 ? 61 A 9 +ATOM 914 C CA . MET A1 1 61 ? -5.203 10.288 -19.104 1.0 32.03 ? 61 A 9 +ATOM 915 C C . MET A1 1 61 ? -3.826 10.805 -19.508 1.0 55.14 ? 61 A 9 +ATOM 916 O O . MET A1 1 61 ? -3.1 11.37 -18.69 1.0 73.23 ? 61 A 9 +ATOM 917 C CB . MET A1 1 61 ? -5.222 8.759 -19.16 1.0 33.12 ? 61 A 9 +ATOM 918 C CG . MET A1 1 61 ? -6.621 8.172 -19.255 1.0 10.31 ? 61 A 9 +ATOM 919 S SD . MET A1 1 61 ? -7.746 8.856 -18.022 1.0 3.45 ? 61 A 9 +ATOM 920 C CE . MET A1 1 61 ? -9.306 8.761 -18.897 1.0 11.34 ? 61 A 9 +ATOM 921 H H . MET A1 1 61 ? -6.603 10.287 -20.691 1.0 44.35 ? 61 A 9 +ATOM 922 H HA . MET A1 1 61 ? -5.411 10.604 -18.093 1.0 14.21 ? 61 A 9 +ATOM 923 H HB2 . MET A1 1 61 ? -4.66 8.435 -20.023 1.0 14.23 ? 61 A 9 +ATOM 924 H HB3 . MET A1 1 61 ? -4.753 8.371 -18.269 1.0 0.24 ? 61 A 9 +ATOM 925 H HG2 . MET A1 1 61 ? -7.019 8.379 -20.237 1.0 62.14 ? 61 A 9 +ATOM 926 H HG3 . MET A1 1 61 ? -6.559 7.104 -19.112 1.0 32.0 ? 61 A 9 +ATOM 927 H HE1 . MET A1 1 61 ? -9.85 7.887 -18.567 1.0 54.23 ? 61 A 9 +ATOM 928 H HE2 . MET A1 1 61 ? -9.888 9.646 -18.692 1.0 64.31 ? 61 A 9 +ATOM 929 H HE3 . MET A1 1 61 ? -9.119 8.69 -19.958 1.0 24.11 ? 61 A 9 +ATOM 930 N N . SER A1 1 62 ? -3.473 10.609 -20.775 1.0 73.15 ? 62 A 9 +ATOM 931 C CA . SER A1 1 62 ? -2.182 11.053 -21.286 1.0 12.22 ? 62 A 9 +ATOM 932 C C . SER A1 1 62 ? -2.007 12.556 -21.09 1.0 13.52 ? 62 A 9 +ATOM 933 O O . SER A1 1 62 ? -0.896 13.039 -20.867 1.0 42.51 ? 62 A 9 +ATOM 934 C CB . SER A1 1 62 ? -2.049 10.702 -22.769 1.0 62.33 ? 62 A 9 +ATOM 935 O OG . SER A1 1 62 ? -0.721 10.319 -23.085 1.0 14.13 ? 62 A 9 +ATOM 936 H H . SER A1 1 62 ? -4.096 10.153 -21.379 1.0 74.25 ? 62 A 9 +ATOM 937 H HA . SER A1 1 62 ? -1.411 10.537 -20.732 1.0 74.15 ? 62 A 9 +ATOM 938 H HB2 . SER A1 1 62 ? -2.712 9.883 -23.003 1.0 54.41 ? 62 A 9 +ATOM 939 H HB3 . SER A1 1 62 ? -2.315 11.563 -23.365 1.0 23.45 ? 62 A 9 +ATOM 940 H HG . SER A1 1 62 ? -0.588 9.399 -22.848 1.0 1.23 ? 62 A 9 +ATOM 941 N N . ASP A1 1 63 ? -3.111 13.289 -21.174 1.0 34.33 ? 63 A 9 +ATOM 942 C CA . ASP A1 1 63 ? -3.082 14.737 -21.005 1.0 10.21 ? 63 A 9 +ATOM 943 C C . ASP A1 1 63 ? -2.595 15.112 -19.608 1.0 63.54 ? 63 A 9 +ATOM 944 O O . ASP A1 1 63 ? -2.068 16.204 -19.396 1.0 31.33 ? 63 A 9 +ATOM 945 C CB . ASP A1 1 63 ? -4.471 15.329 -21.249 1.0 21.1 ? 63 A 9 +ATOM 946 C CG . ASP A1 1 63 ? -4.418 16.799 -21.616 1.0 12.2 ? 63 A 9 +ATOM 947 O OD1 . ASP A1 1 63 ? -4.04 17.614 -20.748 1.0 53.24 ? 63 A 9 +ATOM 948 O OD2 . ASP A1 1 63 ? -4.753 17.134 -22.771 1.0 3.13 ? 63 A 9 +ATOM 949 H H . ASP A1 1 63 ? -3.967 12.846 -21.353 1.0 14.4 ? 63 A 9 +ATOM 950 H HA . ASP A1 1 63 ? -2.395 15.143 -21.732 1.0 72.42 ? 63 A 9 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.946 14.793 -22.058 1.0 63.34 ? 63 A 9 +ATOM 952 H HB3 . ASP A1 1 63 ? -5.064 15.221 -20.353 1.0 44.51 ? 63 A 9 +ATOM 953 N N . TYR A1 1 64 ? -2.775 14.199 -18.66 1.0 43.15 ? 64 A 9 +ATOM 954 C CA . TYR A1 1 64 ? -2.357 14.435 -17.283 1.0 74.44 ? 64 A 9 +ATOM 955 C C . TYR A1 1 64 ? -3.354 15.332 -16.557 1.0 35.31 ? 64 A 9 +ATOM 956 O O . TYR A1 1 64 ? -3.026 15.952 -15.546 1.0 63.11 ? 64 A 9 +ATOM 957 C CB . TYR A1 1 64 ? -0.965 15.069 -17.252 1.0 41.31 ? 64 A 9 +ATOM 958 C CG . TYR A1 1 64 ? -0.188 14.763 -15.992 1.0 35.31 ? 64 A 9 +ATOM 959 C CD1 . TYR A1 1 64 ? 0.232 13.47 -15.708 1.0 10.21 ? 64 A 9 +ATOM 960 C CD2 . TYR A1 1 64 ? 0.126 15.768 -15.085 1.0 61.0 ? 64 A 9 +ATOM 961 C CE1 . TYR A1 1 64 ? 0.942 13.186 -14.557 1.0 31.32 ? 64 A 9 +ATOM 962 C CE2 . TYR A1 1 64 ? 0.836 15.494 -13.932 1.0 3.01 ? 64 A 9 +ATOM 963 C CZ . TYR A1 1 64 ? 1.241 14.201 -13.673 1.0 35.43 ? 64 A 9 +ATOM 964 O OH . TYR A1 1 64 ? 1.949 13.922 -12.526 1.0 23.32 ? 64 A 9 +ATOM 965 H H . TYR A1 1 64 ? -3.2 13.347 -18.891 1.0 10.22 ? 64 A 9 +ATOM 966 H HA . TYR A1 1 64 ? -2.317 13.479 -16.781 1.0 40.51 ? 64 A 9 +ATOM 967 H HB2 . TYR A1 1 64 ? -0.392 14.705 -18.091 1.0 75.32 ? 64 A 9 +ATOM 968 H HB3 . TYR A1 1 64 ? -1.065 16.142 -17.329 1.0 32.34 ? 64 A 9 +ATOM 969 H HD1 . TYR A1 1 64 ? -0.004 12.677 -16.403 1.0 1.35 ? 64 A 9 +ATOM 970 H HD2 . TYR A1 1 64 ? -0.193 16.78 -15.291 1.0 32.41 ? 64 A 9 +ATOM 971 H HE1 . TYR A1 1 64 ? 1.259 12.174 -14.354 1.0 52.21 ? 64 A 9 +ATOM 972 H HE2 . TYR A1 1 64 ? 1.071 16.288 -13.239 1.0 43.14 ? 64 A 9 +ATOM 973 H HH . TYR A1 1 64 ? 1.492 13.242 -12.025 1.0 23.33 ? 64 A 9 +ATOM 974 N N . ASN A1 1 65 ? -4.573 15.397 -17.082 1.0 61.21 ? 65 A 9 +ATOM 975 C CA . ASN A1 1 65 ? -5.62 16.218 -16.485 1.0 70.22 ? 65 A 9 +ATOM 976 C C . ASN A1 1 65 ? -6.684 15.347 -15.824 1.0 21.44 ? 65 A 9 +ATOM 977 O O . ASN A1 1 65 ? -7.76 15.827 -15.466 1.0 22.24 ? 65 A 9 +ATOM 978 C CB . ASN A1 1 65 ? -6.264 17.112 -17.547 1.0 30.31 ? 65 A 9 +ATOM 979 C CG . ASN A1 1 65 ? -7.143 18.189 -16.94 1.0 75.23 ? 65 A 9 +ATOM 980 O OD1 . ASN A1 1 65 ? -6.845 18.718 -15.87 1.0 74.2 ? 65 A 9 +ATOM 981 N ND2 . ASN A1 1 65 ? -8.233 18.517 -17.624 1.0 12.4 ? 65 A 9 +ATOM 982 H H . ASN A1 1 65 ? -4.774 14.88 -17.89 1.0 72.01 ? 65 A 9 +ATOM 983 H HA . ASN A1 1 65 ? -5.163 16.841 -15.731 1.0 43.44 ? 65 A 9 +ATOM 984 H HB2 . ASN A1 1 65 ? -5.487 17.592 -18.124 1.0 12.24 ? 65 A 9 +ATOM 985 H HB3 . ASN A1 1 65 ? -6.87 16.504 -18.201 1.0 73.02 ? 65 A 9 +ATOM 986 H HD21 . ASN A1 1 65 ? -8.406 18.053 -18.47 1.0 23.44 ? 65 A 9 +ATOM 987 H HD22 . ASN A1 1 65 ? -8.818 19.211 -17.256 1.0 32.24 ? 65 A 9 +ATOM 988 N N . VAL A1 1 66 ? -6.376 14.064 -15.664 1.0 11.4 ? 66 A 9 +ATOM 989 C CA . VAL A1 1 66 ? -7.304 13.126 -15.044 1.0 70.45 ? 66 A 9 +ATOM 990 C C . VAL A1 1 66 ? -7.179 13.152 -13.525 1.0 73.11 ? 66 A 9 +ATOM 991 O O . VAL A1 1 66 ? -6.103 12.915 -12.977 1.0 33.12 ? 66 A 9 +ATOM 992 C CB . VAL A1 1 66 ? -7.066 11.689 -15.543 1.0 40.11 ? 66 A 9 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.643 11.246 -15.236 1.0 32.21 ? 66 A 9 +ATOM 994 C CG2 . VAL A1 1 66 ? -8.075 10.735 -14.921 1.0 25.13 ? 66 A 9 +ATOM 995 H H . VAL A1 1 66 ? -5.502 13.741 -15.969 1.0 25.31 ? 66 A 9 +ATOM 996 H HA . VAL A1 1 66 ? -8.307 13.419 -15.318 1.0 44.24 ? 66 A 9 +ATOM 997 H HB . VAL A1 1 66 ? -7.201 11.674 -16.614 1.0 65.05 ? 66 A 9 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.664 10.456 -14.499 1.0 62.5 ? 66 A 9 +ATOM 999 H HG12 . VAL A1 1 66 ? -5.176 10.884 -16.14 1.0 4.5 ? 66 A 9 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.081 12.083 -14.85 1.0 12.32 ? 66 A 9 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.068 10.852 -13.848 1.0 23.4 ? 66 A 9 +ATOM 1002 H HG22 . VAL A1 1 66 ? -9.061 10.959 -15.302 1.0 64.2 ? 66 A 9 +ATOM 1003 H HG23 . VAL A1 1 66 ? -7.814 9.718 -15.175 1.0 74.31 ? 66 A 9 +ATOM 1004 N N . GLN A1 1 67 ? -8.288 13.442 -12.851 1.0 5.43 ? 67 A 9 +ATOM 1005 C CA . GLN A1 1 67 ? -8.302 13.499 -11.394 1.0 15.5 ? 67 A 9 +ATOM 1006 C C . GLN A1 1 67 ? -9.326 12.525 -10.821 1.0 62.54 ? 67 A 9 +ATOM 1007 O O . GLN A1 1 67 ? -9.976 11.784 -11.559 1.0 44.01 ? 67 A 9 +ATOM 1008 C CB . GLN A1 1 67 ? -8.613 14.92 -10.921 1.0 35.11 ? 67 A 9 +ATOM 1009 C CG . GLN A1 1 67 ? -10.002 15.4 -11.31 1.0 11.21 ? 67 A 9 +ATOM 1010 C CD . GLN A1 1 67 ? -10.439 16.621 -10.524 1.0 34.44 ? 67 A 9 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.642 17.697 -11.088 1.0 41.54 ? 67 A 9 +ATOM 1012 N NE2 . GLN A1 1 67 ? -10.585 16.461 -9.214 1.0 50.51 ? 67 A 9 +ATOM 1013 H H . GLN A1 1 67 ? -9.114 13.621 -13.344 1.0 54.23 ? 67 A 9 +ATOM 1014 H HA . GLN A1 1 67 ? -7.321 13.219 -11.041 1.0 21.13 ? 67 A 9 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.531 14.955 -9.845 1.0 61.05 ? 67 A 9 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.889 15.596 -11.351 1.0 21.05 ? 67 A 9 +ATOM 1017 H HG2 . GLN A1 1 67 ? -10.002 15.649 -12.361 1.0 63.24 ? 67 A 9 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.708 14.603 -11.13 1.0 63.02 ? 67 A 9 +ATOM 1019 H HE21 . GLN A1 1 67 ? -10.405 15.576 -8.833 1.0 0.12 ? 67 A 9 +ATOM 1020 H HE22 . GLN A1 1 67 ? -10.866 17.234 -8.682 1.0 72.41 ? 67 A 9 +ATOM 1021 N N . LYS A1 1 68 ? -9.465 12.529 -9.499 1.0 63.33 ? 68 A 9 +ATOM 1022 C CA . LYS A1 1 68 ? -10.41 11.647 -8.826 1.0 34.0 ? 68 A 9 +ATOM 1023 C C . LYS A1 1 68 ? -11.847 12.013 -9.184 1.0 33.21 ? 68 A 9 +ATOM 1024 O O . LYS A1 1 68 ? -12.726 11.152 -9.217 1.0 33.01 ? 68 A 9 +ATOM 1025 C CB . LYS A1 1 68 ? -10.217 11.721 -7.309 1.0 41.41 ? 68 A 9 +ATOM 1026 C CG . LYS A1 1 68 ? -10.817 10.543 -6.561 1.0 61.44 ? 68 A 9 +ATOM 1027 C CD . LYS A1 1 68 ? -10.066 9.255 -6.855 1.0 43.41 ? 68 A 9 +ATOM 1028 C CE . LYS A1 1 68 ? -8.825 9.123 -5.987 1.0 23.43 ? 68 A 9 +ATOM 1029 N NZ . LYS A1 1 68 ? -9.163 9.09 -4.537 1.0 52.05 ? 68 A 9 +ATOM 1030 H H . LYS A1 1 68 ? -8.918 13.142 -8.964 1.0 75.53 ? 68 A 9 +ATOM 1031 H HA . LYS A1 1 68 ? -10.215 10.638 -9.156 1.0 31.4 ? 68 A 9 +ATOM 1032 H HB2 . LYS A1 1 68 ? -9.159 11.756 -7.094 1.0 51.5 ? 68 A 9 +ATOM 1033 H HB3 . LYS A1 1 68 ? -10.68 12.626 -6.944 1.0 62.4 ? 68 A 9 +ATOM 1034 H HG2 . LYS A1 1 68 ? -10.77 10.74 -5.501 1.0 22.33 ? 68 A 9 +ATOM 1035 H HG3 . LYS A1 1 68 ? -11.848 10.425 -6.862 1.0 45.02 ? 68 A 9 +ATOM 1036 H HD2 . LYS A1 1 68 ? -10.718 8.416 -6.661 1.0 14.2 ? 68 A 9 +ATOM 1037 H HD3 . LYS A1 1 68 ? -9.77 9.251 -7.895 1.0 13.53 ? 68 A 9 +ATOM 1038 H HE2 . LYS A1 1 68 ? -8.313 8.21 -6.249 1.0 43.13 ? 68 A 9 +ATOM 1039 H HE3 . LYS A1 1 68 ? -8.177 9.966 -6.177 1.0 63.42 ? 68 A 9 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -8.446 8.547 -4.015 1.0 1.54 ? 68 A 9 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -10.091 8.642 -4.397 1.0 73.32 ? 68 A 9 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -9.197 10.056 -4.155 1.0 23.44 ? 68 A 9 +ATOM 1043 N N . GLU A1 1 69 ? -12.076 13.294 -9.455 1.0 51.1 ? 69 A 9 +ATOM 1044 C CA . GLU A1 1 69 ? -13.407 13.772 -9.812 1.0 15.41 ? 69 A 9 +ATOM 1045 C C . GLU A1 1 69 ? -13.322 14.921 -10.812 1.0 20.25 ? 69 A 9 +ATOM 1046 O O . GLU A1 1 69 ? -13.444 16.089 -10.444 1.0 55.15 ? 69 A 9 +ATOM 1047 C CB . GLU A1 1 69 ? -14.163 14.224 -8.561 1.0 42.14 ? 69 A 9 +ATOM 1048 C CG . GLU A1 1 69 ? -13.333 15.088 -7.627 1.0 32.44 ? 69 A 9 +ATOM 1049 C CD . GLU A1 1 69 ? -14.186 15.95 -6.717 1.0 60.3 ? 69 A 9 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.659 15.434 -5.682 1.0 52.11 ? 69 A 9 +ATOM 1051 O OE2 . GLU A1 1 69 ? -14.38 17.141 -7.039 1.0 33.22 ? 69 A 9 +ATOM 1052 H H . GLU A1 1 69 ? -11.334 13.932 -9.412 1.0 51.55 ? 69 A 9 +ATOM 1053 H HA . GLU A1 1 69 ? -13.942 12.953 -10.268 1.0 21.13 ? 69 A 9 +ATOM 1054 H HB2 . GLU A1 1 69 ? -15.032 14.79 -8.865 1.0 70.35 ? 69 A 9 +ATOM 1055 H HB3 . GLU A1 1 69 ? -14.488 13.35 -8.016 1.0 25.14 ? 69 A 9 +ATOM 1056 H HG2 . GLU A1 1 69 ? -12.717 14.445 -7.015 1.0 60.54 ? 69 A 9 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.7 15.732 -8.22 1.0 2.43 ? 69 A 9 +ATOM 1058 N N . SER A1 1 70 ? -13.111 14.58 -12.08 1.0 51.41 ? 70 A 9 +ATOM 1059 C CA . SER A1 1 70 ? -13.005 15.583 -13.133 1.0 50.24 ? 70 A 9 +ATOM 1060 C C . SER A1 1 70 ? -14.359 15.82 -13.796 1.0 72.1 ? 70 A 9 +ATOM 1061 O O . SER A1 1 70 ? -15.014 14.882 -14.251 1.0 13.02 ? 70 A 9 +ATOM 1062 C CB . SER A1 1 70 ? -11.981 15.145 -14.182 1.0 75.43 ? 70 A 9 +ATOM 1063 O OG . SER A1 1 70 ? -11.057 16.184 -14.458 1.0 45.33 ? 70 A 9 +ATOM 1064 H H . SER A1 1 70 ? -13.023 13.632 -12.311 1.0 42.55 ? 70 A 9 +ATOM 1065 H HA . SER A1 1 70 ? -12.672 16.505 -12.681 1.0 61.25 ? 70 A 9 +ATOM 1066 H HB2 . SER A1 1 70 ? -11.44 14.286 -13.816 1.0 1.23 ? 70 A 9 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.495 14.884 -15.096 1.0 50.33 ? 70 A 9 +ATOM 1068 H HG . SER A1 1 70 ? -11.053 16.367 -15.4 1.0 14.24 ? 70 A 9 +ATOM 1069 N N . THR A1 1 71 ? -14.773 17.083 -13.846 1.0 52.55 ? 71 A 9 +ATOM 1070 C CA . THR A1 1 71 ? -16.048 17.445 -14.451 1.0 43.33 ? 71 A 9 +ATOM 1071 C C . THR A1 1 71 ? -15.871 17.841 -15.912 1.0 63.44 ? 71 A 9 +ATOM 1072 O O . THR A1 1 71 ? -15.23 18.847 -16.22 1.0 13.52 ? 71 A 9 +ATOM 1073 C CB . THR A1 1 71 ? -16.719 18.607 -13.694 1.0 4.41 ? 71 A 9 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.726 19.529 -13.233 1.0 4.41 ? 71 A 9 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.525 18.088 -12.512 1.0 4.35 ? 71 A 9 +ATOM 1076 H H . THR A1 1 71 ? -14.206 17.786 -13.466 1.0 14.04 ? 71 A 9 +ATOM 1077 H HA . THR A1 1 71 ? -16.699 16.584 -14.398 1.0 24.13 ? 71 A 9 +ATOM 1078 H HB . THR A1 1 71 ? -17.389 19.118 -14.37 1.0 70.41 ? 71 A 9 +ATOM 1079 H HG1 . THR A1 1 71 ? -16.147 20.22 -12.715 1.0 53.11 ? 71 A 9 +ATOM 1080 H HG21 . THR A1 1 71 ? -18.522 17.837 -12.839 1.0 12.42 ? 71 A 9 +ATOM 1081 H HG22 . THR A1 1 71 ? -17.579 18.852 -11.75 1.0 75.2 ? 71 A 9 +ATOM 1082 H HG23 . THR A1 1 71 ? -17.046 17.209 -12.108 1.0 31.12 ? 71 A 9 +ATOM 1083 N N . LEU A1 1 72 ? -16.442 17.045 -16.81 1.0 74.32 ? 72 A 9 +ATOM 1084 C CA . LEU A1 1 72 ? -16.348 17.314 -18.24 1.0 62.12 ? 72 A 9 +ATOM 1085 C C . LEU A1 1 72 ? -17.729 17.308 -18.888 1.0 14.1 ? 72 A 9 +ATOM 1086 O O . LEU A1 1 72 ? -18.652 16.655 -18.4 1.0 22.33 ? 72 A 9 +ATOM 1087 C CB . LEU A1 1 72 ? -15.451 16.275 -18.916 1.0 54.24 ? 72 A 9 +ATOM 1088 C CG . LEU A1 1 72 ? -16.164 15.065 -19.521 1.0 12.34 ? 72 A 9 +ATOM 1089 C CD1 . LEU A1 1 72 ? -16.349 15.248 -21.019 1.0 71.53 ? 72 A 9 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.387 13.789 -19.23 1.0 45.31 ? 72 A 9 +ATOM 1091 H H . LEU A1 1 72 ? -16.939 16.259 -16.504 1.0 40.44 ? 72 A 9 +ATOM 1092 H HA . LEU A1 1 72 ? -15.909 18.292 -18.365 1.0 22.23 ? 72 A 9 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.91 16.77 -19.708 1.0 24.33 ? 72 A 9 +ATOM 1094 H HB3 . LEU A1 1 72 ? -14.751 15.913 -18.177 1.0 64.44 ? 72 A 9 +ATOM 1095 H HG . LEU A1 1 72 ? -17.143 14.971 -19.073 1.0 60.22 ? 72 A 9 +ATOM 1096 H HD11 . LEU A1 1 72 ? -15.388 15.407 -21.484 1.0 22.12 ? 72 A 9 +ATOM 1097 H HD12 . LEU A1 1 72 ? -16.983 16.104 -21.201 1.0 11.12 ? 72 A 9 +ATOM 1098 H HD13 . LEU A1 1 72 ? -16.81 14.364 -21.435 1.0 74.11 ? 72 A 9 +ATOM 1099 H HD21 . LEU A1 1 72 ? -14.53 13.732 -19.885 1.0 45.11 ? 72 A 9 +ATOM 1100 H HD22 . LEU A1 1 72 ? -16.026 12.934 -19.397 1.0 64.51 ? 72 A 9 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.056 13.795 -18.202 1.0 15.53 ? 72 A 9 +ATOM 1102 N N . HIS A1 1 73 ? -17.863 18.038 -19.99 1.0 22.1 ? 73 A 9 +ATOM 1103 C CA . HIS A1 1 73 ? -19.131 18.115 -20.707 1.0 43.22 ? 73 A 9 +ATOM 1104 C C . HIS A1 1 73 ? -19.16 17.126 -21.868 1.0 1.12 ? 73 A 9 +ATOM 1105 O O . HIS A1 1 73 ? -18.334 17.197 -22.779 1.0 41.41 ? 73 A 9 +ATOM 1106 C CB . HIS A1 1 73 ? -19.363 19.535 -21.226 1.0 34.11 ? 73 A 9 +ATOM 1107 C CG . HIS A1 1 73 ? -20.8 19.84 -21.515 1.0 25.31 ? 73 A 9 +ATOM 1108 N ND1 . HIS A1 1 73 ? -21.35 21.094 -21.357 1.0 22.31 ? 73 A 9 +ATOM 1109 C CD2 . HIS A1 1 73 ? -21.802 19.044 -21.957 1.0 30.12 ? 73 A 9 +ATOM 1110 C CE1 . HIS A1 1 73 ? -22.629 21.057 -21.687 1.0 74.03 ? 73 A 9 +ATOM 1111 N NE2 . HIS A1 1 73 ? -22.928 19.824 -22.056 1.0 22.32 ? 73 A 9 +ATOM 1112 H H . HIS A1 1 73 ? -17.091 18.537 -20.33 1.0 41.1 ? 73 A 9 +ATOM 1113 H HA . HIS A1 1 73 ? -19.919 17.862 -20.014 1.0 23.25 ? 73 A 9 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.016 20.242 -20.486 1.0 51.13 ? 73 A 9 +ATOM 1115 H HB3 . HIS A1 1 73 ? -18.803 19.673 -22.139 1.0 64.13 ? 73 A 9 +ATOM 1116 H HD1 . HIS A1 1 73 ? -20.875 21.892 -21.046 1.0 63.31 ? 73 A 9 +ATOM 1117 H HD2 . HIS A1 1 73 ? -21.731 17.991 -22.189 1.0 71.43 ? 73 A 9 +ATOM 1118 H HE1 . HIS A1 1 73 ? -23.313 21.891 -21.661 1.0 3.34 ? 73 A 9 +ATOM 1119 N N . LEU A1 1 74 ? -20.115 16.203 -21.829 1.0 31.4 ? 74 A 9 +ATOM 1120 C CA . LEU A1 1 74 ? -20.252 15.198 -22.877 1.0 41.22 ? 74 A 9 +ATOM 1121 C C . LEU A1 1 74 ? -21.463 15.49 -23.757 1.0 21.0 ? 74 A 9 +ATOM 1122 O O . LEU A1 1 74 ? -22.601 15.484 -23.286 1.0 70.53 ? 74 A 9 +ATOM 1123 C CB . LEU A1 1 74 ? -20.378 13.804 -22.261 1.0 42.32 ? 74 A 9 +ATOM 1124 C CG . LEU A1 1 74 ? -21.085 12.753 -23.118 1.0 13.02 ? 74 A 9 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.424 12.644 -24.483 1.0 50.12 ? 74 A 9 +ATOM 1126 C CD2 . LEU A1 1 74 ? -21.086 11.404 -22.414 1.0 22.4 ? 74 A 9 +ATOM 1127 H H . LEU A1 1 74 ? -20.744 16.197 -21.078 1.0 53.04 ? 74 A 9 +ATOM 1128 H HA . LEU A1 1 74 ? -19.362 15.234 -23.488 1.0 65.43 ? 74 A 9 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.382 13.444 -22.052 1.0 22.02 ? 74 A 9 +ATOM 1130 H HB3 . LEU A1 1 74 ? -20.926 13.901 -21.335 1.0 20.31 ? 74 A 9 +ATOM 1131 H HG . LEU A1 1 74 ? -22.113 13.053 -23.268 1.0 34.12 ? 74 A 9 +ATOM 1132 H HD11 . LEU A1 1 74 ? -19.387 12.932 -24.405 1.0 33.01 ? 74 A 9 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.928 13.298 -25.18 1.0 1.34 ? 74 A 9 +ATOM 1134 H HD13 . LEU A1 1 74 ? -20.49 11.625 -24.834 1.0 63.14 ? 74 A 9 +ATOM 1135 H HD21 . LEU A1 1 74 ? -20.074 11.138 -22.145 1.0 12.32 ? 74 A 9 +ATOM 1136 H HD22 . LEU A1 1 74 ? -21.492 10.653 -23.076 1.0 54.43 ? 74 A 9 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.693 11.463 -21.522 1.0 14.02 ? 74 A 9 +ATOM 1138 N N . VAL A1 1 75 ? -21.212 15.742 -25.037 1.0 43.5 ? 75 A 9 +ATOM 1139 C CA . VAL A1 1 75 ? -22.282 16.032 -25.984 1.0 52.32 ? 75 A 9 +ATOM 1140 C C . VAL A1 1 75 ? -22.448 14.9 -26.991 1.0 61.15 ? 75 A 9 +ATOM 1141 O O . VAL A1 1 75 ? -21.483 14.476 -27.629 1.0 54.31 ? 75 A 9 +ATOM 1142 C CB . VAL A1 1 75 ? -22.019 17.346 -26.744 1.0 24.5 ? 75 A 9 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.204 17.697 -27.63 1.0 55.3 ? 75 A 9 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.719 18.474 -25.769 1.0 64.14 ? 75 A 9 +ATOM 1145 H H . VAL A1 1 75 ? -20.284 15.732 -25.353 1.0 70.11 ? 75 A 9 +ATOM 1146 H HA . VAL A1 1 75 ? -23.201 16.142 -25.426 1.0 60.52 ? 75 A 9 +ATOM 1147 H HB . VAL A1 1 75 ? -21.154 17.205 -27.376 1.0 44.41 ? 75 A 9 +ATOM 1148 H HG11 . VAL A1 1 75 ? -23.629 18.636 -27.307 1.0 31.54 ? 75 A 9 +ATOM 1149 H HG12 . VAL A1 1 75 ? -22.874 17.784 -28.655 1.0 61.34 ? 75 A 9 +ATOM 1150 H HG13 . VAL A1 1 75 ? -23.951 16.92 -27.557 1.0 54.52 ? 75 A 9 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.787 19.422 -26.282 1.0 5.24 ? 75 A 9 +ATOM 1152 H HG22 . VAL A1 1 75 ? -22.434 18.45 -24.96 1.0 61.35 ? 75 A 9 +ATOM 1153 H HG23 . VAL A1 1 75 ? -20.722 18.351 -25.371 1.0 24.43 ? 75 A 9 +ATOM 1154 N N . LEU A1 1 76 ? -23.676 14.414 -27.129 1.0 35.1 ? 76 A 9 +ATOM 1155 C CA . LEU A1 1 76 ? -23.969 13.329 -28.06 1.0 22.53 ? 76 A 9 +ATOM 1156 C C . LEU A1 1 76 ? -25.073 13.73 -29.034 1.0 2.14 ? 76 A 9 +ATOM 1157 O O . LEU A1 1 76 ? -26.07 14.336 -28.641 1.0 21.5 ? 76 A 9 +ATOM 1158 C CB . LEU A1 1 76 ? -24.381 12.071 -27.294 1.0 73.12 ? 76 A 9 +ATOM 1159 C CG . LEU A1 1 76 ? -24.311 12.16 -25.769 1.0 64.45 ? 76 A 9 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.526 12.891 -25.221 1.0 24.13 ? 76 A 9 +ATOM 1161 C CD2 . LEU A1 1 76 ? -24.202 10.77 -25.159 1.0 22.03 ? 76 A 9 +ATOM 1162 H H . LEU A1 1 76 ? -24.404 14.792 -26.594 1.0 44.32 ? 76 A 9 +ATOM 1163 H HA . LEU A1 1 76 ? -23.07 13.121 -28.62 1.0 53.04 ? 76 A 9 +ATOM 1164 H HB2 . LEU A1 1 76 ? -25.4 11.838 -27.565 1.0 71.31 ? 76 A 9 +ATOM 1165 H HB3 . LEU A1 1 76 ? -23.734 11.265 -27.61 1.0 62.14 ? 76 A 9 +ATOM 1166 H HG . LEU A1 1 76 ? -23.43 12.72 -25.488 1.0 42.11 ? 76 A 9 +ATOM 1167 H HD11 . LEU A1 1 76 ? -25.784 12.486 -24.254 1.0 12.14 ? 76 A 9 +ATOM 1168 H HD12 . LEU A1 1 76 ? -26.358 12.766 -25.898 1.0 23.21 ? 76 A 9 +ATOM 1169 H HD13 . LEU A1 1 76 ? -25.299 13.943 -25.122 1.0 40.2 ? 76 A 9 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.313 10.714 -24.548 1.0 53.24 ? 76 A 9 +ATOM 1171 H HD22 . LEU A1 1 76 ? -24.144 10.035 -25.947 1.0 72.02 ? 76 A 9 +ATOM 1172 H HD23 . LEU A1 1 76 ? -25.072 10.576 -24.548 1.0 63.4 ? 76 A 9 +ATOM 1173 N N . ARG A1 1 77 ? -24.888 13.387 -30.304 1.0 50.44 ? 77 A 9 +ATOM 1174 C CA . ARG A1 1 77 ? -25.868 13.71 -31.333 1.0 12.4 ? 77 A 9 +ATOM 1175 C C . ARG A1 1 77 ? -26.539 12.446 -31.862 1.0 10.32 ? 77 A 9 +ATOM 1176 O O . ARG A1 1 77 ? -26.292 12.024 -32.992 1.0 12.43 ? 77 A 9 +ATOM 1177 C CB . ARG A1 1 77 ? -25.201 14.465 -32.484 1.0 55.35 ? 77 A 9 +ATOM 1178 C CG . ARG A1 1 77 ? -24.389 15.669 -32.034 1.0 12.22 ? 77 A 9 +ATOM 1179 C CD . ARG A1 1 77 ? -22.934 15.55 -32.458 1.0 60.22 ? 77 A 9 +ATOM 1180 N NE . ARG A1 1 77 ? -22.372 16.839 -32.853 1.0 64.33 ? 77 A 9 +ATOM 1181 C CZ . ARG A1 1 77 ? -21.288 16.967 -33.61 1.0 13.31 ? 77 A 9 +ATOM 1182 N NH1 . ARG A1 1 77 ? -20.654 15.89 -34.053 1.0 63.3 ? 77 A 9 +ATOM 1183 N NH2 . ARG A1 1 77 ? -20.837 18.174 -33.927 1.0 70.54 ? 77 A 9 +ATOM 1184 H H . ARG A1 1 77 ? -24.072 12.905 -30.555 1.0 2.41 ? 77 A 9 +ATOM 1185 H HA . ARG A1 1 77 ? -26.621 14.344 -30.888 1.0 53.23 ? 77 A 9 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.54 13.789 -33.008 1.0 41.04 ? 77 A 9 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.965 14.808 -33.165 1.0 23.23 ? 77 A 9 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.809 16.56 -32.475 1.0 3.21 ? 77 A 9 +ATOM 1189 H HG3 . ARG A1 1 77 ? -24.437 15.741 -30.958 1.0 45.32 ? 77 A 9 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.362 15.157 -31.63 1.0 24.22 ? 77 A 9 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.871 14.869 -33.294 1.0 55.12 ? 77 A 9 +ATOM 1192 H HE . ARG A1 1 77 ? -22.825 17.647 -32.537 1.0 41.44 ? 77 A 9 +ATOM 1193 H HH11 . ARG A1 1 77 ? -20.991 14.979 -33.817 1.0 31.24 ? 77 A 9 +ATOM 1194 H HH12 . ARG A1 1 77 ? -19.839 15.989 -34.625 1.0 72.5 ? 77 A 9 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.313 18.988 -33.595 1.0 71.34 ? 77 A 9 +ATOM 1196 H HH22 . ARG A1 1 77 ? -20.022 18.269 -34.497 1.0 1.44 ? 77 A 9 +ATOM 1197 N N . LEU A1 1 78 ? -27.389 11.845 -31.036 1.0 31.03 ? 78 A 9 +ATOM 1198 C CA . LEU A1 1 78 ? -28.096 10.628 -31.42 1.0 51.32 ? 78 A 9 +ATOM 1199 C C . LEU A1 1 78 ? -29.222 10.938 -32.401 1.0 14.11 ? 78 A 9 +ATOM 1200 O O . LEU A1 1 78 ? -29.411 10.227 -33.389 1.0 12.31 ? 78 A 9 +ATOM 1201 C CB . LEU A1 1 78 ? -28.662 9.931 -30.181 1.0 42.51 ? 78 A 9 +ATOM 1202 C CG . LEU A1 1 78 ? -27.692 9.032 -29.414 1.0 51.45 ? 78 A 9 +ATOM 1203 C CD1 . LEU A1 1 78 ? -26.573 9.856 -28.798 1.0 14.44 ? 78 A 9 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.43 8.244 -28.342 1.0 25.32 ? 78 A 9 +ATOM 1205 H H . LEU A1 1 78 ? -27.546 12.227 -30.148 1.0 75.31 ? 78 A 9 +ATOM 1206 H HA . LEU A1 1 78 ? -27.387 9.97 -31.9 1.0 64.2 ? 78 A 9 +ATOM 1207 H HB2 . LEU A1 1 78 ? -29.011 10.695 -29.503 1.0 61.14 ? 78 A 9 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.499 9.325 -30.497 1.0 62.32 ? 78 A 9 +ATOM 1209 H HG . LEU A1 1 78 ? -27.246 8.326 -30.102 1.0 53.42 ? 78 A 9 +ATOM 1210 H HD11 . LEU A1 1 78 ? -26.997 10.637 -28.185 1.0 3.24 ? 78 A 9 +ATOM 1211 H HD12 . LEU A1 1 78 ? -25.977 10.298 -29.582 1.0 74.14 ? 78 A 9 +ATOM 1212 H HD13 . LEU A1 1 78 ? -25.95 9.218 -28.189 1.0 11.41 ? 78 A 9 +ATOM 1213 H HD21 . LEU A1 1 78 ? -27.79 8.122 -27.481 1.0 65.32 ? 78 A 9 +ATOM 1214 H HD22 . LEU A1 1 78 ? -28.7 7.273 -28.731 1.0 65.43 ? 78 A 9 +ATOM 1215 H HD23 . LEU A1 1 78 ? -29.324 8.778 -28.054 1.0 34.04 ? 78 A 9 +ATOM 1216 N N . ARG A1 1 79 ? -29.964 12.004 -32.124 1.0 44.5 ? 79 A 9 +ATOM 1217 C CA . ARG A1 1 79 ? -31.07 12.41 -32.984 1.0 54.44 ? 79 A 9 +ATOM 1218 C C . ARG A1 1 79 ? -30.556 13.113 -34.236 1.0 43.43 ? 79 A 9 +ATOM 1219 O O . ARG A1 1 79 ? -30.309 14.318 -34.227 1.0 24.23 ? 79 A 9 +ATOM 1220 C CB . ARG A1 1 79 ? -32.024 13.333 -32.223 1.0 53.1 ? 79 A 9 +ATOM 1221 C CG . ARG A1 1 79 ? -33.264 12.628 -31.697 1.0 62.42 ? 79 A 9 +ATOM 1222 C CD . ARG A1 1 79 ? -32.91 11.588 -30.646 1.0 15.2 ? 79 A 9 +ATOM 1223 N NE . ARG A1 1 79 ? -33.266 10.237 -31.072 1.0 22.21 ? 79 A 9 +ATOM 1224 C CZ . ARG A1 1 79 ? -34.518 9.801 -31.166 1.0 43.33 ? 79 A 9 +ATOM 1225 N NH1 . ARG A1 1 79 ? -35.527 10.607 -30.866 1.0 51.34 ? 79 A 9 +ATOM 1226 N NH2 . ARG A1 1 79 ? -34.761 8.558 -31.56 1.0 24.34 ? 79 A 9 +ATOM 1227 H H . ARG A1 1 79 ? -29.765 12.531 -31.323 1.0 30.43 ? 79 A 9 +ATOM 1228 H HA . ARG A1 1 79 ? -31.605 11.519 -33.279 1.0 75.12 ? 79 A 9 +ATOM 1229 H HB2 . ARG A1 1 79 ? -31.498 13.761 -31.382 1.0 72.51 ? 79 A 9 +ATOM 1230 H HB3 . ARG A1 1 79 ? -32.34 14.127 -32.882 1.0 62.3 ? 79 A 9 +ATOM 1231 H HG2 . ARG A1 1 79 ? -33.923 13.36 -31.255 1.0 34.21 ? 79 A 9 +ATOM 1232 H HG3 . ARG A1 1 79 ? -33.765 12.14 -32.52 1.0 51.44 ? 79 A 9 +ATOM 1233 H HD2 . ARG A1 1 79 ? -31.847 11.628 -30.462 1.0 21.42 ? 79 A 9 +ATOM 1234 H HD3 . ARG A1 1 79 ? -33.442 11.82 -29.736 1.0 24.22 ? 79 A 9 +ATOM 1235 H HE . ARG A1 1 79 ? -32.535 9.625 -31.298 1.0 63.2 ? 79 A 9 +ATOM 1236 H HH11 . ARG A1 1 79 ? -35.347 11.544 -30.57 1.0 0.03 ? 79 A 9 +ATOM 1237 H HH12 . ARG A1 1 79 ? -36.469 10.277 -30.939 1.0 54.33 ? 79 A 9 +ATOM 1238 H HH21 . ARG A1 1 79 ? -34.003 7.948 -31.787 1.0 72.3 ? 79 A 9 +ATOM 1239 H HH22 . ARG A1 1 79 ? -35.703 8.232 -31.631 1.0 2.44 ? 79 A 9 +ATOM 1240 N N . GLY A1 1 80 ? -30.396 12.35 -35.314 1.0 11.03 ? 80 A 9 +ATOM 1241 C CA . GLY A1 1 80 ? -29.912 12.917 -36.559 1.0 3.12 ? 80 A 9 +ATOM 1242 C C . GLY A1 1 80 ? -29.827 11.889 -37.67 1.0 52.34 ? 80 A 9 +ATOM 1243 O O . GLY A1 1 80 ? -28.955 11.969 -38.533 1.0 43.44 ? 80 A 9 +ATOM 1244 H H . GLY A1 1 80 ? -30.609 11.395 -35.263 1.0 0.24 ? 80 A 9 +ATOM 1245 H HA2 . GLY A1 1 80 ? -30.579 13.709 -36.865 1.0 71.24 ? 80 A 9 +ATOM 1246 H HA3 . GLY A1 1 80 ? -28.929 13.333 -36.393 1.0 43.14 ? 80 A 9 +ATOM 1247 N N . GLY A1 1 81 ? -30.735 10.919 -37.647 1.0 43.34 ? 81 A 9 +ATOM 1248 C CA . GLY A1 1 81 ? -30.741 9.884 -38.664 1.0 20.2 ? 81 A 9 +ATOM 1249 C C . GLY A1 1 81 ? -30.906 8.496 -38.077 1.0 63.23 ? 81 A 9 +ATOM 1250 O O . GLY A1 1 81 ? -31.912 8.202 -37.431 1.0 30.24 ? 81 A 9 +ATOM 1251 H H . GLY A1 1 81 ? -31.407 10.906 -36.933 1.0 11.33 ? 81 A 9 +ATOM 1252 H HA2 . GLY A1 1 81 ? -31.553 10.072 -39.35 1.0 30.51 ? 81 A 9 +ATOM 1253 H HA3 . GLY A1 1 81 ? -29.807 9.923 -39.207 1.0 55.14 ? 81 A 9 +ATOM 1254 N N . VAL A1 1 82 ? -29.916 7.637 -38.304 1.0 30.52 ? 82 A 9 +ATOM 1255 C CA . VAL A1 1 82 ? -29.956 6.272 -37.794 1.0 4.45 ? 82 A 9 +ATOM 1256 C C . VAL A1 1 82 ? -28.726 5.965 -36.947 1.0 63.52 ? 82 A 9 +ATOM 1257 O O . VAL A1 1 82 ? -28.672 6.306 -35.766 1.0 12.52 ? 82 A 9 +ATOM 1258 C CB . VAL A1 1 82 ? -30.046 5.247 -38.94 1.0 53.54 ? 82 A 9 +ATOM 1259 C CG1 . VAL A1 1 82 ? -28.829 5.352 -39.847 1.0 33.31 ? 82 A 9 +ATOM 1260 C CG2 . VAL A1 1 82 ? -30.187 3.838 -38.384 1.0 1.13 ? 82 A 9 +ATOM 1261 H H . VAL A1 1 82 ? -29.14 7.93 -38.826 1.0 42.11 ? 82 A 9 +ATOM 1262 H HA . VAL A1 1 82 ? -30.839 6.171 -37.179 1.0 65.12 ? 82 A 9 +ATOM 1263 H HB . VAL A1 1 82 ? -30.925 5.47 -39.527 1.0 3.02 ? 82 A 9 +ATOM 1264 H HG11 . VAL A1 1 82 ? -28.729 6.369 -40.197 1.0 71.54 ? 82 A 9 +ATOM 1265 H HG12 . VAL A1 1 82 ? -27.944 5.071 -39.295 1.0 43.52 ? 82 A 9 +ATOM 1266 H HG13 . VAL A1 1 82 ? -28.952 4.691 -40.692 1.0 60.31 ? 82 A 9 +ATOM 1267 H HG21 . VAL A1 1 82 ? -31.144 3.43 -38.675 1.0 51.1 ? 82 A 9 +ATOM 1268 H HG22 . VAL A1 1 82 ? -29.396 3.216 -38.776 1.0 43.42 ? 82 A 9 +ATOM 1269 H HG23 . VAL A1 1 82 ? -30.121 3.867 -37.306 1.0 61.21 ? 82 A 9 +ATOM 1 N N . GLY A1 1 1 ? -9.315 -3.394 -3.453 1.0 13.0 ? 1 A 10 +ATOM 2 C CA . GLY A1 1 1 ? -8.883 -2.262 -2.652 1.0 45.03 ? 1 A 10 +ATOM 3 C C . GLY A1 1 1 ? -7.565 -1.684 -3.129 1.0 65.21 ? 1 A 10 +ATOM 4 O O . GLY A1 1 1 ? -6.539 -1.786 -2.456 1.0 33.34 ? 1 A 10 +ATOM 5 H H1 . GLY A1 1 1 ? -9.316 -4.294 -3.065 1.0 52.4 ? 1 A 10 +ATOM 6 H HA2 . GLY A1 1 1 ? -9.64 -1.493 -2.699 1.0 14.15 ? 1 A 10 +ATOM 7 H HA3 . GLY A1 1 1 ? -8.773 -2.583 -1.627 1.0 34.23 ? 1 A 10 +ATOM 8 N N . PRO A1 1 2 ? -7.582 -1.062 -4.317 1.0 55.32 ? 2 A 10 +ATOM 9 C CA . PRO A1 1 2 ? -6.387 -0.454 -4.909 1.0 21.43 ? 2 A 10 +ATOM 10 C C . PRO A1 1 2 ? -5.934 0.79 -4.154 1.0 41.45 ? 2 A 10 +ATOM 11 O O . PRO A1 1 2 ? -6.508 1.147 -3.124 1.0 62.42 ? 2 A 10 +ATOM 12 C CB . PRO A1 1 2 ? -6.841 -0.086 -6.324 1.0 51.45 ? 2 A 10 +ATOM 13 C CG . PRO A1 1 2 ? -8.318 0.08 -6.217 1.0 43.11 ? 2 A 10 +ATOM 14 C CD . PRO A1 1 2 ? -8.77 -0.903 -5.173 1.0 64.14 ? 2 A 10 +ATOM 15 H HA . PRO A1 1 2 ? -5.57 -1.158 -4.964 1.0 31.54 ? 2 A 10 +ATOM 16 H HB2 . PRO A1 1 2 ? -6.361 0.833 -6.631 1.0 42.4 ? 2 A 10 +ATOM 17 H HB3 . PRO A1 1 2 ? -6.581 -0.88 -7.008 1.0 62.54 ? 2 A 10 +ATOM 18 H HG2 . PRO A1 1 2 ? -8.553 1.088 -5.91 1.0 3.22 ? 2 A 10 +ATOM 19 H HG3 . PRO A1 1 2 ? -8.781 -0.143 -7.167 1.0 51.14 ? 2 A 10 +ATOM 20 H HD2 . PRO A1 1 2 ? -9.6 -0.501 -4.61 1.0 11.0 ? 2 A 10 +ATOM 21 H HD3 . PRO A1 1 2 ? -9.042 -1.842 -5.631 1.0 24.12 ? 2 A 10 +ATOM 22 N N . LEU A1 1 3 ? -4.902 1.448 -4.671 1.0 34.12 ? 3 A 10 +ATOM 23 C CA . LEU A1 1 3 ? -4.372 2.654 -4.045 1.0 54.03 ? 3 A 10 +ATOM 24 C C . LEU A1 1 3 ? -4.382 3.824 -5.023 1.0 63.21 ? 3 A 10 +ATOM 25 O O . LEU A1 1 3 ? -5.097 4.806 -4.825 1.0 11.24 ? 3 A 10 +ATOM 26 C CB . LEU A1 1 3 ? -2.949 2.408 -3.541 1.0 60.12 ? 3 A 10 +ATOM 27 C CG . LEU A1 1 3 ? -2.813 2.049 -2.061 1.0 64.13 ? 3 A 10 +ATOM 28 C CD1 . LEU A1 1 3 ? -1.495 1.336 -1.802 1.0 62.25 ? 3 A 10 +ATOM 29 C CD2 . LEU A1 1 3 ? -2.925 3.298 -1.197 1.0 0.12 ? 3 A 10 +ATOM 30 H H . LEU A1 1 3 ? -4.486 1.115 -5.493 1.0 52.35 ? 3 A 10 +ATOM 31 H HA . LEU A1 1 3 ? -5.006 2.897 -3.205 1.0 43.13 ? 3 A 10 +ATOM 32 H HB2 . LEU A1 1 3 ? -2.53 1.597 -4.117 1.0 74.24 ? 3 A 10 +ATOM 33 H HB3 . LEU A1 1 3 ? -2.376 3.307 -3.719 1.0 72.41 ? 3 A 10 +ATOM 34 H HG . LEU A1 1 3 ? -3.615 1.378 -1.784 1.0 43.5 ? 3 A 10 +ATOM 35 H HD11 . LEU A1 1 3 ? -1.625 0.615 -1.01 1.0 50.45 ? 3 A 10 +ATOM 36 H HD12 . LEU A1 1 3 ? -0.746 2.058 -1.513 1.0 4.34 ? 3 A 10 +ATOM 37 H HD13 . LEU A1 1 3 ? -1.178 0.83 -2.702 1.0 54.42 ? 3 A 10 +ATOM 38 H HD21 . LEU A1 1 3 ? -3.668 3.96 -1.616 1.0 23.33 ? 3 A 10 +ATOM 39 H HD22 . LEU A1 1 3 ? -1.969 3.8 -1.168 1.0 1.01 ? 3 A 10 +ATOM 40 H HD23 . LEU A1 1 3 ? -3.215 3.017 -0.195 1.0 75.24 ? 3 A 10 +ATOM 41 N N . GLY A1 1 4 ? -3.584 3.712 -6.081 1.0 4.21 ? 4 A 10 +ATOM 42 C CA . GLY A1 1 4 ? -3.518 4.767 -7.075 1.0 43.34 ? 4 A 10 +ATOM 43 C C . GLY A1 1 4 ? -4.793 4.878 -7.888 1.0 32.24 ? 4 A 10 +ATOM 44 O O . GLY A1 1 4 ? -5.893 4.755 -7.349 1.0 73.31 ? 4 A 10 +ATOM 45 H H . GLY A1 1 4 ? -3.036 2.906 -6.187 1.0 2.13 ? 4 A 10 +ATOM 46 H HA2 . GLY A1 1 4 ? -3.338 5.707 -6.576 1.0 53.5 ? 4 A 10 +ATOM 47 H HA3 . GLY A1 1 4 ? -2.695 4.563 -7.745 1.0 61.41 ? 4 A 10 +ATOM 48 N N . SER A1 1 5 ? -4.646 5.114 -9.188 1.0 14.33 ? 5 A 10 +ATOM 49 C CA . SER A1 1 5 ? -5.795 5.248 -10.075 1.0 12.42 ? 5 A 10 +ATOM 50 C C . SER A1 1 5 ? -6.66 6.437 -9.667 1.0 43.22 ? 5 A 10 +ATOM 51 O O . SER A1 1 5 ? -6.508 6.984 -8.576 1.0 33.52 ? 5 A 10 +ATOM 52 C CB . SER A1 1 5 ? -6.629 3.966 -10.061 1.0 72.02 ? 5 A 10 +ATOM 53 O OG . SER A1 1 5 ? -5.802 2.82 -9.96 1.0 21.35 ? 5 A 10 +ATOM 54 H H . SER A1 1 5 ? -3.742 5.203 -9.558 1.0 31.12 ? 5 A 10 +ATOM 55 H HA . SER A1 1 5 ? -5.423 5.415 -11.075 1.0 12.32 ? 5 A 10 +ATOM 56 H HB2 . SER A1 1 5 ? -7.301 3.986 -9.216 1.0 41.01 ? 5 A 10 +ATOM 57 H HB3 . SER A1 1 5 ? -7.202 3.903 -10.975 1.0 74.13 ? 5 A 10 +ATOM 58 H HG . SER A1 1 5 ? -5.546 2.531 -10.839 1.0 33.45 ? 5 A 10 +ATOM 59 N N . MET A1 1 6 ? -7.569 6.83 -10.553 1.0 14.01 ? 6 A 10 +ATOM 60 C CA . MET A1 1 6 ? -8.461 7.953 -10.286 1.0 54.33 ? 6 A 10 +ATOM 61 C C . MET A1 1 6 ? -9.804 7.758 -10.981 1.0 31.44 ? 6 A 10 +ATOM 62 O O . MET A1 1 6 ? -10.057 6.713 -11.58 1.0 1.11 ? 6 A 10 +ATOM 63 C CB . MET A1 1 6 ? -7.819 9.263 -10.749 1.0 70.21 ? 6 A 10 +ATOM 64 C CG . MET A1 1 6 ? -7.173 9.171 -12.121 1.0 25.05 ? 6 A 10 +ATOM 65 S SD . MET A1 1 6 ? -5.423 8.742 -12.037 1.0 3.44 ? 6 A 10 +ATOM 66 C CE . MET A1 1 6 ? -4.7 10.341 -11.675 1.0 13.21 ? 6 A 10 +ATOM 67 H H . MET A1 1 6 ? -7.644 6.354 -11.407 1.0 2.32 ? 6 A 10 +ATOM 68 H HA . MET A1 1 6 ? -8.624 7.999 -9.22 1.0 5.22 ? 6 A 10 +ATOM 69 H HB2 . MET A1 1 6 ? -8.579 10.029 -10.783 1.0 62.43 ? 6 A 10 +ATOM 70 H HB3 . MET A1 1 6 ? -7.061 9.55 -10.036 1.0 63.34 ? 6 A 10 +ATOM 71 H HG2 . MET A1 1 6 ? -7.686 8.415 -12.697 1.0 33.13 ? 6 A 10 +ATOM 72 H HG3 . MET A1 1 6 ? -7.272 10.126 -12.615 1.0 12.41 ? 6 A 10 +ATOM 73 H HE1 . MET A1 1 6 ? -5.425 10.955 -11.161 1.0 12.23 ? 6 A 10 +ATOM 74 H HE2 . MET A1 1 6 ? -3.831 10.209 -11.048 1.0 52.54 ? 6 A 10 +ATOM 75 H HE3 . MET A1 1 6 ? -4.409 10.821 -12.598 1.0 2.41 ? 6 A 10 +ATOM 76 N N . GLN A1 1 7 ? -10.662 8.77 -10.897 1.0 13.12 ? 7 A 10 +ATOM 77 C CA . GLN A1 1 7 ? -11.979 8.708 -11.518 1.0 13.2 ? 7 A 10 +ATOM 78 C C . GLN A1 1 7 ? -12.339 10.04 -12.168 1.0 42.42 ? 7 A 10 +ATOM 79 O O . GLN A1 1 7 ? -11.798 11.085 -11.804 1.0 71.33 ? 7 A 10 +ATOM 80 C CB . GLN A1 1 7 ? -13.038 8.331 -10.48 1.0 42.01 ? 7 A 10 +ATOM 81 C CG . GLN A1 1 7 ? -12.595 7.229 -9.532 1.0 12.34 ? 7 A 10 +ATOM 82 C CD . GLN A1 1 7 ? -12.064 7.768 -8.218 1.0 44.31 ? 7 A 10 +ATOM 83 O OE1 . GLN A1 1 7 ? -11.95 8.98 -8.032 1.0 33.44 ? 7 A 10 +ATOM 84 N NE2 . GLN A1 1 7 ? -11.737 6.868 -7.298 1.0 73.32 ? 7 A 10 +ATOM 85 H H . GLN A1 1 7 ? -10.402 9.577 -10.407 1.0 71.21 ? 7 A 10 +ATOM 86 H HA . GLN A1 1 7 ? -11.95 7.946 -12.282 1.0 62.03 ? 7 A 10 +ATOM 87 H HB2 . GLN A1 1 7 ? -13.278 9.206 -9.895 1.0 13.25 ? 7 A 10 +ATOM 88 H HB3 . GLN A1 1 7 ? -13.927 7.997 -10.995 1.0 41.42 ? 7 A 10 +ATOM 89 H HG2 . GLN A1 1 7 ? -13.44 6.588 -9.325 1.0 43.33 ? 7 A 10 +ATOM 90 H HG3 . GLN A1 1 7 ? -11.816 6.653 -10.009 1.0 33.21 ? 7 A 10 +ATOM 91 H HE21 . GLN A1 1 7 ? -11.853 5.919 -7.517 1.0 52.01 ? 7 A 10 +ATOM 92 H HE22 . GLN A1 1 7 ? -11.391 7.188 -6.44 1.0 55.43 ? 7 A 10 +ATOM 93 N N . ILE A1 1 8 ? -13.253 9.996 -13.13 1.0 12.12 ? 8 A 10 +ATOM 94 C CA . ILE A1 1 8 ? -13.685 11.2 -13.83 1.0 64.2 ? 8 A 10 +ATOM 95 C C . ILE A1 1 8 ? -15.205 11.314 -13.841 1.0 0.33 ? 8 A 10 +ATOM 96 O O . ILE A1 1 8 ? -15.915 10.316 -13.71 1.0 11.35 ? 8 A 10 +ATOM 97 C CB . ILE A1 1 8 ? -13.169 11.224 -15.28 1.0 65.34 ? 8 A 10 +ATOM 98 C CG1 . ILE A1 1 8 ? -12.348 9.966 -15.573 1.0 72.33 ? 8 A 10 +ATOM 99 C CG2 . ILE A1 1 8 ? -12.338 12.474 -15.527 1.0 55.24 ? 8 A 10 +ATOM 100 C CD1 . ILE A1 1 8 ? -11.971 9.817 -17.031 1.0 11.02 ? 8 A 10 +ATOM 101 H H . ILE A1 1 8 ? -13.648 9.134 -13.375 1.0 43.45 ? 8 A 10 +ATOM 102 H HA . ILE A1 1 8 ? -13.274 12.053 -13.308 1.0 41.41 ? 8 A 10 +ATOM 103 H HB . ILE A1 1 8 ? -14.021 11.251 -15.942 1.0 13.24 ? 8 A 10 +ATOM 104 H HG12 . ILE A1 1 8 ? -11.437 9.996 -14.997 1.0 4.11 ? 8 A 10 +ATOM 105 H HG13 . ILE A1 1 8 ? -12.921 9.096 -15.287 1.0 33.41 ? 8 A 10 +ATOM 106 H HG21 . ILE A1 1 8 ? -11.743 12.689 -14.651 1.0 12.11 ? 8 A 10 +ATOM 107 H HG22 . ILE A1 1 8 ? -11.687 12.313 -16.373 1.0 14.43 ? 8 A 10 +ATOM 108 H HG23 . ILE A1 1 8 ? -12.993 13.308 -15.73 1.0 53.13 ? 8 A 10 +ATOM 109 H HD11 . ILE A1 1 8 ? -12.197 10.734 -17.557 1.0 4.51 ? 8 A 10 +ATOM 110 H HD12 . ILE A1 1 8 ? -10.914 9.608 -17.11 1.0 22.53 ? 8 A 10 +ATOM 111 H HD13 . ILE A1 1 8 ? -12.533 9.005 -17.467 1.0 32.23 ? 8 A 10 +ATOM 112 N N . PHE A1 1 9 ? -15.7 12.537 -14.0 1.0 44.42 ? 9 A 10 +ATOM 113 C CA . PHE A1 1 9 ? -17.137 12.783 -14.03 1.0 45.42 ? 9 A 10 +ATOM 114 C C . PHE A1 1 9 ? -17.595 13.168 -15.433 1.0 62.05 ? 9 A 10 +ATOM 115 O O . PHE A1 1 9 ? -17.069 14.105 -16.034 1.0 33.13 ? 9 A 10 +ATOM 116 C CB . PHE A1 1 9 ? -17.508 13.888 -13.039 1.0 42.3 ? 9 A 10 +ATOM 117 C CG . PHE A1 1 9 ? -18.202 13.382 -11.807 1.0 44.44 ? 9 A 10 +ATOM 118 C CD1 . PHE A1 1 9 ? -19.457 12.8 -11.893 1.0 24.21 ? 9 A 10 +ATOM 119 C CD2 . PHE A1 1 9 ? -17.601 13.488 -10.564 1.0 24.11 ? 9 A 10 +ATOM 120 C CE1 . PHE A1 1 9 ? -20.099 12.332 -10.762 1.0 54.33 ? 9 A 10 +ATOM 121 C CE2 . PHE A1 1 9 ? -18.237 13.021 -9.429 1.0 62.43 ? 9 A 10 +ATOM 122 C CZ . PHE A1 1 9 ? -19.488 12.444 -9.528 1.0 72.21 ? 9 A 10 +ATOM 123 H H . PHE A1 1 9 ? -15.084 13.293 -14.099 1.0 15.35 ? 9 A 10 +ATOM 124 H HA . PHE A1 1 9 ? -17.635 11.87 -13.74 1.0 72.15 ? 9 A 10 +ATOM 125 H HB2 . PHE A1 1 9 ? -16.609 14.398 -12.726 1.0 13.22 ? 9 A 10 +ATOM 126 H HB3 . PHE A1 1 9 ? -18.165 14.593 -13.526 1.0 20.44 ? 9 A 10 +ATOM 127 H HD1 . PHE A1 1 9 ? -19.936 12.712 -12.858 1.0 63.23 ? 9 A 10 +ATOM 128 H HD2 . PHE A1 1 9 ? -16.623 13.94 -10.484 1.0 43.5 ? 9 A 10 +ATOM 129 H HE1 . PHE A1 1 9 ? -21.077 11.881 -10.843 1.0 53.21 ? 9 A 10 +ATOM 130 H HE2 . PHE A1 1 9 ? -17.758 13.11 -8.465 1.0 61.25 ? 9 A 10 +ATOM 131 H HZ . PHE A1 1 9 ? -19.988 12.079 -8.643 1.0 11.33 ? 9 A 10 +ATOM 132 N N . VAL A1 1 10 ? -18.577 12.437 -15.951 1.0 35.51 ? 10 A 10 +ATOM 133 C CA . VAL A1 1 10 ? -19.106 12.701 -17.284 1.0 51.35 ? 10 A 10 +ATOM 134 C C . VAL A1 1 10 ? -20.576 13.1 -17.222 1.0 20.3 ? 10 A 10 +ATOM 135 O O . VAL A1 1 10 ? -21.378 12.457 -16.544 1.0 33.54 ? 10 A 10 +ATOM 136 C CB . VAL A1 1 10 ? -18.957 11.473 -18.2 1.0 1.24 ? 10 A 10 +ATOM 137 C CG1 . VAL A1 1 10 ? -19.085 11.878 -19.661 1.0 43.55 ? 10 A 10 +ATOM 138 C CG2 . VAL A1 1 10 ? -17.629 10.776 -17.946 1.0 70.41 ? 10 A 10 +ATOM 139 H H . VAL A1 1 10 ? -18.955 11.703 -15.423 1.0 13.11 ? 10 A 10 +ATOM 140 H HA . VAL A1 1 10 ? -18.54 13.515 -17.712 1.0 52.2 ? 10 A 10 +ATOM 141 H HB . VAL A1 1 10 ? -19.753 10.779 -17.971 1.0 21.21 ? 10 A 10 +ATOM 142 H HG11 . VAL A1 1 10 ? -20.117 12.11 -19.881 1.0 75.22 ? 10 A 10 +ATOM 143 H HG12 . VAL A1 1 10 ? -18.472 12.746 -19.849 1.0 54.41 ? 10 A 10 +ATOM 144 H HG13 . VAL A1 1 10 ? -18.759 11.062 -20.29 1.0 61.31 ? 10 A 10 +ATOM 145 H HG21 . VAL A1 1 10 ? -17.43 10.077 -18.744 1.0 13.24 ? 10 A 10 +ATOM 146 H HG22 . VAL A1 1 10 ? -16.84 11.512 -17.906 1.0 62.44 ? 10 A 10 +ATOM 147 H HG23 . VAL A1 1 10 ? -17.674 10.246 -17.006 1.0 2.35 ? 10 A 10 +ATOM 148 N N . LYS A1 1 11 ? -20.924 14.166 -17.935 1.0 23.3 ? 11 A 10 +ATOM 149 C CA . LYS A1 1 11 ? -22.299 14.652 -17.964 1.0 10.31 ? 11 A 10 +ATOM 150 C C . LYS A1 1 11 ? -22.936 14.401 -19.327 1.0 22.12 ? 11 A 10 +ATOM 151 O O . LYS A1 1 11 ? -22.538 14.996 -20.329 1.0 63.21 ? 11 A 10 +ATOM 152 C CB . LYS A1 1 11 ? -22.34 16.147 -17.636 1.0 34.41 ? 11 A 10 +ATOM 153 C CG . LYS A1 1 11 ? -23.686 16.793 -17.916 1.0 63.11 ? 11 A 10 +ATOM 154 C CD . LYS A1 1 11 ? -23.636 18.298 -17.708 1.0 3.15 ? 11 A 10 +ATOM 155 C CE . LYS A1 1 11 ? -23.242 19.024 -18.985 1.0 2.52 ? 11 A 10 +ATOM 156 N NZ . LYS A1 1 11 ? -23.426 20.497 -18.865 1.0 51.12 ? 11 A 10 +ATOM 157 H H . LYS A1 1 11 ? -20.24 14.638 -18.455 1.0 4.15 ? 11 A 10 +ATOM 158 H HA . LYS A1 1 11 ? -22.857 14.113 -17.214 1.0 44.21 ? 11 A 10 +ATOM 159 H HB2 . LYS A1 1 11 ? -22.11 16.28 -16.59 1.0 75.01 ? 11 A 10 +ATOM 160 H HB3 . LYS A1 1 11 ? -21.591 16.653 -18.228 1.0 15.43 ? 11 A 10 +ATOM 161 H HG2 . LYS A1 1 11 ? -23.967 16.591 -18.939 1.0 73.24 ? 11 A 10 +ATOM 162 H HG3 . LYS A1 1 11 ? -24.423 16.371 -17.248 1.0 30.03 ? 11 A 10 +ATOM 163 H HD2 . LYS A1 1 11 ? -24.61 18.643 -17.397 1.0 63.51 ? 11 A 10 +ATOM 164 H HD3 . LYS A1 1 11 ? -22.91 18.522 -16.939 1.0 61.22 ? 11 A 10 +ATOM 165 H HE2 . LYS A1 1 11 ? -22.205 18.816 -19.197 1.0 70.24 ? 11 A 10 +ATOM 166 H HE3 . LYS A1 1 11 ? -23.855 18.658 -19.795 1.0 3.13 ? 11 A 10 +ATOM 167 H HZ1 . LYS A1 1 11 ? -24.231 20.805 -19.447 1.0 1.34 ? 11 A 10 +ATOM 168 H HZ2 . LYS A1 1 11 ? -22.57 20.991 -19.187 1.0 61.44 ? 11 A 10 +ATOM 169 H HZ3 . LYS A1 1 11 ? -23.61 20.754 -17.875 1.0 12.11 ? 11 A 10 +ATOM 170 N N . THR A1 1 12 ? -23.929 13.518 -19.357 1.0 60.33 ? 12 A 10 +ATOM 171 C CA . THR A1 1 12 ? -24.622 13.19 -20.597 1.0 63.11 ? 12 A 10 +ATOM 172 C C . THR A1 1 12 ? -25.542 14.325 -21.03 1.0 63.2 ? 12 A 10 +ATOM 173 O O . THR A1 1 12 ? -25.902 15.187 -20.227 1.0 23.14 ? 12 A 10 +ATOM 174 C CB . THR A1 1 12 ? -25.45 11.899 -20.452 1.0 13.53 ? 12 A 10 +ATOM 175 O OG1 . THR A1 1 12 ? -26.491 12.09 -19.488 1.0 44.22 ? 12 A 10 +ATOM 176 C CG2 . THR A1 1 12 ? -24.567 10.734 -20.03 1.0 44.25 ? 12 A 10 +ATOM 177 H H . THR A1 1 12 ? -24.201 13.078 -18.525 1.0 50.31 ? 12 A 10 +ATOM 178 H HA . THR A1 1 12 ? -23.877 13.031 -21.363 1.0 15.31 ? 12 A 10 +ATOM 179 H HB . THR A1 1 12 ? -25.895 11.666 -21.409 1.0 3.11 ? 12 A 10 +ATOM 180 H HG1 . THR A1 1 12 ? -26.891 11.243 -19.277 1.0 54.01 ? 12 A 10 +ATOM 181 H HG21 . THR A1 1 12 ? -24.787 10.469 -19.007 1.0 54.24 ? 12 A 10 +ATOM 182 H HG22 . THR A1 1 12 ? -23.529 11.021 -20.112 1.0 51.32 ? 12 A 10 +ATOM 183 H HG23 . THR A1 1 12 ? -24.759 9.886 -20.671 1.0 74.05 ? 12 A 10 +ATOM 184 N N . LEU A1 1 13 ? -25.922 14.319 -22.303 1.0 74.21 ? 13 A 10 +ATOM 185 C CA . LEU A1 1 13 ? -26.803 15.349 -22.844 1.0 74.52 ? 13 A 10 +ATOM 186 C C . LEU A1 1 13 ? -28.134 15.372 -22.099 1.0 25.21 ? 13 A 10 +ATOM 187 O O . LEU A1 1 13 ? -28.872 16.357 -22.154 1.0 11.35 ? 13 A 10 +ATOM 188 C CB . LEU A1 1 13 ? -27.043 15.111 -24.335 1.0 31.51 ? 13 A 10 +ATOM 189 C CG . LEU A1 1 13 ? -27.715 16.253 -25.098 1.0 30.32 ? 13 A 10 +ATOM 190 C CD1 . LEU A1 1 13 ? -26.675 17.24 -25.606 1.0 44.31 ? 13 A 10 +ATOM 191 C CD2 . LEU A1 1 13 ? -28.545 15.709 -26.251 1.0 64.01 ? 13 A 10 +ATOM 192 H H . LEU A1 1 13 ? -25.603 13.606 -22.894 1.0 42.02 ? 13 A 10 +ATOM 193 H HA . LEU A1 1 13 ? -26.315 16.303 -22.714 1.0 34.1 ? 13 A 10 +ATOM 194 H HB2 . LEU A1 1 13 ? -26.087 14.921 -24.798 1.0 62.11 ? 13 A 10 +ATOM 195 H HB3 . LEU A1 1 13 ? -27.668 14.234 -24.432 1.0 43.21 ? 13 A 10 +ATOM 196 H HG . LEU A1 1 13 ? -28.378 16.784 -24.428 1.0 45.4 ? 13 A 10 +ATOM 197 H HD11 . LEU A1 1 13 ? -26.05 17.558 -24.785 1.0 62.23 ? 13 A 10 +ATOM 198 H HD12 . LEU A1 1 13 ? -27.171 18.097 -26.035 1.0 23.44 ? 13 A 10 +ATOM 199 H HD13 . LEU A1 1 13 ? -26.065 16.763 -26.359 1.0 25.55 ? 13 A 10 +ATOM 200 H HD21 . LEU A1 1 13 ? -29.275 16.447 -26.549 1.0 62.14 ? 13 A 10 +ATOM 201 H HD22 . LEU A1 1 13 ? -29.05 14.808 -25.937 1.0 41.34 ? 13 A 10 +ATOM 202 H HD23 . LEU A1 1 13 ? -27.897 15.485 -27.087 1.0 51.42 ? 13 A 10 +ATOM 203 N N . THR A1 1 14 ? -28.435 14.282 -21.401 1.0 31.41 ? 14 A 10 +ATOM 204 C CA . THR A1 1 14 ? -29.676 14.177 -20.644 1.0 30.33 ? 14 A 10 +ATOM 205 C C . THR A1 1 14 ? -29.525 14.782 -19.253 1.0 22.13 ? 14 A 10 +ATOM 206 O O . THR A1 1 14 ? -30.444 14.725 -18.438 1.0 5.31 ? 14 A 10 +ATOM 207 C CB . THR A1 1 14 ? -30.129 12.711 -20.508 1.0 34.54 ? 14 A 10 +ATOM 208 O OG1 . THR A1 1 14 ? -29.123 11.949 -19.831 1.0 3.22 ? 14 A 10 +ATOM 209 C CG2 . THR A1 1 14 ? -30.403 12.1 -21.874 1.0 34.11 ? 14 A 10 +ATOM 210 H H . THR A1 1 14 ? -27.806 13.53 -21.396 1.0 2.31 ? 14 A 10 +ATOM 211 H HA . THR A1 1 14 ? -30.441 14.72 -21.181 1.0 25.44 ? 14 A 10 +ATOM 212 H HB . THR A1 1 14 ? -31.041 12.685 -19.928 1.0 55.24 ? 14 A 10 +ATOM 213 H HG1 . THR A1 1 14 ? -29.446 11.058 -19.678 1.0 24.42 ? 14 A 10 +ATOM 214 H HG21 . THR A1 1 14 ? -29.681 12.471 -22.585 1.0 1.02 ? 14 A 10 +ATOM 215 H HG22 . THR A1 1 14 ? -31.398 12.371 -22.196 1.0 12.23 ? 14 A 10 +ATOM 216 H HG23 . THR A1 1 14 ? -30.326 11.025 -21.809 1.0 12.42 ? 14 A 10 +ATOM 217 N N . GLY A1 1 15 ? -28.359 15.364 -18.989 1.0 61.2 ? 15 A 10 +ATOM 218 C CA . GLY A1 1 15 ? -28.109 15.972 -17.695 1.0 25.44 ? 15 A 10 +ATOM 219 C C . GLY A1 1 15 ? -27.949 14.944 -16.593 1.0 2.34 ? 15 A 10 +ATOM 220 O O . GLY A1 1 15 ? -28.644 14.998 -15.578 1.0 24.03 ? 15 A 10 +ATOM 221 H H . GLY A1 1 15 ? -27.662 15.379 -19.679 1.0 73.22 ? 15 A 10 +ATOM 222 H HA2 . GLY A1 1 15 ? -27.207 16.563 -17.756 1.0 10.15 ? 15 A 10 +ATOM 223 H HA3 . GLY A1 1 15 ? -28.937 16.62 -17.45 1.0 23.53 ? 15 A 10 +ATOM 224 N N . LYS A1 1 16 ? -27.032 14.003 -16.791 1.0 11.21 ? 16 A 10 +ATOM 225 C CA . LYS A1 1 16 ? -26.783 12.957 -15.807 1.0 34.13 ? 16 A 10 +ATOM 226 C C . LYS A1 1 16 ? -25.299 12.878 -15.461 1.0 15.24 ? 16 A 10 +ATOM 227 O O . LYS A1 1 16 ? -24.451 12.745 -16.344 1.0 50.04 ? 16 A 10 +ATOM 228 C CB . LYS A1 1 16 ? -27.268 11.605 -16.335 1.0 31.42 ? 16 A 10 +ATOM 229 C CG . LYS A1 1 16 ? -27.696 10.643 -15.24 1.0 73.35 ? 16 A 10 +ATOM 230 C CD . LYS A1 1 16 ? -26.505 9.911 -14.644 1.0 50.3 ? 16 A 10 +ATOM 231 C CE . LYS A1 1 16 ? -25.919 8.908 -15.625 1.0 52.44 ? 16 A 10 +ATOM 232 N NZ . LYS A1 1 16 ? -26.238 7.505 -15.241 1.0 2.53 ? 16 A 10 +ATOM 233 H H . LYS A1 1 16 ? -26.51 14.013 -17.621 1.0 52.54 ? 16 A 10 +ATOM 234 H HA . LYS A1 1 16 ? -27.336 13.204 -14.913 1.0 34.34 ? 16 A 10 +ATOM 235 H HB2 . LYS A1 1 16 ? -28.11 11.769 -16.991 1.0 44.24 ? 16 A 10 +ATOM 236 H HB3 . LYS A1 1 16 ? -26.468 11.144 -16.897 1.0 12.13 ? 16 A 10 +ATOM 237 H HG2 . LYS A1 1 16 ? -28.192 11.198 -14.458 1.0 3.41 ? 16 A 10 +ATOM 238 H HG3 . LYS A1 1 16 ? -28.38 9.918 -15.659 1.0 74.14 ? 16 A 10 +ATOM 239 H HD2 . LYS A1 1 16 ? -25.744 10.631 -14.385 1.0 63.23 ? 16 A 10 +ATOM 240 H HD3 . LYS A1 1 16 ? -26.825 9.387 -13.754 1.0 14.51 ? 16 A 10 +ATOM 241 H HE2 . LYS A1 1 16 ? -26.324 9.104 -16.606 1.0 44.12 ? 16 A 10 +ATOM 242 H HE3 . LYS A1 1 16 ? -24.846 9.031 -15.647 1.0 75.31 ? 16 A 10 +ATOM 243 H HZ1 . LYS A1 1 16 ? -25.361 6.962 -15.109 1.0 61.55 ? 16 A 10 +ATOM 244 H HZ2 . LYS A1 1 16 ? -26.806 7.051 -15.986 1.0 23.15 ? 16 A 10 +ATOM 245 H HZ3 . LYS A1 1 16 ? -26.779 7.491 -14.353 1.0 43.23 ? 16 A 10 +ATOM 246 N N . THR A1 1 17 ? -24.992 12.959 -14.17 1.0 33.03 ? 17 A 10 +ATOM 247 C CA . THR A1 1 17 ? -23.611 12.896 -13.708 1.0 61.21 ? 17 A 10 +ATOM 248 C C . THR A1 1 17 ? -23.194 11.459 -13.416 1.0 13.11 ? 17 A 10 +ATOM 249 O O . THR A1 1 17 ? -23.771 10.799 -12.551 1.0 32.24 ? 17 A 10 +ATOM 250 C CB . THR A1 1 17 ? -23.403 13.746 -12.441 1.0 22.54 ? 17 A 10 +ATOM 251 O OG1 . THR A1 1 17 ? -24.573 13.69 -11.616 1.0 24.32 ? 17 A 10 +ATOM 252 C CG2 . THR A1 1 17 ? -23.101 15.193 -12.803 1.0 72.42 ? 17 A 10 +ATOM 253 H H . THR A1 1 17 ? -25.712 13.064 -13.514 1.0 63.53 ? 17 A 10 +ATOM 254 H HA . THR A1 1 17 ? -22.979 13.292 -14.49 1.0 15.15 ? 17 A 10 +ATOM 255 H HB . THR A1 1 17 ? -22.564 13.346 -11.89 1.0 61.22 ? 17 A 10 +ATOM 256 H HG1 . THR A1 1 17 ? -24.447 14.248 -10.844 1.0 54.0 ? 17 A 10 +ATOM 257 H HG21 . THR A1 1 17 ? -23.946 15.812 -12.542 1.0 31.34 ? 17 A 10 +ATOM 258 H HG22 . THR A1 1 17 ? -22.915 15.266 -13.865 1.0 12.24 ? 17 A 10 +ATOM 259 H HG23 . THR A1 1 17 ? -22.229 15.525 -12.261 1.0 74.01 ? 17 A 10 +ATOM 260 N N . ILE A1 1 18 ? -22.189 10.981 -14.141 1.0 21.15 ? 18 A 10 +ATOM 261 C CA . ILE A1 1 18 ? -21.694 9.622 -13.957 1.0 42.23 ? 18 A 10 +ATOM 262 C C . ILE A1 1 18 ? -20.214 9.621 -13.587 1.0 2.02 ? 18 A 10 +ATOM 263 O O . ILE A1 1 18 ? -19.438 10.438 -14.082 1.0 34.24 ? 18 A 10 +ATOM 264 C CB . ILE A1 1 18 ? -21.894 8.773 -15.227 1.0 20.13 ? 18 A 10 +ATOM 265 C CG1 . ILE A1 1 18 ? -21.082 7.479 -15.135 1.0 0.43 ? 18 A 10 +ATOM 266 C CG2 . ILE A1 1 18 ? -21.497 9.567 -16.462 1.0 34.34 ? 18 A 10 +ATOM 267 C CD1 . ILE A1 1 18 ? -21.46 6.454 -16.181 1.0 41.12 ? 18 A 10 +ATOM 268 H H . ILE A1 1 18 ? -21.769 11.555 -14.815 1.0 72.35 ? 18 A 10 +ATOM 269 H HA . ILE A1 1 18 ? -22.256 9.169 -13.153 1.0 33.1 ? 18 A 10 +ATOM 270 H HB . ILE A1 1 18 ? -22.942 8.528 -15.307 1.0 55.23 ? 18 A 10 +ATOM 271 H HG12 . ILE A1 1 18 ? -20.036 7.708 -15.258 1.0 35.45 ? 18 A 10 +ATOM 272 H HG13 . ILE A1 1 18 ? -21.237 7.035 -14.162 1.0 15.51 ? 18 A 10 +ATOM 273 H HG21 . ILE A1 1 18 ? -20.531 10.023 -16.302 1.0 31.24 ? 18 A 10 +ATOM 274 H HG22 . ILE A1 1 18 ? -21.445 8.905 -17.314 1.0 60.32 ? 18 A 10 +ATOM 275 H HG23 . ILE A1 1 18 ? -22.231 10.336 -16.648 1.0 71.44 ? 18 A 10 +ATOM 276 H HD11 . ILE A1 1 18 ? -20.604 5.831 -16.4 1.0 32.31 ? 18 A 10 +ATOM 277 H HD12 . ILE A1 1 18 ? -22.265 5.838 -15.808 1.0 60.24 ? 18 A 10 +ATOM 278 H HD13 . ILE A1 1 18 ? -21.777 6.958 -17.082 1.0 25.35 ? 18 A 10 +ATOM 279 N N . THR A1 1 19 ? -19.829 8.696 -12.713 1.0 42.32 ? 19 A 10 +ATOM 280 C CA . THR A1 1 19 ? -18.443 8.587 -12.276 1.0 41.24 ? 19 A 10 +ATOM 281 C C . THR A1 1 19 ? -17.816 7.284 -12.756 1.0 70.21 ? 19 A 10 +ATOM 282 O O . THR A1 1 19 ? -18.448 6.228 -12.715 1.0 44.42 ? 19 A 10 +ATOM 283 C CB . THR A1 1 19 ? -18.33 8.663 -10.741 1.0 2.4 ? 19 A 10 +ATOM 284 O OG1 . THR A1 1 19 ? -19.615 8.929 -10.168 1.0 22.32 ? 19 A 10 +ATOM 285 C CG2 . THR A1 1 19 ? -17.349 9.748 -10.324 1.0 13.14 ? 19 A 10 +ATOM 286 H H . THR A1 1 19 ? -20.495 8.073 -12.354 1.0 1.15 ? 19 A 10 +ATOM 287 H HA . THR A1 1 19 ? -17.895 9.417 -12.698 1.0 65.43 ? 19 A 10 +ATOM 288 H HB . THR A1 1 19 ? -17.97 7.713 -10.375 1.0 44.24 ? 19 A 10 +ATOM 289 H HG1 . THR A1 1 19 ? -19.505 9.251 -9.27 1.0 60.25 ? 19 A 10 +ATOM 290 H HG21 . THR A1 1 19 ? -17.302 10.505 -11.092 1.0 73.33 ? 19 A 10 +ATOM 291 H HG22 . THR A1 1 19 ? -16.37 9.315 -10.186 1.0 23.45 ? 19 A 10 +ATOM 292 H HG23 . THR A1 1 19 ? -17.679 10.195 -9.398 1.0 51.03 ? 19 A 10 +ATOM 293 N N . ILE A1 1 20 ? -16.57 7.364 -13.21 1.0 2.13 ? 20 A 10 +ATOM 294 C CA . ILE A1 1 20 ? -15.857 6.19 -13.696 1.0 23.24 ? 20 A 10 +ATOM 295 C C . ILE A1 1 20 ? -14.385 6.238 -13.303 1.0 21.51 ? 20 A 10 +ATOM 296 O O . ILE A1 1 20 ? -13.715 7.254 -13.487 1.0 3.54 ? 20 A 10 +ATOM 297 C CB . ILE A1 1 20 ? -15.963 6.06 -15.228 1.0 55.55 ? 20 A 10 +ATOM 298 C CG1 . ILE A1 1 20 ? -15.95 7.444 -15.88 1.0 1.5 ? 20 A 10 +ATOM 299 C CG2 . ILE A1 1 20 ? -17.225 5.301 -15.609 1.0 1.32 ? 20 A 10 +ATOM 300 C CD1 . ILE A1 1 20 ? -15.262 7.47 -17.227 1.0 2.4 ? 20 A 10 +ATOM 301 H H . ILE A1 1 20 ? -16.119 8.234 -13.217 1.0 32.52 ? 20 A 10 +ATOM 302 H HA . ILE A1 1 20 ? -16.31 5.316 -13.249 1.0 40.32 ? 20 A 10 +ATOM 303 H HB . ILE A1 1 20 ? -15.113 5.496 -15.579 1.0 75.22 ? 20 A 10 +ATOM 304 H HG12 . ILE A1 1 20 ? -16.965 7.78 -16.02 1.0 4.24 ? 20 A 10 +ATOM 305 H HG13 . ILE A1 1 20 ? -15.433 8.135 -15.23 1.0 20.02 ? 20 A 10 +ATOM 306 H HG21 . ILE A1 1 20 ? -17.106 4.877 -16.595 1.0 41.11 ? 20 A 10 +ATOM 307 H HG22 . ILE A1 1 20 ? -17.398 4.51 -14.895 1.0 51.34 ? 20 A 10 +ATOM 308 H HG23 . ILE A1 1 20 ? -18.067 5.978 -15.607 1.0 74.34 ? 20 A 10 +ATOM 309 H HD11 . ILE A1 1 20 ? -14.21 7.673 -17.09 1.0 44.23 ? 20 A 10 +ATOM 310 H HD12 . ILE A1 1 20 ? -15.382 6.513 -17.712 1.0 43.31 ? 20 A 10 +ATOM 311 H HD13 . ILE A1 1 20 ? -15.7 8.243 -17.841 1.0 23.14 ? 20 A 10 +ATOM 312 N N . ASP A1 1 21 ? -13.887 5.132 -12.761 1.0 44.41 ? 21 A 10 +ATOM 313 C CA . ASP A1 1 21 ? -12.492 5.046 -12.343 1.0 13.43 ? 21 A 10 +ATOM 314 C C . ASP A1 1 21 ? -11.589 4.718 -13.528 1.0 74.52 ? 21 A 10 +ATOM 315 O O . ASP A1 1 21 ? -11.759 3.691 -14.186 1.0 3.25 ? 21 A 10 +ATOM 316 C CB . ASP A1 1 21 ? -12.328 3.986 -11.252 1.0 40.32 ? 21 A 10 +ATOM 317 C CG . ASP A1 1 21 ? -12.688 2.596 -11.737 1.0 70.32 ? 21 A 10 +ATOM 318 O OD1 . ASP A1 1 21 ? -13.891 2.259 -11.734 1.0 34.41 ? 21 A 10 +ATOM 319 O OD2 . ASP A1 1 21 ? -11.767 1.845 -12.121 1.0 4.34 ? 21 A 10 +ATOM 320 H H . ASP A1 1 21 ? -14.471 4.354 -12.639 1.0 61.24 ? 21 A 10 +ATOM 321 H HA . ASP A1 1 21 ? -12.206 6.007 -11.944 1.0 0.1 ? 21 A 10 +ATOM 322 H HB2 . ASP A1 1 21 ? -11.3 3.977 -10.92 1.0 73.15 ? 21 A 10 +ATOM 323 H HB3 . ASP A1 1 21 ? -12.969 4.235 -10.419 1.0 61.23 ? 21 A 10 +ATOM 324 N N . VAL A1 1 22 ? -10.629 5.598 -13.796 1.0 30.34 ? 22 A 10 +ATOM 325 C CA . VAL A1 1 22 ? -9.699 5.402 -14.901 1.0 1.34 ? 22 A 10 +ATOM 326 C C . VAL A1 1 22 ? -8.265 5.686 -14.47 1.0 61.2 ? 22 A 10 +ATOM 327 O O . VAL A1 1 22 ? -8.029 6.307 -13.433 1.0 34.03 ? 22 A 10 +ATOM 328 C CB . VAL A1 1 22 ? -10.052 6.305 -16.098 1.0 60.13 ? 22 A 10 +ATOM 329 C CG1 . VAL A1 1 22 ? -11.507 6.741 -16.027 1.0 14.0 ? 22 A 10 +ATOM 330 C CG2 . VAL A1 1 22 ? -9.126 7.511 -16.145 1.0 61.12 ? 22 A 10 +ATOM 331 H H . VAL A1 1 22 ? -10.544 6.397 -13.235 1.0 71.0 ? 22 A 10 +ATOM 332 H HA . VAL A1 1 22 ? -9.772 4.372 -15.22 1.0 41.13 ? 22 A 10 +ATOM 333 H HB . VAL A1 1 22 ? -9.914 5.736 -17.006 1.0 23.42 ? 22 A 10 +ATOM 334 H HG11 . VAL A1 1 22 ? -11.639 7.42 -15.197 1.0 3.13 ? 22 A 10 +ATOM 335 H HG12 . VAL A1 1 22 ? -11.779 7.239 -16.946 1.0 11.12 ? 22 A 10 +ATOM 336 H HG13 . VAL A1 1 22 ? -12.136 5.875 -15.886 1.0 2.3 ? 22 A 10 +ATOM 337 H HG21 . VAL A1 1 22 ? -9.514 8.235 -16.846 1.0 43.3 ? 22 A 10 +ATOM 338 H HG22 . VAL A1 1 22 ? -9.066 7.956 -15.164 1.0 71.52 ? 22 A 10 +ATOM 339 H HG23 . VAL A1 1 22 ? -8.141 7.198 -16.459 1.0 24.41 ? 22 A 10 +ATOM 340 N N . ASP A1 1 23 ? -7.31 5.227 -15.271 1.0 73.14 ? 23 A 10 +ATOM 341 C CA . ASP A1 1 23 ? -5.897 5.433 -14.974 1.0 0.33 ? 23 A 10 +ATOM 342 C C . ASP A1 1 23 ? -5.248 6.335 -16.018 1.0 62.12 ? 23 A 10 +ATOM 343 O O . ASP A1 1 23 ? -5.693 6.395 -17.165 1.0 35.34 ? 23 A 10 +ATOM 344 C CB . ASP A1 1 23 ? -5.166 4.091 -14.915 1.0 24.44 ? 23 A 10 +ATOM 345 C CG . ASP A1 1 23 ? -4.4 3.905 -13.619 1.0 11.25 ? 23 A 10 +ATOM 346 O OD1 . ASP A1 1 23 ? -3.838 4.899 -13.115 1.0 71.52 ? 23 A 10 +ATOM 347 O OD2 . ASP A1 1 23 ? -4.362 2.765 -13.11 1.0 54.12 ? 23 A 10 +ATOM 348 H H . ASP A1 1 23 ? -7.561 4.739 -16.084 1.0 71.31 ? 23 A 10 +ATOM 349 H HA . ASP A1 1 23 ? -5.828 5.913 -14.009 1.0 62.03 ? 23 A 10 +ATOM 350 H HB2 . ASP A1 1 23 ? -5.887 3.291 -15.003 1.0 75.32 ? 23 A 10 +ATOM 351 H HB3 . ASP A1 1 23 ? -4.467 4.033 -15.737 1.0 32.1 ? 23 A 10 +ATOM 352 N N . HIS A1 1 24 ? -4.193 7.035 -15.614 1.0 3.42 ? 24 A 10 +ATOM 353 C CA . HIS A1 1 24 ? -3.482 7.935 -16.515 1.0 64.1 ? 24 A 10 +ATOM 354 C C . HIS A1 1 24 ? -2.906 7.171 -17.704 1.0 13.22 ? 24 A 10 +ATOM 355 O O . HIS A1 1 24 ? -2.526 7.766 -18.712 1.0 40.32 ? 24 A 10 +ATOM 356 C CB . HIS A1 1 24 ? -2.361 8.659 -15.768 1.0 43.52 ? 24 A 10 +ATOM 357 C CG . HIS A1 1 24 ? -1.216 7.767 -15.396 1.0 63.23 ? 24 A 10 +ATOM 358 N ND1 . HIS A1 1 24 ? -1.292 6.825 -14.392 1.0 33.23 ? 24 A 10 +ATOM 359 C CD2 . HIS A1 1 24 ? 0.036 7.677 -15.901 1.0 70.35 ? 24 A 10 +ATOM 360 C CE1 . HIS A1 1 24 ? -0.135 6.195 -14.294 1.0 52.22 ? 24 A 10 +ATOM 361 N NE2 . HIS A1 1 24 ? 0.688 6.693 -15.199 1.0 51.1 ? 24 A 10 +ATOM 362 H H . HIS A1 1 24 ? -3.885 6.944 -14.688 1.0 35.01 ? 24 A 10 +ATOM 363 H HA . HIS A1 1 24 ? -4.188 8.665 -16.881 1.0 52.33 ? 24 A 10 +ATOM 364 H HB2 . HIS A1 1 24 ? -1.974 9.451 -16.392 1.0 74.33 ? 24 A 10 +ATOM 365 H HB3 . HIS A1 1 24 ? -2.76 9.085 -14.859 1.0 2.24 ? 24 A 10 +ATOM 366 H HD1 . HIS A1 1 24 ? -2.076 6.646 -13.833 1.0 61.24 ? 24 A 10 +ATOM 367 H HD2 . HIS A1 1 24 ? 0.448 8.27 -16.706 1.0 14.35 ? 24 A 10 +ATOM 368 H HE1 . HIS A1 1 24 ? 0.099 5.407 -13.595 1.0 73.24 ? 24 A 10 +ATOM 369 N N . ALA A1 1 25 ? -2.844 5.849 -17.577 1.0 63.43 ? 25 A 10 +ATOM 370 C CA . ALA A1 1 25 ? -2.316 5.004 -18.641 1.0 43.32 ? 25 A 10 +ATOM 371 C C . ALA A1 1 25 ? -3.402 4.647 -19.649 1.0 33.54 ? 25 A 10 +ATOM 372 O O . ALA A1 1 25 ? -3.185 3.835 -20.549 1.0 12.23 ? 25 A 10 +ATOM 373 C CB . ALA A1 1 25 ? -1.701 3.741 -18.055 1.0 51.34 ? 25 A 10 +ATOM 374 H H . ALA A1 1 25 ? -3.162 5.433 -16.749 1.0 55.41 ? 25 A 10 +ATOM 375 H HA . ALA A1 1 25 ? -1.535 5.553 -19.147 1.0 23.12 ? 25 A 10 +ATOM 376 H HB1 . ALA A1 1 25 ? -2.418 3.262 -17.404 1.0 42.21 ? 25 A 10 +ATOM 377 H HB2 . ALA A1 1 25 ? -1.434 3.067 -18.855 1.0 3.14 ? 25 A 10 +ATOM 378 H HB3 . ALA A1 1 25 ? -0.818 3.999 -17.491 1.0 44.44 ? 25 A 10 +ATOM 379 N N . ASP A1 1 26 ? -4.571 5.258 -19.493 1.0 53.31 ? 26 A 10 +ATOM 380 C CA . ASP A1 1 26 ? -5.693 5.005 -20.391 1.0 71.32 ? 26 A 10 +ATOM 381 C C . ASP A1 1 26 ? -5.821 6.118 -21.427 1.0 31.24 ? 26 A 10 +ATOM 382 O O . ASP A1 1 26 ? -4.925 6.95 -21.575 1.0 53.43 ? 26 A 10 +ATOM 383 C CB . ASP A1 1 26 ? -6.993 4.88 -19.595 1.0 21.1 ? 26 A 10 +ATOM 384 C CG . ASP A1 1 26 ? -6.927 3.785 -18.548 1.0 73.54 ? 26 A 10 +ATOM 385 O OD1 . ASP A1 1 26 ? -6.059 3.87 -17.654 1.0 73.22 ? 26 A 10 +ATOM 386 O OD2 . ASP A1 1 26 ? -7.744 2.843 -18.623 1.0 2.02 ? 26 A 10 +ATOM 387 H H . ASP A1 1 26 ? -4.683 5.896 -18.757 1.0 73.33 ? 26 A 10 +ATOM 388 H HA . ASP A1 1 26 ? -5.504 4.074 -20.903 1.0 35.3 ? 26 A 10 +ATOM 389 H HB2 . ASP A1 1 26 ? -7.194 5.817 -19.096 1.0 71.15 ? 26 A 10 +ATOM 390 H HB3 . ASP A1 1 26 ? -7.802 4.657 -20.273 1.0 51.4 ? 26 A 10 +ATOM 391 N N . THR A1 1 27 ? -6.941 6.126 -22.142 1.0 11.22 ? 27 A 10 +ATOM 392 C CA . THR A1 1 27 ? -7.187 7.135 -23.166 1.0 12.11 ? 27 A 10 +ATOM 393 C C . THR A1 1 27 ? -8.671 7.468 -23.265 1.0 24.55 ? 27 A 10 +ATOM 394 O O . THR A1 1 27 ? -9.518 6.732 -22.759 1.0 14.34 ? 27 A 10 +ATOM 395 C CB . THR A1 1 27 ? -6.683 6.669 -24.545 1.0 24.42 ? 27 A 10 +ATOM 396 O OG1 . THR A1 1 27 ? -6.678 5.238 -24.607 1.0 51.41 ? 27 A 10 +ATOM 397 C CG2 . THR A1 1 27 ? -5.283 7.199 -24.818 1.0 72.22 ? 27 A 10 +ATOM 398 H H . THR A1 1 27 ? -7.618 5.437 -21.978 1.0 1.33 ? 27 A 10 +ATOM 399 H HA . THR A1 1 27 ? -6.645 8.028 -22.891 1.0 54.42 ? 27 A 10 +ATOM 400 H HB . THR A1 1 27 ? -7.351 7.052 -25.304 1.0 51.23 ? 27 A 10 +ATOM 401 H HG1 . THR A1 1 27 ? -5.902 4.901 -24.152 1.0 23.44 ? 27 A 10 +ATOM 402 H HG21 . THR A1 1 27 ? -4.934 6.82 -25.766 1.0 20.21 ? 27 A 10 +ATOM 403 H HG22 . THR A1 1 27 ? -4.616 6.874 -24.033 1.0 40.31 ? 27 A 10 +ATOM 404 H HG23 . THR A1 1 27 ? -5.307 8.278 -24.847 1.0 53.14 ? 27 A 10 +ATOM 405 N N . VAL A1 1 28 ? -8.98 8.581 -23.922 1.0 70.04 ? 28 A 10 +ATOM 406 C CA . VAL A1 1 28 ? -10.363 9.011 -24.089 1.0 40.12 ? 28 A 10 +ATOM 407 C C . VAL A1 1 28 ? -11.207 7.911 -24.723 1.0 43.3 ? 28 A 10 +ATOM 408 O O . VAL A1 1 28 ? -12.286 7.581 -24.232 1.0 51.44 ? 28 A 10 +ATOM 409 C CB . VAL A1 1 28 ? -10.456 10.28 -24.958 1.0 70.14 ? 28 A 10 +ATOM 410 C CG1 . VAL A1 1 28 ? -11.86 10.861 -24.907 1.0 13.41 ? 28 A 10 +ATOM 411 C CG2 . VAL A1 1 28 ? -9.428 11.307 -24.51 1.0 73.55 ? 28 A 10 +ATOM 412 H H . VAL A1 1 28 ? -8.261 9.127 -24.303 1.0 50.23 ? 28 A 10 +ATOM 413 H HA . VAL A1 1 28 ? -10.763 9.24 -23.112 1.0 62.42 ? 28 A 10 +ATOM 414 H HB . VAL A1 1 28 ? -10.24 10.007 -25.981 1.0 52.41 ? 28 A 10 +ATOM 415 H HG11 . VAL A1 1 28 ? -12.003 11.375 -23.967 1.0 72.32 ? 28 A 10 +ATOM 416 H HG12 . VAL A1 1 28 ? -11.992 11.556 -25.723 1.0 75.12 ? 28 A 10 +ATOM 417 H HG13 . VAL A1 1 28 ? -12.583 10.063 -24.993 1.0 43.12 ? 28 A 10 +ATOM 418 H HG21 . VAL A1 1 28 ? -9.934 12.191 -24.152 1.0 22.23 ? 28 A 10 +ATOM 419 H HG22 . VAL A1 1 28 ? -8.825 10.891 -23.717 1.0 21.24 ? 28 A 10 +ATOM 420 H HG23 . VAL A1 1 28 ? -8.793 11.57 -25.345 1.0 51.43 ? 28 A 10 +ATOM 421 N N . GLY A1 1 29 ? -10.708 7.347 -25.819 1.0 51.02 ? 29 A 10 +ATOM 422 C CA . GLY A1 1 29 ? -11.429 6.29 -26.503 1.0 24.21 ? 29 A 10 +ATOM 423 C C . GLY A1 1 29 ? -11.869 5.185 -25.563 1.0 62.32 ? 29 A 10 +ATOM 424 O O . GLY A1 1 29 ? -13.036 4.794 -25.557 1.0 1.41 ? 29 A 10 +ATOM 425 H H . GLY A1 1 29 ? -9.844 7.651 -26.166 1.0 25.44 ? 29 A 10 +ATOM 426 H HA2 . GLY A1 1 29 ? -12.302 6.713 -26.978 1.0 33.14 ? 29 A 10 +ATOM 427 H HA3 . GLY A1 1 29 ? -10.789 5.866 -27.262 1.0 61.11 ? 29 A 10 +ATOM 428 N N . ALA A1 1 30 ? -10.933 4.681 -24.766 1.0 0.3 ? 30 A 10 +ATOM 429 C CA . ALA A1 1 30 ? -11.23 3.615 -23.817 1.0 24.42 ? 30 A 10 +ATOM 430 C C . ALA A1 1 30 ? -12.301 4.05 -22.821 1.0 23.15 ? 30 A 10 +ATOM 431 O O . ALA A1 1 30 ? -13.182 3.269 -22.461 1.0 23.32 ? 30 A 10 +ATOM 432 C CB . ALA A1 1 30 ? -9.965 3.194 -23.084 1.0 4.23 ? 30 A 10 +ATOM 433 H H . ALA A1 1 30 ? -10.021 5.035 -24.817 1.0 13.0 ? 30 A 10 +ATOM 434 H HA . ALA A1 1 30 ? -11.595 2.764 -24.374 1.0 42.35 ? 30 A 10 +ATOM 435 H HB1 . ALA A1 1 30 ? -10.09 2.191 -22.701 1.0 24.3 ? 30 A 10 +ATOM 436 H HB2 . ALA A1 1 30 ? -9.129 3.218 -23.766 1.0 15.25 ? 30 A 10 +ATOM 437 H HB3 . ALA A1 1 30 ? -9.782 3.872 -22.264 1.0 54.13 ? 30 A 10 +ATOM 438 N N . VAL A1 1 31 ? -12.219 5.301 -22.379 1.0 44.02 ? 31 A 10 +ATOM 439 C CA . VAL A1 1 31 ? -13.181 5.839 -21.426 1.0 44.43 ? 31 A 10 +ATOM 440 C C . VAL A1 1 31 ? -14.586 5.864 -22.017 1.0 22.33 ? 31 A 10 +ATOM 441 O O . VAL A1 1 31 ? -15.56 5.516 -21.348 1.0 41.34 ? 31 A 10 +ATOM 442 C CB . VAL A1 1 31 ? -12.797 7.264 -20.984 1.0 42.01 ? 31 A 10 +ATOM 443 C CG1 . VAL A1 1 31 ? -13.863 7.845 -20.068 1.0 61.22 ? 31 A 10 +ATOM 444 C CG2 . VAL A1 1 31 ? -11.438 7.261 -20.3 1.0 34.2 ? 31 A 10 +ATOM 445 H H . VAL A1 1 31 ? -11.494 5.875 -22.703 1.0 33.11 ? 31 A 10 +ATOM 446 H HA . VAL A1 1 31 ? -13.179 5.202 -20.553 1.0 53.53 ? 31 A 10 +ATOM 447 H HB . VAL A1 1 31 ? -12.733 7.886 -21.864 1.0 34.14 ? 31 A 10 +ATOM 448 H HG11 . VAL A1 1 31 ? -14.495 8.516 -20.631 1.0 24.43 ? 31 A 10 +ATOM 449 H HG12 . VAL A1 1 31 ? -14.461 7.044 -19.658 1.0 62.24 ? 31 A 10 +ATOM 450 H HG13 . VAL A1 1 31 ? -13.389 8.388 -19.264 1.0 4.44 ? 31 A 10 +ATOM 451 H HG21 . VAL A1 1 31 ? -11.185 6.254 -20.005 1.0 32.4 ? 31 A 10 +ATOM 452 H HG22 . VAL A1 1 31 ? -10.691 7.634 -20.985 1.0 31.51 ? 31 A 10 +ATOM 453 H HG23 . VAL A1 1 31 ? -11.473 7.894 -19.426 1.0 2.41 ? 31 A 10 +ATOM 454 N N . LYS A1 1 32 ? -14.685 6.276 -23.276 1.0 44.33 ? 32 A 10 +ATOM 455 C CA . LYS A1 1 32 ? -15.971 6.345 -23.961 1.0 33.41 ? 32 A 10 +ATOM 456 C C . LYS A1 1 32 ? -16.682 4.996 -23.92 1.0 33.52 ? 32 A 10 +ATOM 457 O O . LYS A1 1 32 ? -17.89 4.928 -23.698 1.0 55.22 ? 32 A 10 +ATOM 458 C CB . LYS A1 1 32 ? -15.775 6.786 -25.413 1.0 21.43 ? 32 A 10 +ATOM 459 C CG . LYS A1 1 32 ? -16.397 8.136 -25.727 1.0 62.04 ? 32 A 10 +ATOM 460 C CD . LYS A1 1 32 ? -15.336 9.207 -25.921 1.0 13.3 ? 32 A 10 +ATOM 461 C CE . LYS A1 1 32 ? -15.247 9.647 -27.375 1.0 61.02 ? 32 A 10 +ATOM 462 N NZ . LYS A1 1 32 ? -16.522 10.252 -27.85 1.0 10.13 ? 32 A 10 +ATOM 463 H H . LYS A1 1 32 ? -13.872 6.54 -23.758 1.0 0.43 ? 32 A 10 +ATOM 464 H HA . LYS A1 1 32 ? -16.58 7.075 -23.45 1.0 20.21 ? 32 A 10 +ATOM 465 H HB2 . LYS A1 1 32 ? -14.717 6.844 -25.62 1.0 31.13 ? 32 A 10 +ATOM 466 H HB3 . LYS A1 1 32 ? -16.221 6.048 -26.064 1.0 51.43 ? 32 A 10 +ATOM 467 H HG2 . LYS A1 1 32 ? -16.978 8.053 -26.633 1.0 34.55 ? 32 A 10 +ATOM 468 H HG3 . LYS A1 1 32 ? -17.041 8.425 -24.909 1.0 75.31 ? 32 A 10 +ATOM 469 H HD2 . LYS A1 1 32 ? -15.585 10.063 -25.312 1.0 62.53 ? 32 A 10 +ATOM 470 H HD3 . LYS A1 1 32 ? -14.378 8.812 -25.615 1.0 34.24 ? 32 A 10 +ATOM 471 H HE2 . LYS A1 1 32 ? -14.456 10.375 -27.469 1.0 32.35 ? 32 A 10 +ATOM 472 H HE3 . LYS A1 1 32 ? -15.018 8.785 -27.984 1.0 31.14 ? 32 A 10 +ATOM 473 H HZ1 . LYS A1 1 32 ? -16.366 10.758 -28.744 1.0 3.34 ? 32 A 10 +ATOM 474 H HZ2 . LYS A1 1 32 ? -16.884 10.923 -27.142 1.0 11.13 ? 32 A 10 +ATOM 475 H HZ3 . LYS A1 1 32 ? -17.234 9.51 -28.003 1.0 13.55 ? 32 A 10 +ATOM 476 N N . ALA A1 1 33 ? -15.924 3.926 -24.133 1.0 34.21 ? 33 A 10 +ATOM 477 C CA . ALA A1 1 33 ? -16.481 2.579 -24.117 1.0 60.31 ? 33 A 10 +ATOM 478 C C . ALA A1 1 33 ? -17.027 2.228 -22.737 1.0 31.03 ? 33 A 10 +ATOM 479 O O . ALA A1 1 33 ? -18.1 1.636 -22.615 1.0 31.32 ? 33 A 10 +ATOM 480 C CB . ALA A1 1 33 ? -15.429 1.567 -24.543 1.0 54.24 ? 33 A 10 +ATOM 481 H H . ALA A1 1 33 ? -14.966 4.045 -24.305 1.0 43.1 ? 33 A 10 +ATOM 482 H HA . ALA A1 1 33 ? -17.29 2.544 -24.833 1.0 53.01 ? 33 A 10 +ATOM 483 H HB1 . ALA A1 1 33 ? -14.512 1.753 -24.003 1.0 2.33 ? 33 A 10 +ATOM 484 H HB2 . ALA A1 1 33 ? -15.78 0.569 -24.326 1.0 61.23 ? 33 A 10 +ATOM 485 H HB3 . ALA A1 1 33 ? -15.247 1.662 -25.603 1.0 53.23 ? 33 A 10 +ATOM 486 N N . LYS A1 1 34 ? -16.283 2.596 -21.7 1.0 30.14 ? 34 A 10 +ATOM 487 C CA . LYS A1 1 34 ? -16.692 2.321 -20.328 1.0 3.41 ? 34 A 10 +ATOM 488 C C . LYS A1 1 34 ? -18.027 2.989 -20.013 1.0 51.04 ? 34 A 10 +ATOM 489 O O . LYS A1 1 34 ? -18.889 2.399 -19.363 1.0 30.3 ? 34 A 10 +ATOM 490 C CB . LYS A1 1 34 ? -15.622 2.807 -19.348 1.0 63.02 ? 34 A 10 +ATOM 491 C CG . LYS A1 1 34 ? -15.965 2.541 -17.892 1.0 24.43 ? 34 A 10 +ATOM 492 C CD . LYS A1 1 34 ? -15.943 1.055 -17.577 1.0 44.42 ? 34 A 10 +ATOM 493 C CE . LYS A1 1 34 ? -14.548 0.472 -17.737 1.0 34.12 ? 34 A 10 +ATOM 494 N NZ . LYS A1 1 34 ? -14.444 -0.89 -17.143 1.0 13.0 ? 34 A 10 +ATOM 495 H H . LYS A1 1 34 ? -15.437 3.066 -21.862 1.0 65.25 ? 34 A 10 +ATOM 496 H HA . LYS A1 1 34 ? -16.805 1.252 -20.223 1.0 3.22 ? 34 A 10 +ATOM 497 H HB2 . LYS A1 1 34 ? -14.691 2.309 -19.573 1.0 71.03 ? 34 A 10 +ATOM 498 H HB3 . LYS A1 1 34 ? -15.491 3.872 -19.476 1.0 71.12 ? 34 A 10 +ATOM 499 H HG2 . LYS A1 1 34 ? -15.243 3.042 -17.264 1.0 24.23 ? 34 A 10 +ATOM 500 H HG3 . LYS A1 1 34 ? -16.953 2.929 -17.688 1.0 22.21 ? 34 A 10 +ATOM 501 H HD2 . LYS A1 1 34 ? -16.267 0.907 -16.557 1.0 63.43 ? 34 A 10 +ATOM 502 H HD3 . LYS A1 1 34 ? -16.617 0.543 -18.249 1.0 75.33 ? 34 A 10 +ATOM 503 H HE2 . LYS A1 1 34 ? -14.315 0.415 -18.79 1.0 34.14 ? 34 A 10 +ATOM 504 H HE3 . LYS A1 1 34 ? -13.84 1.124 -17.247 1.0 0.12 ? 34 A 10 +ATOM 505 H HZ1 . LYS A1 1 34 ? -14.375 -0.824 -16.108 1.0 62.42 ? 34 A 10 +ATOM 506 H HZ2 . LYS A1 1 34 ? -13.597 -1.374 -17.506 1.0 14.2 ? 34 A 10 +ATOM 507 H HZ3 . LYS A1 1 34 ? -15.283 -1.452 -17.389 1.0 65.2 ? 34 A 10 +ATOM 508 N N . ILE A1 1 35 ? -18.19 4.223 -20.48 1.0 14.42 ? 35 A 10 +ATOM 509 C CA . ILE A1 1 35 ? -19.42 4.969 -20.251 1.0 22.32 ? 35 A 10 +ATOM 510 C C . ILE A1 1 35 ? -20.579 4.377 -21.046 1.0 74.31 ? 35 A 10 +ATOM 511 O O . ILE A1 1 35 ? -21.719 4.357 -20.58 1.0 33.23 ? 35 A 10 +ATOM 512 C CB . ILE A1 1 35 ? -19.258 6.453 -20.629 1.0 42.5 ? 35 A 10 +ATOM 513 C CG1 . ILE A1 1 35 ? -18.084 7.071 -19.866 1.0 22.04 ? 35 A 10 +ATOM 514 C CG2 . ILE A1 1 35 ? -20.543 7.216 -20.345 1.0 45.14 ? 35 A 10 +ATOM 515 C CD1 . ILE A1 1 35 ? -18.193 6.92 -18.365 1.0 11.1 ? 35 A 10 +ATOM 516 H H . ILE A1 1 35 ? -17.466 4.64 -20.992 1.0 54.44 ? 35 A 10 +ATOM 517 H HA . ILE A1 1 35 ? -19.654 4.911 -19.197 1.0 30.01 ? 35 A 10 +ATOM 518 H HB . ILE A1 1 35 ? -19.06 6.512 -21.689 1.0 2.44 ? 35 A 10 +ATOM 519 H HG12 . ILE A1 1 35 ? -17.168 6.597 -20.181 1.0 3.24 ? 35 A 10 +ATOM 520 H HG13 . ILE A1 1 35 ? -18.035 8.127 -20.091 1.0 0.11 ? 35 A 10 +ATOM 521 H HG21 . ILE A1 1 35 ? -20.354 7.972 -19.596 1.0 65.32 ? 35 A 10 +ATOM 522 H HG22 . ILE A1 1 35 ? -20.889 7.689 -21.252 1.0 43.1 ? 35 A 10 +ATOM 523 H HG23 . ILE A1 1 35 ? -21.296 6.532 -19.985 1.0 75.41 ? 35 A 10 +ATOM 524 H HD11 . ILE A1 1 35 ? -17.422 6.249 -18.014 1.0 43.52 ? 35 A 10 +ATOM 525 H HD12 . ILE A1 1 35 ? -18.07 7.884 -17.895 1.0 71.15 ? 35 A 10 +ATOM 526 H HD13 . ILE A1 1 35 ? -19.162 6.516 -18.112 1.0 74.3 ? 35 A 10 +ATOM 527 N N . TYR A1 1 36 ? -20.28 3.895 -22.247 1.0 62.53 ? 36 A 10 +ATOM 528 C CA . TYR A1 1 36 ? -21.296 3.303 -23.108 1.0 64.44 ? 36 A 10 +ATOM 529 C C . TYR A1 1 36 ? -22.014 2.16 -22.396 1.0 53.42 ? 36 A 10 +ATOM 530 O O . TYR A1 1 36 ? -23.24 2.058 -22.442 1.0 34.33 ? 36 A 10 +ATOM 531 C CB . TYR A1 1 36 ? -20.663 2.794 -24.404 1.0 74.42 ? 36 A 10 +ATOM 532 C CG . TYR A1 1 36 ? -21.079 1.387 -24.769 1.0 43.51 ? 36 A 10 +ATOM 533 C CD1 . TYR A1 1 36 ? -22.358 1.12 -25.24 1.0 62.31 ? 36 A 10 +ATOM 534 C CD2 . TYR A1 1 36 ? -20.192 0.325 -24.642 1.0 22.21 ? 36 A 10 +ATOM 535 C CE1 . TYR A1 1 36 ? -22.743 -0.165 -25.574 1.0 25.24 ? 36 A 10 +ATOM 536 C CE2 . TYR A1 1 36 ? -20.568 -0.962 -24.975 1.0 24.41 ? 36 A 10 +ATOM 537 C CZ . TYR A1 1 36 ? -21.844 -1.202 -25.441 1.0 51.0 ? 36 A 10 +ATOM 538 O OH . TYR A1 1 36 ? -22.222 -2.483 -25.772 1.0 31.41 ? 36 A 10 +ATOM 539 H H . TYR A1 1 36 ? -19.353 3.94 -22.563 1.0 42.53 ? 36 A 10 +ATOM 540 H HA . TYR A1 1 36 ? -22.017 4.071 -23.348 1.0 45.34 ? 36 A 10 +ATOM 541 H HB2 . TYR A1 1 36 ? -20.95 3.445 -25.216 1.0 32.41 ? 36 A 10 +ATOM 542 H HB3 . TYR A1 1 36 ? -19.588 2.807 -24.301 1.0 73.31 ? 36 A 10 +ATOM 543 H HD1 . TYR A1 1 36 ? -23.061 1.934 -25.344 1.0 14.41 ? 36 A 10 +ATOM 544 H HD2 . TYR A1 1 36 ? -19.194 0.516 -24.277 1.0 73.43 ? 36 A 10 +ATOM 545 H HE1 . TYR A1 1 36 ? -23.742 -0.353 -25.939 1.0 30.0 ? 36 A 10 +ATOM 546 H HE2 . TYR A1 1 36 ? -19.864 -1.775 -24.87 1.0 11.1 ? 36 A 10 +ATOM 547 H HH . TYR A1 1 36 ? -22.805 -2.457 -26.534 1.0 20.21 ? 36 A 10 +ATOM 548 N N . ASP A1 1 37 ? -21.241 1.303 -21.739 1.0 31.31 ? 37 A 10 +ATOM 549 C CA . ASP A1 1 37 ? -21.801 0.168 -21.015 1.0 4.3 ? 37 A 10 +ATOM 550 C C . ASP A1 1 37 ? -22.444 0.62 -19.708 1.0 30.32 ? 37 A 10 +ATOM 551 O O . ASP A1 1 37 ? -23.441 0.051 -19.264 1.0 62.0 ? 37 A 10 +ATOM 552 C CB . ASP A1 1 37 ? -20.714 -0.87 -20.732 1.0 35.43 ? 37 A 10 +ATOM 553 C CG . ASP A1 1 37 ? -20.961 -2.179 -21.455 1.0 34.32 ? 37 A 10 +ATOM 554 O OD1 . ASP A1 1 37 ? -21.905 -2.901 -21.071 1.0 31.12 ? 37 A 10 +ATOM 555 O OD2 . ASP A1 1 37 ? -20.209 -2.483 -22.406 1.0 3.2 ? 37 A 10 +ATOM 556 H H . ASP A1 1 37 ? -20.27 1.438 -21.739 1.0 51.42 ? 37 A 10 +ATOM 557 H HA . ASP A1 1 37 ? -22.56 -0.281 -21.638 1.0 32.24 ? 37 A 10 +ATOM 558 H HB2 . ASP A1 1 37 ? -19.759 -0.479 -21.051 1.0 43.14 ? 37 A 10 +ATOM 559 H HB3 . ASP A1 1 37 ? -20.681 -1.067 -19.67 1.0 34.23 ? 37 A 10 +ATOM 560 N N . LYS A1 1 38 ? -21.865 1.646 -19.094 1.0 33.03 ? 38 A 10 +ATOM 561 C CA . LYS A1 1 38 ? -22.379 2.176 -17.837 1.0 33.5 ? 38 A 10 +ATOM 562 C C . LYS A1 1 38 ? -23.843 2.582 -17.976 1.0 62.1 ? 38 A 10 +ATOM 563 O O . LYS A1 1 38 ? -24.678 2.22 -17.148 1.0 13.24 ? 38 A 10 +ATOM 564 C CB . LYS A1 1 38 ? -21.546 3.379 -17.387 1.0 32.13 ? 38 A 10 +ATOM 565 C CG . LYS A1 1 38 ? -20.791 3.144 -16.091 1.0 11.13 ? 38 A 10 +ATOM 566 C CD . LYS A1 1 38 ? -19.332 2.807 -16.348 1.0 55.11 ? 38 A 10 +ATOM 567 C CE . LYS A1 1 38 ? -19.123 1.307 -16.488 1.0 12.13 ? 38 A 10 +ATOM 568 N NZ . LYS A1 1 38 ? -18.425 0.731 -15.306 1.0 62.42 ? 38 A 10 +ATOM 569 H H . LYS A1 1 38 ? -21.071 2.059 -19.497 1.0 40.1 ? 38 A 10 +ATOM 570 H HA . LYS A1 1 38 ? -22.304 1.398 -17.093 1.0 13.43 ? 38 A 10 +ATOM 571 H HB2 . LYS A1 1 38 ? -20.829 3.614 -18.16 1.0 53.44 ? 38 A 10 +ATOM 572 H HB3 . LYS A1 1 38 ? -22.204 4.225 -17.248 1.0 74.35 ? 38 A 10 +ATOM 573 H HG2 . LYS A1 1 38 ? -20.841 4.039 -15.488 1.0 72.35 ? 38 A 10 +ATOM 574 H HG3 . LYS A1 1 38 ? -21.252 2.324 -15.559 1.0 65.33 ? 38 A 10 +ATOM 575 H HD2 . LYS A1 1 38 ? -19.015 3.289 -17.261 1.0 31.44 ? 38 A 10 +ATOM 576 H HD3 . LYS A1 1 38 ? -18.736 3.169 -15.522 1.0 51.13 ? 38 A 10 +ATOM 577 H HE2 . LYS A1 1 38 ? -20.086 0.831 -16.594 1.0 72.24 ? 38 A 10 +ATOM 578 H HE3 . LYS A1 1 38 ? -18.53 1.12 -17.372 1.0 52.14 ? 38 A 10 +ATOM 579 H HZ1 . LYS A1 1 38 ? -17.863 -0.096 -15.59 1.0 12.21 ? 38 A 10 +ATOM 580 H HZ2 . LYS A1 1 38 ? -19.12 0.436 -14.59 1.0 31.3 ? 38 A 10 +ATOM 581 H HZ3 . LYS A1 1 38 ? -17.791 1.44 -14.885 1.0 72.13 ? 38 A 10 +ATOM 582 N N . GLU A1 1 39 ? -24.146 3.334 -19.03 1.0 74.33 ? 39 A 10 +ATOM 583 C CA . GLU A1 1 39 ? -25.51 3.788 -19.277 1.0 31.43 ? 39 A 10 +ATOM 584 C C . GLU A1 1 39 ? -26.159 2.977 -20.394 1.0 55.55 ? 39 A 10 +ATOM 585 O O . GLU A1 1 39 ? -27.217 2.377 -20.206 1.0 44.25 ? 39 A 10 +ATOM 586 C CB . GLU A1 1 39 ? -25.519 5.274 -19.64 1.0 31.12 ? 39 A 10 +ATOM 587 C CG . GLU A1 1 39 ? -24.295 6.029 -19.146 1.0 22.34 ? 39 A 10 +ATOM 588 C CD . GLU A1 1 39 ? -24.253 6.148 -17.635 1.0 34.02 ? 39 A 10 +ATOM 589 O OE1 . GLU A1 1 39 ? -24.41 5.112 -16.955 1.0 60.52 ? 39 A 10 +ATOM 590 O OE2 . GLU A1 1 39 ? -24.064 7.275 -17.133 1.0 24.54 ? 39 A 10 +ATOM 591 H H . GLU A1 1 39 ? -23.436 3.59 -19.655 1.0 53.12 ? 39 A 10 +ATOM 592 H HA . GLU A1 1 39 ? -26.076 3.645 -18.369 1.0 24.23 ? 39 A 10 +ATOM 593 H HB2 . GLU A1 1 39 ? -25.566 5.37 -20.714 1.0 13.32 ? 39 A 10 +ATOM 594 H HB3 . GLU A1 1 39 ? -26.396 5.732 -19.207 1.0 53.15 ? 39 A 10 +ATOM 595 H HG2 . GLU A1 1 39 ? -23.409 5.507 -19.476 1.0 73.51 ? 39 A 10 +ATOM 596 H HG3 . GLU A1 1 39 ? -24.305 7.022 -19.571 1.0 55.55 ? 39 A 10 +ATOM 597 N N . GLY A1 1 40 ? -25.517 2.964 -21.558 1.0 41.31 ? 40 A 10 +ATOM 598 C CA . GLY A1 1 40 ? -26.046 2.224 -22.689 1.0 23.2 ? 40 A 10 +ATOM 599 C C . GLY A1 1 40 ? -26.269 3.103 -23.904 1.0 54.31 ? 40 A 10 +ATOM 600 O O . GLY A1 1 40 ? -27.31 3.02 -24.556 1.0 62.35 ? 40 A 10 +ATOM 601 H H . GLY A1 1 40 ? -24.677 3.46 -21.65 1.0 1.31 ? 40 A 10 +ATOM 602 H HA2 . GLY A1 1 40 ? -25.352 1.439 -22.948 1.0 42.33 ? 40 A 10 +ATOM 603 H HA3 . GLY A1 1 40 ? -26.988 1.779 -22.404 1.0 42.25 ? 40 A 10 +ATOM 604 N N . ILE A1 1 41 ? -25.29 3.949 -24.208 1.0 11.45 ? 41 A 10 +ATOM 605 C CA . ILE A1 1 41 ? -25.385 4.847 -25.352 1.0 13.21 ? 41 A 10 +ATOM 606 C C . ILE A1 1 41 ? -24.237 4.617 -26.328 1.0 73.14 ? 41 A 10 +ATOM 607 O O . ILE A1 1 41 ? -23.176 4.105 -25.968 1.0 54.03 ? 41 A 10 +ATOM 608 C CB . ILE A1 1 41 ? -25.381 6.323 -24.91 1.0 13.54 ? 41 A 10 +ATOM 609 C CG1 . ILE A1 1 41 ? -24.33 6.549 -23.821 1.0 35.25 ? 41 A 10 +ATOM 610 C CG2 . ILE A1 1 41 ? -26.76 6.732 -24.416 1.0 15.54 ? 41 A 10 +ATOM 611 C CD1 . ILE A1 1 41 ? -23.651 7.898 -23.908 1.0 51.21 ? 41 A 10 +ATOM 612 H H . ILE A1 1 41 ? -24.485 3.969 -23.65 1.0 10.31 ? 41 A 10 +ATOM 613 H HA . ILE A1 1 41 ? -26.319 4.646 -25.857 1.0 22.4 ? 41 A 10 +ATOM 614 H HB . ILE A1 1 41 ? -25.137 6.931 -25.768 1.0 2.22 ? 41 A 10 +ATOM 615 H HG12 . ILE A1 1 41 ? -24.802 6.477 -22.854 1.0 53.25 ? 41 A 10 +ATOM 616 H HG13 . ILE A1 1 41 ? -23.568 5.787 -23.903 1.0 73.21 ? 41 A 10 +ATOM 617 H HG21 . ILE A1 1 41 ? -26.78 6.7 -23.337 1.0 41.34 ? 41 A 10 +ATOM 618 H HG22 . ILE A1 1 41 ? -26.979 7.735 -24.75 1.0 35.01 ? 41 A 10 +ATOM 619 H HG23 . ILE A1 1 41 ? -27.501 6.052 -24.81 1.0 24.24 ? 41 A 10 +ATOM 620 H HD11 . ILE A1 1 41 ? -23.533 8.176 -24.946 1.0 13.35 ? 41 A 10 +ATOM 621 H HD12 . ILE A1 1 41 ? -24.256 8.639 -23.405 1.0 5.02 ? 41 A 10 +ATOM 622 H HD13 . ILE A1 1 41 ? -22.681 7.844 -23.438 1.0 73.01 ? 41 A 10 +ATOM 623 N N . PRO A1 1 42 ? -24.45 5.004 -27.594 1.0 42.01 ? 42 A 10 +ATOM 624 C CA . PRO A1 1 42 ? -23.444 4.852 -28.649 1.0 63.34 ? 42 A 10 +ATOM 625 C C . PRO A1 1 42 ? -22.258 5.792 -28.458 1.0 4.23 ? 42 A 10 +ATOM 626 O O . PRO A1 1 42 ? -22.393 7.015 -28.484 1.0 21.54 ? 42 A 10 +ATOM 627 C CB . PRO A1 1 42 ? -24.21 5.211 -29.925 1.0 63.45 ? 42 A 10 +ATOM 628 C CG . PRO A1 1 42 ? -25.312 6.103 -29.467 1.0 31.23 ? 42 A 10 +ATOM 629 C CD . PRO A1 1 42 ? -25.691 5.621 -28.094 1.0 52.22 ? 42 A 10 +ATOM 630 H HA . PRO A1 1 42 ? -23.088 3.834 -28.714 1.0 60.32 ? 42 A 10 +ATOM 631 H HB2 . PRO A1 1 42 ? -23.549 5.719 -30.613 1.0 50.23 ? 42 A 10 +ATOM 632 H HB3 . PRO A1 1 42 ? -24.594 4.312 -30.383 1.0 64.01 ? 42 A 10 +ATOM 633 H HG2 . PRO A1 1 42 ? -24.964 7.124 -29.424 1.0 0.11 ? 42 A 10 +ATOM 634 H HG3 . PRO A1 1 42 ? -26.154 6.019 -30.138 1.0 1.1 ? 42 A 10 +ATOM 635 H HD2 . PRO A1 1 42 ? -25.986 6.452 -27.471 1.0 11.32 ? 42 A 10 +ATOM 636 H HD3 . PRO A1 1 42 ? -26.485 4.892 -28.155 1.0 34.03 ? 42 A 10 +ATOM 637 N N . PRO A1 1 43 ? -21.066 5.209 -28.262 1.0 1.41 ? 43 A 10 +ATOM 638 C CA . PRO A1 1 43 ? -19.832 5.976 -28.064 1.0 62.53 ? 43 A 10 +ATOM 639 C C . PRO A1 1 43 ? -19.384 6.69 -29.334 1.0 21.35 ? 43 A 10 +ATOM 640 O O . PRO A1 1 43 ? -18.741 7.739 -29.274 1.0 73.42 ? 43 A 10 +ATOM 641 C CB . PRO A1 1 43 ? -18.811 4.909 -27.662 1.0 74.43 ? 43 A 10 +ATOM 642 C CG . PRO A1 1 43 ? -19.331 3.645 -28.255 1.0 42.11 ? 43 A 10 +ATOM 643 C CD . PRO A1 1 43 ? -20.83 3.756 -28.219 1.0 32.53 ? 43 A 10 +ATOM 644 H HA . PRO A1 1 43 ? -19.937 6.696 -27.265 1.0 3.1 ? 43 A 10 +ATOM 645 H HB2 . PRO A1 1 43 ? -17.841 5.165 -28.063 1.0 1.2 ? 43 A 10 +ATOM 646 H HB3 . PRO A1 1 43 ? -18.756 4.845 -26.585 1.0 52.2 ? 43 A 10 +ATOM 647 H HG2 . PRO A1 1 43 ? -18.986 3.549 -29.273 1.0 21.5 ? 43 A 10 +ATOM 648 H HG3 . PRO A1 1 43 ? -19.004 2.801 -27.666 1.0 41.32 ? 43 A 10 +ATOM 649 H HD2 . PRO A1 1 43 ? -21.265 3.269 -29.079 1.0 55.24 ? 43 A 10 +ATOM 650 H HD3 . PRO A1 1 43 ? -21.218 3.33 -27.305 1.0 31.14 ? 43 A 10 +ATOM 651 N N . ASP A1 1 44 ? -19.727 6.117 -30.482 1.0 54.12 ? 44 A 10 +ATOM 652 C CA . ASP A1 1 44 ? -19.361 6.7 -31.768 1.0 51.34 ? 44 A 10 +ATOM 653 C C . ASP A1 1 44 ? -20.286 7.86 -32.122 1.0 65.34 ? 44 A 10 +ATOM 654 O O . ASP A1 1 44 ? -19.986 8.657 -33.01 1.0 41.23 ? 44 A 10 +ATOM 655 C CB . ASP A1 1 44 ? -19.41 5.638 -32.867 1.0 23.35 ? 44 A 10 +ATOM 656 C CG . ASP A1 1 44 ? -18.699 6.079 -34.131 1.0 52.14 ? 44 A 10 +ATOM 657 O OD1 . ASP A1 1 44 ? -17.656 6.756 -34.019 1.0 70.43 ? 44 A 10 +ATOM 658 O OD2 . ASP A1 1 44 ? -19.187 5.748 -35.232 1.0 15.14 ? 44 A 10 +ATOM 659 H H . ASP A1 1 44 ? -20.24 5.282 -30.465 1.0 64.31 ? 44 A 10 +ATOM 660 H HA . ASP A1 1 44 ? -18.351 7.074 -31.686 1.0 72.42 ? 44 A 10 +ATOM 661 H HB2 . ASP A1 1 44 ? -18.938 4.735 -32.507 1.0 64.21 ? 44 A 10 +ATOM 662 H HB3 . ASP A1 1 44 ? -20.441 5.428 -33.109 1.0 74.33 ? 44 A 10 +ATOM 663 N N . GLN A1 1 45 ? -21.413 7.946 -31.422 1.0 24.51 ? 45 A 10 +ATOM 664 C CA . GLN A1 1 45 ? -22.384 9.007 -31.665 1.0 55.1 ? 45 A 10 +ATOM 665 C C . GLN A1 1 45 ? -22.256 10.11 -30.62 1.0 65.33 ? 45 A 10 +ATOM 666 O O . GLN A1 1 45 ? -22.82 11.193 -30.776 1.0 0.12 ? 45 A 10 +ATOM 667 C CB . GLN A1 1 45 ? -23.804 8.44 -31.654 1.0 3.33 ? 45 A 10 +ATOM 668 C CG . GLN A1 1 45 ? -24.261 7.917 -33.007 1.0 71.05 ? 45 A 10 +ATOM 669 C CD . GLN A1 1 45 ? -25.17 6.709 -32.889 1.0 50.21 ? 45 A 10 +ATOM 670 O OE1 . GLN A1 1 45 ? -26.386 6.845 -32.747 1.0 30.33 ? 45 A 10 +ATOM 671 N NE2 . GLN A1 1 45 ? -24.584 5.519 -32.947 1.0 54.11 ? 45 A 10 +ATOM 672 H H . GLN A1 1 45 ? -21.597 7.28 -30.728 1.0 33.14 ? 45 A 10 +ATOM 673 H HA . GLN A1 1 45 ? -22.18 9.425 -32.639 1.0 54.13 ? 45 A 10 +ATOM 674 H HB2 . GLN A1 1 45 ? -23.85 7.628 -30.944 1.0 72.22 ? 45 A 10 +ATOM 675 H HB3 . GLN A1 1 45 ? -24.487 9.217 -31.344 1.0 51.24 ? 45 A 10 +ATOM 676 H HG2 . GLN A1 1 45 ? -24.796 8.702 -33.52 1.0 11.31 ? 45 A 10 +ATOM 677 H HG3 . GLN A1 1 45 ? -23.39 7.639 -33.583 1.0 33.23 ? 45 A 10 +ATOM 678 H HE21 . GLN A1 1 45 ? -23.611 5.488 -33.06 1.0 35.4 ? 45 A 10 +ATOM 679 H HE22 . GLN A1 1 45 ? -25.148 4.722 -32.873 1.0 53.4 ? 45 A 10 +ATOM 680 N N . GLN A1 1 46 ? -21.512 9.827 -29.555 1.0 5.34 ? 46 A 10 +ATOM 681 C CA . GLN A1 1 46 ? -21.313 10.796 -28.484 1.0 54.21 ? 46 A 10 +ATOM 682 C C . GLN A1 1 46 ? -19.903 11.378 -28.532 1.0 23.33 ? 46 A 10 +ATOM 683 O O . GLN A1 1 46 ? -18.989 10.769 -29.089 1.0 42.0 ? 46 A 10 +ATOM 684 C CB . GLN A1 1 46 ? -21.562 10.143 -27.124 1.0 54.1 ? 46 A 10 +ATOM 685 C CG . GLN A1 1 46 ? -20.639 8.97 -26.834 1.0 63.33 ? 46 A 10 +ATOM 686 C CD . GLN A1 1 46 ? -19.791 9.186 -25.597 1.0 73.34 ? 46 A 10 +ATOM 687 O OE1 . GLN A1 1 46 ? -20.041 8.594 -24.547 1.0 62.34 ? 46 A 10 +ATOM 688 N NE2 . GLN A1 1 46 ? -18.779 10.038 -25.714 1.0 52.51 ? 46 A 10 +ATOM 689 H H . GLN A1 1 46 ? -21.089 8.947 -29.488 1.0 61.13 ? 46 A 10 +ATOM 690 H HA . GLN A1 1 46 ? -22.023 11.597 -28.625 1.0 1.54 ? 46 A 10 +ATOM 691 H HB2 . GLN A1 1 46 ? -21.421 10.884 -26.351 1.0 70.34 ? 46 A 10 +ATOM 692 H HB3 . GLN A1 1 46 ? -22.581 9.788 -27.089 1.0 24.41 ? 46 A 10 +ATOM 693 H HG2 . GLN A1 1 46 ? -21.24 8.084 -26.689 1.0 71.34 ? 46 A 10 +ATOM 694 H HG3 . GLN A1 1 46 ? -19.985 8.826 -27.681 1.0 12.44 ? 46 A 10 +ATOM 695 H HE21 . GLN A1 1 46 ? -18.64 10.475 -26.581 1.0 61.21 ? 46 A 10 +ATOM 696 H HE22 . GLN A1 1 46 ? -18.215 10.198 -24.93 1.0 54.41 ? 46 A 10 +ATOM 697 N N . ARG A1 1 47 ? -19.735 12.558 -27.946 1.0 11.31 ? 47 A 10 +ATOM 698 C CA . ARG A1 1 47 ? -18.438 13.222 -27.923 1.0 74.42 ? 47 A 10 +ATOM 699 C C . ARG A1 1 47 ? -18.226 13.957 -26.603 1.0 0.05 ? 47 A 10 +ATOM 700 O O . ARG A1 1 47 ? -19.176 14.206 -25.859 1.0 62.43 ? 47 A 10 +ATOM 701 C CB . ARG A1 1 47 ? -18.323 14.205 -29.09 1.0 53.24 ? 47 A 10 +ATOM 702 C CG . ARG A1 1 47 ? -18.388 13.54 -30.455 1.0 25.13 ? 47 A 10 +ATOM 703 C CD . ARG A1 1 47 ? -19.808 13.521 -30.998 1.0 74.31 ? 47 A 10 +ATOM 704 N NE . ARG A1 1 47 ? -19.933 12.663 -32.173 1.0 72.02 ? 47 A 10 +ATOM 705 C CZ . ARG A1 1 47 ? -19.569 13.033 -33.396 1.0 4.33 ? 47 A 10 +ATOM 706 N NH1 . ARG A1 1 47 ? -19.06 14.239 -33.603 1.0 22.33 ? 47 A 10 +ATOM 707 N NH2 . ARG A1 1 47 ? -19.714 12.195 -34.415 1.0 24.44 ? 47 A 10 +ATOM 708 H H . ARG A1 1 47 ? -20.502 12.994 -27.519 1.0 14.32 ? 47 A 10 +ATOM 709 H HA . ARG A1 1 47 ? -17.675 12.465 -28.026 1.0 52.1 ? 47 A 10 +ATOM 710 H HB2 . ARG A1 1 47 ? -19.13 14.92 -29.024 1.0 12.43 ? 47 A 10 +ATOM 711 H HB3 . ARG A1 1 47 ? -17.382 14.728 -29.013 1.0 31.22 ? 47 A 10 +ATOM 712 H HG2 . ARG A1 1 47 ? -17.759 14.087 -31.142 1.0 2.15 ? 47 A 10 +ATOM 713 H HG3 . ARG A1 1 47 ? -18.032 12.525 -30.367 1.0 3.22 ? 47 A 10 +ATOM 714 H HD2 . ARG A1 1 47 ? -20.47 13.157 -30.227 1.0 62.34 ? 47 A 10 +ATOM 715 H HD3 . ARG A1 1 47 ? -20.09 14.528 -31.268 1.0 4.32 ? 47 A 10 +ATOM 716 H HE . ARG A1 1 47 ? -20.307 11.767 -32.043 1.0 51.12 ? 47 A 10 +ATOM 717 H HH11 . ARG A1 1 47 ? -18.948 14.872 -32.837 1.0 35.02 ? 47 A 10 +ATOM 718 H HH12 . ARG A1 1 47 ? -18.785 14.515 -34.524 1.0 42.25 ? 47 A 10 +ATOM 719 H HH21 . ARG A1 1 47 ? -20.097 11.285 -34.263 1.0 32.54 ? 47 A 10 +ATOM 720 H HH22 . ARG A1 1 47 ? -19.44 12.474 -35.334 1.0 51.04 ? 47 A 10 +ATOM 721 N N . LEU A1 1 48 ? -16.975 14.302 -26.317 1.0 13.42 ? 48 A 10 +ATOM 722 C CA . LEU A1 1 48 ? -16.638 15.008 -25.086 1.0 63.04 ? 48 A 10 +ATOM 723 C C . LEU A1 1 48 ? -16.316 16.472 -25.369 1.0 70.54 ? 48 A 10 +ATOM 724 O O . LEU A1 1 48 ? -15.748 16.803 -26.41 1.0 13.22 ? 48 A 10 +ATOM 725 C CB . LEU A1 1 48 ? -15.447 14.336 -24.4 1.0 73.22 ? 48 A 10 +ATOM 726 C CG . LEU A1 1 48 ? -15.363 12.816 -24.538 1.0 23.01 ? 48 A 10 +ATOM 727 C CD1 . LEU A1 1 48 ? -16.741 12.189 -24.389 1.0 2.23 ? 48 A 10 +ATOM 728 C CD2 . LEU A1 1 48 ? -14.744 12.435 -25.875 1.0 62.5 ? 48 A 10 +ATOM 729 H H . LEU A1 1 48 ? -16.261 14.077 -26.949 1.0 13.1 ? 48 A 10 +ATOM 730 H HA . LEU A1 1 48 ? -17.495 14.96 -24.431 1.0 5.14 ? 48 A 10 +ATOM 731 H HB2 . LEU A1 1 48 ? -14.545 14.756 -24.816 1.0 14.35 ? 48 A 10 +ATOM 732 H HB3 . LEU A1 1 48 ? -15.498 14.571 -23.346 1.0 62.22 ? 48 A 10 +ATOM 733 H HG . LEU A1 1 48 ? -14.732 12.423 -23.752 1.0 74.12 ? 48 A 10 +ATOM 734 H HD11 . LEU A1 1 48 ? -17.377 12.849 -23.819 1.0 72.12 ? 48 A 10 +ATOM 735 H HD12 . LEU A1 1 48 ? -16.652 11.243 -23.876 1.0 51.52 ? 48 A 10 +ATOM 736 H HD13 . LEU A1 1 48 ? -17.171 12.029 -25.367 1.0 50.13 ? 48 A 10 +ATOM 737 H HD21 . LEU A1 1 48 ? -14.196 11.51 -25.768 1.0 32.51 ? 48 A 10 +ATOM 738 H HD22 . LEU A1 1 48 ? -14.071 13.217 -26.195 1.0 4.35 ? 48 A 10 +ATOM 739 H HD23 . LEU A1 1 48 ? -15.525 12.309 -26.611 1.0 44.23 ? 48 A 10 +ATOM 740 N N . ILE A1 1 49 ? -16.682 17.343 -24.435 1.0 13.31 ? 49 A 10 +ATOM 741 C CA . ILE A1 1 49 ? -16.429 18.771 -24.582 1.0 13.25 ? 49 A 10 +ATOM 742 C C . ILE A1 1 49 ? -15.989 19.391 -23.26 1.0 73.24 ? 49 A 10 +ATOM 743 O O . ILE A1 1 49 ? -16.67 19.258 -22.243 1.0 20.41 ? 49 A 10 +ATOM 744 C CB . ILE A1 1 49 ? -17.678 19.514 -25.094 1.0 42.12 ? 49 A 10 +ATOM 745 C CG1 . ILE A1 1 49 ? -17.681 19.557 -26.623 1.0 21.4 ? 49 A 10 +ATOM 746 C CG2 . ILE A1 1 49 ? -17.73 20.922 -24.519 1.0 44.11 ? 49 A 10 +ATOM 747 C CD1 . ILE A1 1 49 ? -18.967 19.05 -27.239 1.0 30.32 ? 49 A 10 +ATOM 748 H H . ILE A1 1 49 ? -17.131 17.018 -23.627 1.0 11.12 ? 49 A 10 +ATOM 749 H HA . ILE A1 1 49 ? -15.638 18.897 -25.307 1.0 31.54 ? 49 A 10 +ATOM 750 H HB . ILE A1 1 49 ? -18.552 18.98 -24.753 1.0 10.22 ? 49 A 10 +ATOM 751 H HG12 . ILE A1 1 49 ? -17.537 20.575 -26.949 1.0 52.53 ? 49 A 10 +ATOM 752 H HG13 . ILE A1 1 49 ? -16.871 18.946 -26.995 1.0 23.14 ? 49 A 10 +ATOM 753 H HG21 . ILE A1 1 49 ? -16.75 21.371 -24.58 1.0 54.41 ? 49 A 10 +ATOM 754 H HG22 . ILE A1 1 49 ? -18.433 21.515 -25.084 1.0 2.4 ? 49 A 10 +ATOM 755 H HG23 . ILE A1 1 49 ? -18.042 20.878 -23.486 1.0 53.42 ? 49 A 10 +ATOM 756 H HD11 . ILE A1 1 49 ? -19.801 19.328 -26.61 1.0 43.14 ? 49 A 10 +ATOM 757 H HD12 . ILE A1 1 49 ? -19.094 19.487 -28.218 1.0 61.33 ? 49 A 10 +ATOM 758 H HD13 . ILE A1 1 49 ? -18.926 17.975 -27.326 1.0 3.14 ? 49 A 10 +ATOM 759 N N . PHE A1 1 50 ? -14.847 20.07 -23.283 1.0 0.44 ? 50 A 10 +ATOM 760 C CA . PHE A1 1 50 ? -14.316 20.712 -22.086 1.0 63.4 ? 50 A 10 +ATOM 761 C C . PHE A1 1 50 ? -13.979 22.175 -22.358 1.0 34.31 ? 50 A 10 +ATOM 762 O O . PHE A1 1 50 ? -13.167 22.486 -23.229 1.0 24.03 ? 50 A 10 +ATOM 763 C CB . PHE A1 1 50 ? -13.069 19.973 -21.596 1.0 1.31 ? 50 A 10 +ATOM 764 C CG . PHE A1 1 50 ? -12.754 20.223 -20.149 1.0 63.44 ? 50 A 10 +ATOM 765 C CD1 . PHE A1 1 50 ? -12.429 21.496 -19.707 1.0 63.22 ? 50 A 10 +ATOM 766 C CD2 . PHE A1 1 50 ? -12.783 19.187 -19.23 1.0 31.12 ? 50 A 10 +ATOM 767 C CE1 . PHE A1 1 50 ? -12.138 21.729 -18.376 1.0 44.05 ? 50 A 10 +ATOM 768 C CE2 . PHE A1 1 50 ? -12.493 19.414 -17.898 1.0 53.14 ? 50 A 10 +ATOM 769 C CZ . PHE A1 1 50 ? -12.171 20.687 -17.47 1.0 64.24 ? 50 A 10 +ATOM 770 H H . PHE A1 1 50 ? -14.349 20.141 -24.124 1.0 32.43 ? 50 A 10 +ATOM 771 H HA . PHE A1 1 50 ? -15.075 20.666 -21.321 1.0 55.42 ? 50 A 10 +ATOM 772 H HB2 . PHE A1 1 50 ? -13.215 18.911 -21.724 1.0 72.21 ? 50 A 10 +ATOM 773 H HB3 . PHE A1 1 50 ? -12.219 20.288 -22.181 1.0 52.42 ? 50 A 10 +ATOM 774 H HD1 . PHE A1 1 50 ? -12.404 22.312 -20.414 1.0 64.41 ? 50 A 10 +ATOM 775 H HD2 . PHE A1 1 50 ? -13.035 18.19 -19.564 1.0 25.0 ? 50 A 10 +ATOM 776 H HE1 . PHE A1 1 50 ? -11.887 22.725 -18.045 1.0 33.34 ? 50 A 10 +ATOM 777 H HE2 . PHE A1 1 50 ? -12.519 18.596 -17.192 1.0 34.14 ? 50 A 10 +ATOM 778 H HZ . PHE A1 1 50 ? -11.943 20.866 -16.43 1.0 42.2 ? 50 A 10 +ATOM 779 N N . GLY A1 1 51 ? -14.61 23.072 -21.605 1.0 53.44 ? 51 A 10 +ATOM 780 C CA . GLY A1 1 51 ? -14.365 24.491 -21.78 1.0 33.5 ? 51 A 10 +ATOM 781 C C . GLY A1 1 51 ? -14.886 25.011 -23.105 1.0 34.32 ? 51 A 10 +ATOM 782 O O . GLY A1 1 51 ? -14.634 26.157 -23.473 1.0 0.02 ? 51 A 10 +ATOM 783 H H . GLY A1 1 51 ? -15.247 22.766 -20.926 1.0 14.34 ? 51 A 10 +ATOM 784 H HA2 . GLY A1 1 51 ? -14.849 25.03 -20.979 1.0 71.3 ? 51 A 10 +ATOM 785 H HA3 . GLY A1 1 51 ? -13.301 24.67 -21.73 1.0 2.33 ? 51 A 10 +ATOM 786 N N . GLY A1 1 52 ? -15.615 24.163 -23.826 1.0 51.33 ? 52 A 10 +ATOM 787 C CA . GLY A1 1 52 ? -16.159 24.561 -25.111 1.0 70.11 ? 52 A 10 +ATOM 788 C C . GLY A1 1 52 ? -15.558 23.779 -26.263 1.0 64.35 ? 52 A 10 +ATOM 789 O O . GLY A1 1 52 ? -16.209 23.567 -27.286 1.0 21.12 ? 52 A 10 +ATOM 790 H H . GLY A1 1 52 ? -15.784 23.261 -23.483 1.0 52.33 ? 52 A 10 +ATOM 791 H HA2 . GLY A1 1 52 ? -17.227 24.404 -25.102 1.0 34.31 ? 52 A 10 +ATOM 792 H HA3 . GLY A1 1 52 ? -15.962 25.612 -25.264 1.0 33.12 ? 52 A 10 +ATOM 793 N N . LYS A1 1 53 ? -14.311 23.351 -26.097 1.0 4.12 ? 53 A 10 +ATOM 794 C CA . LYS A1 1 53 ? -13.621 22.588 -27.131 1.0 20.15 ? 53 A 10 +ATOM 795 C C . LYS A1 1 53 ? -13.776 21.089 -26.896 1.0 12.34 ? 53 A 10 +ATOM 796 O O . LYS A1 1 53 ? -13.843 20.635 -25.754 1.0 53.3 ? 53 A 10 +ATOM 797 C CB . LYS A1 1 53 ? -12.136 22.959 -27.161 1.0 12.13 ? 53 A 10 +ATOM 798 C CG . LYS A1 1 53 ? -11.449 22.828 -25.813 1.0 34.42 ? 53 A 10 +ATOM 799 C CD . LYS A1 1 53 ? -10.844 21.446 -25.628 1.0 44.0 ? 53 A 10 +ATOM 800 C CE . LYS A1 1 53 ? -9.721 21.191 -26.621 1.0 75.53 ? 53 A 10 +ATOM 801 N NZ . LYS A1 1 53 ? -8.58 20.469 -25.994 1.0 61.53 ? 53 A 10 +ATOM 802 H H . LYS A1 1 53 ? -13.844 23.551 -25.259 1.0 32.12 ? 53 A 10 +ATOM 803 H HA . LYS A1 1 53 ? -14.066 22.839 -28.082 1.0 74.23 ? 53 A 10 +ATOM 804 H HB2 . LYS A1 1 53 ? -11.631 22.314 -27.865 1.0 34.02 ? 53 A 10 +ATOM 805 H HB3 . LYS A1 1 53 ? -12.041 23.984 -27.492 1.0 32.22 ? 53 A 10 +ATOM 806 H HG2 . LYS A1 1 53 ? -10.662 23.565 -25.748 1.0 24.24 ? 53 A 10 +ATOM 807 H HG3 . LYS A1 1 53 ? -12.174 23.002 -25.031 1.0 53.0 ? 53 A 10 +ATOM 808 H HD2 . LYS A1 1 53 ? -10.449 21.367 -24.626 1.0 22.42 ? 53 A 10 +ATOM 809 H HD3 . LYS A1 1 53 ? -11.616 20.703 -25.772 1.0 0.05 ? 53 A 10 +ATOM 810 H HE2 . LYS A1 1 53 ? -10.107 20.599 -27.436 1.0 25.2 ? 53 A 10 +ATOM 811 H HE3 . LYS A1 1 53 ? -9.371 22.14 -27.0 1.0 75.24 ? 53 A 10 +ATOM 812 H HZ1 . LYS A1 1 53 ? -7.729 20.563 -26.584 1.0 1.33 ? 53 A 10 +ATOM 813 H HZ2 . LYS A1 1 53 ? -8.809 19.459 -25.893 1.0 14.14 ? 53 A 10 +ATOM 814 H HZ3 . LYS A1 1 53 ? -8.381 20.863 -25.053 1.0 31.25 ? 53 A 10 +ATOM 815 N N . GLN A1 1 54 ? -13.83 20.327 -27.983 1.0 32.1 ? 54 A 10 +ATOM 816 C CA . GLN A1 1 54 ? -13.976 18.879 -27.894 1.0 3.14 ? 54 A 10 +ATOM 817 C C . GLN A1 1 54 ? -12.679 18.229 -27.423 1.0 14.5 ? 54 A 10 +ATOM 818 O O . GLN A1 1 54 ? -11.622 18.861 -27.415 1.0 22.04 ? 54 A 10 +ATOM 819 C CB . GLN A1 1 54 ? -14.386 18.302 -29.25 1.0 14.03 ? 54 A 10 +ATOM 820 C CG . GLN A1 1 54 ? -15.837 17.852 -29.306 1.0 52.41 ? 54 A 10 +ATOM 821 C CD . GLN A1 1 54 ? -16.29 17.515 -30.713 1.0 44.23 ? 54 A 10 +ATOM 822 O OE1 . GLN A1 1 54 ? -17.342 17.97 -31.165 1.0 25.33 ? 54 A 10 +ATOM 823 N NE2 . GLN A1 1 54 ? -15.496 16.715 -31.415 1.0 63.1 ? 54 A 10 +ATOM 824 H H . GLN A1 1 54 ? -13.77 20.748 -28.865 1.0 52.11 ? 54 A 10 +ATOM 825 H HA . GLN A1 1 54 ? -14.752 18.668 -27.174 1.0 62.04 ? 54 A 10 +ATOM 826 H HB2 . GLN A1 1 54 ? -14.235 19.054 -30.009 1.0 31.24 ? 54 A 10 +ATOM 827 H HB3 . GLN A1 1 54 ? -13.76 17.45 -29.469 1.0 25.42 ? 54 A 10 +ATOM 828 H HG2 . GLN A1 1 54 ? -15.953 16.975 -28.687 1.0 52.11 ? 54 A 10 +ATOM 829 H HG3 . GLN A1 1 54 ? -16.461 18.646 -28.923 1.0 53.52 ? 54 A 10 +ATOM 830 H HE21 . GLN A1 1 54 ? -14.675 16.39 -30.989 1.0 45.55 ? 54 A 10 +ATOM 831 H HE22 . GLN A1 1 54 ? -15.765 16.48 -32.326 1.0 62.42 ? 54 A 10 +ATOM 832 N N . LEU A1 1 55 ? -12.766 16.963 -27.03 1.0 51.34 ? 55 A 10 +ATOM 833 C CA . LEU A1 1 55 ? -11.599 16.226 -26.557 1.0 40.45 ? 55 A 10 +ATOM 834 C C . LEU A1 1 55 ? -11.26 15.078 -27.502 1.0 63.5 ? 55 A 10 +ATOM 835 O O . LEU A1 1 55 ? -12.112 14.248 -27.815 1.0 52.11 ? 55 A 10 +ATOM 836 C CB . LEU A1 1 55 ? -11.85 15.685 -25.148 1.0 25.03 ? 55 A 10 +ATOM 837 C CG . LEU A1 1 55 ? -12.291 16.711 -24.104 1.0 41.33 ? 55 A 10 +ATOM 838 C CD1 . LEU A1 1 55 ? -12.344 16.078 -22.722 1.0 33.24 ? 55 A 10 +ATOM 839 C CD2 . LEU A1 1 55 ? -11.354 17.911 -24.106 1.0 52.23 ? 55 A 10 +ATOM 840 H H . LEU A1 1 55 ? -13.635 16.512 -27.059 1.0 12.34 ? 55 A 10 +ATOM 841 H HA . LEU A1 1 55 ? -10.765 16.911 -26.527 1.0 22.21 ? 55 A 10 +ATOM 842 H HB2 . LEU A1 1 55 ? -12.619 14.931 -25.216 1.0 55.1 ? 55 A 10 +ATOM 843 H HB3 . LEU A1 1 55 ? -10.933 15.231 -24.801 1.0 51.11 ? 55 A 10 +ATOM 844 H HG . LEU A1 1 55 ? -13.284 17.061 -24.348 1.0 72.12 ? 55 A 10 +ATOM 845 H HD11 . LEU A1 1 55 ? -11.383 15.647 -22.486 1.0 32.04 ? 55 A 10 +ATOM 846 H HD12 . LEU A1 1 55 ? -13.098 15.305 -22.71 1.0 44.35 ? 55 A 10 +ATOM 847 H HD13 . LEU A1 1 55 ? -12.591 16.832 -21.989 1.0 32.21 ? 55 A 10 +ATOM 848 H HD21 . LEU A1 1 55 ? -10.482 17.685 -24.701 1.0 33.14 ? 55 A 10 +ATOM 849 H HD22 . LEU A1 1 55 ? -11.052 18.133 -23.093 1.0 72.01 ? 55 A 10 +ATOM 850 H HD23 . LEU A1 1 55 ? -11.866 18.766 -24.525 1.0 74.33 ? 55 A 10 +ATOM 851 N N . GLU A1 1 56 ? -10.009 15.037 -27.95 1.0 12.02 ? 56 A 10 +ATOM 852 C CA . GLU A1 1 56 ? -9.557 13.99 -28.858 1.0 31.33 ? 56 A 10 +ATOM 853 C C . GLU A1 1 56 ? -9.589 12.626 -28.174 1.0 62.51 ? 56 A 10 +ATOM 854 O O . GLU A1 1 56 ? -10.042 12.501 -27.036 1.0 51.02 ? 56 A 10 +ATOM 855 C CB . GLU A1 1 56 ? -8.142 14.29 -29.355 1.0 62.01 ? 56 A 10 +ATOM 856 C CG . GLU A1 1 56 ? -7.99 15.677 -29.957 1.0 21.02 ? 56 A 10 +ATOM 857 C CD . GLU A1 1 56 ? -6.767 15.796 -30.846 1.0 1.0 ? 56 A 10 +ATOM 858 O OE1 . GLU A1 1 56 ? -6.055 14.785 -31.016 1.0 61.34 ? 56 A 10 +ATOM 859 O OE2 . GLU A1 1 56 ? -6.523 16.902 -31.373 1.0 22.01 ? 56 A 10 +ATOM 860 H H . GLU A1 1 56 ? -9.375 15.728 -27.664 1.0 72.43 ? 56 A 10 +ATOM 861 H HA . GLU A1 1 56 ? -10.229 13.971 -29.703 1.0 4.21 ? 56 A 10 +ATOM 862 H HB2 . GLU A1 1 56 ? -7.456 14.202 -28.526 1.0 41.11 ? 56 A 10 +ATOM 863 H HB3 . GLU A1 1 56 ? -7.876 13.563 -30.109 1.0 51.02 ? 56 A 10 +ATOM 864 H HG2 . GLU A1 1 56 ? -8.867 15.898 -30.546 1.0 71.31 ? 56 A 10 +ATOM 865 H HG3 . GLU A1 1 56 ? -7.905 16.396 -29.156 1.0 60.44 ? 56 A 10 +ATOM 866 N N . ASP A1 1 57 ? -9.106 11.607 -28.876 1.0 71.03 ? 57 A 10 +ATOM 867 C CA . ASP A1 1 57 ? -9.078 10.252 -28.338 1.0 63.41 ? 57 A 10 +ATOM 868 C C . ASP A1 1 57 ? -8.006 10.118 -27.261 1.0 21.4 ? 57 A 10 +ATOM 869 O O . ASP A1 1 57 ? -8.102 9.264 -26.379 1.0 43.31 ? 57 A 10 +ATOM 870 C CB . ASP A1 1 57 ? -8.823 9.241 -29.457 1.0 45.31 ? 57 A 10 +ATOM 871 C CG . ASP A1 1 57 ? -9.769 9.423 -30.628 1.0 55.43 ? 57 A 10 +ATOM 872 O OD1 . ASP A1 1 57 ? -9.522 10.325 -31.456 1.0 72.35 ? 57 A 10 +ATOM 873 O OD2 . ASP A1 1 57 ? -10.756 8.664 -30.717 1.0 15.11 ? 57 A 10 +ATOM 874 H H . ASP A1 1 57 ? -8.759 11.771 -29.779 1.0 23.12 ? 57 A 10 +ATOM 875 H HA . ASP A1 1 57 ? -10.042 10.051 -27.896 1.0 62.14 ? 57 A 10 +ATOM 876 H HB2 . ASP A1 1 57 ? -7.811 9.357 -29.815 1.0 24.44 ? 57 A 10 +ATOM 877 H HB3 . ASP A1 1 57 ? -8.951 8.242 -29.066 1.0 64.03 ? 57 A 10 +ATOM 878 N N . SER A1 1 58 ? -6.986 10.966 -27.339 1.0 32.51 ? 58 A 10 +ATOM 879 C CA . SER A1 1 58 ? -5.893 10.938 -26.373 1.0 62.24 ? 58 A 10 +ATOM 880 C C . SER A1 1 58 ? -5.931 12.171 -25.476 1.0 2.12 ? 58 A 10 +ATOM 881 O O . SER A1 1 58 ? -5.049 12.373 -24.642 1.0 12.21 ? 58 A 10 +ATOM 882 C CB . SER A1 1 58 ? -4.547 10.861 -27.097 1.0 65.11 ? 58 A 10 +ATOM 883 O OG . SER A1 1 58 ? -3.482 10.704 -26.175 1.0 34.21 ? 58 A 10 +ATOM 884 H H . SER A1 1 58 ? -6.966 11.624 -28.065 1.0 21.03 ? 58 A 10 +ATOM 885 H HA . SER A1 1 58 ? -6.014 10.058 -25.761 1.0 33.55 ? 58 A 10 +ATOM 886 H HB2 . SER A1 1 58 ? -4.551 10.017 -27.77 1.0 31.42 ? 58 A 10 +ATOM 887 H HB3 . SER A1 1 58 ? -4.391 11.77 -27.659 1.0 40.4 ? 58 A 10 +ATOM 888 H HG . SER A1 1 58 ? -2.75 11.27 -26.433 1.0 10.23 ? 58 A 10 +ATOM 889 N N . ASN A1 1 59 ? -6.959 12.994 -25.653 1.0 35.41 ? 59 A 10 +ATOM 890 C CA . ASN A1 1 59 ? -7.113 14.208 -24.86 1.0 52.34 ? 59 A 10 +ATOM 891 C C . ASN A1 1 59 ? -7.797 13.906 -23.53 1.0 4.01 ? 59 A 10 +ATOM 892 O O . ASN A1 1 59 ? -8.986 14.173 -23.358 1.0 42.21 ? 59 A 10 +ATOM 893 C CB . ASN A1 1 59 ? -7.92 15.251 -25.637 1.0 21.1 ? 59 A 10 +ATOM 894 C CG . ASN A1 1 59 ? -7.801 16.638 -25.037 1.0 14.54 ? 59 A 10 +ATOM 895 O OD1 . ASN A1 1 59 ? -8.328 16.907 -23.957 1.0 24.42 ? 59 A 10 +ATOM 896 N ND2 . ASN A1 1 59 ? -7.106 17.528 -25.736 1.0 14.44 ? 59 A 10 +ATOM 897 H H . ASN A1 1 59 ? -7.631 12.78 -26.334 1.0 5.51 ? 59 A 10 +ATOM 898 H HA . ASN A1 1 59 ? -6.127 14.602 -24.664 1.0 74.51 ? 59 A 10 +ATOM 899 H HB2 . ASN A1 1 59 ? -7.562 15.288 -26.655 1.0 43.43 ? 59 A 10 +ATOM 900 H HB3 . ASN A1 1 59 ? -8.961 14.966 -25.635 1.0 11.21 ? 59 A 10 +ATOM 901 H HD21 . ASN A1 1 59 ? -6.715 17.243 -26.589 1.0 21.33 ? 59 A 10 +ATOM 902 H HD22 . ASN A1 1 59 ? -7.013 18.432 -25.372 1.0 12.0 ? 59 A 10 +ATOM 903 N N . ALA A1 1 60 ? -7.037 13.35 -22.593 1.0 13.11 ? 60 A 10 +ATOM 904 C CA . ALA A1 1 60 ? -7.568 13.014 -21.278 1.0 35.51 ? 60 A 10 +ATOM 905 C C . ALA A1 1 60 ? -6.457 12.565 -20.335 1.0 74.01 ? 60 A 10 +ATOM 906 O O . ALA A1 1 60 ? -5.97 13.347 -19.518 1.0 74.24 ? 60 A 10 +ATOM 907 C CB . ALA A1 1 60 ? -8.63 11.931 -21.398 1.0 64.13 ? 60 A 10 +ATOM 908 H H . ALA A1 1 60 ? -6.096 13.161 -22.791 1.0 31.12 ? 60 A 10 +ATOM 909 H HA . ALA A1 1 60 ? -8.036 13.899 -20.871 1.0 20.01 ? 60 A 10 +ATOM 910 H HB1 . ALA A1 1 60 ? -8.199 11.056 -21.862 1.0 72.33 ? 60 A 10 +ATOM 911 H HB2 . ALA A1 1 60 ? -8.996 11.675 -20.415 1.0 25.02 ? 60 A 10 +ATOM 912 H HB3 . ALA A1 1 60 ? -9.447 12.295 -22.004 1.0 51.02 ? 60 A 10 +ATOM 913 N N . MET A1 1 61 ? -6.061 11.302 -20.453 1.0 21.52 ? 61 A 10 +ATOM 914 C CA . MET A1 1 61 ? -5.006 10.75 -19.611 1.0 32.03 ? 61 A 10 +ATOM 915 C C . MET A1 1 61 ? -3.639 11.276 -20.037 1.0 55.14 ? 61 A 10 +ATOM 916 O O . MET A1 1 61 ? -2.93 11.898 -19.246 1.0 73.23 ? 61 A 10 +ATOM 917 C CB . MET A1 1 61 ? -5.021 9.222 -19.675 1.0 33.12 ? 61 A 10 +ATOM 918 C CG . MET A1 1 61 ? -6.419 8.627 -19.685 1.0 10.31 ? 61 A 10 +ATOM 919 S SD . MET A1 1 61 ? -7.479 9.322 -18.403 1.0 3.45 ? 61 A 10 +ATOM 920 C CE . MET A1 1 61 ? -9.075 9.266 -19.215 1.0 11.34 ? 61 A 10 +ATOM 921 H H . MET A1 1 61 ? -6.487 10.727 -21.123 1.0 44.35 ? 61 A 10 +ATOM 922 H HA . MET A1 1 61 ? -5.198 11.061 -18.595 1.0 14.21 ? 61 A 10 +ATOM 923 H HB2 . MET A1 1 61 ? -4.512 8.906 -20.574 1.0 14.23 ? 61 A 10 +ATOM 924 H HB3 . MET A1 1 61 ? -4.494 8.832 -18.817 1.0 0.24 ? 61 A 10 +ATOM 925 H HG2 . MET A1 1 61 ? -6.871 8.818 -20.647 1.0 62.14 ? 61 A 10 +ATOM 926 H HG3 . MET A1 1 61 ? -6.343 7.56 -19.532 1.0 32.0 ? 61 A 10 +ATOM 927 H HE1 . MET A1 1 61 ? -9.645 8.433 -18.83 1.0 54.23 ? 61 A 10 +ATOM 928 H HE2 . MET A1 1 61 ? -9.608 10.185 -19.024 1.0 64.31 ? 61 A 10 +ATOM 929 H HE3 . MET A1 1 61 ? -8.933 9.145 -20.278 1.0 24.11 ? 61 A 10 +ATOM 930 N N . SER A1 1 62 ? -3.276 11.022 -21.29 1.0 73.15 ? 62 A 10 +ATOM 931 C CA . SER A1 1 62 ? -1.992 11.466 -21.819 1.0 12.22 ? 62 A 10 +ATOM 932 C C . SER A1 1 62 ? -1.85 12.98 -21.699 1.0 13.52 ? 62 A 10 +ATOM 933 O O . SER A1 1 62 ? -0.751 13.498 -21.499 1.0 42.51 ? 62 A 10 +ATOM 934 C CB . SER A1 1 62 ? -1.846 11.043 -23.282 1.0 62.33 ? 62 A 10 +ATOM 935 O OG . SER A1 1 62 ? -1.165 9.805 -23.389 1.0 14.13 ? 62 A 10 +ATOM 936 H H . SER A1 1 62 ? -3.886 10.521 -21.871 1.0 74.25 ? 62 A 10 +ATOM 937 H HA . SER A1 1 62 ? -1.213 10.996 -21.237 1.0 74.15 ? 62 A 10 +ATOM 938 H HB2 . SER A1 1 62 ? -2.825 10.941 -23.724 1.0 54.41 ? 62 A 10 +ATOM 939 H HB3 . SER A1 1 62 ? -1.285 11.796 -23.817 1.0 23.45 ? 62 A 10 +ATOM 940 H HG . SER A1 1 62 ? -0.635 9.799 -24.19 1.0 1.23 ? 62 A 10 +ATOM 941 N N . ASP A1 1 63 ? -2.969 13.685 -21.822 1.0 34.33 ? 63 A 10 +ATOM 942 C CA . ASP A1 1 63 ? -2.971 15.14 -21.727 1.0 10.21 ? 63 A 10 +ATOM 943 C C . ASP A1 1 63 ? -2.497 15.595 -20.35 1.0 63.54 ? 63 A 10 +ATOM 944 O O . ASP A1 1 63 ? -1.999 16.71 -20.191 1.0 31.33 ? 63 A 10 +ATOM 945 C CB . ASP A1 1 63 ? -4.372 15.689 -22.004 1.0 21.1 ? 63 A 10 +ATOM 946 C CG . ASP A1 1 63 ? -4.347 17.135 -22.457 1.0 12.2 ? 63 A 10 +ATOM 947 O OD1 . ASP A1 1 63 ? -3.265 17.615 -22.854 1.0 53.24 ? 63 A 10 +ATOM 948 O OD2 . ASP A1 1 63 ? -5.411 17.787 -22.416 1.0 3.13 ? 63 A 10 +ATOM 949 H H . ASP A1 1 63 ? -3.815 13.215 -21.981 1.0 14.4 ? 63 A 10 +ATOM 950 H HA . ASP A1 1 63 ? -2.291 15.522 -22.473 1.0 72.42 ? 63 A 10 +ATOM 951 H HB2 . ASP A1 1 63 ? -4.837 15.096 -22.779 1.0 63.34 ? 63 A 10 +ATOM 952 H HB3 . ASP A1 1 63 ? -4.962 15.622 -21.102 1.0 44.51 ? 63 A 10 +ATOM 953 N N . TYR A1 1 64 ? -2.654 14.725 -19.359 1.0 43.15 ? 64 A 10 +ATOM 954 C CA . TYR A1 1 64 ? -2.245 15.039 -17.995 1.0 74.44 ? 64 A 10 +ATOM 955 C C . TYR A1 1 64 ? -3.274 15.933 -17.309 1.0 35.31 ? 64 A 10 +ATOM 956 O O . TYR A1 1 64 ? -2.945 16.692 -16.399 1.0 63.11 ? 64 A 10 +ATOM 957 C CB . TYR A1 1 64 ? -0.878 15.723 -17.995 1.0 41.31 ? 64 A 10 +ATOM 958 C CG . TYR A1 1 64 ? 0.071 15.181 -16.95 1.0 35.31 ? 64 A 10 +ATOM 959 C CD1 . TYR A1 1 64 ? -0.32 15.065 -15.622 1.0 10.21 ? 64 A 10 +ATOM 960 C CD2 . TYR A1 1 64 ? 1.359 14.785 -17.29 1.0 61.0 ? 64 A 10 +ATOM 961 C CE1 . TYR A1 1 64 ? 0.544 14.57 -14.663 1.0 31.32 ? 64 A 10 +ATOM 962 C CE2 . TYR A1 1 64 ? 2.228 14.288 -16.339 1.0 3.01 ? 64 A 10 +ATOM 963 C CZ . TYR A1 1 64 ? 1.816 14.183 -15.027 1.0 35.43 ? 64 A 10 +ATOM 964 O OH . TYR A1 1 64 ? 2.68 13.69 -14.076 1.0 23.32 ? 64 A 10 +ATOM 965 H H . TYR A1 1 64 ? -3.057 13.852 -19.548 1.0 10.22 ? 64 A 10 +ATOM 966 H HA . TYR A1 1 64 ? -2.172 14.11 -17.449 1.0 40.51 ? 64 A 10 +ATOM 967 H HB2 . TYR A1 1 64 ? -0.416 15.591 -18.961 1.0 75.32 ? 64 A 10 +ATOM 968 H HB3 . TYR A1 1 64 ? -1.011 16.779 -17.806 1.0 32.34 ? 64 A 10 +ATOM 969 H HD1 . TYR A1 1 64 ? -1.317 15.369 -15.34 1.0 1.35 ? 64 A 10 +ATOM 970 H HD2 . TYR A1 1 64 ? 1.678 14.869 -18.319 1.0 32.41 ? 64 A 10 +ATOM 971 H HE1 . TYR A1 1 64 ? 0.222 14.488 -13.636 1.0 52.21 ? 64 A 10 +ATOM 972 H HE2 . TYR A1 1 64 ? 3.225 13.985 -16.624 1.0 43.14 ? 64 A 10 +ATOM 973 H HH . TYR A1 1 64 ? 3.217 12.993 -14.462 1.0 23.33 ? 64 A 10 +ATOM 974 N N . ASN A1 1 65 ? -4.523 15.836 -17.754 1.0 61.21 ? 65 A 10 +ATOM 975 C CA . ASN A1 1 65 ? -5.601 16.635 -17.185 1.0 70.22 ? 65 A 10 +ATOM 976 C C . ASN A1 1 65 ? -6.6 15.752 -16.443 1.0 21.44 ? 65 A 10 +ATOM 977 O O . ASN A1 1 65 ? -7.697 16.191 -16.097 1.0 22.24 ? 65 A 10 +ATOM 978 C CB . ASN A1 1 65 ? -6.318 17.421 -18.285 1.0 30.31 ? 65 A 10 +ATOM 979 C CG . ASN A1 1 65 ? -7.157 18.556 -17.732 1.0 75.23 ? 65 A 10 +ATOM 980 O OD1 . ASN A1 1 65 ? -8.372 18.426 -17.577 1.0 74.2 ? 65 A 10 +ATOM 981 N ND2 . ASN A1 1 65 ? -6.512 19.677 -17.43 1.0 12.4 ? 65 A 10 +ATOM 982 H H . ASN A1 1 65 ? -4.724 15.212 -18.483 1.0 72.01 ? 65 A 10 +ATOM 983 H HA . ASN A1 1 65 ? -5.164 17.331 -16.484 1.0 43.44 ? 65 A 10 +ATOM 984 H HB2 . ASN A1 1 65 ? -5.582 17.838 -18.958 1.0 12.24 ? 65 A 10 +ATOM 985 H HB3 . ASN A1 1 65 ? -6.964 16.753 -18.834 1.0 73.02 ? 65 A 10 +ATOM 986 H HD21 . ASN A1 1 65 ? -5.544 19.709 -17.58 1.0 23.44 ? 65 A 10 +ATOM 987 H HD22 . ASN A1 1 65 ? -7.03 20.427 -17.07 1.0 32.24 ? 65 A 10 +ATOM 988 N N . VAL A1 1 66 ? -6.212 14.503 -16.201 1.0 11.4 ? 66 A 10 +ATOM 989 C CA . VAL A1 1 66 ? -7.072 13.558 -15.499 1.0 70.45 ? 66 A 10 +ATOM 990 C C . VAL A1 1 66 ? -6.853 13.631 -13.992 1.0 73.11 ? 66 A 10 +ATOM 991 O O . VAL A1 1 66 ? -5.731 13.477 -13.511 1.0 33.12 ? 66 A 10 +ATOM 992 C CB . VAL A1 1 66 ? -6.823 12.114 -15.974 1.0 40.11 ? 66 A 10 +ATOM 993 C CG1 . VAL A1 1 66 ? -5.395 11.689 -15.667 1.0 32.21 ? 66 A 10 +ATOM 994 C CG2 . VAL A1 1 66 ? -7.821 11.163 -15.331 1.0 25.13 ? 66 A 10 +ATOM 995 H H . VAL A1 1 66 ? -5.326 14.212 -16.502 1.0 25.31 ? 66 A 10 +ATOM 996 H HA . VAL A1 1 66 ? -8.098 13.815 -15.717 1.0 44.24 ? 66 A 10 +ATOM 997 H HB . VAL A1 1 66 ? -6.963 12.079 -17.044 1.0 65.05 ? 66 A 10 +ATOM 998 H HG11 . VAL A1 1 66 ? -5.165 10.783 -16.208 1.0 62.5 ? 66 A 10 +ATOM 999 H HG12 . VAL A1 1 66 ? -4.714 12.472 -15.967 1.0 4.5 ? 66 A 10 +ATOM 1000 H HG13 . VAL A1 1 66 ? -5.294 11.51 -14.607 1.0 12.32 ? 66 A 10 +ATOM 1001 H HG21 . VAL A1 1 66 ? -8.825 11.475 -15.576 1.0 23.4 ? 66 A 10 +ATOM 1002 H HG22 . VAL A1 1 66 ? -7.653 10.162 -15.701 1.0 64.2 ? 66 A 10 +ATOM 1003 H HG23 . VAL A1 1 66 ? -7.692 11.176 -14.258 1.0 74.31 ? 66 A 10 +ATOM 1004 N N . GLN A1 1 67 ? -7.933 13.866 -13.254 1.0 5.43 ? 67 A 10 +ATOM 1005 C CA . GLN A1 1 67 ? -7.859 13.959 -11.801 1.0 15.5 ? 67 A 10 +ATOM 1006 C C . GLN A1 1 67 ? -8.794 12.95 -11.142 1.0 62.54 ? 67 A 10 +ATOM 1007 O O . GLN A1 1 67 ? -9.456 12.166 -11.821 1.0 44.01 ? 67 A 10 +ATOM 1008 C CB . GLN A1 1 67 ? -8.21 15.375 -11.341 1.0 35.11 ? 67 A 10 +ATOM 1009 C CG . GLN A1 1 67 ? -9.647 15.773 -11.64 1.0 11.21 ? 67 A 10 +ATOM 1010 C CD . GLN A1 1 67 ? -10.108 16.959 -10.817 1.0 34.44 ? 67 A 10 +ATOM 1011 O OE1 . GLN A1 1 67 ? -10.362 16.836 -9.618 1.0 41.54 ? 67 A 10 +ATOM 1012 N NE2 . GLN A1 1 67 ? -10.217 18.117 -11.456 1.0 50.51 ? 67 A 10 +ATOM 1013 H H . GLN A1 1 67 ? -8.799 13.98 -13.697 1.0 54.23 ? 67 A 10 +ATOM 1014 H HA . GLN A1 1 67 ? -6.844 13.736 -11.506 1.0 21.13 ? 67 A 10 +ATOM 1015 H HB2 . GLN A1 1 67 ? -8.055 15.443 -10.274 1.0 61.05 ? 67 A 10 +ATOM 1016 H HB3 . GLN A1 1 67 ? -7.555 16.075 -11.838 1.0 21.05 ? 67 A 10 +ATOM 1017 H HG2 . GLN A1 1 67 ? -9.725 16.028 -12.686 1.0 63.24 ? 67 A 10 +ATOM 1018 H HG3 . GLN A1 1 67 ? -10.291 14.932 -11.427 1.0 63.02 ? 67 A 10 +ATOM 1019 H HE21 . GLN A1 1 67 ? -9.999 18.14 -12.412 1.0 0.12 ? 67 A 10 +ATOM 1020 H HE22 . GLN A1 1 67 ? -10.514 18.9 -10.949 1.0 72.41 ? 67 A 10 +ATOM 1021 N N . LYS A1 1 68 ? -8.843 12.976 -9.814 1.0 63.33 ? 68 A 10 +ATOM 1022 C CA . LYS A1 1 68 ? -9.698 12.066 -9.062 1.0 34.0 ? 68 A 10 +ATOM 1023 C C . LYS A1 1 68 ? -11.171 12.347 -9.34 1.0 33.21 ? 68 A 10 +ATOM 1024 O O . LYS A1 1 68 ? -12.003 11.441 -9.304 1.0 33.01 ? 68 A 10 +ATOM 1025 C CB . LYS A1 1 68 ? -9.418 12.192 -7.563 1.0 41.41 ? 68 A 10 +ATOM 1026 C CG . LYS A1 1 68 ? -10.018 11.068 -6.736 1.0 61.44 ? 68 A 10 +ATOM 1027 C CD . LYS A1 1 68 ? -9.338 9.74 -7.022 1.0 43.41 ? 68 A 10 +ATOM 1028 C CE . LYS A1 1 68 ? -8.06 9.582 -6.214 1.0 23.43 ? 68 A 10 +ATOM 1029 N NZ . LYS A1 1 68 ? -8.323 9.611 -4.748 1.0 52.05 ? 68 A 10 +ATOM 1030 H H . LYS A1 1 68 ? -8.292 13.625 -9.328 1.0 75.53 ? 68 A 10 +ATOM 1031 H HA . LYS A1 1 68 ? -9.47 11.059 -9.379 1.0 31.4 ? 68 A 10 +ATOM 1032 H HB2 . LYS A1 1 68 ? -8.349 12.194 -7.408 1.0 51.5 ? 68 A 10 +ATOM 1033 H HB3 . LYS A1 1 68 ? -9.826 13.128 -7.21 1.0 62.4 ? 68 A 10 +ATOM 1034 H HG2 . LYS A1 1 68 ? -9.9 11.302 -5.688 1.0 22.33 ? 68 A 10 +ATOM 1035 H HG3 . LYS A1 1 68 ? -11.07 10.982 -6.971 1.0 45.02 ? 68 A 10 +ATOM 1036 H HD2 . LYS A1 1 68 ? -10.014 8.937 -6.767 1.0 14.2 ? 68 A 10 +ATOM 1037 H HD3 . LYS A1 1 68 ? -9.097 9.689 -8.075 1.0 13.53 ? 68 A 10 +ATOM 1038 H HE2 . LYS A1 1 68 ? -7.601 8.639 -6.47 1.0 43.13 ? 68 A 10 +ATOM 1039 H HE3 . LYS A1 1 68 ? -7.388 10.389 -6.466 1.0 63.42 ? 68 A 10 +ATOM 1040 H HZ1 . LYS A1 1 68 ? -7.612 9.042 -4.246 1.0 1.54 ? 68 A 10 +ATOM 1041 H HZ2 . LYS A1 1 68 ? -9.267 9.223 -4.548 1.0 73.32 ? 68 A 10 +ATOM 1042 H HZ3 . LYS A1 1 68 ? -8.281 10.589 -4.397 1.0 23.44 ? 68 A 10 +ATOM 1043 N N . GLU A1 1 69 ? -11.486 13.608 -9.62 1.0 51.1 ? 69 A 10 +ATOM 1044 C CA . GLU A1 1 69 ? -12.859 14.007 -9.904 1.0 15.41 ? 69 A 10 +ATOM 1045 C C . GLU A1 1 69 ? -12.893 15.208 -10.845 1.0 20.25 ? 69 A 10 +ATOM 1046 O O . GLU A1 1 69 ? -13.001 16.352 -10.404 1.0 55.15 ? 69 A 10 +ATOM 1047 C CB . GLU A1 1 69 ? -13.596 14.341 -8.606 1.0 42.14 ? 69 A 10 +ATOM 1048 C CG . GLU A1 1 69 ? -12.799 15.227 -7.664 1.0 32.44 ? 69 A 10 +ATOM 1049 C CD . GLU A1 1 69 ? -13.656 16.278 -6.985 1.0 60.3 ? 69 A 10 +ATOM 1050 O OE1 . GLU A1 1 69 ? -14.35 15.934 -6.006 1.0 52.11 ? 69 A 10 +ATOM 1051 O OE2 . GLU A1 1 69 ? -13.632 17.443 -7.434 1.0 33.22 ? 69 A 10 +ATOM 1052 H H . GLU A1 1 69 ? -10.778 14.286 -9.634 1.0 51.55 ? 69 A 10 +ATOM 1053 H HA . GLU A1 1 69 ? -13.353 13.176 -10.384 1.0 21.13 ? 69 A 10 +ATOM 1054 H HB2 . GLU A1 1 69 ? -14.518 14.848 -8.85 1.0 70.35 ? 69 A 10 +ATOM 1055 H HB3 . GLU A1 1 69 ? -13.828 13.421 -8.091 1.0 25.14 ? 69 A 10 +ATOM 1056 H HG2 . GLU A1 1 69 ? -12.347 14.607 -6.903 1.0 60.54 ? 69 A 10 +ATOM 1057 H HG3 . GLU A1 1 69 ? -12.024 15.725 -8.228 1.0 2.43 ? 69 A 10 +ATOM 1058 N N . SER A1 1 70 ? -12.798 14.939 -12.143 1.0 51.41 ? 70 A 10 +ATOM 1059 C CA . SER A1 1 70 ? -12.813 15.997 -13.146 1.0 50.24 ? 70 A 10 +ATOM 1060 C C . SER A1 1 70 ? -14.201 16.142 -13.762 1.0 72.1 ? 70 A 10 +ATOM 1061 O O . SER A1 1 70 ? -14.87 15.151 -14.057 1.0 13.02 ? 70 A 10 +ATOM 1062 C CB . SER A1 1 70 ? -11.785 15.705 -14.241 1.0 75.43 ? 70 A 10 +ATOM 1063 O OG . SER A1 1 70 ? -10.992 16.847 -14.514 1.0 45.33 ? 70 A 10 +ATOM 1064 H H . SER A1 1 70 ? -12.713 14.006 -12.432 1.0 42.55 ? 70 A 10 +ATOM 1065 H HA . SER A1 1 70 ? -12.55 16.923 -12.656 1.0 61.25 ? 70 A 10 +ATOM 1066 H HB2 . SER A1 1 70 ? -11.139 14.902 -13.921 1.0 1.23 ? 70 A 10 +ATOM 1067 H HB3 . SER A1 1 70 ? -12.299 15.414 -15.146 1.0 50.33 ? 70 A 10 +ATOM 1068 H HG . SER A1 1 70 ? -10.875 16.937 -15.463 1.0 14.24 ? 70 A 10 +ATOM 1069 N N . THR A1 1 71 ? -14.629 17.386 -13.953 1.0 52.55 ? 71 A 10 +ATOM 1070 C CA . THR A1 1 71 ? -15.938 17.663 -14.532 1.0 43.33 ? 71 A 10 +ATOM 1071 C C . THR A1 1 71 ? -15.839 17.875 -16.039 1.0 63.44 ? 71 A 10 +ATOM 1072 O O . THR A1 1 71 ? -15.212 18.829 -16.502 1.0 13.52 ? 71 A 10 +ATOM 1073 C CB . THR A1 1 71 ? -16.584 18.906 -13.892 1.0 4.41 ? 71 A 10 +ATOM 1074 O OG1 . THR A1 1 71 ? -15.621 19.962 -13.791 1.0 4.41 ? 71 A 10 +ATOM 1075 C CG2 . THR A1 1 71 ? -17.133 18.58 -12.511 1.0 4.35 ? 71 A 10 +ATOM 1076 H H . THR A1 1 71 ? -14.051 18.134 -13.698 1.0 14.04 ? 71 A 10 +ATOM 1077 H HA . THR A1 1 71 ? -16.575 16.812 -14.339 1.0 24.13 ? 71 A 10 +ATOM 1078 H HB . THR A1 1 71 ? -17.4 19.233 -14.52 1.0 70.41 ? 71 A 10 +ATOM 1079 H HG1 . THR A1 1 71 ? -15.898 20.584 -13.114 1.0 53.11 ? 71 A 10 +ATOM 1080 H HG21 . THR A1 1 71 ? -18.178 18.321 -12.592 1.0 12.42 ? 71 A 10 +ATOM 1081 H HG22 . THR A1 1 71 ? -17.024 19.441 -11.868 1.0 75.2 ? 71 A 10 +ATOM 1082 H HG23 . THR A1 1 71 ? -16.586 17.748 -12.094 1.0 31.12 ? 71 A 10 +ATOM 1083 N N . LEU A1 1 72 ? -16.461 16.981 -16.799 1.0 74.32 ? 72 A 10 +ATOM 1084 C CA . LEU A1 1 72 ? -16.444 17.071 -18.255 1.0 62.12 ? 72 A 10 +ATOM 1085 C C . LEU A1 1 72 ? -17.86 17.026 -18.82 1.0 14.1 ? 72 A 10 +ATOM 1086 O O . LEU A1 1 72 ? -18.738 16.358 -18.273 1.0 22.33 ? 72 A 10 +ATOM 1087 C CB . LEU A1 1 72 ? -15.611 15.932 -18.846 1.0 54.24 ? 72 A 10 +ATOM 1088 C CG . LEU A1 1 72 ? -15.91 15.566 -20.3 1.0 12.34 ? 72 A 10 +ATOM 1089 C CD1 . LEU A1 1 72 ? -15.547 16.717 -21.226 1.0 71.53 ? 72 A 10 +ATOM 1090 C CD2 . LEU A1 1 72 ? -15.16 14.303 -20.698 1.0 45.31 ? 72 A 10 +ATOM 1091 H H . LEU A1 1 72 ? -16.944 16.243 -16.373 1.0 40.44 ? 72 A 10 +ATOM 1092 H HA . LEU A1 1 72 ? -15.992 18.014 -18.524 1.0 22.23 ? 72 A 10 +ATOM 1093 H HB2 . LEU A1 1 72 ? -14.572 16.216 -18.784 1.0 24.33 ? 72 A 10 +ATOM 1094 H HB3 . LEU A1 1 72 ? -15.779 15.052 -18.241 1.0 64.44 ? 72 A 10 +ATOM 1095 H HG . LEU A1 1 72 ? -16.969 15.374 -20.406 1.0 60.22 ? 72 A 10 +ATOM 1096 H HD11 . LEU A1 1 72 ? -14.788 16.394 -21.921 1.0 22.12 ? 72 A 10 +ATOM 1097 H HD12 . LEU A1 1 72 ? -15.173 17.544 -20.641 1.0 11.12 ? 72 A 10 +ATOM 1098 H HD13 . LEU A1 1 72 ? -16.426 17.031 -21.771 1.0 74.11 ? 72 A 10 +ATOM 1099 H HD21 . LEU A1 1 72 ? -14.981 13.699 -19.82 1.0 45.11 ? 72 A 10 +ATOM 1100 H HD22 . LEU A1 1 72 ? -14.215 14.573 -21.147 1.0 64.51 ? 72 A 10 +ATOM 1101 H HD23 . LEU A1 1 72 ? -15.75 13.742 -21.408 1.0 15.53 ? 72 A 10 +ATOM 1102 N N . HIS A1 1 73 ? -18.076 17.74 -19.921 1.0 22.1 ? 73 A 10 +ATOM 1103 C CA . HIS A1 1 73 ? -19.385 17.78 -20.562 1.0 43.22 ? 73 A 10 +ATOM 1104 C C . HIS A1 1 73 ? -19.454 16.787 -21.719 1.0 1.12 ? 73 A 10 +ATOM 1105 O O . HIS A1 1 73 ? -18.68 16.875 -22.673 1.0 41.41 ? 73 A 10 +ATOM 1106 C CB . HIS A1 1 73 ? -19.686 19.191 -21.068 1.0 34.11 ? 73 A 10 +ATOM 1107 C CG . HIS A1 1 73 ? -19.52 20.25 -20.022 1.0 25.31 ? 73 A 10 +ATOM 1108 N ND1 . HIS A1 1 73 ? -19.343 21.584 -20.323 1.0 22.31 ? 73 A 10 +ATOM 1109 C CD2 . HIS A1 1 73 ? -19.507 20.166 -18.671 1.0 30.12 ? 73 A 10 +ATOM 1110 C CE1 . HIS A1 1 73 ? -19.226 22.274 -19.202 1.0 74.03 ? 73 A 10 +ATOM 1111 N NE2 . HIS A1 1 73 ? -19.323 21.437 -18.185 1.0 22.32 ? 73 A 10 +ATOM 1112 H H . HIS A1 1 73 ? -17.336 18.252 -20.31 1.0 41.1 ? 73 A 10 +ATOM 1113 H HA . HIS A1 1 73 ? -20.124 17.506 -19.825 1.0 23.25 ? 73 A 10 +ATOM 1114 H HB2 . HIS A1 1 73 ? -19.018 19.424 -21.884 1.0 51.13 ? 73 A 10 +ATOM 1115 H HB3 . HIS A1 1 73 ? -20.706 19.23 -21.421 1.0 64.13 ? 73 A 10 +ATOM 1116 H HD1 . HIS A1 1 73 ? -19.306 21.968 -21.223 1.0 63.31 ? 73 A 10 +ATOM 1117 H HD2 . HIS A1 1 73 ? -19.62 19.266 -18.083 1.0 71.43 ? 73 A 10 +ATOM 1118 H HE1 . HIS A1 1 73 ? -19.078 23.341 -19.129 1.0 3.34 ? 73 A 10 +ATOM 1119 N N . LEU A1 1 74 ? -20.384 15.843 -21.627 1.0 31.4 ? 74 A 10 +ATOM 1120 C CA . LEU A1 1 74 ? -20.553 14.833 -22.665 1.0 41.22 ? 74 A 10 +ATOM 1121 C C . LEU A1 1 74 ? -21.86 15.044 -23.422 1.0 21.0 ? 74 A 10 +ATOM 1122 O O . LEU A1 1 74 ? -22.944 14.967 -22.844 1.0 70.53 ? 74 A 10 +ATOM 1123 C CB . LEU A1 1 74 ? -20.527 13.432 -22.051 1.0 42.32 ? 74 A 10 +ATOM 1124 C CG . LEU A1 1 74 ? -21.197 12.328 -22.868 1.0 13.02 ? 74 A 10 +ATOM 1125 C CD1 . LEU A1 1 74 ? -20.623 12.282 -24.276 1.0 50.12 ? 74 A 10 +ATOM 1126 C CD2 . LEU A1 1 74 ? -21.034 10.98 -22.18 1.0 22.4 ? 74 A 10 +ATOM 1127 H H . LEU A1 1 74 ? -20.971 15.824 -20.843 1.0 53.04 ? 74 A 10 +ATOM 1128 H HA . LEU A1 1 74 ? -19.73 14.929 -23.358 1.0 65.43 ? 74 A 10 +ATOM 1129 H HB2 . LEU A1 1 74 ? -19.494 13.155 -21.905 1.0 22.02 ? 74 A 10 +ATOM 1130 H HB3 . LEU A1 1 74 ? -21.023 13.483 -21.092 1.0 20.31 ? 74 A 10 +ATOM 1131 H HG . LEU A1 1 74 ? -22.255 12.538 -22.947 1.0 34.12 ? 74 A 10 +ATOM 1132 H HD11 . LEU A1 1 74 ? -21.228 12.889 -24.931 1.0 33.01 ? 74 A 10 +ATOM 1133 H HD12 . LEU A1 1 74 ? -20.62 11.262 -24.63 1.0 1.34 ? 74 A 10 +ATOM 1134 H HD13 . LEU A1 1 74 ? -19.612 12.661 -24.264 1.0 63.14 ? 74 A 10 +ATOM 1135 H HD21 . LEU A1 1 74 ? -21.583 10.983 -21.25 1.0 12.32 ? 74 A 10 +ATOM 1136 H HD22 . LEU A1 1 74 ? -19.988 10.803 -21.98 1.0 54.43 ? 74 A 10 +ATOM 1137 H HD23 . LEU A1 1 74 ? -21.415 10.2 -22.822 1.0 14.02 ? 74 A 10 +ATOM 1138 N N . VAL A1 1 75 ? -21.751 15.307 -24.72 1.0 43.5 ? 75 A 10 +ATOM 1139 C CA . VAL A1 1 75 ? -22.924 15.526 -25.558 1.0 52.32 ? 75 A 10 +ATOM 1140 C C . VAL A1 1 75 ? -23.042 14.449 -26.63 1.0 61.15 ? 75 A 10 +ATOM 1141 O O . VAL A1 1 75 ? -22.041 14.016 -27.204 1.0 54.31 ? 75 A 10 +ATOM 1142 C CB . VAL A1 1 75 ? -22.879 16.908 -26.237 1.0 24.5 ? 75 A 10 +ATOM 1143 C CG1 . VAL A1 1 75 ? -23.246 18.002 -25.246 1.0 55.3 ? 75 A 10 +ATOM 1144 C CG2 . VAL A1 1 75 ? -21.505 17.161 -26.839 1.0 64.14 ? 75 A 10 +ATOM 1145 H H . VAL A1 1 75 ? -20.859 15.355 -25.125 1.0 70.11 ? 75 A 10 +ATOM 1146 H HA . VAL A1 1 75 ? -23.798 15.487 -24.925 1.0 60.52 ? 75 A 10 +ATOM 1147 H HB . VAL A1 1 75 ? -23.606 16.918 -27.035 1.0 44.41 ? 75 A 10 +ATOM 1148 H HG11 . VAL A1 1 75 ? -23.938 17.608 -24.515 1.0 31.54 ? 75 A 10 +ATOM 1149 H HG12 . VAL A1 1 75 ? -22.354 18.351 -24.747 1.0 61.34 ? 75 A 10 +ATOM 1150 H HG13 . VAL A1 1 75 ? -23.71 18.823 -25.772 1.0 54.52 ? 75 A 10 +ATOM 1151 H HG21 . VAL A1 1 75 ? -21.212 16.312 -27.437 1.0 5.24 ? 75 A 10 +ATOM 1152 H HG22 . VAL A1 1 75 ? -21.543 18.044 -27.459 1.0 61.35 ? 75 A 10 +ATOM 1153 H HG23 . VAL A1 1 75 ? -20.786 17.309 -26.046 1.0 24.43 ? 75 A 10 +ATOM 1154 N N . LEU A1 1 76 ? -24.271 14.02 -26.898 1.0 35.1 ? 76 A 10 +ATOM 1155 C CA . LEU A1 1 76 ? -24.521 12.993 -27.903 1.0 22.53 ? 76 A 10 +ATOM 1156 C C . LEU A1 1 76 ? -25.441 13.518 -29.0 1.0 2.14 ? 76 A 10 +ATOM 1157 O O . LEU A1 1 76 ? -26.419 14.212 -28.724 1.0 21.5 ? 76 A 10 +ATOM 1158 C CB . LEU A1 1 76 ? -25.139 11.755 -27.252 1.0 73.12 ? 76 A 10 +ATOM 1159 C CG . LEU A1 1 76 ? -25.096 11.707 -25.724 1.0 64.45 ? 76 A 10 +ATOM 1160 C CD1 . LEU A1 1 76 ? -25.934 10.55 -25.202 1.0 24.13 ? 76 A 10 +ATOM 1161 C CD2 . LEU A1 1 76 ? -23.66 11.592 -25.234 1.0 22.03 ? 76 A 10 +ATOM 1162 H H . LEU A1 1 76 ? -25.028 14.403 -26.408 1.0 44.32 ? 76 A 10 +ATOM 1163 H HA . LEU A1 1 76 ? -23.573 12.723 -28.343 1.0 53.04 ? 76 A 10 +ATOM 1164 H HB2 . LEU A1 1 76 ? -26.174 11.704 -27.555 1.0 71.31 ? 76 A 10 +ATOM 1165 H HB3 . LEU A1 1 76 ? -24.614 10.888 -27.626 1.0 62.14 ? 76 A 10 +ATOM 1166 H HG . LEU A1 1 76 ? -25.512 12.624 -25.33 1.0 42.11 ? 76 A 10 +ATOM 1167 H HD11 . LEU A1 1 76 ? -26.78 10.936 -24.654 1.0 12.14 ? 76 A 10 +ATOM 1168 H HD12 . LEU A1 1 76 ? -25.332 9.936 -24.549 1.0 23.21 ? 76 A 10 +ATOM 1169 H HD13 . LEU A1 1 76 ? -26.283 9.955 -26.033 1.0 40.2 ? 76 A 10 +ATOM 1170 H HD21 . LEU A1 1 76 ? -23.562 12.095 -24.284 1.0 53.24 ? 76 A 10 +ATOM 1171 H HD22 . LEU A1 1 76 ? -22.997 12.048 -25.955 1.0 72.02 ? 76 A 10 +ATOM 1172 H HD23 . LEU A1 1 76 ? -23.402 10.549 -25.118 1.0 63.4 ? 76 A 10 +ATOM 1173 N N . ARG A1 1 77 ? -25.121 13.18 -30.245 1.0 50.44 ? 77 A 10 +ATOM 1174 C CA . ARG A1 1 77 ? -25.919 13.616 -31.384 1.0 12.4 ? 77 A 10 +ATOM 1175 C C . ARG A1 1 77 ? -26.547 12.422 -32.098 1.0 10.32 ? 77 A 10 +ATOM 1176 O O . ARG A1 1 77 ? -26.049 11.97 -33.13 1.0 12.43 ? 77 A 10 +ATOM 1177 C CB . ARG A1 1 77 ? -25.056 14.413 -32.364 1.0 55.35 ? 77 A 10 +ATOM 1178 C CG . ARG A1 1 77 ? -24.567 15.739 -31.805 1.0 12.22 ? 77 A 10 +ATOM 1179 C CD . ARG A1 1 77 ? -23.053 15.761 -31.669 1.0 60.22 ? 77 A 10 +ATOM 1180 N NE . ARG A1 1 77 ? -22.577 16.995 -31.049 1.0 64.33 ? 77 A 10 +ATOM 1181 C CZ . ARG A1 1 77 ? -22.55 18.168 -31.673 1.0 13.31 ? 77 A 10 +ATOM 1182 N NH1 . ARG A1 1 77 ? -22.97 18.265 -32.927 1.0 63.3 ? 77 A 10 +ATOM 1183 N NH2 . ARG A1 1 77 ? -22.104 19.246 -31.042 1.0 70.54 ? 77 A 10 +ATOM 1184 H H . ARG A1 1 77 ? -24.329 12.624 -30.401 1.0 2.41 ? 77 A 10 +ATOM 1185 H HA . ARG A1 1 77 ? -26.708 14.253 -31.013 1.0 53.23 ? 77 A 10 +ATOM 1186 H HB2 . ARG A1 1 77 ? -24.193 13.82 -32.631 1.0 41.04 ? 77 A 10 +ATOM 1187 H HB3 . ARG A1 1 77 ? -25.634 14.613 -33.254 1.0 23.23 ? 77 A 10 +ATOM 1188 H HG2 . ARG A1 1 77 ? -24.869 16.533 -32.472 1.0 3.21 ? 77 A 10 +ATOM 1189 H HG3 . ARG A1 1 77 ? -25.01 15.894 -30.833 1.0 45.32 ? 77 A 10 +ATOM 1190 H HD2 . ARG A1 1 77 ? -22.747 14.924 -31.06 1.0 24.22 ? 77 A 10 +ATOM 1191 H HD3 . ARG A1 1 77 ? -22.615 15.671 -32.652 1.0 55.12 ? 77 A 10 +ATOM 1192 H HE . ARG A1 1 77 ? -22.262 16.946 -30.123 1.0 41.44 ? 77 A 10 +ATOM 1193 H HH11 . ARG A1 1 77 ? -23.308 17.454 -33.404 1.0 31.24 ? 77 A 10 +ATOM 1194 H HH12 . ARG A1 1 77 ? -22.95 19.15 -33.394 1.0 72.5 ? 77 A 10 +ATOM 1195 H HH21 . ARG A1 1 77 ? -21.787 19.177 -30.097 1.0 71.34 ? 77 A 10 +ATOM 1196 H HH22 . ARG A1 1 77 ? -22.084 20.128 -31.512 1.0 1.44 ? 77 A 10 +ATOM 1197 N N . LEU A1 1 78 ? -27.641 11.915 -31.541 1.0 31.03 ? 78 A 10 +ATOM 1198 C CA . LEU A1 1 78 ? -28.337 10.773 -32.123 1.0 51.32 ? 78 A 10 +ATOM 1199 C C . LEU A1 1 78 ? -29.16 11.197 -33.335 1.0 14.11 ? 78 A 10 +ATOM 1200 O O . LEU A1 1 78 ? -29.106 10.561 -34.388 1.0 12.31 ? 78 A 10 +ATOM 1201 C CB . LEU A1 1 78 ? -29.244 10.117 -31.08 1.0 42.51 ? 78 A 10 +ATOM 1202 C CG . LEU A1 1 78 ? -28.537 9.447 -29.902 1.0 51.45 ? 78 A 10 +ATOM 1203 C CD1 . LEU A1 1 78 ? -27.402 8.562 -30.394 1.0 14.44 ? 78 A 10 +ATOM 1204 C CD2 . LEU A1 1 78 ? -28.016 10.492 -28.927 1.0 25.32 ? 78 A 10 +ATOM 1205 H H . LEU A1 1 78 ? -27.991 12.318 -30.719 1.0 75.31 ? 78 A 10 +ATOM 1206 H HA . LEU A1 1 78 ? -27.593 10.058 -32.441 1.0 64.2 ? 78 A 10 +ATOM 1207 H HB2 . LEU A1 1 78 ? -29.896 10.88 -30.683 1.0 61.14 ? 78 A 10 +ATOM 1208 H HB3 . LEU A1 1 78 ? -29.836 9.366 -31.583 1.0 62.32 ? 78 A 10 +ATOM 1209 H HG . LEU A1 1 78 ? -29.244 8.82 -29.375 1.0 53.42 ? 78 A 10 +ATOM 1210 H HD11 . LEU A1 1 78 ? -26.463 9.081 -30.274 1.0 3.24 ? 78 A 10 +ATOM 1211 H HD12 . LEU A1 1 78 ? -27.555 8.329 -31.438 1.0 74.14 ? 78 A 10 +ATOM 1212 H HD13 . LEU A1 1 78 ? -27.385 7.647 -29.82 1.0 11.41 ? 78 A 10 +ATOM 1213 H HD21 . LEU A1 1 78 ? -27.131 10.957 -29.337 1.0 65.32 ? 78 A 10 +ATOM 1214 H HD22 . LEU A1 1 78 ? -27.772 10.018 -27.988 1.0 65.43 ? 78 A 10 +ATOM 1215 H HD23 . LEU A1 1 78 ? -28.776 11.243 -28.765 1.0 34.04 ? 78 A 10 +ATOM 1216 N N . ARG A1 1 79 ? -29.921 12.275 -33.18 1.0 44.5 ? 79 A 10 +ATOM 1217 C CA . ARG A1 1 79 ? -30.755 12.785 -34.262 1.0 54.44 ? 79 A 10 +ATOM 1218 C C . ARG A1 1 79 ? -29.896 13.356 -35.386 1.0 43.43 ? 79 A 10 +ATOM 1219 O O . ARG A1 1 79 ? -29.597 14.549 -35.408 1.0 24.23 ? 79 A 10 +ATOM 1220 C CB . ARG A1 1 79 ? -31.708 13.86 -33.737 1.0 53.1 ? 79 A 10 +ATOM 1221 C CG . ARG A1 1 79 ? -32.962 13.298 -33.088 1.0 62.42 ? 79 A 10 +ATOM 1222 C CD . ARG A1 1 79 ? -33.05 13.683 -31.619 1.0 15.2 ? 79 A 10 +ATOM 1223 N NE . ARG A1 1 79 ? -33.765 14.941 -31.425 1.0 22.21 ? 79 A 10 +ATOM 1224 C CZ . ARG A1 1 79 ? -34.09 15.425 -30.231 1.0 43.33 ? 79 A 10 +ATOM 1225 N NH1 . ARG A1 1 79 ? -33.766 14.759 -29.131 1.0 51.34 ? 79 A 10 +ATOM 1226 N NH2 . ARG A1 1 79 ? -34.741 16.577 -30.136 1.0 24.34 ? 79 A 10 +ATOM 1227 H H . ARG A1 1 79 ? -29.922 12.74 -32.316 1.0 30.43 ? 79 A 10 +ATOM 1228 H HA . ARG A1 1 79 ? -31.334 11.961 -34.65 1.0 75.12 ? 79 A 10 +ATOM 1229 H HB2 . ARG A1 1 79 ? -31.188 14.459 -33.004 1.0 72.51 ? 79 A 10 +ATOM 1230 H HB3 . ARG A1 1 79 ? -32.006 14.492 -34.559 1.0 62.3 ? 79 A 10 +ATOM 1231 H HG2 . ARG A1 1 79 ? -33.828 13.687 -33.603 1.0 34.21 ? 79 A 10 +ATOM 1232 H HG3 . ARG A1 1 79 ? -32.946 12.221 -33.169 1.0 51.44 ? 79 A 10 +ATOM 1233 H HD2 . ARG A1 1 79 ? -33.567 12.9 -31.086 1.0 21.42 ? 79 A 10 +ATOM 1234 H HD3 . ARG A1 1 79 ? -32.049 13.784 -31.227 1.0 24.22 ? 79 A 10 +ATOM 1235 H HE . ARG A1 1 79 ? -34.015 15.449 -32.224 1.0 63.2 ? 79 A 10 +ATOM 1236 H HH11 . ARG A1 1 79 ? -33.274 13.891 -29.2 1.0 0.03 ? 79 A 10 +ATOM 1237 H HH12 . ARG A1 1 79 ? -34.011 15.126 -28.234 1.0 54.33 ? 79 A 10 +ATOM 1238 H HH21 . ARG A1 1 79 ? -34.988 17.082 -30.963 1.0 72.3 ? 79 A 10 +ATOM 1239 H HH22 . ARG A1 1 79 ? -34.986 16.94 -29.237 1.0 2.44 ? 79 A 10 +ATOM 1240 N N . GLY A1 1 80 ? -29.502 12.495 -36.319 1.0 11.03 ? 80 A 10 +ATOM 1241 C CA . GLY A1 1 80 ? -28.682 12.932 -37.434 1.0 3.12 ? 80 A 10 +ATOM 1242 C C . GLY A1 1 80 ? -27.45 12.068 -37.621 1.0 52.34 ? 80 A 10 +ATOM 1243 O O . GLY A1 1 80 ? -26.324 12.562 -37.575 1.0 43.44 ? 80 A 10 +ATOM 1244 H H . GLY A1 1 80 ? -29.771 11.554 -36.25 1.0 0.24 ? 80 A 10 +ATOM 1245 H HA2 . GLY A1 1 80 ? -29.273 12.898 -38.337 1.0 71.24 ? 80 A 10 +ATOM 1246 H HA3 . GLY A1 1 80 ? -28.369 13.951 -37.258 1.0 43.14 ? 80 A 10 +ATOM 1247 N N . GLY A1 1 81 ? -27.664 10.772 -37.831 1.0 43.34 ? 81 A 10 +ATOM 1248 C CA . GLY A1 1 81 ? -26.553 9.859 -38.02 1.0 20.2 ? 81 A 10 +ATOM 1249 C C . GLY A1 1 81 ? -26.951 8.411 -37.813 1.0 63.23 ? 81 A 10 +ATOM 1250 O O . GLY A1 1 81 ? -28.106 8.115 -37.506 1.0 30.24 ? 81 A 10 +ATOM 1251 H H . GLY A1 1 81 ? -28.584 10.435 -37.857 1.0 11.33 ? 81 A 10 +ATOM 1252 H HA2 . GLY A1 1 81 ? -26.171 9.976 -39.023 1.0 30.51 ? 81 A 10 +ATOM 1253 H HA3 . GLY A1 1 81 ? -25.772 10.109 -37.317 1.0 55.14 ? 81 A 10 +ATOM 1254 N N . VAL A1 1 82 ? -25.993 7.505 -37.983 1.0 30.52 ? 82 A 10 +ATOM 1255 C CA . VAL A1 1 82 ? -26.25 6.08 -37.813 1.0 4.45 ? 82 A 10 +ATOM 1256 C C . VAL A1 1 82 ? -25.05 5.376 -37.189 1.0 63.52 ? 82 A 10 +ATOM 1257 O O . VAL A1 1 82 ? -24.155 6.02 -36.642 1.0 12.52 ? 82 A 10 +ATOM 1258 C CB . VAL A1 1 82 ? -26.584 5.406 -39.157 1.0 53.54 ? 82 A 10 +ATOM 1259 C CG1 . VAL A1 1 82 ? -25.44 5.585 -40.144 1.0 33.31 ? 82 A 10 +ATOM 1260 C CG2 . VAL A1 1 82 ? -26.895 3.931 -38.951 1.0 1.13 ? 82 A 10 +ATOM 1261 H H . VAL A1 1 82 ? -25.092 7.802 -38.228 1.0 42.11 ? 82 A 10 +ATOM 1262 H HA . VAL A1 1 82 ? -27.101 5.969 -37.158 1.0 65.12 ? 82 A 10 +ATOM 1263 H HB . VAL A1 1 82 ? -27.462 5.883 -39.568 1.0 3.02 ? 82 A 10 +ATOM 1264 H HG11 . VAL A1 1 82 ? -25.603 4.95 -41.002 1.0 71.54 ? 82 A 10 +ATOM 1265 H HG12 . VAL A1 1 82 ? -25.396 6.616 -40.461 1.0 43.52 ? 82 A 10 +ATOM 1266 H HG13 . VAL A1 1 82 ? -24.509 5.314 -39.668 1.0 60.31 ? 82 A 10 +ATOM 1267 H HG21 . VAL A1 1 82 ? -26.003 3.347 -39.123 1.0 51.1 ? 82 A 10 +ATOM 1268 H HG22 . VAL A1 1 82 ? -27.238 3.775 -37.939 1.0 43.42 ? 82 A 10 +ATOM 1269 H HG23 . VAL A1 1 82 ? -27.665 3.624 -39.644 1.0 61.21 ? 82 A 10 +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-PEPTIDE LINKING' ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-PEPTIDE LINKING' ARGININE ? 'C6 H15 N4 O2' 175.209 +ASN 'L-PEPTIDE LINKING' ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-PEPTIDE LINKING' 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +GLN 'L-PEPTIDE LINKING' GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-PEPTIDE LINKING' 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'PEPTIDE LINKING' GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-PEPTIDE LINKING' HISTIDINE ? 'C6 H10 N3 O2' 156.162 +ILE 'L-PEPTIDE LINKING' ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-PEPTIDE LINKING' LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-PEPTIDE LINKING' LYSINE ? 'C6 H15 N2 O2' 147.195 +MET 'L-PEPTIDE LINKING' METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-PEPTIDE LINKING' PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-PEPTIDE LINKING' PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-PEPTIDE LINKING' SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-PEPTIDE LINKING' THREONINE ? 'C4 H9 N O3' 119.119 +TYR 'L-PEPTIDE LINKING' TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-PEPTIDE LINKING' VALINE ? 'C5 H11 N O2' 117.146 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +GLN N N N N 74 +GLN CA C N S 75 +GLN C C N N 76 +GLN O O N N 77 +GLN CB C N N 78 +GLN CG C N N 79 +GLN CD C N N 80 +GLN OE1 O N N 81 +GLN NE2 N N N 82 +GLN OXT O N N 83 +GLN H H N N 84 +GLN H2 H N N 85 +GLN HA H N N 86 +GLN HB2 H N N 87 +GLN HB3 H N N 88 +GLN HG2 H N N 89 +GLN HG3 H N N 90 +GLN HE21 H N N 91 +GLN HE22 H N N 92 +GLN HXT H N N 93 +GLU N N N N 94 +GLU CA C N S 95 +GLU C C N N 96 +GLU O O N N 97 +GLU CB C N N 98 +GLU CG C N N 99 +GLU CD C N N 100 +GLU OE1 O N N 101 +GLU OE2 O N N 102 +GLU OXT O N N 103 +GLU H H N N 104 +GLU H2 H N N 105 +GLU HA H N N 106 +GLU HB2 H N N 107 +GLU HB3 H N N 108 +GLU HG2 H N N 109 +GLU HG3 H N N 110 +GLU HE2 H N N 111 +GLU HXT H N N 112 +GLY N N N N 113 +GLY CA C N N 114 +GLY C C N N 115 +GLY O O N N 116 +GLY OXT O N N 117 +GLY H H N N 118 +GLY H2 H N N 119 +GLY HA2 H N N 120 +GLY HA3 H N N 121 +GLY HXT H N N 122 +HIS N N N N 123 +HIS CA C N S 124 +HIS C C N N 125 +HIS O O N N 126 +HIS CB C N N 127 +HIS CG C Y N 128 +HIS ND1 N Y N 129 +HIS CD2 C Y N 130 +HIS CE1 C Y N 131 +HIS NE2 N Y N 132 +HIS OXT O N N 133 +HIS H H N N 134 +HIS H2 H N N 135 +HIS HA H N N 136 +HIS HB2 H N N 137 +HIS HB3 H N N 138 +HIS HD1 H N N 139 +HIS HD2 H N N 140 +HIS HE1 H N N 141 +HIS HE2 H N N 142 +HIS HXT H N N 143 +ILE N N N N 144 +ILE CA C N S 145 +ILE C C N N 146 +ILE O O N N 147 +ILE CB C N S 148 +ILE CG1 C N N 149 +ILE CG2 C N N 150 +ILE CD1 C N N 151 +ILE OXT O N N 152 +ILE H H N N 153 +ILE H2 H N N 154 +ILE HA H N N 155 +ILE HB H N N 156 +ILE HG12 H N N 157 +ILE HG13 H N N 158 +ILE HG21 H N N 159 +ILE HG22 H N N 160 +ILE HG23 H N N 161 +ILE HD11 H N N 162 +ILE HD12 H N N 163 +ILE HD13 H N N 164 +ILE HXT H N N 165 +LEU N N N N 166 +LEU CA C N S 167 +LEU C C N N 168 +LEU O O N N 169 +LEU CB C N N 170 +LEU CG C N N 171 +LEU CD1 C N N 172 +LEU CD2 C N N 173 +LEU OXT O N N 174 +LEU H H N N 175 +LEU H2 H N N 176 +LEU HA H N N 177 +LEU HB2 H N N 178 +LEU HB3 H N N 179 +LEU HG H N N 180 +LEU HD11 H N N 181 +LEU HD12 H N N 182 +LEU HD13 H N N 183 +LEU HD21 H N N 184 +LEU HD22 H N N 185 +LEU HD23 H N N 186 +LEU HXT H N N 187 +LYS N N N N 188 +LYS CA C N S 189 +LYS C C N N 190 +LYS O O N N 191 +LYS CB C N N 192 +LYS CG C N N 193 +LYS CD C N N 194 +LYS CE C N N 195 +LYS NZ N N N 196 +LYS OXT O N N 197 +LYS H H N N 198 +LYS H2 H N N 199 +LYS HA H N N 200 +LYS HB2 H N N 201 +LYS HB3 H N N 202 +LYS HG2 H N N 203 +LYS HG3 H N N 204 +LYS HD2 H N N 205 +LYS HD3 H N N 206 +LYS HE2 H N N 207 +LYS HE3 H N N 208 +LYS HZ1 H N N 209 +LYS HZ2 H N N 210 +LYS HZ3 H N N 211 +LYS HXT H N N 212 +MET N N N N 213 +MET CA C N S 214 +MET C C N N 215 +MET O O N N 216 +MET CB C N N 217 +MET CG C N N 218 +MET SD S N N 219 +MET CE C N N 220 +MET OXT O N N 221 +MET H H N N 222 +MET H2 H N N 223 +MET HA H N N 224 +MET HB2 H N N 225 +MET HB3 H N N 226 +MET HG2 H N N 227 +MET HG3 H N N 228 +MET HE1 H N N 229 +MET HE2 H N N 230 +MET HE3 H N N 231 +MET HXT H N N 232 +PHE N N N N 233 +PHE CA C N S 234 +PHE C C N N 235 +PHE O O N N 236 +PHE CB C N N 237 +PHE CG C Y N 238 +PHE CD1 C Y N 239 +PHE CD2 C Y N 240 +PHE CE1 C Y N 241 +PHE CE2 C Y N 242 +PHE CZ C Y N 243 +PHE OXT O N N 244 +PHE H H N N 245 +PHE H2 H N N 246 +PHE HA H N N 247 +PHE HB2 H N N 248 +PHE HB3 H N N 249 +PHE HD1 H N N 250 +PHE HD2 H N N 251 +PHE HE1 H N N 252 +PHE HE2 H N N 253 +PHE HZ H N N 254 +PHE HXT H N N 255 +PRO N N N N 256 +PRO CA C N S 257 +PRO C C N N 258 +PRO O O N N 259 +PRO CB C N N 260 +PRO CG C N N 261 +PRO CD C N N 262 +PRO OXT O N N 263 +PRO H H N N 264 +PRO HA H N N 265 +PRO HB2 H N N 266 +PRO HB3 H N N 267 +PRO HG2 H N N 268 +PRO HG3 H N N 269 +PRO HD2 H N N 270 +PRO HD3 H N N 271 +PRO HXT H N N 272 +SER N N N N 273 +SER CA C N S 274 +SER C C N N 275 +SER O O N N 276 +SER CB C N N 277 +SER OG O N N 278 +SER OXT O N N 279 +SER H H N N 280 +SER H2 H N N 281 +SER HA H N N 282 +SER HB2 H N N 283 +SER HB3 H N N 284 +SER HG H N N 285 +SER HXT H N N 286 +THR N N N N 287 +THR CA C N S 288 +THR C C N N 289 +THR O O N N 290 +THR CB C N R 291 +THR OG1 O N N 292 +THR CG2 C N N 293 +THR OXT O N N 294 +THR H H N N 295 +THR H2 H N N 296 +THR HA H N N 297 +THR HB H N N 298 +THR HG1 H N N 299 +THR HG21 H N N 300 +THR HG22 H N N 301 +THR HG23 H N N 302 +THR HXT H N N 303 +TYR N N N N 304 +TYR CA C N S 305 +TYR C C N N 306 +TYR O O N N 307 +TYR CB C N N 308 +TYR CG C Y N 309 +TYR CD1 C Y N 310 +TYR CD2 C Y N 311 +TYR CE1 C Y N 312 +TYR CE2 C Y N 313 +TYR CZ C Y N 314 +TYR OH O N N 315 +TYR OXT O N N 316 +TYR H H N N 317 +TYR H2 H N N 318 +TYR HA H N N 319 +TYR HB2 H N N 320 +TYR HB3 H N N 321 +TYR HD1 H N N 322 +TYR HD2 H N N 323 +TYR HE1 H N N 324 +TYR HE2 H N N 325 +TYR HH H N N 326 +TYR HXT H N N 327 +VAL N N N N 328 +VAL CA C N S 329 +VAL C C N N 330 +VAL O O N N 331 +VAL CB C N N 332 +VAL CG1 C N N 333 +VAL CG2 C N N 334 +VAL OXT O N N 335 +VAL H H N N 336 +VAL H2 H N N 337 +VAL HA H N N 338 +VAL HB H N N 339 +VAL HG11 H N N 340 +VAL HG12 H N N 341 +VAL HG13 H N N 342 +VAL HG21 H N N 343 +VAL HG22 H N N 344 +VAL HG23 H N N 345 +VAL HXT H N N 346 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA SING N N 1 +ALA N H SING N N 2 +ALA N H2 SING N N 3 +ALA CA C SING N N 4 +ALA CA CB SING N N 5 +ALA CA HA SING N N 6 +ALA C O DOUB N N 7 +ALA C OXT SING N N 8 +ALA CB HB1 SING N N 9 +ALA CB HB2 SING N N 10 +ALA CB HB3 SING N N 11 +ALA OXT HXT SING N N 12 +ARG N CA SING N N 13 +ARG N H SING N N 14 +ARG N H2 SING N N 15 +ARG CA C SING N N 16 +ARG CA CB SING N N 17 +ARG CA HA SING N N 18 +ARG C O DOUB N N 19 +ARG C OXT SING N N 20 +ARG CB CG SING N N 21 +ARG CB HB2 SING N N 22 +ARG CB HB3 SING N N 23 +ARG CG CD SING N N 24 +ARG CG HG2 SING N N 25 +ARG CG HG3 SING N N 26 +ARG CD NE SING N N 27 +ARG CD HD2 SING N N 28 +ARG CD HD3 SING N N 29 +ARG NE CZ SING N N 30 +ARG NE HE SING N N 31 +ARG CZ NH1 SING N N 32 +ARG CZ NH2 DOUB N N 33 +ARG NH1 HH11 SING N N 34 +ARG NH1 HH12 SING N N 35 +ARG NH2 HH21 SING N N 36 +ARG NH2 HH22 SING N N 37 +ARG OXT HXT SING N N 38 +ASN N CA SING N N 39 +ASN N H SING N N 40 +ASN N H2 SING N N 41 +ASN CA C SING N N 42 +ASN CA CB SING N N 43 +ASN CA HA SING N N 44 +ASN C O DOUB N N 45 +ASN C OXT SING N N 46 +ASN CB CG SING N N 47 +ASN CB HB2 SING N N 48 +ASN CB HB3 SING N N 49 +ASN CG OD1 DOUB N N 50 +ASN CG ND2 SING N N 51 +ASN ND2 HD21 SING N N 52 +ASN ND2 HD22 SING N N 53 +ASN OXT HXT SING N N 54 +ASP N CA SING N N 55 +ASP N H SING N N 56 +ASP N H2 SING N N 57 +ASP CA C SING N N 58 +ASP CA CB SING N N 59 +ASP CA HA SING N N 60 +ASP C O DOUB N N 61 +ASP C OXT SING N N 62 +ASP CB CG SING N N 63 +ASP CB HB2 SING N N 64 +ASP CB HB3 SING N N 65 +ASP CG OD1 DOUB N N 66 +ASP CG OD2 SING N N 67 +ASP OD2 HD2 SING N N 68 +ASP OXT HXT SING N N 69 +GLN N CA SING N N 70 +GLN N H SING N N 71 +GLN N H2 SING N N 72 +GLN CA C SING N N 73 +GLN CA CB SING N N 74 +GLN CA HA SING N N 75 +GLN C O DOUB N N 76 +GLN C OXT SING N N 77 +GLN CB CG SING N N 78 +GLN CB HB2 SING N N 79 +GLN CB HB3 SING N N 80 +GLN CG CD SING N N 81 +GLN CG HG2 SING N N 82 +GLN CG HG3 SING N N 83 +GLN CD OE1 DOUB N N 84 +GLN CD NE2 SING N N 85 +GLN NE2 HE21 SING N N 86 +GLN NE2 HE22 SING N N 87 +GLN OXT HXT SING N N 88 +GLU N CA SING N N 89 +GLU N H SING N N 90 +GLU N H2 SING N N 91 +GLU CA C SING N N 92 +GLU CA CB SING N N 93 +GLU CA HA SING N N 94 +GLU C O DOUB N N 95 +GLU C OXT SING N N 96 +GLU CB CG SING N N 97 +GLU CB HB2 SING N N 98 +GLU CB HB3 SING N N 99 +GLU CG CD SING N N 100 +GLU CG HG2 SING N N 101 +GLU CG HG3 SING N N 102 +GLU CD OE1 DOUB N N 103 +GLU CD OE2 SING N N 104 +GLU OE2 HE2 SING N N 105 +GLU OXT HXT SING N N 106 +GLY N CA SING N N 107 +GLY N H SING N N 108 +GLY N H2 SING N N 109 +GLY CA C SING N N 110 +GLY CA HA2 SING N N 111 +GLY CA HA3 SING N N 112 +GLY C O DOUB N N 113 +GLY C OXT SING N N 114 +GLY OXT HXT SING N N 115 +HIS N CA SING N N 116 +HIS N H SING N N 117 +HIS N H2 SING N N 118 +HIS CA C SING N N 119 +HIS CA CB SING N N 120 +HIS CA HA SING N N 121 +HIS C O DOUB N N 122 +HIS C OXT SING N N 123 +HIS CB CG SING N N 124 +HIS CB HB2 SING N N 125 +HIS CB HB3 SING N N 126 +HIS CG ND1 SING Y N 127 +HIS CG CD2 DOUB Y N 128 +HIS ND1 CE1 DOUB Y N 129 +HIS ND1 HD1 SING N N 130 +HIS CD2 NE2 SING Y N 131 +HIS CD2 HD2 SING N N 132 +HIS CE1 NE2 SING Y N 133 +HIS CE1 HE1 SING N N 134 +HIS NE2 HE2 SING N N 135 +HIS OXT HXT SING N N 136 +ILE N CA SING N N 137 +ILE N H SING N N 138 +ILE N H2 SING N N 139 +ILE CA C SING N N 140 +ILE CA CB SING N N 141 +ILE CA HA SING N N 142 +ILE C O DOUB N N 143 +ILE C OXT SING N N 144 +ILE CB CG1 SING N N 145 +ILE CB CG2 SING N N 146 +ILE CB HB SING N N 147 +ILE CG1 CD1 SING N N 148 +ILE CG1 HG12 SING N N 149 +ILE CG1 HG13 SING N N 150 +ILE CG2 HG21 SING N N 151 +ILE CG2 HG22 SING N N 152 +ILE CG2 HG23 SING N N 153 +ILE CD1 HD11 SING N N 154 +ILE CD1 HD12 SING N N 155 +ILE CD1 HD13 SING N N 156 +ILE OXT HXT SING N N 157 +LEU N CA SING N N 158 +LEU N H SING N N 159 +LEU N H2 SING N N 160 +LEU CA C SING N N 161 +LEU CA CB SING N N 162 +LEU CA HA SING N N 163 +LEU C O DOUB N N 164 +LEU C OXT SING N N 165 +LEU CB CG SING N N 166 +LEU CB HB2 SING N N 167 +LEU CB HB3 SING N N 168 +LEU CG CD1 SING N N 169 +LEU CG CD2 SING N N 170 +LEU CG HG SING N N 171 +LEU CD1 HD11 SING N N 172 +LEU CD1 HD12 SING N N 173 +LEU CD1 HD13 SING N N 174 +LEU CD2 HD21 SING N N 175 +LEU CD2 HD22 SING N N 176 +LEU CD2 HD23 SING N N 177 +LEU OXT HXT SING N N 178 +LYS N CA SING N N 179 +LYS N H SING N N 180 +LYS N H2 SING N N 181 +LYS CA C SING N N 182 +LYS CA CB SING N N 183 +LYS CA HA SING N N 184 +LYS C O DOUB N N 185 +LYS C OXT SING N N 186 +LYS CB CG SING N N 187 +LYS CB HB2 SING N N 188 +LYS CB HB3 SING N N 189 +LYS CG CD SING N N 190 +LYS CG HG2 SING N N 191 +LYS CG HG3 SING N N 192 +LYS CD CE SING N N 193 +LYS CD HD2 SING N N 194 +LYS CD HD3 SING N N 195 +LYS CE NZ SING N N 196 +LYS CE HE2 SING N N 197 +LYS CE HE3 SING N N 198 +LYS NZ HZ1 SING N N 199 +LYS NZ HZ2 SING N N 200 +LYS NZ HZ3 SING N N 201 +LYS OXT HXT SING N N 202 +MET N CA SING N N 203 +MET N H SING N N 204 +MET N H2 SING N N 205 +MET CA C SING N N 206 +MET CA CB SING N N 207 +MET CA HA SING N N 208 +MET C O DOUB N N 209 +MET C OXT SING N N 210 +MET CB CG SING N N 211 +MET CB HB2 SING N N 212 +MET CB HB3 SING N N 213 +MET CG SD SING N N 214 +MET CG HG2 SING N N 215 +MET CG HG3 SING N N 216 +MET SD CE SING N N 217 +MET CE HE1 SING N N 218 +MET CE HE2 SING N N 219 +MET CE HE3 SING N N 220 +MET OXT HXT SING N N 221 +PHE N CA SING N N 222 +PHE N H SING N N 223 +PHE N H2 SING N N 224 +PHE CA C SING N N 225 +PHE CA CB SING N N 226 +PHE CA HA SING N N 227 +PHE C O DOUB N N 228 +PHE C OXT SING N N 229 +PHE CB CG SING N N 230 +PHE CB HB2 SING N N 231 +PHE CB HB3 SING N N 232 +PHE CG CD1 DOUB Y N 233 +PHE CG CD2 SING Y N 234 +PHE CD1 CE1 SING Y N 235 +PHE CD1 HD1 SING N N 236 +PHE CD2 CE2 DOUB Y N 237 +PHE CD2 HD2 SING N N 238 +PHE CE1 CZ DOUB Y N 239 +PHE CE1 HE1 SING N N 240 +PHE CE2 CZ SING Y N 241 +PHE CE2 HE2 SING N N 242 +PHE CZ HZ SING N N 243 +PHE OXT HXT SING N N 244 +PRO N CA SING N N 245 +PRO N CD SING N N 246 +PRO N H SING N N 247 +PRO CA C SING N N 248 +PRO CA CB SING N N 249 +PRO CA HA SING N N 250 +PRO C O DOUB N N 251 +PRO C OXT SING N N 252 +PRO CB CG SING N N 253 +PRO CB HB2 SING N N 254 +PRO CB HB3 SING N N 255 +PRO CG CD SING N N 256 +PRO CG HG2 SING N N 257 +PRO CG HG3 SING N N 258 +PRO CD HD2 SING N N 259 +PRO CD HD3 SING N N 260 +PRO OXT HXT SING N N 261 +SER N CA SING N N 262 +SER N H SING N N 263 +SER N H2 SING N N 264 +SER CA C SING N N 265 +SER CA CB SING N N 266 +SER CA HA SING N N 267 +SER C O DOUB N N 268 +SER C OXT SING N N 269 +SER CB OG SING N N 270 +SER CB HB2 SING N N 271 +SER CB HB3 SING N N 272 +SER OG HG SING N N 273 +SER OXT HXT SING N N 274 +THR N CA SING N N 275 +THR N H SING N N 276 +THR N H2 SING N N 277 +THR CA C SING N N 278 +THR CA CB SING N N 279 +THR CA HA SING N N 280 +THR C O DOUB N N 281 +THR C OXT SING N N 282 +THR CB OG1 SING N N 283 +THR CB CG2 SING N N 284 +THR CB HB SING N N 285 +THR OG1 HG1 SING N N 286 +THR CG2 HG21 SING N N 287 +THR CG2 HG22 SING N N 288 +THR CG2 HG23 SING N N 289 +THR OXT HXT SING N N 290 +TYR N CA SING N N 291 +TYR N H SING N N 292 +TYR N H2 SING N N 293 +TYR CA C SING N N 294 +TYR CA CB SING N N 295 +TYR CA HA SING N N 296 +TYR C O DOUB N N 297 +TYR C OXT SING N N 298 +TYR CB CG SING N N 299 +TYR CB HB2 SING N N 300 +TYR CB HB3 SING N N 301 +TYR CG CD1 DOUB Y N 302 +TYR CG CD2 SING Y N 303 +TYR CD1 CE1 SING Y N 304 +TYR CD1 HD1 SING N N 305 +TYR CD2 CE2 DOUB Y N 306 +TYR CD2 HD2 SING N N 307 +TYR CE1 CZ DOUB Y N 308 +TYR CE1 HE1 SING N N 309 +TYR CE2 CZ SING Y N 310 +TYR CE2 HE2 SING N N 311 +TYR CZ OH SING N N 312 +TYR OH HH SING N N 313 +TYR OXT HXT SING N N 314 +VAL N CA SING N N 315 +VAL N H SING N N 316 +VAL N H2 SING N N 317 +VAL CA C SING N N 318 +VAL CA CB SING N N 319 +VAL CA HA SING N N 320 +VAL C O DOUB N N 321 +VAL C OXT SING N N 322 +VAL CB CG1 SING N N 323 +VAL CB CG2 SING N N 324 +VAL CB HB SING N N 325 +VAL CG1 HG11 SING N N 326 +VAL CG1 HG12 SING N N 327 +VAL CG1 HG13 SING N N 328 +VAL CG2 HG21 SING N N 329 +VAL CG2 HG22 SING N N 330 +VAL CG2 HG23 SING N N 331 +VAL OXT HXT SING N N 332 +# diff --git a/tests/test_data/write_cif2.cif b/tests/test_data/write_cif2.cif index d4c2d8d..ad459a1 100644 --- a/tests/test_data/write_cif2.cif +++ b/tests/test_data/write_cif2.cif @@ -1697,7 +1697,7 @@ _software.description 'Protein modeling' _software.name chiLife _software.pdbx_ordinal 1 _software.type 'python package' -_software.version 1.2.0dev2 +_software.version 1.2.2 # loop_ _struct_asym.entity_id @@ -1716,6551 +1716,6552 @@ _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code -_atom_site.cartn_x -_atom_site.cartn_y -_atom_site.cartn_z +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num -ATOM 1 N N . MET A1 1 1 ? 38.148 15.945 -39.073 0.79 41.59 -9 A 1 -ATOM 2 C CA . MET A1 1 1 ? 36.885 15.61 -38.335 0.79 76.65 -9 A 1 -ATOM 3 C C . MET A1 1 1 ? 37.158 14.603 -37.223 0.79 73.14 -9 A 1 -ATOM 4 O O . MET A1 1 1 ? 37.995 13.711 -37.337 0.79 78.18 -9 A 1 -ATOM 5 C CB . MET A1 1 1 ? 35.785 15.067 -39.263 0.79 41.4 -9 A 1 -ATOM 6 C CG . MET A1 1 1 ? 34.44 14.758 -38.636 0.79 36.33 -9 A 1 -ATOM 7 S SD . MET A1 1 1 ? 33.713 16.096 -37.624 0.79 36.0 -9 A 1 -ATOM 8 C CE . MET A1 1 1 ? 33.668 17.43 -38.787 0.79 35.87 -9 A 1 -ATOM 9 H H1 . MET A1 1 1 ? 37.959 16.487 -39.754 0.79 49.91 -9 A 1 -ATOM 10 H H2 . MET A1 1 1 ? 38.716 16.35 -38.521 0.79 49.91 -9 A 1 -ATOM 11 H H3 . MET A1 1 1 ? 38.517 15.197 -39.383 0.79 49.91 -9 A 1 -ATOM 12 H HA . MET A1 1 1 ? 36.546 16.437 -37.957 0.79 91.98 -9 A 1 -ATOM 13 H HB2 . MET A1 1 1 ? 35.628 15.726 -39.957 0.79 49.68 -9 A 1 -ATOM 14 H HB3 . MET A1 1 1 ? 36.108 14.241 -39.657 0.79 49.68 -9 A 1 -ATOM 15 H HG2 . MET A1 1 1 ? 33.81 14.562 -39.348 0.79 43.6 -9 A 1 -ATOM 16 H HG3 . MET A1 1 1 ? 34.542 13.985 -38.061 0.79 43.6 -9 A 1 -ATOM 17 H HE1 . MET A1 1 1 ? 33.292 18.213 -38.354 0.79 43.05 -9 A 1 -ATOM 18 H HE2 . MET A1 1 1 ? 34.571 17.619 -39.086 0.79 43.05 -9 A 1 -ATOM 19 H HE3 . MET A1 1 1 ? 33.116 17.172 -39.542 0.79 43.05 -9 A 1 -ATOM 20 N N . TRP A1 1 2 ? 36.397 14.756 -36.154 1.0 51.72 -8 A 1 -ATOM 21 C CA . TRP A1 1 2 ? 36.576 14.031 -34.911 1.0 37.95 -8 A 1 -ATOM 22 C C . TRP A1 1 2 ? 35.234 13.355 -34.569 1.0 60.47 -8 A 1 -ATOM 23 O O . TRP A1 1 2 ? 34.2 13.59 -35.212 1.0 39.4 -8 A 1 -ATOM 24 C CB . TRP A1 1 2 ? 36.969 15.024 -33.802 1.0 41.92 -8 A 1 -ATOM 25 C CG . TRP A1 1 2 ? 35.911 16.127 -33.579 1.0 49.1 -8 A 1 -ATOM 26 C CD1 . TRP A1 1 2 ? 34.842 16.078 -32.737 1.0 41.65 -8 A 1 -ATOM 27 C CD2 . TRP A1 1 2 ? 35.847 17.403 -34.224 1.0 37.75 -8 A 1 -ATOM 28 N NE1 . TRP A1 1 2 ? 34.11 17.246 -32.808 1.0 42.91 -8 A 1 -ATOM 29 C CE2 . TRP A1 1 2 ? 34.703 18.069 -33.725 1.0 45.83 -8 A 1 -ATOM 30 C CE3 . TRP A1 1 2 ? 36.639 18.044 -35.193 1.0 41.88 -8 A 1 -ATOM 31 C CZ2 . TRP A1 1 2 ? 34.342 19.349 -34.141 1.0 44.65 -8 A 1 -ATOM 32 C CZ3 . TRP A1 1 2 ? 36.273 19.312 -35.607 1.0 82.58 -8 A 1 -ATOM 33 C CH2 . TRP A1 1 2 ? 35.132 19.948 -35.084 1.0 66.0 -8 A 1 -ATOM 34 H H . TRP A1 1 2 ? 35.735 15.304 -36.123 1.0 62.07 -8 A 1 -ATOM 35 H HA . TRP A1 1 2 ? 37.261 13.348 -34.986 1.0 45.54 -8 A 1 -ATOM 36 H HB2 . TRP A1 1 2 ? 37.077 14.539 -32.969 1.0 50.3 -8 A 1 -ATOM 37 H HB3 . TRP A1 1 2 ? 37.804 15.454 -34.046 1.0 50.3 -8 A 1 -ATOM 38 H HD1 . TRP A1 1 2 ? 34.633 15.356 -32.19 1.0 49.98 -8 A 1 -ATOM 39 H HE1 . TRP A1 1 2 ? 33.403 17.426 -32.353 1.0 51.5 -8 A 1 -ATOM 40 H HE3 . TRP A1 1 2 ? 37.391 17.625 -35.547 1.0 50.25 -8 A 1 -ATOM 41 H HZ2 . TRP A1 1 2 ? 33.594 19.778 -33.792 1.0 53.58 -8 A 1 -ATOM 42 H HZ3 . TRP A1 1 2 ? 36.789 19.751 -36.244 1.0 99.1 -8 A 1 -ATOM 43 H HH2 . TRP A1 1 2 ? 34.909 20.799 -35.386 1.0 79.2 -8 A 1 -ATOM 44 N N . SER A1 1 3 ? 35.238 12.526 -33.522 1.0 29.85 -7 A 1 -ATOM 45 C CA A SER A1 1 3 ? 34.091 11.739 -33.112 0.63 28.25 -7 A 1 -ATOM 46 C CA B SER A1 1 3 ? 34.095 11.738 -33.109 0.37 28.25 -7 A 1 -ATOM 47 C C . SER A1 1 3 ? 33.087 12.601 -32.344 1.0 27.43 -7 A 1 -ATOM 48 O O . SER A1 1 3 ? 33.363 13.725 -31.927 1.0 36.37 -7 A 1 -ATOM 49 C CB A SER A1 1 3 ? 34.537 10.559 -32.252 0.63 38.49 -7 A 1 -ATOM 50 C CB B SER A1 1 3 ? 34.57 10.572 -32.243 0.37 36.36 -7 A 1 -ATOM 51 O OG A SER A1 1 3 ? 33.445 9.699 -31.985 0.63 63.39 -7 A 1 -ATOM 52 O OG B SER A1 1 3 ? 35.205 11.043 -31.066 0.37 62.85 -7 A 1 -ATOM 53 H H . SER A1 1 3 ? 35.923 12.401 -33.017 1.0 35.82 -7 A 1 -ATOM 54 H HA . SER A1 1 3 ? 33.648 11.394 -33.902 1.0 33.9 -7 A 1 -ATOM 55 H HB2 A SER A1 1 3 ? 35.223 10.064 -32.725 0.63 46.19 -7 A 1 -ATOM 56 H HB2 B SER A1 1 3 ? 33.804 10.031 -31.994 0.37 43.64 -7 A 1 -ATOM 57 H HB3 A SER A1 1 3 ? 34.889 10.894 -31.412 0.63 46.19 -7 A 1 -ATOM 58 H HB3 B SER A1 1 3 ? 35.202 10.039 -32.751 0.37 43.64 -7 A 1 -ATOM 59 H HG A SER A1 1 3 ? 33.692 9.068 -31.488 0.63 76.07 -7 A 1 -ATOM 60 H HG B SER A1 1 3 ? 34.661 11.488 -30.605 0.37 75.43 -7 A 1 -ATOM 61 N N . HIS A1 1 4 ? 31.903 12.063 -32.172 1.0 26.34 -6 A 1 -ATOM 62 C CA . HIS A1 1 4 ? 30.834 12.761 -31.484 1.0 25.69 -6 A 1 -ATOM 63 C C . HIS A1 1 4 ? 30.056 11.791 -30.615 1.0 24.36 -6 A 1 -ATOM 64 O O . HIS A1 1 4 ? 28.874 11.508 -30.852 1.0 27.57 -6 A 1 -ATOM 65 C CB . HIS A1 1 4 ? 29.885 13.431 -32.497 1.0 31.17 -6 A 1 -ATOM 66 C CG . HIS A1 1 4 ? 28.911 14.393 -31.898 1.0 33.72 -6 A 1 -ATOM 67 N ND1 . HIS A1 1 4 ? 29.313 15.567 -31.292 1.0 32.82 -6 A 1 -ATOM 68 C CD2 . HIS A1 1 4 ? 27.558 14.413 -31.907 1.0 40.6 -6 A 1 -ATOM 69 C CE1 . HIS A1 1 4 ? 28.243 16.251 -30.931 1.0 30.94 -6 A 1 -ATOM 70 N NE2 . HIS A1 1 4 ? 27.162 15.556 -31.248 1.0 30.54 -6 A 1 -ATOM 71 H H . HIS A1 1 4 ? 31.685 11.278 -32.45 1.0 31.61 -6 A 1 -ATOM 72 H HA . HIS A1 1 4 ? 31.233 13.434 -30.91 1.0 30.83 -6 A 1 -ATOM 73 H HB2 . HIS A1 1 4 ? 30.418 13.919 -33.143 1.0 37.4 -6 A 1 -ATOM 74 H HB3 . HIS A1 1 4 ? 29.374 12.738 -32.945 1.0 37.4 -6 A 1 -ATOM 75 H HD1 . HIS A1 1 4 ? 30.128 15.812 -31.169 1.0 39.38 -6 A 1 -ATOM 76 H HD2 . HIS A1 1 4 ? 27.0 13.774 -32.287 1.0 48.72 -6 A 1 -ATOM 77 H HE1 . HIS A1 1 4 ? 28.248 17.085 -30.521 1.0 37.12 -6 A 1 -ATOM 78 N N . PRO A1 1 5 ? 30.646 11.321 -29.516 1.0 25.28 -5 A 1 -ATOM 79 C CA . PRO A1 1 5 ? 29.93 10.356 -28.687 1.0 24.96 -5 A 1 -ATOM 80 C C . PRO A1 1 5 ? 28.873 10.989 -27.816 1.0 24.39 -5 A 1 -ATOM 81 O O . PRO A1 1 5 ? 28.908 12.182 -27.52 1.0 30.77 -5 A 1 -ATOM 82 C CB . PRO A1 1 5 ? 31.044 9.786 -27.805 1.0 26.01 -5 A 1 -ATOM 83 C CG . PRO A1 1 5 ? 32.069 10.791 -27.814 1.0 27.78 -5 A 1 -ATOM 84 C CD . PRO A1 1 5 ? 31.989 11.621 -29.065 1.0 27.01 -5 A 1 -ATOM 85 H HA . PRO A1 1 5 ? 29.526 9.673 -29.245 1.0 29.95 -5 A 1 -ATOM 86 H HB2 . PRO A1 1 5 ? 30.711 9.636 -26.907 1.0 31.22 -5 A 1 -ATOM 87 H HB3 . PRO A1 1 5 ? 31.37 8.953 -28.181 1.0 31.22 -5 A 1 -ATOM 88 H HG2 . PRO A1 1 5 ? 31.947 11.36 -27.038 1.0 33.34 -5 A 1 -ATOM 89 H HG3 . PRO A1 1 5 ? 32.931 10.35 -27.771 1.0 33.34 -5 A 1 -ATOM 90 H HD2 . PRO A1 1 5 ? 32.094 12.565 -28.87 1.0 32.41 -5 A 1 -ATOM 91 H HD3 . PRO A1 1 5 ? 32.651 11.341 -29.717 1.0 32.41 -5 A 1 -ATOM 92 N N . GLN A1 1 6 ? 27.874 10.185 -27.464 1.0 23.78 -4 A 1 -ATOM 93 C CA . GLN A1 1 6 ? 26.799 10.587 -26.595 1.0 23.02 -4 A 1 -ATOM 94 C C . GLN A1 1 6 ? 27.211 10.457 -25.129 1.0 24.25 -4 A 1 -ATOM 95 O O . GLN A1 1 6 ? 28.094 9.691 -24.801 1.0 27.41 -4 A 1 -ATOM 96 C CB . GLN A1 1 6 ? 25.61 9.66 -26.823 1.0 24.39 -4 A 1 -ATOM 97 C CG . GLN A1 1 6 ? 24.956 9.818 -28.22 1.0 37.55 -4 A 1 -ATOM 98 H H . GLN A1 1 6 ? 27.802 9.371 -27.731 1.0 28.54 -4 A 1 -ATOM 99 H HA . GLN A1 1 6 ? 26.562 11.509 -26.779 1.0 27.62 -4 A 1 -ATOM 100 H HB2 . GLN A1 1 6 ? 25.908 8.742 -26.738 1.0 29.27 -4 A 1 -ATOM 101 H HB3 . GLN A1 1 6 ? 24.932 9.852 -26.155 1.0 29.27 -4 A 1 -ATOM 102 N N . PHE A1 1 7 ? 26.523 11.19 -24.294 1.0 24.25 -3 A 1 -ATOM 103 C CA . PHE A1 1 7 ? 26.769 11.152 -22.851 1.0 23.83 -3 A 1 -ATOM 104 C C . PHE A1 1 7 ? 26.07 9.96 -22.223 1.0 26.94 -3 A 1 -ATOM 105 O O . PHE A1 1 7 ? 25.039 9.48 -22.696 1.0 28.29 -3 A 1 -ATOM 106 C CB . PHE A1 1 7 ? 26.202 12.43 -22.239 1.0 22.45 -3 A 1 -ATOM 107 C CG . PHE A1 1 7 ? 26.994 13.655 -22.589 1.0 22.39 -3 A 1 -ATOM 108 C CD1 . PHE A1 1 7 ? 28.253 13.859 -22.148 1.0 22.48 -3 A 1 -ATOM 109 C CD2 . PHE A1 1 7 ? 26.445 14.634 -23.393 1.0 48.1 -3 A 1 -ATOM 110 C CE1 . PHE A1 1 7 ? 28.984 14.967 -22.405 1.0 23.69 -3 A 1 -ATOM 111 C CE2 . PHE A1 1 7 ? 27.189 15.774 -23.716 1.0 40.66 -3 A 1 -ATOM 112 C CZ . PHE A1 1 7 ? 28.451 15.934 -23.212 1.0 36.7 -3 A 1 -ATOM 113 H H . PHE A1 1 7 ? 25.896 11.73 -24.527 1.0 29.11 -3 A 1 -ATOM 114 H HA . PHE A1 1 7 ? 27.719 11.078 -22.668 1.0 28.6 -3 A 1 -ATOM 115 H HB2 . PHE A1 1 7 ? 25.297 12.558 -22.562 1.0 26.95 -3 A 1 -ATOM 116 H HB3 . PHE A1 1 7 ? 26.2 12.342 -21.273 1.0 26.95 -3 A 1 -ATOM 117 H HD1 . PHE A1 1 7 ? 28.644 13.192 -21.631 1.0 26.97 -3 A 1 -ATOM 118 H HD2 . PHE A1 1 7 ? 25.58 14.536 -23.72 1.0 57.71 -3 A 1 -ATOM 119 H HE1 . PHE A1 1 7 ? 29.834 15.069 -22.041 1.0 28.43 -3 A 1 -ATOM 120 H HE2 . PHE A1 1 7 ? 26.825 16.423 -24.275 1.0 48.79 -3 A 1 -ATOM 121 H HZ . PHE A1 1 7 ? 28.942 16.696 -23.416 1.0 44.04 -3 A 1 -ATOM 122 N N . GLU A1 1 8 ? 26.632 9.501 -21.115 1.0 25.59 -2 A 1 -ATOM 123 C CA . GLU A1 1 8 ? 26.009 8.428 -20.348 1.0 29.53 -2 A 1 -ATOM 124 C C . GLU A1 1 8 ? 24.61 8.778 -19.864 1.0 26.25 -2 A 1 -ATOM 125 O O . GLU A1 1 8 ? 24.321 9.884 -19.391 1.0 25.07 -2 A 1 -ATOM 126 C CB . GLU A1 1 8 ? 26.922 8.09 -19.165 1.0 29.58 -2 A 1 -ATOM 127 C CG . GLU A1 1 8 ? 26.626 6.753 -18.496 1.0 69.91 -2 A 1 -ATOM 128 C CD . GLU A1 1 8 ? 25.582 6.852 -17.405 1.0 107.8 -2 A 1 -ATOM 129 O OE1 . GLU A1 1 8 ? 25.557 7.881 -16.687 1.0 49.86 -2 A 1 -ATOM 130 O OE2 . GLU A1 1 8 ? 24.789 5.892 -17.262 1.0 36.84 -2 A 1 -ATOM 131 H H . GLU A1 1 8 ? 27.371 9.791 -20.785 1.0 30.7 -2 A 1 -ATOM 132 H HA . GLU A1 1 8 ? 25.899 7.65 -20.917 1.0 35.44 -2 A 1 -ATOM 133 H HB2 . GLU A1 1 8 ? 27.839 8.062 -19.48 1.0 35.5 -2 A 1 -ATOM 134 H HB3 . GLU A1 1 8 ? 26.824 8.781 -18.491 1.0 35.5 -2 A 1 -ATOM 135 H HG2 . GLU A1 1 8 ? 26.299 6.132 -19.166 1.0 83.9 -2 A 1 -ATOM 136 H HG3 . GLU A1 1 8 ? 27.442 6.412 -18.098 1.0 83.9 -2 A 1 -ATOM 137 N N . LYS A1 1 9 ? 23.739 7.751 -19.85 1.0 28.53 -1 A 1 -ATOM 138 C CA . LYS A1 1 9 ? 22.313 7.942 -19.606 1.0 28.31 -1 A 1 -ATOM 139 C C . LYS A1 1 9 ? 21.967 8.358 -18.174 1.0 23.68 -1 A 1 -ATOM 140 O O . LYS A1 1 9 ? 21.176 9.268 -17.966 1.0 25.84 -1 A 1 -ATOM 141 C CB . LYS A1 1 9 ? 21.569 6.649 -19.99 1.0 29.13 -1 A 1 -ATOM 142 C CG . LYS A1 1 9 ? 21.697 6.312 -21.459 1.0 40.7 -1 A 1 -ATOM 143 H H . LYS A1 1 9 ? 23.958 6.929 -19.982 1.0 34.23 -1 A 1 -ATOM 144 H HA . LYS A1 1 9 ? 22.018 8.679 -20.163 1.0 33.97 -1 A 1 -ATOM 145 H HB2 . LYS A1 1 9 ? 21.936 5.91 -19.48 1.0 34.96 -1 A 1 -ATOM 146 H HB3 . LYS A1 1 9 ? 20.626 6.755 -19.788 1.0 34.96 -1 A 1 -ATOM 147 N N . ALA A1 1 10 ? 22.541 7.7 -17.158 1.0 27.77 0 A 1 -ATOM 148 C CA . ALA A1 1 10 ? 22.168 8.046 -15.794 1.0 32.88 0 A 1 -ATOM 149 C C . ALA A1 1 10 ? 22.572 9.48 -15.477 1.0 25.14 0 A 1 -ATOM 150 O O . ALA A1 1 10 ? 21.811 10.22 -14.86 1.0 26.67 0 A 1 -ATOM 151 C CB . ALA A1 1 10 ? 22.841 7.093 -14.797 1.0 40.14 0 A 1 -ATOM 152 H H . ALA A1 1 10 ? 23.125 7.074 -17.235 1.0 33.33 0 A 1 -ATOM 153 H HA . ALA A1 1 10 ? 21.206 7.955 -15.702 1.0 39.45 0 A 1 -ATOM 154 H HB1 . ALA A1 1 10 ? 22.582 7.344 -13.897 1.0 48.16 0 A 1 -ATOM 155 H HB2 . ALA A1 1 10 ? 22.552 6.186 -14.984 1.0 48.16 0 A 1 -ATOM 156 H HB3 . ALA A1 1 10 ? 23.803 7.161 -14.896 1.0 48.16 0 A 1 -ATOM 157 N N . SER A1 1 11 ? 23.757 9.886 -15.915 1.0 29.79 1 A 1 -ATOM 158 C CA . SER A1 1 11 ? 24.198 11.235 -15.579 1.0 27.03 1 A 1 -ATOM 159 C C . SER A1 1 11 ? 23.384 12.274 -16.34 1.0 23.91 1 A 1 -ATOM 160 O O . SER A1 1 11 ? 22.95 13.267 -15.741 1.0 24.82 1 A 1 -ATOM 161 C CB . SER A1 1 11 ? 25.659 11.439 -15.899 1.0 32.94 1 A 1 -ATOM 162 O OG . SER A1 1 11 ? 25.972 12.758 -15.498 1.0 30.22 1 A 1 -ATOM 163 H H . SER A1 1 11 ? 24.304 9.42 -16.388 1.0 35.75 1 A 1 -ATOM 164 H HA . SER A1 1 11 ? 24.08 11.349 -14.623 1.0 32.44 1 A 1 -ATOM 165 H HB2 . SER A1 1 11 ? 26.201 10.803 -15.407 1.0 39.53 1 A 1 -ATOM 166 H HB3 . SER A1 1 11 ? 25.81 11.336 -16.852 1.0 39.53 1 A 1 -ATOM 167 H HG . SER A1 1 11 ? 26.741 12.964 -15.764 1.0 36.27 1 A 1 -ATOM 168 N N . THR A1 1 12 ? 23.071 11.994 -17.619 1.0 24.48 2 A 1 -ATOM 169 C CA . THR A1 1 12 ? 22.142 12.835 -18.388 1.0 22.44 2 A 1 -ATOM 170 C C . THR A1 1 12 ? 20.8 12.944 -17.679 1.0 24.37 2 A 1 -ATOM 171 O O . THR A1 1 12 ? 20.262 14.04 -17.484 1.0 24.1 2 A 1 -ATOM 172 C CB . THR A1 1 12 ? 21.902 12.264 -19.776 1.0 23.42 2 A 1 -ATOM 173 O OG1 . THR A1 1 12 ? 23.105 12.36 -20.515 1.0 28.21 2 A 1 -ATOM 174 C CG2 . THR A1 1 12 ? 20.819 13.054 -20.49 1.0 27.46 2 A 1 -ATOM 175 H H . THR A1 1 12 ? 23.383 11.326 -18.061 1.0 29.38 2 A 1 -ATOM 176 H HA . THR A1 1 12 ? 22.55 13.711 -18.477 1.0 26.92 2 A 1 -ATOM 177 H HB . THR A1 1 12 ? 21.617 11.339 -19.713 1.0 28.1 2 A 1 -ATOM 178 H HG1 . THR A1 1 12 ? 23.715 11.93 -20.129 1.0 33.86 2 A 1 -ATOM 179 H HG21 . THR A1 1 12 ? 20.895 12.93 -21.449 1.0 32.95 2 A 1 -ATOM 180 H HG22 . THR A1 1 12 ? 19.943 12.752 -20.202 1.0 32.95 2 A 1 -ATOM 181 H HG23 . THR A1 1 12 ? 20.908 13.999 -20.286 1.0 32.95 2 A 1 -ATOM 182 N N . GLY A1 1 13 ? 20.284 11.818 -17.21 1.0 22.35 3 A 1 -ATOM 183 C CA . GLY A1 1 13 ? 19.055 11.861 -16.42 1.0 23.55 3 A 1 -ATOM 184 C C . GLY A1 1 13 ? 19.172 12.688 -15.15 1.0 22.85 3 A 1 -ATOM 185 O O . GLY A1 1 13 ? 18.268 13.45 -14.787 1.0 24.72 3 A 1 -ATOM 186 H H . GLY A1 1 13 ? 20.614 11.033 -17.328 1.0 26.82 3 A 1 -ATOM 187 H HA2 . GLY A1 1 13 ? 18.346 12.241 -16.962 1.0 28.26 3 A 1 -ATOM 188 H HA3 . GLY A1 1 13 ? 18.81 10.957 -16.168 1.0 28.26 3 A 1 -ATOM 189 N N . ARG A1 1 14 ? 20.3 12.569 -14.456 1.0 23.83 4 A 1 -ATOM 190 C CA . ARG A1 1 14 ? 20.472 13.36 -13.245 1.0 27.88 4 A 1 -ATOM 191 C C . ARG A1 1 14 ? 20.564 14.849 -13.602 1.0 26.39 4 A 1 -ATOM 192 O O . ARG A1 1 14 ? 20.095 15.71 -12.859 1.0 32.82 4 A 1 -ATOM 193 C CB . ARG A1 1 14 ? 21.74 12.914 -12.471 1.0 33.78 4 A 1 -ATOM 194 C CG . ARG A1 1 14 ? 21.559 11.537 -11.752 1.0 32.28 4 A 1 -ATOM 195 C CD . ARG A1 1 14 ? 22.699 11.213 -10.769 1.0 30.62 4 A 1 -ATOM 196 N NE . ARG A1 1 14 ? 23.986 11.187 -11.435 1.0 33.27 4 A 1 -ATOM 197 C CZ . ARG A1 1 14 ? 24.548 10.094 -11.971 1.0 57.78 4 A 1 -ATOM 198 N NH1 . ARG A1 1 14 ? 23.95 8.905 -11.915 1.0 37.08 4 A 1 -ATOM 199 N NH2 . ARG A1 1 14 ? 25.728 10.187 -12.55 1.0 36.56 4 A 1 -ATOM 200 H H . ARG A1 1 14 ? 20.959 12.055 -14.658 1.0 28.6 4 A 1 -ATOM 201 H HA . ARG A1 1 14 ? 19.711 13.215 -12.66 1.0 33.46 4 A 1 -ATOM 202 H HB2 . ARG A1 1 14 ? 22.478 12.832 -13.095 1.0 40.54 4 A 1 -ATOM 203 H HB3 . ARG A1 1 14 ? 21.948 13.579 -11.796 1.0 40.54 4 A 1 -ATOM 204 H HG2 . ARG A1 1 14 ? 20.728 11.549 -11.251 1.0 38.74 4 A 1 -ATOM 205 H HG3 . ARG A1 1 14 ? 21.532 10.834 -12.42 1.0 38.74 4 A 1 -ATOM 206 H HD2 . ARG A1 1 14 ? 22.728 11.892 -10.076 1.0 36.75 4 A 1 -ATOM 207 H HD3 . ARG A1 1 14 ? 22.543 10.341 -10.373 1.0 36.75 4 A 1 -ATOM 208 H HE . ARG A1 1 14 ? 24.422 11.926 -11.49 1.0 39.93 4 A 1 -ATOM 209 H HH11 . ARG A1 1 14 ? 23.186 8.825 -11.528 1.0 44.5 4 A 1 -ATOM 210 H HH12 . ARG A1 1 14 ? 24.328 8.216 -12.265 1.0 44.5 4 A 1 -ATOM 211 H HH21 . ARG A1 1 14 ? 26.132 10.946 -12.582 1.0 43.87 4 A 1 -ATOM 212 H HH22 . ARG A1 1 14 ? 26.094 9.49 -12.896 1.0 43.87 4 A 1 -ATOM 213 N N . GLU A1 1 15 ? 21.198 15.156 -14.706 1.0 25.65 5 A 1 -ATOM 214 C CA . GLU A1 1 15 ? 21.264 16.554 -15.15 1.0 30.27 5 A 1 -ATOM 215 C C . GLU A1 1 15 ? 19.891 17.084 -15.572 1.0 24.14 5 A 1 -ATOM 216 O O . GLU A1 1 15 ? 19.563 18.239 -15.295 1.0 27.91 5 A 1 -ATOM 217 C CB . GLU A1 1 15 ? 22.283 16.719 -16.265 1.0 26.51 5 A 1 -ATOM 218 C CG . GLU A1 1 15 ? 23.76 16.717 -15.647 1.0 36.46 5 A 1 -ATOM 219 C CD . GLU A1 1 15 ? 24.891 17.064 -16.619 1.0 84.59 5 A 1 -ATOM 220 O OE1 . GLU A1 1 15 ? 24.669 16.827 -17.823 1.0 62.11 5 A 1 -ATOM 221 O OE2 . GLU A1 1 15 ? 26.002 17.557 -16.187 1.0 31.23 5 A 1 -ATOM 222 H H . GLU A1 1 15 ? 21.597 14.594 -15.22 1.0 30.78 5 A 1 -ATOM 223 H HA . GLU A1 1 15 ? 21.566 17.093 -14.402 1.0 36.32 5 A 1 -ATOM 224 H HB2 . GLU A1 1 15 ? 22.205 15.983 -16.892 1.0 31.82 5 A 1 -ATOM 225 H HB3 . GLU A1 1 15 ? 22.136 17.562 -16.722 1.0 31.82 5 A 1 -ATOM 226 H HG2 . GLU A1 1 15 ? 23.79 17.368 -14.928 1.0 43.75 5 A 1 -ATOM 227 H HG3 . GLU A1 1 15 ? 23.943 15.83 -15.299 1.0 43.75 5 A 1 -ATOM 228 N N . ILE A1 1 16 ? 19.081 16.258 -16.22 1.0 23.23 6 A 1 -ATOM 229 C CA . ILE A1 1 16 ? 17.701 16.66 -16.524 1.0 22.2 6 A 1 -ATOM 230 C C . ILE A1 1 16 ? 16.905 16.926 -15.244 1.0 23.61 6 A 1 -ATOM 231 O O . ILE A1 1 16 ? 16.211 17.945 -15.124 1.0 25.49 6 A 1 -ATOM 232 C CB . ILE A1 1 16 ? 17.031 15.613 -17.421 1.0 22.84 6 A 1 -ATOM 233 C CG1 . ILE A1 1 16 ? 17.66 15.544 -18.815 1.0 24.96 6 A 1 -ATOM 234 C CG2 . ILE A1 1 16 ? 15.517 15.874 -17.557 1.0 22.82 6 A 1 -ATOM 235 C CD1 . ILE A1 1 16 ? 17.553 16.818 -19.644 1.0 27.36 6 A 1 -ATOM 236 H H . ILE A1 1 16 ? 19.295 15.472 -16.493 1.0 27.88 6 A 1 -ATOM 237 H HA . ILE A1 1 16 ? 17.727 17.498 -17.012 1.0 26.64 6 A 1 -ATOM 238 H HB . ILE A1 1 16 ? 17.175 14.761 -16.981 1.0 27.41 6 A 1 -ATOM 239 H HG12 . ILE A1 1 16 ? 18.604 15.343 -18.715 1.0 29.95 6 A 1 -ATOM 240 H HG13 . ILE A1 1 16 ? 17.221 14.837 -19.314 1.0 29.95 6 A 1 -ATOM 241 H HG21 . ILE A1 1 16 ? 15.174 15.36 -18.306 1.0 27.39 6 A 1 -ATOM 242 H HG22 . ILE A1 1 16 ? 15.074 15.601 -16.739 1.0 27.39 6 A 1 -ATOM 243 H HG23 . ILE A1 1 16 ? 15.372 16.821 -17.712 1.0 27.39 6 A 1 -ATOM 244 H HD11 . ILE A1 1 16 ? 17.903 16.647 -20.532 1.0 32.83 6 A 1 -ATOM 245 H HD12 . ILE A1 1 16 ? 16.621 17.081 -19.701 1.0 32.83 6 A 1 -ATOM 246 H HD13 . ILE A1 1 16 ? 18.069 17.518 -19.215 1.0 32.83 6 A 1 -ATOM 247 N N . LEU A1 1 17 ? 17.007 16.033 -14.251 1.0 23.41 7 A 1 -ATOM 248 C CA . LEU A1 1 17 ? 16.324 16.247 -12.971 1.0 24.52 7 A 1 -ATOM 249 C C . LEU A1 1 17 ? 16.76 17.543 -12.311 1.0 24.47 7 A 1 -ATOM 250 O O . LEU A1 1 17 ? 15.918 18.276 -11.782 1.0 28.2 7 A 1 -ATOM 251 C CB . LEU A1 1 17 ? 16.555 15.062 -12.021 1.0 25.43 7 A 1 -ATOM 252 C CG . LEU A1 1 17 ? 15.876 13.781 -12.48 1.0 23.71 7 A 1 -ATOM 253 C CD1 . LEU A1 1 17 ? 16.474 12.537 -11.806 1.0 27.62 7 A 1 -ATOM 254 C CD2 . LEU A1 1 17 ? 14.367 13.813 -12.227 1.0 28.12 7 A 1 -ATOM 255 H H . LEU A1 1 17 ? 17.46 15.303 -14.293 1.0 28.09 7 A 1 -ATOM 256 H HA . LEU A1 1 17 ? 15.372 16.304 -13.149 1.0 29.42 7 A 1 -ATOM 257 H HB2 . LEU A1 1 17 ? 17.508 14.89 -11.962 1.0 30.51 7 A 1 -ATOM 258 H HB3 . LEU A1 1 17 ? 16.204 15.289 -11.146 1.0 30.51 7 A 1 -ATOM 259 H HG . LEU A1 1 17 ? 16.029 13.715 -13.435 1.0 28.45 7 A 1 -ATOM 260 H HD11 . LEU A1 1 17 ? 16.022 11.747 -12.142 1.0 33.14 7 A 1 -ATOM 261 H HD12 . LEU A1 1 17 ? 17.421 12.49 -12.014 1.0 33.14 7 A 1 -ATOM 262 H HD13 . LEU A1 1 17 ? 16.35 12.607 -10.847 1.0 33.14 7 A 1 -ATOM 263 H HD21 . LEU A1 1 17 ? 13.982 12.967 -12.503 1.0 33.75 7 A 1 -ATOM 264 H HD22 . LEU A1 1 17 ? 14.208 13.955 -11.28 1.0 33.75 7 A 1 -ATOM 265 H HD23 . LEU A1 1 17 ? 13.976 14.538 -12.739 1.0 33.75 7 A 1 -ATOM 266 N N . GLU A1 1 18 ? 18.064 17.866 -12.362 1.0 25.93 8 A 1 -ATOM 267 C CA . GLU A1 1 18 ? 18.543 19.097 -11.763 1.0 30.48 8 A 1 -ATOM 268 C C . GLU A1 1 18 ? 17.961 20.312 -12.474 1.0 26.17 8 A 1 -ATOM 269 O O . GLU A1 1 18 ? 17.606 21.303 -11.829 1.0 30.91 8 A 1 -ATOM 270 C CB . GLU A1 1 18 ? 20.073 19.122 -11.798 1.0 31.8 8 A 1 -ATOM 271 C CG . GLU A1 1 18 ? 20.671 20.503 -11.577 1.0 45.12 8 A 1 -ATOM 272 C CD . GLU A1 1 18 ? 22.035 20.454 -10.928 1.0 84.93 8 A 1 -ATOM 273 O OE1 . GLU A1 1 18 ? 22.991 19.98 -11.578 1.0 73.57 8 A 1 -ATOM 274 O OE2 . GLU A1 1 18 ? 22.143 20.881 -9.76 1.0 100.44 8 A 1 -ATOM 275 H H . GLU A1 1 18 ? 18.675 17.389 -12.734 1.0 31.12 8 A 1 -ATOM 276 H HA . GLU A1 1 18 ? 18.264 19.137 -10.836 1.0 36.57 8 A 1 -ATOM 277 H HB2 . GLU A1 1 18 ? 20.41 18.538 -11.1 1.0 38.16 8 A 1 -ATOM 278 H HB3 . GLU A1 1 18 ? 20.37 18.806 -12.666 1.0 38.16 8 A 1 -ATOM 279 H HG2 . GLU A1 1 18 ? 20.762 20.949 -12.434 1.0 54.15 8 A 1 -ATOM 280 H HG3 . GLU A1 1 18 ? 20.082 21.013 -10.998 1.0 54.15 8 A 1 -ATOM 281 N N . LYS A1 1 19 ? 17.866 20.252 -13.806 1.0 28.95 9 A 1 -ATOM 282 C CA . LYS A1 1 19 ? 17.277 21.358 -14.557 1.0 27.62 9 A 1 -ATOM 283 C C . LYS A1 1 19 ? 15.79 21.51 -14.235 1.0 23.18 9 A 1 -ATOM 284 O O . LYS A1 1 19 ? 15.299 22.615 -14.069 1.0 26.16 9 A 1 -ATOM 285 C CB . LYS A1 1 19 ? 17.534 21.173 -16.056 1.0 26.87 9 A 1 -ATOM 286 C CG . LYS A1 1 19 ? 19.016 21.383 -16.439 1.0 30.45 9 A 1 -ATOM 287 C CD . LYS A1 1 19 ? 19.242 21.46 -17.915 1.0 34.83 9 A 1 -ATOM 288 C CE . LYS A1 1 19 ? 20.715 21.78 -18.239 1.0 46.24 9 A 1 -ATOM 289 H H . LYS A1 1 19 ? 18.131 19.592 -14.289 1.0 34.74 9 A 1 -ATOM 290 H HA . LYS A1 1 19 ? 17.707 22.189 -14.303 1.0 33.14 9 A 1 -ATOM 291 H HB2 . LYS A1 1 19 ? 17.282 20.271 -16.31 1.0 32.24 9 A 1 -ATOM 292 H HB3 . LYS A1 1 19 ? 17.002 21.817 -16.549 1.0 32.24 9 A 1 -ATOM 293 H HG2 . LYS A1 1 19 ? 19.328 22.214 -16.047 1.0 36.53 9 A 1 -ATOM 294 H HG3 . LYS A1 1 19 ? 19.537 20.639 -16.098 1.0 36.53 9 A 1 -ATOM 295 H HD2 . LYS A1 1 19 ? 19.018 20.608 -18.32 1.0 41.79 9 A 1 -ATOM 296 H HD3 . LYS A1 1 19 ? 18.687 22.162 -18.289 1.0 41.79 9 A 1 -ATOM 297 N N . LEU A1 1 20 ? 15.082 20.398 -14.04 1.0 22.9 10 A 1 -ATOM 298 C CA . LEU A1 1 20 ? 13.655 20.477 -13.678 1.0 23.21 10 A 1 -ATOM 299 C C . LEU A1 1 20 ? 13.502 21.062 -12.281 1.0 23.54 10 A 1 -ATOM 300 O O . LEU A1 1 20 ? 12.613 21.888 -12.046 1.0 28.3 10 A 1 -ATOM 301 C CB . LEU A1 1 20 ? 13.004 19.094 -13.776 1.0 21.14 10 A 1 -ATOM 302 C CG . LEU A1 1 20 ? 12.88 18.566 -15.2 1.0 21.97 10 A 1 -ATOM 303 C CD1 . LEU A1 1 20 ? 12.384 17.125 -15.134 1.0 21.62 10 A 1 -ATOM 304 C CD2 . LEU A1 1 20 ? 11.98 19.399 -16.042 1.0 25.63 10 A 1 -ATOM 305 H H . LEU A1 1 20 ? 15.391 19.598 -14.108 1.0 27.48 10 A 1 -ATOM 306 H HA . LEU A1 1 20 ? 13.191 21.053 -14.306 1.0 27.85 10 A 1 -ATOM 307 H HB2 . LEU A1 1 20 ? 13.54 18.462 -13.271 1.0 25.37 10 A 1 -ATOM 308 H HB3 . LEU A1 1 20 ? 12.11 19.145 -13.4 1.0 25.37 10 A 1 -ATOM 309 H HG . LEU A1 1 20 ? 13.748 18.601 -15.632 1.0 26.37 10 A 1 -ATOM 310 H HD11 . LEU A1 1 20 ? 12.316 16.773 -16.035 1.0 25.94 10 A 1 -ATOM 311 H HD12 . LEU A1 1 20 ? 13.015 16.598 -14.619 1.0 25.94 10 A 1 -ATOM 312 H HD13 . LEU A1 1 20 ? 11.514 17.11 -14.706 1.0 25.94 10 A 1 -ATOM 313 H HD21 . LEU A1 1 20 ? 11.78 18.919 -16.861 1.0 30.75 10 A 1 -ATOM 314 H HD22 . LEU A1 1 20 ? 11.161 19.573 -15.552 1.0 30.75 10 A 1 -ATOM 315 H HD23 . LEU A1 1 20 ? 12.425 20.235 -16.249 1.0 30.75 10 A 1 -ATOM 316 N N . GLU A1 1 21 ? 14.406 20.681 -11.353 1.0 26.73 11 A 1 -ATOM 317 C CA . GLU A1 1 21 ? 14.338 21.168 -9.979 1.0 31.03 11 A 1 -ATOM 318 C C . GLU A1 1 21 ? 14.664 22.651 -9.907 1.0 33.81 11 A 1 -ATOM 319 O O . GLU A1 1 21 ? 14.092 23.367 -9.081 1.0 35.52 11 A 1 -ATOM 320 C CB . GLU A1 1 21 ? 15.285 20.356 -9.099 1.0 38.79 11 A 1 -ATOM 321 C CG . GLU A1 1 21 ? 14.8 20.202 -7.664 1.0 47.09 11 A 1 -ATOM 322 C CD . GLU A1 1 21 ? 15.923 19.896 -6.695 1.0 113.55 11 A 1 -ATOM 323 O OE1 . GLU A1 1 21 ? 16.0 20.565 -5.637 1.0 76.71 11 A 1 -ATOM 324 O OE2 . GLU A1 1 21 ? 16.733 18.992 -6.999 1.0 123.52 11 A 1 -ATOM 325 H H . GLU A1 1 21 ? 15.061 20.144 -11.502 1.0 32.08 11 A 1 -ATOM 326 H HA . GLU A1 1 21 ? 13.439 21.046 -9.635 1.0 37.24 11 A 1 -ATOM 327 H HB2 . GLU A1 1 21 ? 15.379 19.468 -9.478 1.0 46.55 11 A 1 -ATOM 328 H HB3 . GLU A1 1 21 ? 16.147 20.799 -9.075 1.0 46.55 11 A 1 -ATOM 329 H HG2 . GLU A1 1 21 ? 14.378 21.029 -7.382 1.0 56.51 11 A 1 -ATOM 330 H HG3 . GLU A1 1 21 ? 14.161 19.473 -7.622 1.0 56.51 11 A 1 -ATOM 331 N N . ARG A1 1 22 ? 15.541 23.129 -10.782 1.0 33.16 12 A 1 -ATOM 332 C CA . ARG A1 1 22 ? 15.856 24.545 -10.942 1.0 36.15 12 A 1 -ATOM 333 C C . ARG A1 1 22 ? 14.873 25.262 -11.858 1.0 31.75 12 A 1 -ATOM 334 O O . ARG A1 1 22 ? 15.021 26.47 -12.106 1.0 35.07 12 A 1 -ATOM 335 C CB . ARG A1 1 22 ? 17.29 24.717 -11.479 1.0 34.0 12 A 1 -ATOM 336 C CG . ARG A1 1 22 ? 18.347 24.519 -10.402 1.0 65.65 12 A 1 -ATOM 337 C CD . ARG A1 1 22 ? 19.745 24.786 -10.939 1.0 52.58 12 A 1 -ATOM 338 N NE . ARG A1 1 22 ? 19.949 24.136 -12.225 1.0 47.82 12 A 1 -ATOM 339 C CZ . ARG A1 1 22 ? 21.088 24.152 -12.904 1.0 90.47 12 A 1 -ATOM 340 N NH1 . ARG A1 1 22 ? 22.139 24.8 -12.422 1.0 100.68 12 A 1 -ATOM 341 N NH2 . ARG A1 1 22 ? 21.178 23.52 -14.067 1.0 62.28 12 A 1 -ATOM 342 H H . ARG A1 1 22 ? 15.99 22.63 -11.32 1.0 39.8 12 A 1 -ATOM 343 H HA . ARG A1 1 22 ? 15.82 24.971 -10.072 1.0 43.38 12 A 1 -ATOM 344 H HB2 . ARG A1 1 22 ? 17.447 24.063 -12.178 1.0 40.8 12 A 1 -ATOM 345 H HB3 . ARG A1 1 22 ? 17.389 25.614 -11.836 1.0 40.8 12 A 1 -ATOM 346 H HG2 . ARG A1 1 22 ? 18.179 25.132 -9.67 1.0 78.78 12 A 1 -ATOM 347 H HG3 . ARG A1 1 22 ? 18.313 23.603 -10.083 1.0 78.78 12 A 1 -ATOM 348 H HD2 . ARG A1 1 22 ? 19.868 25.741 -11.056 1.0 63.09 12 A 1 -ATOM 349 H HD3 . ARG A1 1 22 ? 20.402 24.441 -10.314 1.0 63.09 12 A 1 -ATOM 350 H HE . ARG A1 1 22 ? 19.285 23.711 -12.568 1.0 57.38 12 A 1 -ATOM 351 H HH11 . ARG A1 1 22 ? 22.082 25.21 -11.668 1.0 120.82 12 A 1 -ATOM 352 H HH12 . ARG A1 1 22 ? 22.877 24.811 -12.863 1.0 120.82 12 A 1 -ATOM 353 H HH21 . ARG A1 1 22 ? 20.497 23.099 -14.381 1.0 74.73 12 A 1 -ATOM 354 H HH22 . ARG A1 1 22 ? 21.917 23.531 -14.507 1.0 74.73 12 A 1 -ATOM 355 N N . ARG A1 1 23 ? 13.876 24.557 -12.364 1.0 28.77 13 A 1 -ATOM 356 C CA . ARG A1 1 23 ? 12.812 25.158 -13.155 1.0 30.18 13 A 1 -ATOM 357 C C . ARG A1 1 23 ? 13.321 25.773 -14.454 1.0 28.29 13 A 1 -ATOM 358 O O . ARG A1 1 23 ? 12.854 26.824 -14.893 1.0 34.96 13 A 1 -ATOM 359 C CB . ARG A1 1 23 ? 11.983 26.11 -12.295 1.0 29.75 13 A 1 -ATOM 360 C CG . ARG A1 1 23 ? 11.456 25.385 -11.033 1.0 31.48 13 A 1 -ATOM 361 C CD . ARG A1 1 23 ? 10.403 26.141 -10.278 1.0 36.0 13 A 1 -ATOM 362 N NE . ARG A1 1 23 ? 9.186 26.295 -11.055 1.0 31.74 13 A 1 -ATOM 363 C CZ . ARG A1 1 23 ? 8.266 25.348 -11.216 1.0 28.16 13 A 1 -ATOM 364 N NH1 . ARG A1 1 23 ? 8.419 24.148 -10.689 1.0 23.79 13 A 1 -ATOM 365 N NH2 . ARG A1 1 23 ? 7.189 25.656 -11.936 1.0 25.67 13 A 1 -ATOM 366 H H . ARG A1 1 23 ? 13.788 23.708 -12.261 1.0 34.52 13 A 1 -ATOM 367 H HA . ARG A1 1 23 ? 12.209 24.461 -13.457 1.0 36.22 13 A 1 -ATOM 368 H HB2 . ARG A1 1 23 ? 12.535 26.857 -12.015 1.0 35.71 13 A 1 -ATOM 369 H HB3 . ARG A1 1 23 ? 11.225 26.431 -12.807 1.0 35.71 13 A 1 -ATOM 370 H HG2 . ARG A1 1 23 ? 11.071 24.536 -11.301 1.0 37.78 13 A 1 -ATOM 371 H HG3 . ARG A1 1 23 ? 12.199 25.235 -10.428 1.0 37.78 13 A 1 -ATOM 372 H HD2 . ARG A1 1 23 ? 10.185 25.66 -9.464 1.0 43.2 13 A 1 -ATOM 373 H HD3 . ARG A1 1 23 ? 10.738 27.025 -10.061 1.0 43.2 13 A 1 -ATOM 374 H HE . ARG A1 1 23 ? 9.05 27.052 -11.438 1.0 38.08 13 A 1 -ATOM 375 H HH11 . ARG A1 1 23 ? 9.124 23.966 -10.232 1.0 28.54 13 A 1 -ATOM 376 H HH12 . ARG A1 1 23 ? 7.814 23.548 -10.804 1.0 28.54 13 A 1 -ATOM 377 H HH21 . ARG A1 1 23 ? 7.109 26.442 -12.276 1.0 30.8 13 A 1 -ATOM 378 H HH22 . ARG A1 1 23 ? 6.573 25.068 -12.061 1.0 30.8 13 A 1 -ATOM 379 N N . GLU A1 1 24 ? 14.301 25.103 -15.074 1.0 29.75 14 A 1 -ATOM 380 C CA . GLU A1 1 24 ? 14.852 25.506 -16.372 1.0 30.25 14 A 1 -ATOM 381 C C . GLU A1 1 24 ? 14.151 24.672 -17.438 1.0 37.12 14 A 1 -ATOM 382 O O . GLU A1 1 24 ? 14.655 23.64 -17.883 1.0 36.14 14 A 1 -ATOM 383 C CB . GLU A1 1 24 ? 16.361 25.288 -16.372 1.0 37.31 14 A 1 -ATOM 384 C CG . GLU A1 1 24 ? 17.069 26.077 -15.286 1.0 55.06 14 A 1 -ATOM 385 C CD . GLU A1 1 24 ? 18.576 25.898 -15.313 1.0 75.5 14 A 1 -ATOM 386 O OE1 . GLU A1 1 24 ? 19.22 26.14 -14.27 1.0 59.69 14 A 1 -ATOM 387 O OE2 . GLU A1 1 24 ? 19.11 25.52 -16.378 1.0 62.03 14 A 1 -ATOM 388 H H . GLU A1 1 24 ? 14.671 24.395 -14.754 1.0 35.7 14 A 1 -ATOM 389 H HA . GLU A1 1 24 ? 14.668 26.442 -16.55 1.0 36.3 14 A 1 -ATOM 390 H HB2 . GLU A1 1 24 ? 16.543 24.347 -16.227 1.0 44.77 14 A 1 -ATOM 391 H HB3 . GLU A1 1 24 ? 16.72 25.567 -17.228 1.0 44.77 14 A 1 -ATOM 392 H HG2 . GLU A1 1 24 ? 16.878 27.02 -15.405 1.0 66.07 14 A 1 -ATOM 393 H HG3 . GLU A1 1 24 ? 16.748 25.78 -14.42 1.0 66.07 14 A 1 -ATOM 394 N N . PHE A1 1 25 ? 12.984 25.149 -17.871 1.0 29.91 15 A 1 -ATOM 395 C CA . PHE A1 1 25 ? 12.045 24.338 -18.643 1.0 31.37 15 A 1 -ATOM 396 C C . PHE A1 1 25 ? 12.225 24.54 -20.148 1.0 43.89 15 A 1 -ATOM 397 O O . PHE A1 1 25 ? 11.305 24.878 -20.885 1.0 37.04 15 A 1 -ATOM 398 C CB . PHE A1 1 25 ? 10.62 24.682 -18.23 1.0 32.95 15 A 1 -ATOM 399 C CG . PHE A1 1 25 ? 10.313 24.398 -16.801 1.0 27.88 15 A 1 -ATOM 400 C CD1 . PHE A1 1 25 ? 10.635 23.183 -16.237 1.0 25.35 15 A 1 -ATOM 401 C CD2 . PHE A1 1 25 ? 9.696 25.361 -16.03 1.0 26.83 15 A 1 -ATOM 402 C CE1 . PHE A1 1 25 ? 10.312 22.924 -14.904 1.0 24.53 15 A 1 -ATOM 403 C CE2 . PHE A1 1 25 ? 9.368 25.099 -14.719 1.0 28.82 15 A 1 -ATOM 404 C CZ . PHE A1 1 25 ? 9.674 23.895 -14.166 1.0 26.67 15 A 1 -ATOM 405 H H . PHE A1 1 25 ? 12.709 25.951 -17.727 1.0 35.89 15 A 1 -ATOM 406 H HA . PHE A1 1 25 ? 12.226 23.405 -18.449 1.0 37.64 15 A 1 -ATOM 407 H HB2 . PHE A1 1 25 ? 10.474 25.629 -18.38 1.0 39.54 15 A 1 -ATOM 408 H HB3 . PHE A1 1 25 ? 10.006 24.162 -18.772 1.0 39.54 15 A 1 -ATOM 409 H HD1 . PHE A1 1 25 ? 11.068 22.535 -16.745 1.0 30.42 15 A 1 -ATOM 410 H HD2 . PHE A1 1 25 ? 9.501 26.192 -16.399 1.0 32.19 15 A 1 -ATOM 411 H HE1 . PHE A1 1 25 ? 10.526 22.105 -14.518 1.0 29.43 15 A 1 -ATOM 412 H HE2 . PHE A1 1 25 ? 8.937 25.747 -14.21 1.0 34.59 15 A 1 -ATOM 413 H HZ . PHE A1 1 25 ? 9.449 23.725 -13.28 1.0 32.0 15 A 1 -ATOM 414 N N . THR A1 1 26 ? 13.431 24.294 -20.616 1.0 30.38 16 A 1 -ATOM 415 C CA . THR A1 1 26 ? 13.648 24.448 -22.042 1.0 32.36 16 A 1 -ATOM 416 C C . THR A1 1 26 ? 13.02 23.277 -22.796 1.0 33.72 16 A 1 -ATOM 417 O O . THR A1 1 26 ? 12.801 22.19 -22.266 1.0 28.55 16 A 1 -ATOM 418 C CB . THR A1 1 26 ? 15.145 24.465 -22.341 1.0 34.49 16 A 1 -ATOM 419 O OG1 . THR A1 1 26 ? 15.694 23.186 -22.035 1.0 31.37 16 A 1 -ATOM 420 C CG2 . THR A1 1 26 ? 15.864 25.552 -21.51 1.0 32.53 16 A 1 -ATOM 421 H H . THR A1 1 26 ? 14.111 24.047 -20.152 1.0 36.46 16 A 1 -ATOM 422 H HA . THR A1 1 26 ? 13.249 25.279 -22.343 1.0 38.83 16 A 1 -ATOM 423 H HB . THR A1 1 26 ? 15.288 24.668 -23.279 1.0 41.39 16 A 1 -ATOM 424 H HG1 . THR A1 1 26 ? 16.518 23.181 -22.198 1.0 37.64 16 A 1 -ATOM 425 H HG21 . THR A1 1 26 ? 16.796 25.608 -21.772 1.0 39.03 16 A 1 -ATOM 426 H HG22 . THR A1 1 26 ? 15.443 26.414 -21.657 1.0 39.03 16 A 1 -ATOM 427 H HG23 . THR A1 1 26 ? 15.815 25.335 -20.566 1.0 39.03 16 A 1 -ATOM 428 N N . ARG A1 1 27 ? 12.747 23.508 -24.068 1.0 31.58 17 A 1 -ATOM 429 C CA A ARG A1 1 27 ? 12.212 22.459 -24.922 0.49 27.64 17 A 1 -ATOM 430 C CA B ARG A1 1 27 ? 12.204 22.452 -24.909 0.51 29.49 17 A 1 -ATOM 431 C C . ARG A1 1 27 ? 13.095 21.215 -24.903 1.0 27.78 17 A 1 -ATOM 432 O O . ARG A1 1 27 ? 12.594 20.092 -24.812 1.0 26.63 17 A 1 -ATOM 433 C CB A ARG A1 1 27 ? 12.067 23.001 -26.337 0.49 33.87 17 A 1 -ATOM 434 C CB B ARG A1 1 27 ? 12.019 22.98 -26.32 0.51 28.14 17 A 1 -ATOM 435 C CG A ARG A1 1 27 ? 11.523 22.013 -27.301 0.49 35.32 17 A 1 -ATOM 436 C CG B ARG A1 1 27 ? 11.441 22.012 -27.306 0.51 33.9 17 A 1 -ATOM 437 C CD A ARG A1 1 27 ? 11.298 22.615 -28.673 0.49 30.48 17 A 1 -ATOM 438 C CD B ARG A1 1 27 ? 11.31 22.699 -28.66 0.51 29.86 17 A 1 -ATOM 439 N NE A ARG A1 1 27 ? 10.367 21.753 -29.392 0.49 40.81 17 A 1 -ATOM 440 N NE B ARG A1 1 27 ? 10.668 24.012 -28.511 0.51 40.51 17 A 1 -ATOM 441 C CZ A ARG A1 1 27 ? 9.056 21.753 -29.202 0.49 27.42 17 A 1 -ATOM 442 C CZ B ARG A1 1 27 ? 9.359 24.232 -28.536 0.51 37.42 17 A 1 -ATOM 443 N NH1 A ARG A1 1 27 ? 8.491 22.589 -28.344 0.49 50.28 17 A 1 -ATOM 444 N NH1 B ARG A1 1 27 ? 8.51 23.234 -28.701 0.51 28.71 17 A 1 -ATOM 445 N NH2 A ARG A1 1 27 ? 8.291 20.919 -29.895 0.49 50.98 17 A 1 -ATOM 446 N NH2 B ARG A1 1 27 ? 8.888 25.461 -28.386 0.51 51.63 17 A 1 -ATOM 447 H H A ARG A1 1 27 ? 12.862 24.263 -24.464 0.49 37.9 17 A 1 -ATOM 448 H H B ARG A1 1 27 ? 12.865 24.26 -24.468 0.51 37.9 17 A 1 -ATOM 449 H HA A ARG A1 1 27 ? 11.336 22.193 -24.6 0.49 33.17 17 A 1 -ATOM 450 H HA B ARG A1 1 27 ? 11.337 22.183 -24.566 0.51 35.38 17 A 1 -ATOM 451 H HB2 A ARG A1 1 27 ? 11.465 23.761 -26.319 0.49 40.64 17 A 1 -ATOM 452 H HB2 B ARG A1 1 27 ? 11.422 23.744 -26.283 0.51 33.76 17 A 1 -ATOM 453 H HB3 A ARG A1 1 27 ? 12.941 23.277 -26.656 0.49 40.64 17 A 1 -ATOM 454 H HB3 B ARG A1 1 27 ? 12.886 23.253 -26.659 0.51 33.76 17 A 1 -ATOM 455 H HG2 A ARG A1 1 27 ? 12.151 21.279 -27.393 0.49 42.39 17 A 1 -ATOM 456 H HG2 B ARG A1 1 27 ? 12.027 21.245 -27.398 0.51 40.69 17 A 1 -ATOM 457 H HG3 A ARG A1 1 27 ? 10.673 21.682 -26.973 0.49 42.39 17 A 1 -ATOM 458 H HG3 B ARG A1 1 27 ? 10.562 21.726 -27.012 0.51 40.69 17 A 1 -ATOM 459 H HD2 A ARG A1 1 27 ? 10.914 23.502 -28.591 0.49 36.58 17 A 1 -ATOM 460 H HD2 B ARG A1 1 27 ? 12.191 22.828 -29.045 0.51 35.83 17 A 1 -ATOM 461 H HD3 A ARG A1 1 27 ? 12.135 22.659 -29.161 0.49 36.58 17 A 1 -ATOM 462 H HD3 B ARG A1 1 27 ? 10.767 22.154 -29.25 0.51 35.83 17 A 1 -ATOM 463 H HE A ARG A1 1 27 ? 10.689 21.212 -29.977 0.49 48.98 17 A 1 -ATOM 464 H HE B ARG A1 1 27 ? 11.181 24.693 -28.398 0.51 48.61 17 A 1 -ATOM 465 H HH11 A ARG A1 1 27 ? 8.977 23.144 -27.901 0.49 60.33 17 A 1 -ATOM 466 H HH11 B ARG A1 1 27 ? 8.803 22.431 -28.793 0.51 34.45 17 A 1 -ATOM 467 H HH12 A ARG A1 1 27 ? 7.639 22.578 -28.231 0.49 60.33 17 A 1 -ATOM 468 H HH12 B ARG A1 1 27 ? 7.664 23.387 -28.716 0.51 34.45 17 A 1 -ATOM 469 H HH21 A ARG A1 1 27 ? 8.646 20.382 -30.465 0.49 61.18 17 A 1 -ATOM 470 H HH21 B ARG A1 1 27 ? 9.43 26.119 -28.272 0.51 61.96 17 A 1 -ATOM 471 H HH22 A ARG A1 1 27 ? 7.439 20.916 -29.774 0.49 61.18 17 A 1 -ATOM 472 H HH22 B ARG A1 1 27 ? 8.039 25.601 -28.403 0.51 61.96 17 A 1 -ATOM 473 N N . GLU A1 1 28 ? 14.423 21.394 -24.97 1.0 25.58 18 A 1 -ATOM 474 C CA . GLU A1 1 28 ? 15.316 20.246 -24.962 1.0 23.71 18 A 1 -ATOM 475 C C . GLU A1 1 28 ? 15.21 19.458 -23.658 1.0 24.71 18 A 1 -ATOM 476 O O . GLU A1 1 28 ? 15.336 18.228 -23.664 1.0 23.24 18 A 1 -ATOM 477 C CB . GLU A1 1 28 ? 16.765 20.74 -25.202 1.0 31.32 18 A 1 -ATOM 478 C CG . GLU A1 1 28 ? 17.836 20.084 -24.469 1.0 43.13 18 A 1 -ATOM 479 C CD . GLU A1 1 28 ? 19.199 20.645 -24.833 1.0 91.85 18 A 1 -ATOM 480 O OE1 . GLU A1 1 28 ? 19.575 20.56 -26.019 1.0 50.29 18 A 1 -ATOM 481 O OE2 . GLU A1 1 28 ? 19.878 21.202 -23.944 1.0 38.35 18 A 1 -ATOM 482 H H . GLU A1 1 28 ? 14.817 22.156 -25.02 1.0 30.69 18 A 1 -ATOM 483 H HA . GLU A1 1 28 ? 15.072 19.638 -25.677 1.0 28.45 18 A 1 -ATOM 484 H HB2 . GLU A1 1 28 ? 16.963 20.628 -26.145 1.0 37.58 18 A 1 -ATOM 485 H HB3 . GLU A1 1 28 ? 16.8 21.68 -24.965 1.0 37.58 18 A 1 -ATOM 486 H HG2 . GLU A1 1 28 ? 17.698 20.215 -23.518 1.0 51.75 18 A 1 -ATOM 487 H HG3 . GLU A1 1 28 ? 17.832 19.137 -24.678 1.0 51.75 18 A 1 -ATOM 488 N N . VAL A1 1 29 ? 15.029 20.147 -22.542 1.0 23.29 19 A 1 -ATOM 489 C CA . VAL A1 1 29 ? 14.929 19.465 -21.259 1.0 20.86 19 A 1 -ATOM 490 C C . VAL A1 1 29 ? 13.63 18.67 -21.21 1.0 21.02 19 A 1 -ATOM 491 O O . VAL A1 1 29 ? 13.625 17.52 -20.758 1.0 20.8 19 A 1 -ATOM 492 C CB . VAL A1 1 29 ? 14.993 20.484 -20.108 1.0 25.38 19 A 1 -ATOM 493 C CG1 . VAL A1 1 29 ? 14.536 19.872 -18.786 1.0 27.16 19 A 1 -ATOM 494 C CG2 . VAL A1 1 29 ? 16.42 21.008 -19.937 1.0 29.05 19 A 1 -ATOM 495 H H . VAL A1 1 29 ? 14.962 21.003 -22.498 1.0 27.95 19 A 1 -ATOM 496 H HA . VAL A1 1 29 ? 15.678 18.856 -21.164 1.0 25.03 19 A 1 -ATOM 497 H HB . VAL A1 1 29 ? 14.397 21.215 -20.335 1.0 30.46 19 A 1 -ATOM 498 H HG11 . VAL A1 1 29 ? 14.836 20.436 -18.057 1.0 32.59 19 A 1 -ATOM 499 H HG12 . VAL A1 1 29 ? 13.567 19.815 -18.783 1.0 32.59 19 A 1 -ATOM 500 H HG13 . VAL A1 1 29 ? 14.92 18.985 -18.699 1.0 32.59 19 A 1 -ATOM 501 H HG21 . VAL A1 1 29 ? 16.417 21.724 -19.283 1.0 34.86 19 A 1 -ATOM 502 H HG22 . VAL A1 1 29 ? 16.988 20.283 -19.631 1.0 34.86 19 A 1 -ATOM 503 H HG23 . VAL A1 1 29 ? 16.739 21.34 -20.79 1.0 34.86 19 A 1 -ATOM 504 N N . LEU A1 1 30 ? 12.518 19.275 -21.626 1.0 20.54 20 A 1 -ATOM 505 C CA . LEU A1 1 30 ? 11.23 18.564 -21.591 1.0 18.48 20 A 1 -ATOM 506 C C . LEU A1 1 30 ? 11.252 17.389 -22.535 1.0 20.92 20 A 1 -ATOM 507 O O . LEU A1 1 30 ? 10.788 16.299 -22.191 1.0 20.51 20 A 1 -ATOM 508 C CB . LEU A1 1 30 ? 10.074 19.497 -21.916 1.0 21.21 20 A 1 -ATOM 509 C CG . LEU A1 1 30 ? 9.919 20.644 -20.896 1.0 22.17 20 A 1 -ATOM 510 C CD1 . LEU A1 1 30 ? 8.867 21.616 -21.385 1.0 25.03 20 A 1 -ATOM 511 C CD2 . LEU A1 1 30 ? 9.601 20.17 -19.521 1.0 21.75 20 A 1 -ATOM 512 H H . LEU A1 1 30 ? 12.476 20.079 -21.927 1.0 24.65 20 A 1 -ATOM 513 H HA . LEU A1 1 30 ? 11.081 18.239 -20.689 1.0 22.17 20 A 1 -ATOM 514 H HB2 . LEU A1 1 30 ? 10.224 19.891 -22.789 1.0 25.45 20 A 1 -ATOM 515 H HB3 . LEU A1 1 30 ? 9.249 18.986 -21.92 1.0 25.45 20 A 1 -ATOM 516 H HG . LEU A1 1 30 ? 10.774 21.096 -20.826 1.0 26.61 20 A 1 -ATOM 517 H HD11 . LEU A1 1 30 ? 8.789 22.343 -20.748 1.0 30.04 20 A 1 -ATOM 518 H HD12 . LEU A1 1 30 ? 9.135 21.962 -22.251 1.0 30.04 20 A 1 -ATOM 519 H HD13 . LEU A1 1 30 ? 8.019 21.152 -21.462 1.0 30.04 20 A 1 -ATOM 520 H HD21 . LEU A1 1 30 ? 9.372 20.934 -18.969 1.0 26.1 20 A 1 -ATOM 521 H HD22 . LEU A1 1 30 ? 8.851 19.557 -19.564 1.0 26.1 20 A 1 -ATOM 522 H HD23 . LEU A1 1 30 ? 10.377 19.718 -19.156 1.0 26.1 20 A 1 -ATOM 523 N N . LYS A1 1 31 ? 11.822 17.568 -23.741 1.0 20.08 21 A 1 -ATOM 524 C CA . LYS A1 1 31 ? 11.891 16.469 -24.697 1.0 22.75 21 A 1 -ATOM 525 C C . LYS A1 1 31 ? 12.703 15.321 -24.114 1.0 20.73 21 A 1 -ATOM 526 O O . LYS A1 1 31 ? 12.33 14.153 -24.259 1.0 21.91 21 A 1 -ATOM 527 C CB . LYS A1 1 31 ? 12.492 16.945 -26.007 1.0 24.5 21 A 1 -ATOM 528 C CG . LYS A1 1 31 ? 12.534 15.815 -27.054 1.0 24.43 21 A 1 -ATOM 529 C CD . LYS A1 1 31 ? 12.945 16.317 -28.405 1.0 29.93 21 A 1 -ATOM 530 C CE . LYS A1 1 31 ? 12.823 15.211 -29.456 1.0 39.81 21 A 1 -ATOM 531 N NZ . LYS A1 1 31 ? 13.085 15.723 -30.824 1.0 67.35 21 A 1 -ATOM 532 H H . LYS A1 1 31 ? 12.167 18.305 -24.018 1.0 24.09 21 A 1 -ATOM 533 H HA . LYS A1 1 31 ? 10.995 16.151 -24.89 1.0 27.3 21 A 1 -ATOM 534 H HB2 . LYS A1 1 31 ? 11.954 17.671 -26.361 1.0 29.41 21 A 1 -ATOM 535 H HB3 . LYS A1 1 31 ? 13.4 17.251 -25.85 1.0 29.41 21 A 1 -ATOM 536 H HG2 . LYS A1 1 31 ? 13.175 15.143 -26.773 1.0 29.31 21 A 1 -ATOM 537 H HG3 . LYS A1 1 31 ? 11.652 15.42 -27.133 1.0 29.31 21 A 1 -ATOM 538 H HD2 . LYS A1 1 31 ? 12.369 17.053 -28.665 1.0 35.92 21 A 1 -ATOM 539 H HD3 . LYS A1 1 31 ? 13.868 16.612 -28.374 1.0 35.92 21 A 1 -ATOM 540 H HE2 . LYS A1 1 31 ? 13.47 14.513 -29.264 1.0 47.77 21 A 1 -ATOM 541 H HE3 . LYS A1 1 31 ? 11.925 14.845 -29.435 1.0 47.77 21 A 1 -ATOM 542 H HZ1 . LYS A1 1 31 ? 13.907 16.061 -30.87 1.0 80.82 21 A 1 -ATOM 543 H HZ2 . LYS A1 1 31 ? 13.011 15.062 -31.416 1.0 80.82 21 A 1 -ATOM 544 H HZ3 . LYS A1 1 31 ? 12.498 16.36 -31.028 1.0 80.82 21 A 1 -ATOM 545 N N . GLU A1 1 32 ? 13.846 15.627 -23.534 1.0 22.47 22 A 1 -ATOM 546 C CA . GLU A1 1 32 ? 14.656 14.555 -22.993 1.0 21.67 22 A 1 -ATOM 547 C C . GLU A1 1 32 ? 13.976 13.863 -21.827 1.0 23.52 22 A 1 -ATOM 548 O O . GLU A1 1 32 ? 14.02 12.625 -21.727 1.0 22.53 22 A 1 -ATOM 549 C CB . GLU A1 1 32 ? 16.036 15.092 -22.632 1.0 25.44 22 A 1 -ATOM 550 C CG . GLU A1 1 32 ? 17.048 14.007 -22.224 1.0 41.87 22 A 1 -ATOM 551 C CD . GLU A1 1 32 ? 17.422 13.041 -23.35 1.0 55.28 22 A 1 -ATOM 552 O OE1 . GLU A1 1 32 ? 17.113 13.313 -24.532 1.0 43.92 22 A 1 -ATOM 553 O OE2 . GLU A1 1 32 ? 18.03 11.993 -23.047 1.0 55.49 22 A 1 -ATOM 554 H H . GLU A1 1 32 ? 14.166 16.42 -23.442 1.0 26.96 22 A 1 -ATOM 555 H HA . GLU A1 1 32 ? 14.782 13.872 -23.671 1.0 26.0 22 A 1 -ATOM 556 H HB2 . GLU A1 1 32 ? 16.399 15.558 -23.401 1.0 30.53 22 A 1 -ATOM 557 H HB3 . GLU A1 1 32 ? 15.945 15.704 -21.885 1.0 30.53 22 A 1 -ATOM 558 H HG2 . GLU A1 1 32 ? 17.864 14.439 -21.926 1.0 50.25 22 A 1 -ATOM 559 H HG3 . GLU A1 1 32 ? 16.668 13.483 -21.502 1.0 50.25 22 A 1 -ATOM 560 N N . ALA A1 1 33 ? 13.316 14.619 -20.952 1.0 21.62 23 A 1 -ATOM 561 C CA . ALA A1 1 33 ? 12.579 13.96 -19.868 1.0 20.66 23 A 1 -ATOM 562 C C . ALA A1 1 33 ? 11.541 13.001 -20.415 1.0 20.32 23 A 1 -ATOM 563 O O . ALA A1 1 33 ? 11.352 11.9 -19.872 1.0 20.89 23 A 1 -ATOM 564 C CB . ALA A1 1 33 ? 11.913 15.015 -18.992 1.0 20.29 23 A 1 -ATOM 565 H H . ALA A1 1 33 ? 13.279 15.478 -20.959 1.0 25.94 23 A 1 -ATOM 566 H HA . ALA A1 1 33 ? 13.201 13.452 -19.324 1.0 24.8 23 A 1 -ATOM 567 H HB1 . ALA A1 1 33 ? 11.439 14.573 -18.271 1.0 24.34 23 A 1 -ATOM 568 H HB2 . ALA A1 1 33 ? 12.596 15.601 -18.629 1.0 24.34 23 A 1 -ATOM 569 H HB3 . ALA A1 1 33 ? 11.291 15.528 -19.532 1.0 24.34 23 A 1 -ATOM 570 N N . LEU A1 1 34 ? 10.823 13.385 -21.472 1.0 19.65 24 A 1 -ATOM 571 C CA . LEU A1 1 34 ? 9.819 12.504 -22.027 1.0 19.87 24 A 1 -ATOM 572 C C . LEU A1 1 34 ? 10.444 11.334 -22.764 1.0 23.35 24 A 1 -ATOM 573 O O . LEU A1 1 34 ? 9.808 10.279 -22.85 1.0 30.44 24 A 1 -ATOM 574 C CB . LEU A1 1 34 ? 8.904 13.267 -22.973 1.0 20.15 24 A 1 -ATOM 575 C CG . LEU A1 1 34 ? 7.957 14.222 -22.258 1.0 19.98 24 A 1 -ATOM 576 C CD1 . LEU A1 1 34 ? 7.296 15.094 -23.31 1.0 20.6 24 A 1 -ATOM 577 C CD2 . LEU A1 1 34 ? 6.885 13.497 -21.458 1.0 20.32 24 A 1 -ATOM 578 H H . LEU A1 1 34 ? 10.902 14.141 -21.874 1.0 23.58 24 A 1 -ATOM 579 H HA . LEU A1 1 34 ? 9.274 12.159 -21.302 1.0 23.84 24 A 1 -ATOM 580 H HB2 . LEU A1 1 34 ? 9.449 13.788 -23.583 1.0 24.18 24 A 1 -ATOM 581 H HB3 . LEU A1 1 34 ? 8.366 12.63 -23.469 1.0 24.18 24 A 1 -ATOM 582 H HG . LEU A1 1 34 ? 8.464 14.752 -21.624 1.0 23.98 24 A 1 -ATOM 583 H HD11 . LEU A1 1 34 ? 6.679 15.702 -22.874 1.0 24.72 24 A 1 -ATOM 584 H HD12 . LEU A1 1 34 ? 7.981 15.597 -23.779 1.0 24.72 24 A 1 -ATOM 585 H HD13 . LEU A1 1 34 ? 6.817 14.527 -23.934 1.0 24.72 24 A 1 -ATOM 586 H HD21 . LEU A1 1 34 ? 6.247 14.147 -21.123 1.0 24.38 24 A 1 -ATOM 587 H HD22 . LEU A1 1 34 ? 6.437 12.859 -22.035 1.0 24.38 24 A 1 -ATOM 588 H HD23 . LEU A1 1 34 ? 7.304 13.033 -20.716 1.0 24.38 24 A 1 -ATOM 589 N N . SER A1 1 35 ? 11.673 11.482 -23.239 1.0 21.38 25 A 1 -ATOM 590 C CA . SER A1 1 35 ? 12.267 10.472 -24.104 1.0 24.3 25 A 1 -ATOM 591 C C . SER A1 1 35 ? 13.031 9.396 -23.341 1.0 26.21 25 A 1 -ATOM 592 O O . SER A1 1 35 ? 13.146 8.265 -23.842 1.0 27.79 25 A 1 -ATOM 593 C CB . SER A1 1 35 ? 13.242 11.171 -25.046 1.0 24.27 25 A 1 -ATOM 594 O OG . SER A1 1 35 ? 12.503 12.033 -25.919 1.0 27.22 25 A 1 -ATOM 595 H H . SER A1 1 35 ? 12.182 12.156 -23.076 1.0 25.65 25 A 1 -ATOM 596 H HA . SER A1 1 35 ? 11.566 10.031 -24.608 1.0 29.16 25 A 1 -ATOM 597 H HB2 . SER A1 1 35 ? 13.872 11.697 -24.528 1.0 29.12 25 A 1 -ATOM 598 H HB3 . SER A1 1 35 ? 13.717 10.507 -25.571 1.0 29.12 25 A 1 -ATOM 599 H HG . SER A1 1 35 ? 12.079 12.602 -25.47 1.0 32.66 25 A 1 -ATOM 600 N N . ILE A1 1 36 ? 13.557 9.721 -22.157 1.0 23.3 26 A 1 -ATOM 601 C CA . ILE A1 1 36 ? 14.34 8.76 -21.369 1.0 22.3 26 A 1 -ATOM 602 C C . ILE A1 1 36 ? 13.437 7.616 -20.956 1.0 23.52 26 A 1 -ATOM 603 O O . ILE A1 1 36 ? 12.35 7.834 -20.39 1.0 26.66 26 A 1 -ATOM 604 C CB . ILE A1 1 36 ? 14.943 9.47 -20.155 1.0 22.82 26 A 1 -ATOM 605 C CG1 . ILE A1 1 36 ? 16.013 10.435 -20.584 1.0 23.34 26 A 1 -ATOM 606 C CG2 . ILE A1 1 36 ? 15.45 8.441 -19.128 1.0 26.19 26 A 1 -ATOM 607 C CD1 . ILE A1 1 36 ? 16.522 11.393 -19.509 1.0 31.36 26 A 1 -ATOM 608 H H . ILE A1 1 36 ? 13.476 10.492 -21.785 1.0 27.96 26 A 1 -ATOM 609 H HA . ILE A1 1 36 ? 15.063 8.399 -21.906 1.0 26.76 26 A 1 -ATOM 610 H HB . ILE A1 1 36 ? 14.252 9.993 -19.719 1.0 27.39 26 A 1 -ATOM 611 H HG12 . ILE A1 1 36 ? 16.775 9.922 -20.895 1.0 28.01 26 A 1 -ATOM 612 H HG13 . ILE A1 1 36 ? 15.66 10.977 -21.307 1.0 28.01 26 A 1 -ATOM 613 H HG21 . ILE A1 1 36 ? 16.052 8.882 -18.509 1.0 31.43 26 A 1 -ATOM 614 H HG22 . ILE A1 1 36 ? 14.691 8.074 -18.648 1.0 31.43 26 A 1 -ATOM 615 H HG23 . ILE A1 1 36 ? 15.919 7.732 -19.597 1.0 31.43 26 A 1 -ATOM 616 H HD11 . ILE A1 1 36 ? 17.164 12.001 -19.907 1.0 37.63 26 A 1 -ATOM 617 H HD12 . ILE A1 1 36 ? 15.772 11.892 -19.15 1.0 37.63 26 A 1 -ATOM 618 H HD13 . ILE A1 1 36 ? 16.946 10.88 -18.803 1.0 37.63 26 A 1 -ATOM 619 N N A ASN A1 1 37 ? 13.88 6.367 -21.136 0.48 19.63 27 A 1 -ATOM 620 N N B ASN A1 1 37 ? 13.864 6.4 -21.264 0.52 25.48 27 A 1 -ATOM 621 C CA A ASN A1 1 37 ? 13.048 5.191 -20.839 0.48 28.91 27 A 1 -ATOM 622 C CA B ASN A1 1 37 ? 13.17 5.184 -20.883 0.52 18.22 27 A 1 -ATOM 623 C C A ASN A1 1 37 ? 13.487 4.391 -19.593 0.48 20.77 27 A 1 -ATOM 624 C C B ASN A1 1 37 ? 14.046 4.453 -19.867 0.52 21.31 27 A 1 -ATOM 625 O O A ASN A1 1 37 ? 13.165 3.22 -19.444 0.48 31.28 27 A 1 -ATOM 626 O O B ASN A1 1 37 ? 14.678 3.445 -20.169 0.52 23.33 27 A 1 -ATOM 627 C CB A ASN A1 1 37 ? 12.936 4.27 -22.058 0.48 29.13 27 A 1 -ATOM 628 C CB B ASN A1 1 37 ? 12.89 4.307 -22.124 0.52 29.3 27 A 1 -ATOM 629 C CG A ASN A1 1 37 ? 11.99 4.808 -23.112 0.48 33.75 27 A 1 -ATOM 630 C CG B ASN A1 1 37 ? 11.789 3.263 -21.893 0.52 38.43 27 A 1 -ATOM 631 O OD1 A ASN A1 1 37 ? 11.018 5.502 -22.802 0.48 67.44 27 A 1 -ATOM 632 O OD1 B ASN A1 1 37 ? 11.227 3.135 -20.802 0.52 30.82 27 A 1 -ATOM 633 N ND2 A ASN A1 1 37 ? 12.276 4.496 -24.369 0.48 38.3 27 A 1 -ATOM 634 N ND2 B ASN A1 1 37 ? 11.466 2.521 -22.944 0.52 32.91 27 A 1 -ATOM 635 H H A ASN A1 1 37 ? 14.664 6.173 -21.431 0.48 23.55 27 A 1 -ATOM 636 H H B ASN A1 1 37 ? 14.582 6.25 -21.712 0.52 30.57 27 A 1 -ATOM 637 H HA A ASN A1 1 37 ? 12.164 5.533 -20.633 0.48 34.69 27 A 1 -ATOM 638 H HA B ASN A1 1 37 ? 12.316 5.403 -20.479 0.52 21.86 27 A 1 -ATOM 639 H HB2 A ASN A1 1 37 ? 13.812 4.173 -22.462 0.48 34.95 27 A 1 -ATOM 640 H HB2 B ASN A1 1 37 ? 12.609 4.879 -22.855 0.52 35.16 27 A 1 -ATOM 641 H HB3 A ASN A1 1 37 ? 12.605 3.405 -21.771 0.48 34.95 27 A 1 -ATOM 642 H HB3 B ASN A1 1 37 ? 13.702 3.834 -22.365 0.52 35.16 27 A 1 -ATOM 643 H HD21 A ASN A1 1 37 ? 11.772 4.775 -25.007 0.48 45.96 27 A 1 -ATOM 644 H HD21 B ASN A1 1 37 ? 10.855 1.919 -22.875 0.52 39.49 27 A 1 -ATOM 645 H HD22 A ASN A1 1 37 ? 12.966 4.014 -24.545 0.48 45.96 27 A 1 -ATOM 646 H HD22 B ASN A1 1 37 ? 11.867 2.642 -23.695 0.52 39.49 27 A 1 -ATOM 647 N N . ASP A1 1 38 ? 14.155 5.037 -18.671 1.0 29.93 28 A 1 -ATOM 648 C CA . ASP A1 1 38 ? 14.851 4.398 -17.548 1.0 24.65 28 A 1 -ATOM 649 C C . ASP A1 1 38 ? 13.926 4.458 -16.342 1.0 21.1 28 A 1 -ATOM 650 O O . ASP A1 1 38 ? 13.482 5.546 -15.971 1.0 24.99 28 A 1 -ATOM 651 C CB . ASP A1 1 38 ? 16.175 5.136 -17.341 1.0 24.97 28 A 1 -ATOM 652 C CG . ASP A1 1 38 ? 17.068 4.497 -16.283 1.0 25.15 28 A 1 -ATOM 653 O OD1 . ASP A1 1 38 ? 16.679 4.641 -15.085 1.0 27.41 28 A 1 -ATOM 654 O OD2 . ASP A1 1 38 ? 18.143 3.927 -16.61 1.0 28.08 28 A 1 -ATOM 655 H H A ASP A1 1 38 ? 14.232 5.894 -18.66 0.48 35.92 28 A 1 -ATOM 656 H H B ASP A1 1 38 ? 13.83 5.812 -18.483 0.52 35.92 28 A 1 -ATOM 657 H HA . ASP A1 1 38 ? 15.046 3.459 -17.695 1.0 29.58 28 A 1 -ATOM 658 H HB2 . ASP A1 1 38 ? 16.665 5.141 -18.178 1.0 29.96 28 A 1 -ATOM 659 H HB3 . ASP A1 1 38 ? 15.987 6.045 -17.061 1.0 29.96 28 A 1 -ATOM 660 N N . ARG A1 1 39 ? 13.606 3.296 -15.777 1.0 25.33 29 A 1 -ATOM 661 C CA . ARG A1 1 39 ? 12.703 3.173 -14.627 1.0 29.67 29 A 1 -ATOM 662 C C . ARG A1 1 39 ? 13.128 4.074 -13.466 1.0 21.98 29 A 1 -ATOM 663 O O . ARG A1 1 39 ? 12.301 4.684 -12.789 1.0 21.96 29 A 1 -ATOM 664 C CB . ARG A1 1 39 ? 12.705 1.697 -14.158 1.0 31.35 29 A 1 -ATOM 665 C CG . ARG A1 1 39 ? 11.356 1.081 -13.919 1.0 78.29 29 A 1 -ATOM 666 C CD . ARG A1 1 39 ? 11.266 -0.394 -14.382 1.0 90.52 29 A 1 -ATOM 667 N NE . ARG A1 1 39 ? 12.447 -1.225 -14.099 1.0 47.15 29 A 1 -ATOM 668 C CZ . ARG A1 1 39 ? 13.093 -1.963 -15.009 1.0 57.27 29 A 1 -ATOM 669 N NH1 . ARG A1 1 39 ? 14.149 -2.705 -14.665 1.0 53.54 29 A 1 -ATOM 670 N NH2 . ARG A1 1 39 ? 12.677 -1.996 -16.262 1.0 51.03 29 A 1 -ATOM 671 H H . ARG A1 1 39 ? 13.905 2.536 -16.046 1.0 30.4 29 A 1 -ATOM 672 H HA . ARG A1 1 39 ? 11.81 3.438 -14.896 1.0 35.6 29 A 1 -ATOM 673 H HB2 . ARG A1 1 39 ? 13.148 1.163 -14.837 1.0 37.62 29 A 1 -ATOM 674 H HB3 . ARG A1 1 39 ? 13.196 1.644 -13.323 1.0 37.62 29 A 1 -ATOM 675 H HG2 . ARG A1 1 39 ? 11.162 1.107 -12.969 1.0 93.95 29 A 1 -ATOM 676 H HG3 . ARG A1 1 39 ? 10.688 1.588 -14.408 1.0 93.95 29 A 1 -ATOM 677 H HD2 . ARG A1 1 39 ? 10.51 -0.807 -13.936 1.0 108.63 29 A 1 -ATOM 678 H HD3 . ARG A1 1 39 ? 11.131 -0.404 -15.342 1.0 108.63 29 A 1 -ATOM 679 H HE . ARG A1 1 39 ? 12.743 -1.238 -13.291 1.0 56.58 29 A 1 -ATOM 680 H HH11 . ARG A1 1 39 ? 14.422 -2.712 -13.849 1.0 64.25 29 A 1 -ATOM 681 H HH12 . ARG A1 1 39 ? 14.556 -3.175 -15.258 1.0 64.25 29 A 1 -ATOM 682 H HH21 . ARG A1 1 39 ? 11.987 -1.541 -16.498 1.0 61.24 29 A 1 -ATOM 683 H HH22 . ARG A1 1 39 ? 13.097 -2.472 -16.842 1.0 61.24 29 A 1 -ATOM 684 N N . GLY A1 1 40 ? 14.437 4.185 -13.226 1.0 24.21 30 A 1 -ATOM 685 C CA . GLY A1 1 40 ? 14.889 5.005 -12.107 1.0 23.32 30 A 1 -ATOM 686 C C . GLY A1 1 40 ? 14.827 6.495 -12.359 1.0 21.31 30 A 1 -ATOM 687 O O . GLY A1 1 40 ? 14.447 7.262 -11.455 1.0 22.83 30 A 1 -ATOM 688 H H . GLY A1 1 40 ? 15.061 3.809 -13.682 1.0 29.05 30 A 1 -ATOM 689 H HA2 . GLY A1 1 40 ? 14.336 4.81 -11.334 1.0 27.98 30 A 1 -ATOM 690 H HA3 . GLY A1 1 40 ? 15.809 4.775 -11.903 1.0 27.98 30 A 1 -ATOM 691 N N . PHE A1 1 41 ? 15.061 6.948 -13.602 1.0 19.68 31 A 1 -ATOM 692 C CA . PHE A1 1 41 ? 14.808 8.325 -13.925 1.0 18.52 31 A 1 -ATOM 693 C C . PHE A1 1 41 ? 13.327 8.62 -13.743 1.0 20.45 31 A 1 -ATOM 694 O O . PHE A1 1 41 ? 12.938 9.642 -13.173 1.0 18.84 31 A 1 -ATOM 695 C CB . PHE A1 1 41 ? 15.208 8.64 -15.376 1.0 19.78 31 A 1 -ATOM 696 C CG . PHE A1 1 41 ? 14.752 9.986 -15.814 1.0 19.17 31 A 1 -ATOM 697 C CD1 . PHE A1 1 41 ? 15.511 11.127 -15.489 1.0 20.65 31 A 1 -ATOM 698 C CD2 . PHE A1 1 41 ? 13.553 10.178 -16.488 1.0 19.94 31 A 1 -ATOM 699 C CE1 . PHE A1 1 41 ? 15.062 12.356 -15.823 1.0 22.07 31 A 1 -ATOM 700 C CE2 . PHE A1 1 41 ? 13.118 11.444 -16.862 1.0 19.97 31 A 1 -ATOM 701 C CZ . PHE A1 1 41 ? 13.86 12.531 -16.507 1.0 21.88 31 A 1 -ATOM 702 H H . PHE A1 1 41 ? 15.36 6.472 -14.253 1.0 23.62 31 A 1 -ATOM 703 H HA . PHE A1 1 41 ? 15.345 8.884 -13.342 1.0 22.22 31 A 1 -ATOM 704 H HB2 . PHE A1 1 41 ? 16.175 8.61 -15.451 1.0 23.73 31 A 1 -ATOM 705 H HB3 . PHE A1 1 41 ? 14.81 7.98 -15.964 1.0 23.73 31 A 1 -ATOM 706 H HD1 . PHE A1 1 41 ? 16.322 11.034 -15.044 1.0 24.78 31 A 1 -ATOM 707 H HD2 . PHE A1 1 41 ? 13.028 9.44 -16.696 1.0 23.92 31 A 1 -ATOM 708 H HE1 . PHE A1 1 41 ? 15.566 13.103 -15.592 1.0 26.49 31 A 1 -ATOM 709 H HE2 . PHE A1 1 41 ? 12.332 11.548 -17.348 1.0 23.96 31 A 1 -ATOM 710 H HZ . PHE A1 1 41 ? 13.565 13.387 -16.72 1.0 26.26 31 A 1 -ATOM 711 N N . ASN A1 1 42 ? 12.469 7.753 -14.305 1.0 20.34 32 A 1 -ATOM 712 C CA . ASN A1 1 42 ? 11.019 8.02 -14.231 1.0 17.41 32 A 1 -ATOM 713 C C . ASN A1 1 42 ? 10.556 8.086 -12.782 1.0 17.79 32 A 1 -ATOM 714 O O . ASN A1 1 42 ? 9.747 8.951 -12.429 1.0 18.13 32 A 1 -ATOM 715 C CB . ASN A1 1 42 ? 10.252 6.925 -14.971 1.0 18.49 32 A 1 -ATOM 716 C CG . ASN A1 1 42 ? 10.441 6.964 -16.47 1.0 19.2 32 A 1 -ATOM 717 O OD1 . ASN A1 1 42 ? 10.93 7.922 -17.022 1.0 18.92 32 A 1 -ATOM 718 N ND2 . ASN A1 1 42 ? 10.055 5.899 -17.111 1.0 19.95 32 A 1 -ATOM 719 H H . ASN A1 1 42 ? 12.689 7.032 -14.719 1.0 24.41 32 A 1 -ATOM 720 H HA . ASN A1 1 42 ? 10.831 8.87 -14.659 1.0 20.89 32 A 1 -ATOM 721 H HB2 . ASN A1 1 42 ? 10.559 6.061 -14.656 1.0 22.19 32 A 1 -ATOM 722 H HB3 . ASN A1 1 42 ? 9.305 7.028 -14.788 1.0 22.19 32 A 1 -ATOM 723 H HD21 . ASN A1 1 42 ? 10.136 5.859 -17.967 1.0 23.94 32 A 1 -ATOM 724 H HD22 . ASN A1 1 42 ? 9.72 5.235 -16.679 1.0 23.94 32 A 1 -ATOM 725 N N . GLU A1 1 43 ? 11.053 7.18 -11.949 1.0 18.03 33 A 1 -ATOM 726 C CA . GLU A1 1 43 ? 10.66 7.192 -10.54 1.0 17.08 33 A 1 -ATOM 727 C C . GLU A1 1 43 ? 11.083 8.495 -9.864 1.0 20.17 33 A 1 -ATOM 728 O O . GLU A1 1 43 ? 10.331 9.057 -9.082 1.0 18.96 33 A 1 -ATOM 729 C CB . GLU A1 1 43 ? 11.183 5.942 -9.856 1.0 23.68 33 A 1 -ATOM 730 C CG . GLU A1 1 43 ? 11.056 5.89 -8.367 1.0 55.69 33 A 1 -ATOM 731 C CD . GLU A1 1 43 ? 11.293 4.482 -7.82 1.0 72.22 33 A 1 -ATOM 732 O OE1 . GLU A1 1 43 ? 11.229 3.509 -8.603 1.0 50.7 33 A 1 -ATOM 733 O OE2 . GLU A1 1 43 ? 11.541 4.352 -6.606 1.0 92.3 33 A 1 -ATOM 734 H H . GLU A1 1 43 ? 11.606 6.558 -12.165 1.0 21.63 33 A 1 -ATOM 735 H HA . GLU A1 1 43 ? 9.694 7.158 -10.454 1.0 20.5 33 A 1 -ATOM 736 H HB2 . GLU A1 1 43 ? 10.698 5.18 -10.21 1.0 28.41 33 A 1 -ATOM 737 H HB3 . GLU A1 1 43 ? 12.127 5.858 -10.064 1.0 28.41 33 A 1 -ATOM 738 H HG2 . GLU A1 1 43 ? 11.712 6.484 -7.97 1.0 66.82 33 A 1 -ATOM 739 H HG3 . GLU A1 1 43 ? 10.161 6.167 -8.114 1.0 66.82 33 A 1 -ATOM 740 N N . ALA A1 1 44 ? 12.271 9.001 -10.157 1.0 19.26 34 A 1 -ATOM 741 C CA . ALA A1 1 44 ? 12.705 10.289 -9.616 1.0 20.2 34 A 1 -ATOM 742 C C . ALA A1 1 44 ? 11.85 11.437 -10.119 1.0 18.18 34 A 1 -ATOM 743 O O . ALA A1 1 44 ? 11.529 12.359 -9.358 1.0 19.56 34 A 1 -ATOM 744 C CB . ALA A1 1 44 ? 14.176 10.523 -9.982 1.0 21.17 34 A 1 -ATOM 745 H H . ALA A1 1 44 ? 12.85 8.623 -10.668 1.0 23.11 34 A 1 -ATOM 746 H HA . ALA A1 1 44 ? 12.618 10.265 -8.65 1.0 24.24 34 A 1 -ATOM 747 H HB1 . ALA A1 1 44 ? 14.457 11.381 -9.628 1.0 25.41 34 A 1 -ATOM 748 H HB2 . ALA A1 1 44 ? 14.714 9.813 -9.596 1.0 25.41 34 A 1 -ATOM 749 H HB3 . ALA A1 1 44 ? 14.265 10.518 -10.948 1.0 25.41 34 A 1 -ATOM 750 N N . LEU A1 1 45 ? 11.454 11.407 -11.398 1.0 16.86 35 A 1 -ATOM 751 C CA . LEU A1 1 45 ? 10.543 12.41 -11.93 1.0 16.72 35 A 1 -ATOM 752 C C . LEU A1 1 45 ? 9.192 12.367 -11.207 1.0 16.31 35 A 1 -ATOM 753 O O . LEU A1 1 45 ? 8.649 13.413 -10.845 1.0 16.63 35 A 1 -ATOM 754 C CB . LEU A1 1 45 ? 10.353 12.17 -13.43 1.0 16.41 35 A 1 -ATOM 755 C CG . LEU A1 1 45 ? 9.379 13.074 -14.141 1.0 16.77 35 A 1 -ATOM 756 C CD1 . LEU A1 1 45 ? 9.919 14.524 -14.192 1.0 21.67 35 A 1 -ATOM 757 C CD2 . LEU A1 1 45 ? 9.043 12.585 -15.557 1.0 19.98 35 A 1 -ATOM 758 H H . LEU A1 1 45 ? 11.7 10.816 -11.972 1.0 20.24 35 A 1 -ATOM 759 H HA . LEU A1 1 45 ? 10.925 13.292 -11.798 1.0 20.06 35 A 1 -ATOM 760 H HB2 . LEU A1 1 45 ? 11.214 12.282 -13.863 1.0 19.7 35 A 1 -ATOM 761 H HB3 . LEU A1 1 45 ? 10.037 11.261 -13.551 1.0 19.7 35 A 1 -ATOM 762 H HG . LEU A1 1 45 ? 8.552 13.062 -13.635 1.0 20.12 35 A 1 -ATOM 763 H HD11 . LEU A1 1 45 ? 9.301 15.073 -14.698 1.0 26.01 35 A 1 -ATOM 764 H HD12 . LEU A1 1 45 ? 9.999 14.863 -13.286 1.0 26.01 35 A 1 -ATOM 765 H HD13 . LEU A1 1 45 ? 10.789 14.522 -14.622 1.0 26.01 35 A 1 -ATOM 766 H HD21 . LEU A1 1 45 ? 8.405 13.196 -15.959 1.0 23.97 35 A 1 -ATOM 767 H HD22 . LEU A1 1 45 ? 9.856 12.562 -16.085 1.0 23.97 35 A 1 -ATOM 768 H HD23 . LEU A1 1 45 ? 8.659 11.696 -15.501 1.0 23.97 35 A 1 -ATOM 769 N N . PHE A1 1 46 ? 8.647 11.162 -11.008 1.0 15.68 36 A 1 -ATOM 770 C CA . PHE A1 1 46 ? 7.38 11.026 -10.276 1.0 15.06 36 A 1 -ATOM 771 C C . PHE A1 1 46 ? 7.518 11.536 -8.849 1.0 17.02 36 A 1 -ATOM 772 O O . PHE A1 1 46 ? 6.591 12.203 -8.363 1.0 17.67 36 A 1 -ATOM 773 C CB . PHE A1 1 46 ? 6.913 9.573 -10.277 1.0 15.75 36 A 1 -ATOM 774 C CG . PHE A1 1 46 ? 6.705 8.954 -11.645 1.0 14.46 36 A 1 -ATOM 775 C CD1 . PHE A1 1 46 ? 6.279 9.729 -12.741 1.0 15.56 36 A 1 -ATOM 776 C CD2 . PHE A1 1 46 ? 6.932 7.649 -11.82 1.0 16.19 36 A 1 -ATOM 777 C CE1 . PHE A1 1 46 ? 6.115 9.155 -13.941 1.0 15.57 36 A 1 -ATOM 778 C CE2 . PHE A1 1 46 ? 6.799 7.067 -13.088 1.0 18.27 36 A 1 -ATOM 779 C CZ . PHE A1 1 46 ? 6.391 7.842 -14.155 1.0 15.99 36 A 1 -ATOM 780 H H . PHE A1 1 46 ? 8.984 10.419 -11.28 1.0 18.81 36 A 1 -ATOM 781 H HA . PHE A1 1 46 ? 6.704 11.554 -10.728 1.0 18.08 36 A 1 -ATOM 782 H HB2 . PHE A1 1 46 ? 7.579 9.038 -9.817 1.0 18.9 36 A 1 -ATOM 783 H HB3 . PHE A1 1 46 ? 6.066 9.524 -9.806 1.0 18.9 36 A 1 -ATOM 784 H HD1 . PHE A1 1 46 ? 6.11 10.637 -12.632 1.0 18.67 36 A 1 -ATOM 785 H HD2 . PHE A1 1 46 ? 7.181 7.123 -11.095 1.0 19.43 36 A 1 -ATOM 786 H HE1 . PHE A1 1 46 ? 5.804 9.672 -14.649 1.0 18.68 36 A 1 -ATOM 787 H HE2 . PHE A1 1 46 ? 6.985 6.164 -13.21 1.0 21.92 36 A 1 -ATOM 788 H HZ . PHE A1 1 46 ? 6.305 7.472 -15.005 1.0 19.19 36 A 1 -ATOM 789 N N . LYS A1 1 47 ? 8.628 11.248 -8.186 1.0 16.8 37 A 1 -ATOM 790 C CA . LYS A1 1 47 ? 8.811 11.726 -6.81 1.0 17.75 37 A 1 -ATOM 791 C C . LYS A1 1 47 ? 8.955 13.239 -6.75 1.0 20.35 37 A 1 -ATOM 792 O O . LYS A1 1 47 ? 8.465 13.865 -5.808 1.0 18.67 37 A 1 -ATOM 793 C CB . LYS A1 1 47 ? 9.997 11.02 -6.181 1.0 21.93 37 A 1 -ATOM 794 C CG . LYS A1 1 47 ? 9.723 9.582 -5.822 1.0 25.16 37 A 1 -ATOM 795 C CD . LYS A1 1 47 ? 11.0 8.941 -5.281 1.0 51.44 37 A 1 -ATOM 796 C CE . LYS A1 1 47 ? 10.782 7.506 -4.876 1.0 71.22 37 A 1 -ATOM 797 N NZ . LYS A1 1 47 ? 12.096 6.81 -4.728 1.0 74.43 37 A 1 -ATOM 798 H H . LYS A1 1 47 ? 9.284 10.787 -8.498 1.0 20.16 37 A 1 -ATOM 799 H HA . LYS A1 1 47 ? 8.024 11.503 -6.288 1.0 21.3 37 A 1 -ATOM 800 H HB2 . LYS A1 1 47 ? 10.737 11.033 -6.808 1.0 26.32 37 A 1 -ATOM 801 H HB3 . LYS A1 1 47 ? 10.243 11.487 -5.367 1.0 26.32 37 A 1 -ATOM 802 H HG2 . LYS A1 1 47 ? 9.036 9.538 -5.138 1.0 30.19 37 A 1 -ATOM 803 H HG3 . LYS A1 1 47 ? 9.437 9.094 -6.61 1.0 30.19 37 A 1 -ATOM 804 H HD2 . LYS A1 1 47 ? 11.683 8.961 -5.969 1.0 61.73 37 A 1 -ATOM 805 H HD3 . LYS A1 1 47 ? 11.299 9.433 -4.501 1.0 61.73 37 A 1 -ATOM 806 H HE2 . LYS A1 1 47 ? 10.315 7.473 -4.027 1.0 85.46 37 A 1 -ATOM 807 H HE3 . LYS A1 1 47 ? 10.264 7.049 -5.557 1.0 85.46 37 A 1 -ATOM 808 H HZ1 . LYS A1 1 47 ? 12.589 7.217 -4.109 1.0 89.32 37 A 1 -ATOM 809 H HZ2 . LYS A1 1 47 ? 11.967 5.964 -4.484 1.0 89.32 37 A 1 -ATOM 810 H HZ3 . LYS A1 1 47 ? 12.537 6.823 -5.502 1.0 89.32 37 A 1 -ATOM 811 N N . LEU A1 1 48 ? 9.6 13.86 -7.742 1.0 18.55 38 A 1 -ATOM 812 C CA . LEU A1 1 48 ? 9.656 15.311 -7.805 1.0 18.75 38 A 1 -ATOM 813 C C . LEU A1 1 48 ? 8.272 15.91 -7.944 1.0 17.65 38 A 1 -ATOM 814 O O . LEU A1 1 48 ? 7.915 16.867 -7.235 1.0 17.53 38 A 1 -ATOM 815 C CB . LEU A1 1 48 ? 10.579 15.739 -8.946 1.0 20.13 38 A 1 -ATOM 816 C CG . LEU A1 1 48 ? 10.662 17.248 -9.176 1.0 19.78 38 A 1 -ATOM 817 C CD1 . LEU A1 1 48 ? 11.07 18.007 -7.94 1.0 20.4 38 A 1 -ATOM 818 C CD2 . LEU A1 1 48 ? 11.661 17.495 -10.33 1.0 21.02 38 A 1 -ATOM 819 H H . LEU A1 1 48 ? 10.009 13.462 -8.385 1.0 22.26 38 A 1 -ATOM 820 H HA . LEU A1 1 48 ? 10.031 15.655 -6.979 1.0 22.51 38 A 1 -ATOM 821 H HB2 . LEU A1 1 48 ? 11.476 15.424 -8.749 1.0 24.16 38 A 1 -ATOM 822 H HB3 . LEU A1 1 48 ? 10.259 15.336 -9.768 1.0 24.16 38 A 1 -ATOM 823 H HG . LEU A1 1 48 ? 9.784 17.589 -9.407 1.0 23.74 38 A 1 -ATOM 824 H HD11 . LEU A1 1 48 ? 11.216 18.937 -8.174 1.0 24.48 38 A 1 -ATOM 825 H HD12 . LEU A1 1 48 ? 10.362 17.939 -7.28 1.0 24.48 38 A 1 -ATOM 826 H HD13 . LEU A1 1 48 ? 11.888 17.622 -7.588 1.0 24.48 38 A 1 -ATOM 827 H HD21 . LEU A1 1 48 ? 11.728 18.449 -10.492 1.0 25.22 38 A 1 -ATOM 828 H HD22 . LEU A1 1 48 ? 12.529 17.141 -10.078 1.0 25.22 38 A 1 -ATOM 829 H HD23 . LEU A1 1 48 ? 11.34 17.047 -11.128 1.0 25.22 38 A 1 -ATOM 830 N N . ALA A1 1 49 ? 7.49 15.394 -8.885 1.0 16.48 39 A 1 -ATOM 831 C CA . ALA A1 1 49 ? 6.141 15.878 -9.061 1.0 15.27 39 A 1 -ATOM 832 C C . ALA A1 1 49 ? 5.304 15.676 -7.791 1.0 15.99 39 A 1 -ATOM 833 O O . ALA A1 1 49 ? 4.569 16.59 -7.399 1.0 15.49 39 A 1 -ATOM 834 C CB . ALA A1 1 49 ? 5.483 15.203 -10.251 1.0 15.62 39 A 1 -ATOM 835 H H . ALA A1 1 49 ? 7.72 14.768 -9.428 1.0 19.78 39 A 1 -ATOM 836 H HA . ALA A1 1 49 ? 6.18 16.83 -9.247 1.0 18.33 39 A 1 -ATOM 837 H HB1 . ALA A1 1 49 ? 4.594 15.574 -10.372 1.0 18.74 39 A 1 -ATOM 838 H HB2 . ALA A1 1 49 ? 6.019 15.365 -11.042 1.0 18.74 39 A 1 -ATOM 839 H HB3 . ALA A1 1 49 ? 5.423 14.25 -10.08 1.0 18.74 39 A 1 -ATOM 840 N N . ASP A1 1 50 ? 5.446 14.512 -7.168 1.0 15.31 40 A 1 -ATOM 841 C CA . ASP A1 1 50 ? 4.734 14.285 -5.912 1.0 15.7 40 A 1 -ATOM 842 C C . ASP A1 1 50 ? 5.153 15.26 -4.831 1.0 16.42 40 A 1 -ATOM 843 O O . ASP A1 1 50 ? 4.271 15.735 -4.082 1.0 16.92 40 A 1 -ATOM 844 C CB . ASP A1 1 50 ? 4.94 12.844 -5.5 1.0 15.92 40 A 1 -ATOM 845 C CG . ASP A1 1 50 ? 4.187 12.483 -4.257 1.0 17.3 40 A 1 -ATOM 846 O OD1 . ASP A1 1 50 ? 2.935 12.348 -4.322 1.0 18.21 40 A 1 -ATOM 847 O OD2 . ASP A1 1 50 ? 4.83 12.307 -3.2 1.0 19.08 40 A 1 -ATOM 848 H H . ASP A1 1 50 ? 5.932 13.857 -7.44 1.0 18.37 40 A 1 -ATOM 849 H HA . ASP A1 1 50 ? 3.784 14.433 -6.04 1.0 18.84 40 A 1 -ATOM 850 H HB2 . ASP A1 1 50 ? 4.634 12.264 -6.215 1.0 19.1 40 A 1 -ATOM 851 H HB3 . ASP A1 1 50 ? 5.884 12.695 -5.333 1.0 19.1 40 A 1 -ATOM 852 N N . GLU A1 1 51 ? 6.424 15.601 -4.749 1.0 16.59 41 A 1 -ATOM 853 C CA . GLU A1 1 51 ? 6.87 16.557 -3.761 1.0 18.01 41 A 1 -ATOM 854 C C . GLU A1 1 51 ? 6.222 17.91 -4.013 1.0 17.4 41 A 1 -ATOM 855 O O . GLU A1 1 51 ? 5.769 18.582 -3.089 1.0 19.33 41 A 1 -ATOM 856 C CB . GLU A1 1 51 ? 8.383 16.679 -3.854 1.0 22.96 41 A 1 -ATOM 857 C CG . GLU A1 1 51 ? 8.954 17.582 -2.864 1.0 29.44 41 A 1 -ATOM 858 C CD . GLU A1 1 51 ? 10.469 17.656 -3.021 1.0 67.73 41 A 1 -ATOM 859 O OE1 . GLU A1 1 51 ? 10.964 18.469 -3.827 1.0 63.26 41 A 1 -ATOM 860 O OE2 . GLU A1 1 51 ? 11.151 16.864 -2.364 1.0 39.0 41 A 1 -ATOM 861 H H . GLU A1 1 51 ? 7.049 15.293 -5.253 1.0 19.91 41 A 1 -ATOM 862 H HA . GLU A1 1 51 ? 6.628 16.257 -2.871 1.0 21.61 41 A 1 -ATOM 863 H HB2 . GLU A1 1 51 ? 8.776 15.803 -3.72 1.0 27.55 41 A 1 -ATOM 864 H HB3 . GLU A1 1 51 ? 8.616 17.016 -4.733 1.0 27.55 41 A 1 -ATOM 865 H HG2 . GLU A1 1 51 ? 8.587 18.471 -2.985 1.0 35.32 41 A 1 -ATOM 866 H HG3 . GLU A1 1 51 ? 8.751 17.257 -1.973 1.0 35.32 41 A 1 -ATOM 867 N N . ILE A1 1 52 ? 6.212 18.356 -5.264 1.0 16.07 42 A 1 -ATOM 868 C CA . ILE A1 1 52 ? 5.657 19.648 -5.587 1.0 16.14 42 A 1 -ATOM 869 C C . ILE A1 1 52 ? 4.165 19.64 -5.278 1.0 16.02 42 A 1 -ATOM 870 O O . ILE A1 1 52 ? 3.606 20.636 -4.764 1.0 16.74 42 A 1 -ATOM 871 C CB . ILE A1 1 52 ? 5.96 19.997 -7.073 1.0 16.03 42 A 1 -ATOM 872 C CG1 . ILE A1 1 52 ? 7.449 20.208 -7.205 1.0 20.85 42 A 1 -ATOM 873 C CG2 . ILE A1 1 52 ? 5.197 21.194 -7.536 1.0 17.03 42 A 1 -ATOM 874 C CD1 . ILE A1 1 52 ? 7.933 20.471 -8.628 1.0 38.42 42 A 1 -ATOM 875 H H . ILE A1 1 52 ? 6.522 17.925 -5.94 1.0 19.28 42 A 1 -ATOM 876 H HA . ILE A1 1 52 ? 6.072 20.336 -5.043 1.0 19.37 42 A 1 -ATOM 877 H HB . ILE A1 1 52 ? 5.673 19.264 -7.639 1.0 19.23 42 A 1 -ATOM 878 H HG12 . ILE A1 1 52 ? 7.701 20.973 -6.665 1.0 25.02 42 A 1 -ATOM 879 H HG13 . ILE A1 1 52 ? 7.902 19.412 -6.884 1.0 25.02 42 A 1 -ATOM 880 H HG21 . ILE A1 1 52 ? 5.479 21.418 -8.437 1.0 20.44 42 A 1 -ATOM 881 H HG22 . ILE A1 1 52 ? 4.25 20.987 -7.527 1.0 20.44 42 A 1 -ATOM 882 H HG23 . ILE A1 1 52 ? 5.38 21.936 -6.939 1.0 20.44 42 A 1 -ATOM 883 H HD11 . ILE A1 1 52 ? 8.888 20.309 -8.672 1.0 46.1 42 A 1 -ATOM 884 H HD12 . ILE A1 1 52 ? 7.468 19.873 -9.235 1.0 46.1 42 A 1 -ATOM 885 H HD13 . ILE A1 1 52 ? 7.742 21.393 -8.861 1.0 46.1 42 A 1 -ATOM 886 N N . ARG A1 1 53 ? 3.482 18.55 -5.605 1.0 15.25 43 A 1 -ATOM 887 C CA . ARG A1 1 53 ? 2.067 18.413 -5.268 1.0 14.48 43 A 1 -ATOM 888 C C . ARG A1 1 53 ? 1.856 18.56 -3.755 1.0 15.39 43 A 1 -ATOM 889 O O . ARG A1 1 53 ? 0.986 19.356 -3.333 1.0 16.46 43 A 1 -ATOM 890 C CB . ARG A1 1 53 ? 1.573 17.074 -5.793 1.0 15.04 43 A 1 -ATOM 891 C CG . ARG A1 1 53 ? 0.096 16.746 -5.675 1.0 15.02 43 A 1 -ATOM 892 C CD . ARG A1 1 53 ? -0.32 16.279 -4.259 1.0 15.04 43 A 1 -ATOM 893 N NE . ARG A1 1 53 ? 0.339 15.055 -3.901 1.0 15.94 43 A 1 -ATOM 894 C CZ . ARG A1 1 53 ? 0.364 14.512 -2.692 1.0 15.2 43 A 1 -ATOM 895 N NH1 . ARG A1 1 53 ? -0.247 15.148 -1.69 1.0 17.18 43 A 1 -ATOM 896 N NH2 . ARG A1 1 53 ? 0.986 13.396 -2.466 1.0 16.41 43 A 1 -ATOM 897 H H . ARG A1 1 53 ? 3.811 17.874 -6.023 1.0 18.3 43 A 1 -ATOM 898 H HA . ARG A1 1 53 ? 1.544 19.11 -5.694 1.0 17.37 43 A 1 -ATOM 899 H HB2 . ARG A1 1 53 ? 1.79 17.032 -6.738 1.0 18.05 43 A 1 -ATOM 900 H HB3 . ARG A1 1 53 ? 2.049 16.378 -5.313 1.0 18.05 43 A 1 -ATOM 901 H HG2 . ARG A1 1 53 ? -0.42 17.539 -5.889 1.0 18.03 43 A 1 -ATOM 902 H HG3 . ARG A1 1 53 ? -0.118 16.034 -6.298 1.0 18.03 43 A 1 -ATOM 903 H HD2 . ARG A1 1 53 ? -0.078 16.959 -3.611 1.0 18.05 43 A 1 -ATOM 904 H HD3 . ARG A1 1 53 ? -1.278 16.128 -4.238 1.0 18.05 43 A 1 -ATOM 905 H HE . ARG A1 1 53 ? 0.755 14.637 -4.527 1.0 19.12 43 A 1 -ATOM 906 H HH11 . ARG A1 1 53 ? -0.647 15.895 -1.835 1.0 20.62 43 A 1 -ATOM 907 H HH12 . ARG A1 1 53 ? -0.24 14.81 -0.899 1.0 20.62 43 A 1 -ATOM 908 H HH21 . ARG A1 1 53 ? 1.393 12.993 -3.108 1.0 19.69 43 A 1 -ATOM 909 H HH22 . ARG A1 1 53 ? 0.991 13.059 -1.675 1.0 19.69 43 A 1 -ATOM 910 N N . ARG A1 1 54 ? 2.628 17.821 -2.959 1.0 15.34 44 A 1 -ATOM 911 C CA . ARG A1 1 54 ? 2.494 17.939 -1.507 1.0 16.73 44 A 1 -ATOM 912 C C . ARG A1 1 54 ? 2.653 19.384 -1.063 1.0 18.65 44 A 1 -ATOM 913 O O . ARG A1 1 54 ? 1.925 19.849 -0.173 1.0 20.75 44 A 1 -ATOM 914 C CB . ARG A1 1 54 ? 3.568 17.082 -0.859 1.0 18.28 44 A 1 -ATOM 915 C CG . ARG A1 1 54 ? 3.325 15.587 -0.936 1.0 17.16 44 A 1 -ATOM 916 C CD . ARG A1 1 54 ? 4.542 14.812 -0.555 1.0 20.11 44 A 1 -ATOM 917 N NE . ARG A1 1 54 ? 4.378 13.385 -0.688 1.0 22.23 44 A 1 -ATOM 918 C CZ . ARG A1 1 54 ? 3.863 12.57 0.204 0.89 26.85 44 A 1 -ATOM 919 N NH1 . ARG A1 1 54 ? 3.474 13.031 1.403 0.7 23.89 44 A 1 -ATOM 920 N NH2 . ARG A1 1 54 ? 3.802 11.268 -0.054 0.73 26.78 44 A 1 -ATOM 921 H H . ARG A1 1 54 ? 3.222 17.259 -3.227 1.0 18.4 44 A 1 -ATOM 922 H HA . ARG A1 1 54 ? 1.618 17.63 -1.228 1.0 20.07 44 A 1 -ATOM 923 H HB2 . ARG A1 1 54 ? 4.413 17.263 -1.3 1.0 21.93 44 A 1 -ATOM 924 H HB3 . ARG A1 1 54 ? 3.626 17.32 0.08 1.0 21.93 44 A 1 -ATOM 925 H HG2 . ARG A1 1 54 ? 2.608 15.346 -0.329 1.0 20.59 44 A 1 -ATOM 926 H HG3 . ARG A1 1 54 ? 3.084 15.347 -1.845 1.0 20.59 44 A 1 -ATOM 927 H HD2 . ARG A1 1 54 ? 5.277 15.081 -1.127 1.0 24.13 44 A 1 -ATOM 928 H HD3 . ARG A1 1 54 ? 4.756 15.001 0.372 1.0 24.13 44 A 1 -ATOM 929 H HE . ARG A1 1 54 ? 4.645 13.033 -1.425 1.0 26.68 44 A 1 -ATOM 930 H HH11 . ARG A1 1 54 ? 3.56 13.865 1.592 0.81 28.67 44 A 1 -ATOM 931 H HH12 . ARG A1 1 54 ? 3.137 12.492 1.982 0.81 28.67 44 A 1 -ATOM 932 H HH21 . ARG A1 1 54 ? 4.099 10.964 -0.801 0.75 32.13 44 A 1 -ATOM 933 H HH22 . ARG A1 1 54 ? 3.466 10.73 0.527 0.72 32.13 44 A 1 -ATOM 934 N N . LYS A1 1 55 ? 3.641 20.093 -1.582 1.0 17.59 45 A 1 -ATOM 935 C CA . LYS A1 1 55 ? 3.943 21.425 -1.109 1.0 19.63 45 A 1 -ATOM 936 C C . LYS A1 1 55 ? 2.903 22.446 -1.506 1.0 17.14 45 A 1 -ATOM 937 O O . LYS A1 1 55 ? 2.642 23.378 -0.746 1.0 20.76 45 A 1 -ATOM 938 C CB . LYS A1 1 55 ? 5.34 21.769 -1.556 1.0 21.86 45 A 1 -ATOM 939 C CG . LYS A1 1 55 ? 6.356 20.861 -0.881 1.0 22.37 45 A 1 -ATOM 940 C CD . LYS A1 1 55 ? 7.779 21.328 -1.2 1.0 29.14 45 A 1 -ATOM 941 C CE . LYS A1 1 55 ? 8.863 20.43 -0.5 1.0 25.72 45 A 1 -ATOM 942 N NZ . LYS A1 1 55 ? 10.166 20.911 -0.707 1.0 29.81 45 A 1 -ATOM 943 H H . LYS A1 1 55 ? 4.156 19.821 -2.215 1.0 21.11 45 A 1 -ATOM 944 H HA . LYS A1 1 55 ? 3.926 21.45 -0.139 1.0 23.55 45 A 1 -ATOM 945 H HB2 . LYS A1 1 55 ? 5.411 21.652 -2.516 1.0 26.24 45 A 1 -ATOM 946 H HB3 . LYS A1 1 55 ? 5.539 22.688 -1.317 1.0 26.24 45 A 1 -ATOM 947 H HG2 . LYS A1 1 55 ? 6.23 20.889 0.081 1.0 26.85 45 A 1 -ATOM 948 H HG3 . LYS A1 1 55 ? 6.248 19.953 -1.204 1.0 26.85 45 A 1 -ATOM 949 H HD2 . LYS A1 1 55 ? 7.922 21.284 -2.159 1.0 34.96 45 A 1 -ATOM 950 H HD3 . LYS A1 1 55 ? 7.894 22.24 -0.89 1.0 34.96 45 A 1 -ATOM 951 H HE2 . LYS A1 1 55 ? 8.695 20.414 0.456 1.0 30.87 45 A 1 -ATOM 952 H HE3 . LYS A1 1 55 ? 8.813 19.53 -0.86 1.0 30.87 45 A 1 -ATOM 953 H HZ1 . LYS A1 1 55 ? 10.754 20.381 -0.302 1.0 35.78 45 A 1 -ATOM 954 H HZ2 . LYS A1 1 55 ? 10.347 20.932 -1.578 1.0 35.78 45 A 1 -ATOM 955 H HZ3 . LYS A1 1 55 ? 10.242 21.734 -0.376 1.0 35.78 45 A 1 -ATOM 956 N N . TYR A1 1 56 ? 2.337 22.364 -2.724 1.0 16.69 46 A 1 -ATOM 957 C CA . TYR A1 1 56 ? 1.54 23.458 -3.241 1.0 18.52 46 A 1 -ATOM 958 C C . TYR A1 1 56 ? 0.057 23.194 -3.351 1.0 17.69 46 A 1 -ATOM 959 O O . TYR A1 1 56 ? -0.684 24.152 -3.441 1.0 20.41 46 A 1 -ATOM 960 C CB . TYR A1 1 56 ? 2.123 23.965 -4.576 1.0 17.94 46 A 1 -ATOM 961 C CG . TYR A1 1 56 ? 3.49 24.57 -4.276 1.0 19.38 46 A 1 -ATOM 962 C CD1 . TYR A1 1 56 ? 3.622 25.792 -3.647 1.0 20.13 46 A 1 -ATOM 963 C CD2 . TYR A1 1 56 ? 4.659 23.826 -4.494 1.0 20.97 46 A 1 -ATOM 964 C CE1 . TYR A1 1 56 ? 4.86 26.323 -3.295 1.0 25.17 46 A 1 -ATOM 965 C CE2 . TYR A1 1 56 ? 5.923 24.359 -4.105 1.0 22.79 46 A 1 -ATOM 966 C CZ . TYR A1 1 56 ? 6.003 25.587 -3.528 1.0 23.08 46 A 1 -ATOM 967 O OH . TYR A1 1 56 ? 7.24 26.077 -3.158 1.0 26.63 46 A 1 -ATOM 968 H H . TYR A1 1 56 ? 2.408 21.689 -3.252 1.0 20.03 46 A 1 -ATOM 969 H HA . TYR A1 1 56 ? 1.603 24.198 -2.617 1.0 22.23 46 A 1 -ATOM 970 H HB2 . TYR A1 1 56 ? 2.225 23.229 -5.199 1.0 21.53 46 A 1 -ATOM 971 H HB3 . TYR A1 1 56 ? 1.546 24.645 -4.958 1.0 21.53 46 A 1 -ATOM 972 H HD1 . TYR A1 1 56 ? 2.855 26.279 -3.451 1.0 24.16 46 A 1 -ATOM 973 H HD2 . TYR A1 1 56 ? 4.61 22.986 -4.892 1.0 25.16 46 A 1 -ATOM 974 H HE1 . TYR A1 1 56 ? 4.916 27.166 -2.906 1.0 30.2 46 A 1 -ATOM 975 H HE2 . TYR A1 1 56 ? 6.697 23.864 -4.248 1.0 27.35 46 A 1 -ATOM 976 H HH . TYR A1 1 56 ? 7.154 26.83 -2.796 1.0 31.96 46 A 1 -ATOM 977 N N . VAL A1 1 57 ? -0.396 21.94 -3.34 1.0 17.59 47 A 1 -ATOM 978 C CA . VAL A1 1 57 ? -1.823 21.627 -3.249 1.0 16.9 47 A 1 -ATOM 979 C C . VAL A1 1 57 ? -2.138 20.713 -2.077 1.0 17.01 47 A 1 -ATOM 980 O O . VAL A1 1 57 ? -3.325 20.439 -1.872 1.0 17.34 47 A 1 -ATOM 981 C CB . VAL A1 1 57 ? -2.417 21.084 -4.57 1.0 16.64 47 A 1 -ATOM 982 C CG1 . VAL A1 1 57 ? -2.267 22.142 -5.707 1.0 16.02 47 A 1 -ATOM 983 C CG2 . VAL A1 1 57 ? -1.818 19.74 -4.971 1.0 15.98 47 A 1 -ATOM 984 H H . VAL A1 1 57 ? 0.109 21.246 -3.384 1.0 21.11 47 A 1 -ATOM 985 H HA . VAL A1 1 57 ? -2.298 22.459 -3.096 1.0 20.28 47 A 1 -ATOM 986 H HB . VAL A1 1 57 ? -3.363 20.921 -4.426 1.0 19.96 47 A 1 -ATOM 987 H HG11 . VAL A1 1 57 ? -2.693 21.805 -6.511 1.0 19.22 47 A 1 -ATOM 988 H HG12 . VAL A1 1 57 ? -2.692 22.968 -5.428 1.0 19.22 47 A 1 -ATOM 989 H HG13 . VAL A1 1 57 ? -1.323 22.295 -5.873 1.0 19.22 47 A 1 -ATOM 990 H HG21 . VAL A1 1 57 ? -2.2 19.465 -5.819 1.0 19.17 47 A 1 -ATOM 991 H HG22 . VAL A1 1 57 ? -0.857 19.836 -5.057 1.0 19.17 47 A 1 -ATOM 992 H HG23 . VAL A1 1 57 ? -2.025 19.085 -4.287 1.0 19.17 47 A 1 -ATOM 993 N N . GLY A1 1 58 ? -1.154 20.212 -1.353 1.0 17.86 48 A 1 -ATOM 994 C CA . GLY A1 1 58 ? -1.461 19.519 -0.109 1.0 19.29 48 A 1 -ATOM 995 C C . GLY A1 1 58 ? -1.981 18.106 -0.333 1.0 17.95 48 A 1 -ATOM 996 O O . GLY A1 1 58 ? -1.86 17.511 -1.431 1.0 18.76 48 A 1 -ATOM 997 H H . GLY A1 1 58 ? -0.318 20.258 -1.551 1.0 21.43 48 A 1 -ATOM 998 H HA2 . GLY A1 1 58 ? -0.659 19.464 0.434 1.0 23.15 48 A 1 -ATOM 999 H HA3 . GLY A1 1 58 ? -2.137 20.017 0.376 1.0 23.15 48 A 1 -ATOM 1000 N N . ASP A1 1 59 ? -2.605 17.543 0.717 1.0 18.09 49 A 1 -ATOM 1001 C CA A ASP A1 1 59 ? -2.973 16.128 0.748 0.72 17.17 49 A 1 -ATOM 1002 C CA B ASP A1 1 59 ? -2.954 16.13 0.692 0.28 21.98 49 A 1 -ATOM 1003 C C . ASP A1 1 59 ? -4.424 15.867 0.409 1.0 18.12 49 A 1 -ATOM 1004 O O . ASP A1 1 59 ? -4.808 14.714 0.266 1.0 20.81 49 A 1 -ATOM 1005 C CB A ASP A1 1 59 ? -2.655 15.487 2.111 0.72 21.63 49 A 1 -ATOM 1006 C CB B ASP A1 1 59 ? -2.46 15.398 1.927 0.28 40.47 49 A 1 -ATOM 1007 C CG A ASP A1 1 59 ? -1.465 14.458 2.003 0.72 24.72 49 A 1 -ATOM 1008 C CG B ASP A1 1 59 ? -3.345 15.585 3.078 0.28 32.72 49 A 1 -ATOM 1009 O OD1 A ASP A1 1 59 ? -0.483 14.576 1.139 0.72 21.91 49 A 1 -ATOM 1010 O OD1 B ASP A1 1 59 ? -3.906 16.69 3.224 0.28 36.53 49 A 1 -ATOM 1011 O OD2 A ASP A1 1 59 ? -1.47 13.523 2.807 0.72 31.5 49 A 1 -ATOM 1012 O OD2 B ASP A1 1 59 ? -3.517 14.605 3.82 0.28 29.57 49 A 1 -ATOM 1013 H H . ASP A1 1 59 ? -2.825 17.973 1.429 1.0 21.71 49 A 1 -ATOM 1014 H HA . ASP A1 1 59 ? -2.426 15.68 0.085 1.0 26.38 49 A 1 -ATOM 1015 H HB2 A ASP A1 1 59 ? -2.403 16.181 2.741 0.72 25.96 49 A 1 -ATOM 1016 H HB2 B ASP A1 1 59 ? -2.412 14.448 1.735 0.28 48.56 49 A 1 -ATOM 1017 H HB3 A ASP A1 1 59 ? -3.438 15.015 2.435 0.72 25.96 49 A 1 -ATOM 1018 H HB3 B ASP A1 1 59 ? -1.581 15.733 2.165 0.28 48.56 49 A 1 -ATOM 1019 N N . GLU A1 1 60 ? -5.258 16.914 0.246 1.0 16.54 50 A 1 -ATOM 1020 C CA . GLU A1 1 60 ? -6.657 16.7 -0.102 1.0 17.67 50 A 1 -ATOM 1021 C C . GLU A1 1 60 ? -6.762 16.232 -1.546 1.0 17.52 50 A 1 -ATOM 1022 O O . GLU A1 1 60 ? -6.157 16.822 -2.452 1.0 16.7 50 A 1 -ATOM 1023 C CB . GLU A1 1 60 ? -7.465 18.003 0.094 1.0 18.44 50 A 1 -ATOM 1024 C CG . GLU A1 1 60 ? -7.639 18.332 1.568 1.0 21.81 50 A 1 -ATOM 1025 C CD . GLU A1 1 60 ? -8.324 19.639 1.93 1.0 38.42 50 A 1 -ATOM 1026 O OE1 . GLU A1 1 60 ? -9.206 20.129 1.232 1.0 26.81 50 A 1 -ATOM 1027 O OE2 . GLU A1 1 60 ? -7.977 20.177 3.003 1.0 47.03 50 A 1 -ATOM 1028 H H . GLU A1 1 60 ? -5.033 17.739 0.332 1.0 19.85 50 A 1 -ATOM 1029 H HA . GLU A1 1 60 ? -7.035 16.02 0.477 1.0 21.2 50 A 1 -ATOM 1030 H HB2 . GLU A1 1 60 ? -6.996 18.739 -0.33 1.0 22.13 50 A 1 -ATOM 1031 H HB3 . GLU A1 1 60 ? -8.344 17.898 -0.302 1.0 22.13 50 A 1 -ATOM 1032 H HG2 . GLU A1 1 60 ? -8.165 17.622 1.969 1.0 26.17 50 A 1 -ATOM 1033 H HG3 . GLU A1 1 60 ? -6.757 18.359 1.971 1.0 26.17 50 A 1 -ATOM 1034 N N . VAL A1 1 61 ? -7.552 15.188 -1.769 1.0 16.05 51 A 1 -ATOM 1035 C CA . VAL A1 1 61 ? -7.91 14.736 -3.122 1.0 15.57 51 A 1 -ATOM 1036 C C . VAL A1 1 61 ? -9.352 15.161 -3.33 1.0 15.54 51 A 1 -ATOM 1037 O O . VAL A1 1 61 ? -10.256 14.697 -2.636 1.0 16.9 51 A 1 -ATOM 1038 C CB . VAL A1 1 61 ? -7.746 13.233 -3.285 1.0 15.31 51 A 1 -ATOM 1039 C CG1 . VAL A1 1 61 ? -8.214 12.773 -4.652 1.0 15.4 51 A 1 -ATOM 1040 C CG2 . VAL A1 1 61 ? -6.288 12.856 -3.117 1.0 16.48 51 A 1 -ATOM 1041 H H . VAL A1 1 61 ? -7.903 14.712 -1.145 1.0 19.27 51 A 1 -ATOM 1042 H HA . VAL A1 1 61 ? -7.344 15.166 -3.782 1.0 18.68 51 A 1 -ATOM 1043 H HB . VAL A1 1 61 ? -8.285 12.794 -2.608 1.0 18.37 51 A 1 -ATOM 1044 H HG11 . VAL A1 1 61 ? -7.971 11.842 -4.773 1.0 18.49 51 A 1 -ATOM 1045 H HG12 . VAL A1 1 61 ? -9.178 12.873 -4.706 1.0 18.49 51 A 1 -ATOM 1046 H HG13 . VAL A1 1 61 ? -7.787 13.318 -5.332 1.0 18.49 51 A 1 -ATOM 1047 H HG21 . VAL A1 1 61 ? -6.193 11.899 -3.239 1.0 19.78 51 A 1 -ATOM 1048 H HG22 . VAL A1 1 61 ? -5.761 13.328 -3.781 1.0 19.78 51 A 1 -ATOM 1049 H HG23 . VAL A1 1 61 ? -5.997 13.106 -2.226 1.0 19.78 51 A 1 -ATOM 1050 N N . HIS A1 1 62 ? -9.57 16.114 -4.23 1.0 15.21 52 A 1 -ATOM 1051 C CA . HIS A1 1 62 ? -10.896 16.673 -4.453 1.0 15.01 52 A 1 -ATOM 1052 C C . HIS A1 1 62 ? -11.749 15.764 -5.302 1.0 14.07 52 A 1 -ATOM 1053 O O . HIS A1 1 62 ? -11.274 15.264 -6.337 1.0 15.69 52 A 1 -ATOM 1054 C CB . HIS A1 1 62 ? -10.797 18.072 -5.051 1.0 14.57 52 A 1 -ATOM 1055 C CG . HIS A1 1 62 ? -10.071 18.999 -4.143 1.0 15.99 52 A 1 -ATOM 1056 N ND1 . HIS A1 1 62 ? -10.636 19.419 -2.972 1.0 17.59 52 A 1 -ATOM 1057 C CD2 . HIS A1 1 62 ? -8.804 19.463 -4.162 1.0 18.68 52 A 1 -ATOM 1058 C CE1 . HIS A1 1 62 ? -9.75 20.153 -2.314 1.0 18.36 52 A 1 -ATOM 1059 N NE2 . HIS A1 1 62 ? -8.634 20.193 -3.007 1.0 18.23 52 A 1 -ATOM 1060 H H . HIS A1 1 62 ? -8.96 16.457 -4.729 1.0 18.25 52 A 1 -ATOM 1061 H HA . HIS A1 1 62 ? -11.347 16.749 -3.598 1.0 18.02 52 A 1 -ATOM 1062 H HB2 . HIS A1 1 62 ? -10.316 18.029 -5.892 1.0 17.49 52 A 1 -ATOM 1063 H HB3 . HIS A1 1 62 ? -11.689 18.423 -5.196 1.0 17.49 52 A 1 -ATOM 1064 H HD1 . HIS A1 1 62 ? -11.434 19.238 -2.707 1.0 21.1 52 A 1 -ATOM 1065 H HD2 . HIS A1 1 62 ? -8.169 19.319 -4.826 1.0 22.41 52 A 1 -ATOM 1066 H HE1 . HIS A1 1 62 ? -9.895 20.571 -1.496 1.0 22.03 52 A 1 -ATOM 1067 N N . ILE A1 1 63 ? -12.971 15.558 -4.915 1.0 14.57 53 A 1 -ATOM 1068 C CA . ILE A1 1 63 ? -13.892 14.681 -5.599 1.0 15.62 53 A 1 -ATOM 1069 C C . ILE A1 1 63 ? -14.814 15.516 -6.456 1.0 14.65 53 A 1 -ATOM 1070 O O . ILE A1 1 63 ? -15.549 16.372 -5.956 1.0 15.42 53 A 1 -ATOM 1071 C CB . ILE A1 1 63 ? -14.677 13.834 -4.59 1.0 16.65 53 A 1 -ATOM 1072 C CG1 . ILE A1 1 63 ? -13.721 12.902 -3.859 1.0 18.43 53 A 1 -ATOM 1073 C CG2 . ILE A1 1 63 ? -15.783 13.06 -5.306 1.0 18.74 53 A 1 -ATOM 1074 C CD1 . ILE A1 1 63 ? -14.348 12.183 -2.66 1.0 23.7 53 A 1 -ATOM 1075 H H . ILE A1 1 63 ? -13.317 15.932 -4.223 1.0 17.49 53 A 1 -ATOM 1076 H HA . ILE A1 1 63 ? -13.401 14.09 -6.192 1.0 18.75 53 A 1 -ATOM 1077 H HB . ILE A1 1 63 ? -15.097 14.412 -3.934 1.0 19.98 53 A 1 -ATOM 1078 H HG12 . ILE A1 1 63 ? -13.411 12.224 -4.48 1.0 22.12 53 A 1 -ATOM 1079 H HG13 . ILE A1 1 63 ? -12.969 13.42 -3.532 1.0 22.12 53 A 1 -ATOM 1080 H HG21 . ILE A1 1 63 ? -16.112 12.362 -4.718 1.0 22.49 53 A 1 -ATOM 1081 H HG22 . ILE A1 1 63 ? -16.503 13.671 -5.529 1.0 22.49 53 A 1 -ATOM 1082 H HG23 . ILE A1 1 63 ? -15.421 12.667 -6.116 1.0 22.49 53 A 1 -ATOM 1083 H HD11 . ILE A1 1 63 ? -13.647 11.741 -2.156 1.0 28.45 53 A 1 -ATOM 1084 H HD12 . ILE A1 1 63 ? -14.797 12.835 -2.101 1.0 28.45 53 A 1 -ATOM 1085 H HD13 . ILE A1 1 63 ? -14.987 11.528 -2.983 1.0 28.45 53 A 1 -ATOM 1086 N N . ARG A1 1 64 ? -14.864 15.233 -7.759 1.0 13.74 54 A 1 -ATOM 1087 C CA . ARG A1 1 64 ? -15.715 15.929 -8.706 1.0 14.06 54 A 1 -ATOM 1088 C C . ARG A1 1 64 ? -16.631 14.865 -9.303 1.0 15.32 54 A 1 -ATOM 1089 O O . ARG A1 1 64 ? -16.172 14.059 -10.111 1.0 16.05 54 A 1 -ATOM 1090 C CB . ARG A1 1 64 ? -14.91 16.621 -9.811 1.0 14.22 54 A 1 -ATOM 1091 C CG . ARG A1 1 64 ? -13.536 17.177 -9.427 1.0 14.19 54 A 1 -ATOM 1092 C CD . ARG A1 1 64 ? -13.563 18.305 -8.535 1.0 15.96 54 A 1 -ATOM 1093 N NE . ARG A1 1 64 ? -12.312 19.099 -8.562 1.0 14.64 54 A 1 -ATOM 1094 C CZ . ARG A1 1 64 ? -12.036 20.079 -7.743 1.0 15.52 54 A 1 -ATOM 1095 N NH1 . ARG A1 1 64 ? -12.756 20.306 -6.682 1.0 16.26 54 A 1 -ATOM 1096 N NH2 . ARG A1 1 64 ? -10.973 20.848 -7.994 1.0 17.69 54 A 1 -ATOM 1097 H H . ARG A1 1 64 ? -14.392 14.615 -8.127 1.0 16.49 54 A 1 -ATOM 1098 H HA . ARG A1 1 64 ? -16.228 16.615 -8.25 1.0 16.87 54 A 1 -ATOM 1099 H HB2 . ARG A1 1 64 ? -14.765 15.978 -10.522 1.0 17.06 54 A 1 -ATOM 1100 H HB3 . ARG A1 1 64 ? -15.434 17.368 -10.14 1.0 17.06 54 A 1 -ATOM 1101 H HG2 . ARG A1 1 64 ? -13.03 16.474 -8.99 1.0 17.03 54 A 1 -ATOM 1102 H HG3 . ARG A1 1 64 ? -13.081 17.458 -10.236 1.0 17.03 54 A 1 -ATOM 1103 H HD2 . ARG A1 1 64 ? -14.293 18.89 -8.791 1.0 19.15 54 A 1 -ATOM 1104 H HD3 . ARG A1 1 64 ? -13.694 17.986 -7.629 1.0 19.15 54 A 1 -ATOM 1105 H HE . ARG A1 1 64 ? -11.726 18.9 -9.159 1.0 17.57 54 A 1 -ATOM 1106 H HH11 . ARG A1 1 64 ? -13.432 19.804 -6.505 1.0 19.52 54 A 1 -ATOM 1107 H HH12 . ARG A1 1 64 ? -12.556 20.957 -6.157 1.0 19.52 54 A 1 -ATOM 1108 H HH21 . ARG A1 1 64 ? -10.483 20.693 -8.684 1.0 21.23 54 A 1 -ATOM 1109 H HH22 . ARG A1 1 64 ? -10.777 21.497 -7.465 1.0 21.23 54 A 1 -ATOM 1110 N N . ALA A1 1 65 ? -17.913 14.844 -8.946 1.0 13.32 55 A 1 -ATOM 1111 C CA . ALA A1 1 65 ? -18.782 13.797 -9.436 1.0 12.77 55 A 1 -ATOM 1112 C C . ALA A1 1 65 ? -19.308 14.164 -10.816 1.0 13.03 55 A 1 -ATOM 1113 O O . ALA A1 1 65 ? -19.921 15.212 -10.995 1.0 14.51 55 A 1 -ATOM 1114 C CB . ALA A1 1 65 ? -19.985 13.614 -8.513 1.0 14.49 55 A 1 -ATOM 1115 H H . ALA A1 1 65 ? -18.29 15.418 -8.429 1.0 15.98 55 A 1 -ATOM 1116 H HA . ALA A1 1 65 ? -18.275 12.972 -9.477 1.0 15.32 55 A 1 -ATOM 1117 H HB1 . ALA A1 1 65 ? -20.553 12.912 -8.868 1.0 17.39 55 A 1 -ATOM 1118 H HB2 . ALA A1 1 65 ? -19.671 13.369 -7.629 1.0 17.39 55 A 1 -ATOM 1119 H HB3 . ALA A1 1 65 ? -20.479 14.448 -8.469 1.0 17.39 55 A 1 -ATOM 1120 N N . ILE A1 1 66 ? -19.101 13.267 -11.784 1.0 12.92 56 A 1 -ATOM 1121 C CA . ILE A1 1 66 ? -19.465 13.543 -13.181 1.0 13.41 56 A 1 -ATOM 1122 C C . ILE A1 1 66 ? -20.821 12.951 -13.497 1.0 13.42 56 A 1 -ATOM 1123 O O . ILE A1 1 66 ? -21.05 11.755 -13.264 1.0 15.24 56 A 1 -ATOM 1124 C CB . ILE A1 1 66 ? -18.462 12.963 -14.178 1.0 12.74 56 A 1 -ATOM 1125 C CG1 . ILE A1 1 66 ? -17.015 13.342 -13.906 1.0 15.18 56 A 1 -ATOM 1126 C CG2 . ILE A1 1 66 ? -18.776 13.479 -15.609 1.0 15.31 56 A 1 -ATOM 1127 C CD1 A ILE A1 1 66 ? -16.062 12.47 -14.761 0.85 15.32 56 A 1 -ATOM 1128 H H . ILE A1 1 66 ? -18.751 12.491 -11.657 1.0 15.5 56 A 1 -ATOM 1129 H HA . ILE A1 1 66 ? -19.497 14.509 -13.261 1.0 16.09 56 A 1 -ATOM 1130 H HB . ILE A1 1 66 ? -18.557 12.002 -14.085 1.0 15.29 56 A 1 -ATOM 1131 H HG12 A ILE A1 1 66 ? -16.874 14.273 -14.136 0.85 18.21 56 A 1 -ATOM 1132 H HG13 A ILE A1 1 66 ? -16.812 13.197 -12.968 0.85 18.21 56 A 1 -ATOM 1133 H HG21 . ILE A1 1 66 ? -18.137 13.096 -16.23 1.0 18.37 56 A 1 -ATOM 1134 H HG22 . ILE A1 1 66 ? -19.676 13.209 -15.852 1.0 18.37 56 A 1 -ATOM 1135 H HG23 . ILE A1 1 66 ? -18.707 14.447 -15.618 1.0 18.37 56 A 1 -ATOM 1136 H HD11 A ILE A1 1 66 ? -15.307 12.2 -14.215 0.85 18.39 56 A 1 -ATOM 1137 H HD12 A ILE A1 1 66 ? -16.544 11.686 -15.07 0.85 18.39 56 A 1 -ATOM 1138 H HD13 A ILE A1 1 66 ? -15.754 12.989 -15.519 0.85 18.39 56 A 1 -ATOM 1139 N N . ILE A1 1 67 ? -21.702 13.758 -14.059 1.0 12.78 57 A 1 -ATOM 1140 C CA . ILE A1 1 67 ? -22.939 13.263 -14.644 1.0 12.95 57 A 1 -ATOM 1141 C C . ILE A1 1 67 ? -22.849 13.529 -16.146 1.0 12.34 57 A 1 -ATOM 1142 O O . ILE A1 1 67 ? -22.806 14.68 -16.586 1.0 12.7 57 A 1 -ATOM 1143 C CB . ILE A1 1 67 ? -24.178 13.923 -14.024 1.0 13.42 57 A 1 -ATOM 1144 C CG1 . ILE A1 1 67 ? -24.214 13.719 -12.525 1.0 14.6 57 A 1 -ATOM 1145 C CG2 . ILE A1 1 67 ? -25.457 13.381 -14.681 1.0 14.97 57 A 1 -ATOM 1146 C CD1 . ILE A1 1 67 ? -25.276 14.53 -11.811 1.0 16.1 57 A 1 -ATOM 1147 H H . ILE A1 1 67 ? -21.606 14.611 -14.116 1.0 15.33 57 A 1 -ATOM 1148 H HA . ILE A1 1 67 ? -23.012 12.306 -14.499 1.0 15.54 57 A 1 -ATOM 1149 H HB . ILE A1 1 67 ? -24.124 14.877 -14.19 1.0 16.11 57 A 1 -ATOM 1150 H HG12 . ILE A1 1 67 ? -24.39 12.782 -12.344 1.0 17.52 57 A 1 -ATOM 1151 H HG13 . ILE A1 1 67 ? -23.354 13.972 -12.156 1.0 17.52 57 A 1 -ATOM 1152 H HG21 . ILE A1 1 67 ? -26.228 13.792 -14.259 1.0 17.97 57 A 1 -ATOM 1153 H HG22 . ILE A1 1 67 ? -25.443 13.599 -15.626 1.0 17.97 57 A 1 -ATOM 1154 H HG23 . ILE A1 1 67 ? -25.489 12.419 -14.564 1.0 17.97 57 A 1 -ATOM 1155 H HD11 . ILE A1 1 67 ? -25.146 14.446 -10.853 1.0 19.32 57 A 1 -ATOM 1156 H HD12 . ILE A1 1 67 ? -25.195 15.459 -12.076 1.0 19.32 57 A 1 -ATOM 1157 H HD13 . ILE A1 1 67 ? -26.151 14.191 -12.057 1.0 19.32 57 A 1 -ATOM 1158 N N . GLU A1 1 68 ? -22.798 12.428 -16.918 1.0 12.47 58 A 1 -ATOM 1159 C CA . GLU A1 1 68 ? -22.657 12.474 -18.382 1.0 12.62 58 A 1 -ATOM 1160 C C . GLU A1 1 68 ? -24.074 12.393 -18.906 1.0 13.28 58 A 1 -ATOM 1161 O O . GLU A1 1 68 ? -24.66 11.313 -19.023 1.0 14.3 58 A 1 -ATOM 1162 C CB . GLU A1 1 68 ? -21.792 11.303 -18.837 1.0 13.32 58 A 1 -ATOM 1163 C CG . GLU A1 1 68 ? -20.412 11.298 -18.23 1.0 14.9 58 A 1 -ATOM 1164 C CD . GLU A1 1 68 ? -19.738 9.951 -18.162 1.0 17.79 58 A 1 -ATOM 1165 O OE1 . GLU A1 1 68 ? -20.491 8.966 -17.981 1.0 19.87 58 A 1 -ATOM 1166 O OE2 . GLU A1 1 68 ? -18.487 9.944 -18.049 1.0 18.94 58 A 1 -ATOM 1167 H H . GLU A1 1 68 ? -22.844 11.627 -16.608 1.0 14.96 58 A 1 -ATOM 1168 H HA . GLU A1 1 68 ? -22.239 13.291 -18.696 1.0 15.15 58 A 1 -ATOM 1169 H HB2 . GLU A1 1 68 ? -22.23 10.475 -18.586 1.0 15.98 58 A 1 -ATOM 1170 H HB3 . GLU A1 1 68 ? -21.692 11.346 -19.801 1.0 15.98 58 A 1 -ATOM 1171 H HG2 . GLU A1 1 68 ? -19.843 11.879 -18.76 1.0 17.88 58 A 1 -ATOM 1172 H HG3 . GLU A1 1 68 ? -20.476 11.635 -17.323 1.0 17.88 58 A 1 -ATOM 1173 N N . PHE A1 1 69 ? -24.691 13.545 -19.114 1.0 13.59 59 A 1 -ATOM 1174 C CA . PHE A1 1 69 ? -26.146 13.591 -19.161 1.0 13.32 59 A 1 -ATOM 1175 C C . PHE A1 1 69 ? -26.756 13.395 -20.548 1.0 14.8 59 A 1 -ATOM 1176 O O . PHE A1 1 69 ? -27.969 13.26 -20.668 1.0 14.31 59 A 1 -ATOM 1177 C CB . PHE A1 1 69 ? -26.647 14.897 -18.494 1.0 13.66 59 A 1 -ATOM 1178 C CG . PHE A1 1 69 ? -26.21 16.139 -19.191 1.0 13.82 59 A 1 -ATOM 1179 C CD1 . PHE A1 1 69 ? -26.938 16.651 -20.262 1.0 14.13 59 A 1 -ATOM 1180 C CD2 . PHE A1 1 69 ? -25.066 16.807 -18.809 1.0 14.64 59 A 1 -ATOM 1181 C CE1 . PHE A1 1 69 ? -26.536 17.782 -20.91 1.0 14.31 59 A 1 -ATOM 1182 C CE2 . PHE A1 1 69 ? -24.62 17.961 -19.457 1.0 13.27 59 A 1 -ATOM 1183 C CZ . PHE A1 1 69 ? -25.381 18.43 -20.536 1.0 14.08 59 A 1 -ATOM 1184 H H . PHE A1 1 69 ? -24.298 14.301 -19.23 1.0 16.31 59 A 1 -ATOM 1185 H HA . PHE A1 1 69 ? -26.492 12.85 -18.639 1.0 15.99 59 A 1 -ATOM 1186 H HB2 . PHE A1 1 69 ? -27.617 14.89 -18.486 1.0 16.39 59 A 1 -ATOM 1187 H HB3 . PHE A1 1 69 ? -26.308 14.933 -17.586 1.0 16.39 59 A 1 -ATOM 1188 H HD1 . PHE A1 1 69 ? -27.71 16.214 -20.54 1.0 16.96 59 A 1 -ATOM 1189 H HD2 . PHE A1 1 69 ? -24.572 16.477 -18.093 1.0 17.57 59 A 1 -ATOM 1190 H HE1 . PHE A1 1 69 ? -27.047 18.118 -21.61 1.0 17.18 59 A 1 -ATOM 1191 H HE2 . PHE A1 1 69 ? -23.849 18.402 -19.183 1.0 15.93 59 A 1 -ATOM 1192 H HZ . PHE A1 1 69 ? -25.104 19.184 -21.004 1.0 16.9 59 A 1 -ATOM 1193 N N . SER A1 1 70 ? -25.925 13.436 -21.582 1.0 13.09 60 A 1 -ATOM 1194 C CA . SER A1 1 70 ? -26.361 13.144 -22.946 1.0 13.3 60 A 1 -ATOM 1195 C C . SER A1 1 70 ? -25.158 12.637 -23.702 1.0 12.5 60 A 1 -ATOM 1196 O O . SER A1 1 70 ? -24.081 13.193 -23.58 1.0 13.47 60 A 1 -ATOM 1197 C CB . SER A1 1 70 ? -26.885 14.432 -23.59 1.0 14.06 60 A 1 -ATOM 1198 O OG . SER A1 1 70 ? -27.043 14.124 -25.006 1.0 14.73 60 A 1 -ATOM 1199 H H . SER A1 1 70 ? -25.09 13.632 -21.522 1.0 15.7 60 A 1 -ATOM 1200 H HA . SER A1 1 70 ? -27.055 12.467 -22.972 1.0 15.96 60 A 1 -ATOM 1201 H HB2 . SER A1 1 70 ? -27.739 14.679 -23.202 1.0 16.87 60 A 1 -ATOM 1202 H HB3 . SER A1 1 70 ? -26.246 15.152 -23.472 1.0 16.87 60 A 1 -ATOM 1203 H HG . SER A1 1 70 ? -27.364 14.787 -25.409 1.0 17.68 60 A 1 -ATOM 1204 N N . ASN A1 1 71 ? -25.354 11.615 -24.537 1.0 13.69 61 A 1 -ATOM 1205 C CA . ASN A1 1 71 ? -24.301 11.149 -25.432 1.0 13.71 61 A 1 -ATOM 1206 C C . ASN A1 1 71 ? -24.58 11.547 -26.874 1.0 14.61 61 A 1 -ATOM 1207 O O . ASN A1 1 71 ? -23.942 10.982 -27.778 1.0 15.31 61 A 1 -ATOM 1208 C CB . ASN A1 1 71 ? -24.052 9.647 -25.319 1.0 14.01 61 A 1 -ATOM 1209 C CG . ASN A1 1 71 ? -25.134 8.824 -25.912 1.0 13.41 61 A 1 -ATOM 1210 O OD1 . ASN A1 1 71 ? -26.19 9.329 -26.239 1.0 14.99 61 A 1 -ATOM 1211 N ND2 . ASN A1 1 71 ? -24.938 7.504 -25.97 1.0 14.08 61 A 1 -ATOM 1212 H H . ASN A1 1 71 ? -26.091 11.176 -24.601 1.0 16.43 61 A 1 -ATOM 1213 H HA . ASN A1 1 71 ? -23.473 11.569 -25.15 1.0 16.45 61 A 1 -ATOM 1214 H HB2 . ASN A1 1 71 ? -23.227 9.43 -25.781 1.0 16.81 61 A 1 -ATOM 1215 H HB3 . ASN A1 1 71 ? -23.979 9.41 -24.381 1.0 16.81 61 A 1 -ATOM 1216 H HD21 . ASN A1 1 71 ? -25.542 6.993 -26.307 1.0 16.89 61 A 1 -ATOM 1217 H HD22 . ASN A1 1 71 ? -24.206 7.164 -25.67 1.0 16.89 61 A 1 -ATOM 1218 N N . VAL A1 1 72 ? -25.455 12.516 -27.09 1.0 14.06 62 A 1 -ATOM 1219 C CA . VAL A1 1 72 ? -25.731 13.037 -28.434 1.0 13.63 62 A 1 -ATOM 1220 C C . VAL A1 1 72 ? -24.651 14.054 -28.739 1.0 14.16 62 A 1 -ATOM 1221 O O . VAL A1 1 72 ? -24.392 14.973 -27.956 1.0 14.75 62 A 1 -ATOM 1222 C CB . VAL A1 1 72 ? -27.089 13.705 -28.427 1.0 15.04 62 A 1 -ATOM 1223 C CG1 . VAL A1 1 72 ? -27.377 14.4 -29.763 1.0 15.76 62 A 1 -ATOM 1224 C CG2 . VAL A1 1 72 ? -28.182 12.69 -28.137 1.0 17.41 62 A 1 -ATOM 1225 H H . VAL A1 1 72 ? -25.912 12.9 -26.471 1.0 16.87 62 A 1 -ATOM 1226 H HA . VAL A1 1 72 ? -25.719 12.331 -29.099 1.0 16.35 62 A 1 -ATOM 1227 H HB . VAL A1 1 72 ? -27.085 14.378 -27.729 1.0 18.04 62 A 1 -ATOM 1228 H HG11 . VAL A1 1 72 ? -28.306 14.677 -29.78 1.0 18.92 62 A 1 -ATOM 1229 H HG12 . VAL A1 1 72 ? -26.799 15.174 -29.847 1.0 18.92 62 A 1 -ATOM 1230 H HG13 . VAL A1 1 72 ? -27.203 13.777 -30.486 1.0 18.92 62 A 1 -ATOM 1231 H HG21 . VAL A1 1 72 ? -29.046 13.108 -28.28 1.0 20.89 62 A 1 -ATOM 1232 H HG22 . VAL A1 1 72 ? -28.078 11.934 -28.735 1.0 20.89 62 A 1 -ATOM 1233 H HG23 . VAL A1 1 72 ? -28.104 12.397 -27.216 1.0 20.89 62 A 1 -ATOM 1234 N N . CYS A1 1 73 ? -24.05 13.958 -29.939 1.0 14.41 63 A 1 -ATOM 1235 C CA . CYS A1 1 73 ? -23.058 14.927 -30.335 1.0 15.16 63 A 1 -ATOM 1236 C C . CYS A1 1 73 ? -23.191 15.293 -31.811 1.0 14.66 63 A 1 -ATOM 1237 O O . CYS A1 1 73 ? -23.315 14.421 -32.684 1.0 15.26 63 A 1 -ATOM 1238 C CB . CYS A1 1 73 ? -21.603 14.453 -30.095 1.0 15.02 63 A 1 -ATOM 1239 S SG . CYS A1 1 73 ? -20.438 15.815 -30.213 1.0 14.48 63 A 1 -ATOM 1240 H H . CYS A1 1 73 ? -24.209 13.344 -30.519 1.0 17.3 63 A 1 -ATOM 1241 H HA . CYS A1 1 73 ? -23.228 15.717 -29.799 1.0 18.2 63 A 1 -ATOM 1242 H HB2 . CYS A1 1 73 ? -21.535 14.067 -29.207 1.0 18.03 63 A 1 -ATOM 1243 H HB3 . CYS A1 1 73 ? -21.368 13.79 -30.763 1.0 18.03 63 A 1 -ATOM 1244 N N . ARG A1 1 74 ? -23.11 16.59 -32.083 1.0 14.8 64 A 1 -ATOM 1245 C CA . ARG A1 1 74 ? -23.112 17.116 -33.441 1.0 14.81 64 A 1 -ATOM 1246 C C . ARG A1 1 74 ? -21.765 17.0 -34.127 1.0 14.23 64 A 1 -ATOM 1247 O O . ARG A1 1 74 ? -21.734 17.159 -35.365 1.0 15.88 64 A 1 -ATOM 1248 C CB . ARG A1 1 74 ? -23.569 18.578 -33.425 1.0 15.63 64 A 1 -ATOM 1249 C CG . ARG A1 1 74 ? -22.613 19.534 -32.785 1.0 15.45 64 A 1 -ATOM 1250 C CD . ARG A1 1 74 ? -23.148 20.904 -32.679 1.0 16.92 64 A 1 -ATOM 1251 N NE . ARG A1 1 74 ? -22.25 21.772 -31.947 1.0 16.51 64 A 1 -ATOM 1252 C CZ . ARG A1 1 74 ? -22.364 23.092 -31.867 1.0 19.43 64 A 1 -ATOM 1253 N NH1 . ARG A1 1 74 ? -23.37 23.744 -32.489 1.0 21.87 64 A 1 -ATOM 1254 N NH2 . ARG A1 1 74 ? -21.43 23.778 -31.212 1.0 19.85 64 A 1 -ATOM 1255 H H . ARG A1 1 74 ? -23.053 17.203 -31.482 1.0 17.76 64 A 1 -ATOM 1256 H HA . ARG A1 1 74 ? -23.746 16.611 -33.973 1.0 17.78 64 A 1 -ATOM 1257 H HB2 . ARG A1 1 74 ? -23.699 18.868 -34.342 1.0 18.75 64 A 1 -ATOM 1258 H HB3 . ARG A1 1 74 ? -24.405 18.632 -32.937 1.0 18.75 64 A 1 -ATOM 1259 H HG2 . ARG A1 1 74 ? -22.41 19.224 -31.888 1.0 18.54 64 A 1 -ATOM 1260 H HG3 . ARG A1 1 74 ? -21.801 19.571 -33.314 1.0 18.54 64 A 1 -ATOM 1261 H HD2 . ARG A1 1 74 ? -23.268 21.271 -33.569 1.0 20.3 64 A 1 -ATOM 1262 H HD3 . ARG A1 1 74 ? -23.998 20.881 -32.213 1.0 20.3 64 A 1 -ATOM 1263 H HE . ARG A1 1 74 ? -21.592 21.405 -31.532 1.0 19.81 64 A 1 -ATOM 1264 H HH11 . ARG A1 1 74 ? -23.95 23.304 -32.946 1.0 26.24 64 A 1 -ATOM 1265 H HH12 . ARG A1 1 74 ? -23.43 24.6 -32.427 1.0 26.24 64 A 1 -ATOM 1266 H HH21 . ARG A1 1 74 ? -20.769 23.365 -30.849 1.0 23.83 64 A 1 -ATOM 1267 H HH22 . ARG A1 1 74 ? -21.489 24.633 -31.15 1.0 23.83 64 A 1 -ATOM 1268 N N . LYS A1 1 75 ? -20.685 16.745 -33.422 1.0 14.49 65 A 1 -ATOM 1269 C CA . LYS A1 1 75 ? -19.337 16.659 -33.993 1.0 15.88 65 A 1 -ATOM 1270 C C . LYS A1 1 75 ? -18.981 15.206 -34.331 1.0 14.27 65 A 1 -ATOM 1271 O O . LYS A1 1 75 ? -19.759 14.266 -34.097 1.0 15.73 65 A 1 -ATOM 1272 C CB . LYS A1 1 75 ? -18.311 17.31 -33.064 1.0 15.35 65 A 1 -ATOM 1273 C CG . LYS A1 1 75 ? -18.335 18.848 -33.196 1.0 16.35 65 A 1 -ATOM 1274 C CD . LYS A1 1 75 ? -17.259 19.462 -32.282 1.0 16.49 65 A 1 -ATOM 1275 C CE . LYS A1 1 75 ? -16.984 20.949 -32.582 1.0 17.47 65 A 1 -ATOM 1276 N NZ . LYS A1 1 75 ? -18.213 21.791 -32.602 1.0 17.59 65 A 1 -ATOM 1277 H H . LYS A1 1 75 ? -20.695 16.612 -32.573 1.0 17.39 65 A 1 -ATOM 1278 H HA . LYS A1 1 75 ? -19.307 17.153 -34.827 1.0 19.06 65 A 1 -ATOM 1279 H HB2 . LYS A1 1 75 ? -18.516 17.077 -32.145 1.0 18.42 65 A 1 -ATOM 1280 H HB3 . LYS A1 1 75 ? -17.423 16.996 -33.295 1.0 18.42 65 A 1 -ATOM 1281 H HG2 . LYS A1 1 75 ? -18.149 19.102 -34.113 1.0 19.62 65 A 1 -ATOM 1282 H HG3 . LYS A1 1 75 ? -19.204 19.187 -32.928 1.0 19.62 65 A 1 -ATOM 1283 H HD2 . LYS A1 1 75 ? -17.552 19.394 -31.36 1.0 19.78 65 A 1 -ATOM 1284 H HD3 . LYS A1 1 75 ? -16.428 18.976 -32.403 1.0 19.78 65 A 1 -ATOM 1285 H HE2 . LYS A1 1 75 ? -16.394 21.302 -31.898 1.0 20.97 65 A 1 -ATOM 1286 H HE3 . LYS A1 1 75 ? -16.563 21.02 -33.453 1.0 20.97 65 A 1 -ATOM 1287 H HZ1 . LYS A1 1 75 ? -18.001 22.635 -32.788 1.0 21.11 65 A 1 -ATOM 1288 H HZ2 . LYS A1 1 75 ? -18.778 21.492 -33.221 1.0 21.11 65 A 1 -ATOM 1289 H HZ3 . LYS A1 1 75 ? -18.614 21.763 -31.807 1.0 21.11 65 A 1 -ATOM 1290 N N . ASN A1 1 76 ? -17.843 15.057 -34.982 1.0 15.29 66 A 1 -ATOM 1291 C CA . ASN A1 1 76 ? -17.449 13.775 -35.579 1.0 15.71 66 A 1 -ATOM 1292 C C . ASN A1 1 76 ? -15.965 13.479 -35.321 1.0 14.93 66 A 1 -ATOM 1293 O O . ASN A1 1 76 ? -15.285 12.912 -36.193 1.0 15.97 66 A 1 -ATOM 1294 C CB . ASN A1 1 76 ? -17.732 13.816 -37.091 1.0 15.52 66 A 1 -ATOM 1295 C CG . ASN A1 1 76 ? -18.064 12.449 -37.697 1.0 16.48 66 A 1 -ATOM 1296 O OD1 . ASN A1 1 76 ? -18.525 11.543 -37.025 1.0 16.62 66 A 1 -ATOM 1297 N ND2 . ASN A1 1 76 ? -17.797 12.305 -38.977 1.0 18.35 66 A 1 -ATOM 1298 H H . ASN A1 1 76 ? -17.269 15.687 -35.098 1.0 18.34 66 A 1 -ATOM 1299 H HA . ASN A1 1 76 ? -17.955 13.058 -35.166 1.0 18.85 66 A 1 -ATOM 1300 H HB2 . ASN A1 1 76 ? -18.488 14.402 -37.251 1.0 18.62 66 A 1 -ATOM 1301 H HB3 . ASN A1 1 76 ? -16.946 14.158 -37.546 1.0 18.62 66 A 1 -ATOM 1302 H HD21 . ASN A1 1 76 ? -17.963 11.558 -39.37 1.0 22.02 66 A 1 -ATOM 1303 H HD22 . ASN A1 1 76 ? -17.456 12.958 -39.421 1.0 22.02 66 A 1 -ATOM 1304 N N . CYS A1 1 77 ? -15.457 13.838 -34.14 1.0 14.33 67 A 1 -ATOM 1305 C CA . CYS A1 1 77 ? -14.054 13.619 -33.832 1.0 13.89 67 A 1 -ATOM 1306 C C . CYS A1 1 77 ? -13.665 12.175 -34.108 1.0 14.31 67 A 1 -ATOM 1307 O O . CYS A1 1 77 ? -14.381 11.248 -33.721 1.0 15.41 67 A 1 -ATOM 1308 C CB . CYS A1 1 77 ? -13.769 13.993 -32.387 1.0 13.78 67 A 1 -ATOM 1309 S SG . CYS A1 1 77 ? -14.334 15.672 -31.912 1.0 15.24 67 A 1 -ATOM 1310 H H . CYS A1 1 77 ? -15.906 14.207 -33.506 1.0 17.19 67 A 1 -ATOM 1311 H HA . CYS A1 1 77 ? -13.505 14.186 -34.395 1.0 16.67 67 A 1 -ATOM 1312 H HB2 . CYS A1 1 77 ? -14.219 13.358 -31.809 1.0 16.54 67 A 1 -ATOM 1313 H HB3 . CYS A1 1 77 ? -12.811 13.954 -32.241 1.0 16.54 67 A 1 -ATOM 1314 N N . LEU A1 1 78 ? -12.509 11.989 -34.738 1.0 14.47 68 A 1 -ATOM 1315 C CA . LEU A1 1 78 ? -12.139 10.668 -35.238 1.0 15.23 68 A 1 -ATOM 1316 C C . LEU A1 1 78 ? -11.861 9.688 -34.124 1.0 15.3 68 A 1 -ATOM 1317 O O . LEU A1 1 78 ? -11.983 8.489 -34.319 1.0 15.55 68 A 1 -ATOM 1318 C CB . LEU A1 1 78 ? -10.916 10.73 -36.172 1.0 15.24 68 A 1 -ATOM 1319 C CG . LEU A1 1 78 ? -11.251 10.982 -37.646 1.0 18.47 68 A 1 -ATOM 1320 C CD1 . LEU A1 1 78 ? -11.939 12.314 -37.89 1.0 20.04 68 A 1 -ATOM 1321 C CD2 . LEU A1 1 78 ? -10.004 10.867 -38.518 1.0 18.49 68 A 1 -ATOM 1322 H H . LEU A1 1 78 ? -11.927 12.603 -34.889 1.0 17.37 68 A 1 -ATOM 1323 H HA . LEU A1 1 78 ? -12.894 10.348 -35.756 1.0 18.28 68 A 1 -ATOM 1324 H HB2 . LEU A1 1 78 ? -10.339 11.45 -35.875 1.0 18.29 68 A 1 -ATOM 1325 H HB3 . LEU A1 1 78 ? -10.445 9.884 -36.119 1.0 18.29 68 A 1 -ATOM 1326 H HG . LEU A1 1 78 ? -11.885 10.295 -37.906 1.0 22.16 68 A 1 -ATOM 1327 H HD11 . LEU A1 1 78 ? -12.12 12.407 -38.838 1.0 24.05 68 A 1 -ATOM 1328 H HD12 . LEU A1 1 78 ? -12.77 12.337 -37.39 1.0 24.05 68 A 1 -ATOM 1329 H HD13 . LEU A1 1 78 ? -11.355 13.03 -37.593 1.0 24.05 68 A 1 -ATOM 1330 H HD21 . LEU A1 1 78 ? -10.252 11.015 -39.444 1.0 22.19 68 A 1 -ATOM 1331 H HD22 . LEU A1 1 78 ? -9.36 11.535 -38.237 1.0 22.19 68 A 1 -ATOM 1332 H HD23 . LEU A1 1 78 ? -9.627 9.979 -38.414 1.0 22.19 68 A 1 -ATOM 1333 N N . TYR A1 1 79 ? -11.476 10.172 -32.961 1.0 14.81 69 A 1 -ATOM 1334 C CA . TYR A1 1 79 ? -11.12 9.296 -31.835 1.0 14.2 69 A 1 -ATOM 1335 C C . TYR A1 1 79 ? -12.317 8.868 -31.001 1.0 14.35 69 A 1 -ATOM 1336 O O . TYR A1 1 79 ? -12.185 7.929 -30.166 1.0 14.68 69 A 1 -ATOM 1337 C CB . TYR A1 1 79 ? -10.05 9.971 -30.967 1.0 14.19 69 A 1 -ATOM 1338 C CG . TYR A1 1 79 ? -10.389 11.418 -30.619 1.0 13.33 69 A 1 -ATOM 1339 C CD1 . TYR A1 1 79 ? -11.264 11.756 -29.596 1.0 14.16 69 A 1 -ATOM 1340 C CD2 . TYR A1 1 79 ? -9.779 12.463 -31.305 1.0 13.87 69 A 1 -ATOM 1341 C CE1 . TYR A1 1 79 ? -11.557 13.099 -29.308 1.0 13.38 69 A 1 -ATOM 1342 C CE2 . TYR A1 1 79 ? -10.066 13.749 -31.021 1.0 15.1 69 A 1 -ATOM 1343 C CZ . TYR A1 1 79 ? -10.934 14.087 -30.037 1.0 14.55 69 A 1 -ATOM 1344 O OH . TYR A1 1 79 ? -11.175 15.447 -29.804 1.0 16.65 69 A 1 -ATOM 1345 H H . TYR A1 1 79 ? -11.409 11.011 -32.785 1.0 17.78 69 A 1 -ATOM 1346 H HA . TYR A1 1 79 ? -10.726 8.478 -32.176 1.0 17.04 69 A 1 -ATOM 1347 H HB2 . TYR A1 1 79 ? -9.96 9.477 -30.137 1.0 17.03 69 A 1 -ATOM 1348 H HB3 . TYR A1 1 79 ? -9.208 9.969 -31.448 1.0 17.03 69 A 1 -ATOM 1349 H HD1 . TYR A1 1 79 ? -11.663 11.083 -29.093 1.0 16.99 69 A 1 -ATOM 1350 H HD2 . TYR A1 1 79 ? -9.161 12.271 -31.974 1.0 16.64 69 A 1 -ATOM 1351 H HE1 . TYR A1 1 79 ? -12.162 13.318 -28.636 1.0 16.05 69 A 1 -ATOM 1352 H HE2 . TYR A1 1 79 ? -9.656 14.423 -31.513 1.0 18.12 69 A 1 -ATOM 1353 H HH . TYR A1 1 79 ? -11.772 15.537 -29.221 1.0 19.98 69 A 1 -ATOM 1354 N N . CYS A1 1 80 ? -13.44 9.558 -31.052 1.0 13.93 70 A 1 -ATOM 1355 C CA . CYS A1 1 80 ? -14.444 9.474 -29.999 1.0 13.99 70 A 1 -ATOM 1356 C C . CYS A1 1 80 ? -15.599 8.564 -30.367 1.0 12.82 70 A 1 -ATOM 1357 O O . CYS A1 1 80 ? -16.193 8.71 -31.427 1.0 14.65 70 A 1 -ATOM 1358 C CB . CYS A1 1 80 ? -14.962 10.878 -29.743 1.0 14.33 70 A 1 -ATOM 1359 S SG . CYS A1 1 80 ? -16.178 10.968 -28.388 1.0 14.41 70 A 1 -ATOM 1360 H H . CYS A1 1 80 ? -13.651 10.09 -31.694 1.0 16.72 70 A 1 -ATOM 1361 H HA . CYS A1 1 80 ? -14.046 9.085 -29.204 1.0 16.79 70 A 1 -ATOM 1362 H HB2 . CYS A1 1 80 ? -14.213 11.45 -29.509 1.0 17.19 70 A 1 -ATOM 1363 H HB3 . CYS A1 1 80 ? -15.39 11.205 -30.549 1.0 17.19 70 A 1 -ATOM 1364 N N . GLY A1 1 81 ? -15.978 7.649 -29.451 1.0 13.51 71 A 1 -ATOM 1365 C CA . GLY A1 1 81 ? -17.103 6.788 -29.705 1.0 14.64 71 A 1 -ATOM 1366 C C . GLY A1 1 81 ? -18.435 7.519 -29.861 1.0 14.03 71 A 1 -ATOM 1367 O O . GLY A1 1 81 ? -19.379 6.932 -30.411 1.0 16.44 71 A 1 -ATOM 1368 H H . GLY A1 1 81 ? -15.593 7.525 -28.692 1.0 16.21 71 A 1 -ATOM 1369 H HA2 . GLY A1 1 81 ? -16.939 6.291 -30.522 1.0 17.57 71 A 1 -ATOM 1370 H HA3 . GLY A1 1 81 ? -17.191 6.163 -28.968 1.0 17.57 71 A 1 -ATOM 1371 N N . LEU A1 1 82 ? -18.542 8.764 -29.372 1.0 13.94 72 A 1 -ATOM 1372 C CA . LEU A1 1 82 ? -19.793 9.497 -29.512 1.0 14.29 72 A 1 -ATOM 1373 C C . LEU A1 1 82 ? -19.908 10.238 -30.829 1.0 14.57 72 A 1 -ATOM 1374 O O . LEU A1 1 82 ? -20.944 10.904 -31.084 1.0 15.22 72 A 1 -ATOM 1375 C CB . LEU A1 1 82 ? -20.003 10.504 -28.368 1.0 13.53 72 A 1 -ATOM 1376 C CG . LEU A1 1 82 ? -19.868 9.926 -26.962 1.0 17.76 72 A 1 -ATOM 1377 C CD1 . LEU A1 1 82 ? -20.347 10.991 -25.926 1.0 15.96 72 A 1 -ATOM 1378 C CD2 . LEU A1 1 82 ? -20.527 8.652 -26.782 1.0 20.61 72 A 1 -ATOM 1379 H H . LEU A1 1 82 ? -17.914 9.189 -28.965 1.0 16.73 72 A 1 -ATOM 1380 H HA . LEU A1 1 82 ? -20.505 8.841 -29.456 1.0 17.14 72 A 1 -ATOM 1381 H HB2 . LEU A1 1 82 ? -19.343 11.209 -28.457 1.0 16.24 72 A 1 -ATOM 1382 H HB3 . LEU A1 1 82 ? -20.896 10.873 -28.446 1.0 16.24 72 A 1 -ATOM 1383 H HG . LEU A1 1 82 ? -18.932 9.724 -26.805 1.0 21.31 72 A 1 -ATOM 1384 H HD11 . LEU A1 1 82 ? -20.244 10.631 -25.032 1.0 19.15 72 A 1 -ATOM 1385 H HD12 . LEU A1 1 82 ? -19.808 11.792 -26.024 1.0 19.15 72 A 1 -ATOM 1386 H HD13 . LEU A1 1 82 ? -21.279 11.198 -26.094 1.0 19.15 72 A 1 -ATOM 1387 H HD21 . LEU A1 1 82 ? -20.551 8.439 -25.836 1.0 24.73 72 A 1 -ATOM 1388 H HD22 . LEU A1 1 82 ? -21.431 8.712 -27.13 1.0 24.73 72 A 1 -ATOM 1389 H HD23 . LEU A1 1 82 ? -20.032 7.97 -27.263 1.0 24.73 72 A 1 -ATOM 1390 N N . ARG A1 1 83 ? -18.894 10.175 -31.672 1.0 13.87 73 A 1 -ATOM 1391 C CA . ARG A1 1 83 ? -18.962 10.878 -32.945 1.0 14.47 73 A 1 -ATOM 1392 C C . ARG A1 1 83 ? -20.258 10.555 -33.666 1.0 15.01 73 A 1 -ATOM 1393 O O . ARG A1 1 83 ? -20.778 9.445 -33.618 1.0 15.17 73 A 1 -ATOM 1394 C CB . ARG A1 1 83 ? -17.749 10.51 -33.799 1.0 14.25 73 A 1 -ATOM 1395 C CG . ARG A1 1 83 ? -17.697 9.063 -34.302 1.0 15.26 73 A 1 -ATOM 1396 C CD . ARG A1 1 83 ? -16.281 8.646 -34.728 1.0 14.85 73 A 1 -ATOM 1397 N NE . ARG A1 1 83 ? -15.746 9.59 -35.684 1.0 15.74 73 A 1 -ATOM 1398 C CZ . ARG A1 1 83 ? -15.89 9.532 -36.996 1.0 15.66 73 A 1 -ATOM 1399 N NH1 . ARG A1 1 83 ? -16.485 8.512 -37.58 1.0 16.69 73 A 1 -ATOM 1400 N NH2 . ARG A1 1 83 ? -15.342 10.484 -37.733 1.0 18.07 73 A 1 -ATOM 1401 H H . ARG A1 1 83 ? -18.165 9.739 -31.536 1.0 16.64 73 A 1 -ATOM 1402 H HA . ARG A1 1 83 ? -18.943 11.837 -32.797 1.0 17.37 73 A 1 -ATOM 1403 H HB2 . ARG A1 1 83 ? -17.742 11.085 -34.58 1.0 17.1 73 A 1 -ATOM 1404 H HB3 . ARG A1 1 83 ? -16.949 10.659 -33.271 1.0 17.1 73 A 1 -ATOM 1405 H HG2 . ARG A1 1 83 ? -17.986 8.469 -33.591 1.0 18.31 73 A 1 -ATOM 1406 H HG3 . ARG A1 1 83 ? -18.282 8.972 -35.07 1.0 18.31 73 A 1 -ATOM 1407 H HD2 . ARG A1 1 83 ? -15.7 8.627 -33.951 1.0 17.82 73 A 1 -ATOM 1408 H HD3 . ARG A1 1 83 ? -16.311 7.768 -35.141 1.0 17.82 73 A 1 -ATOM 1409 H HE . ARG A1 1 83 ? -15.294 10.251 -35.37 1.0 18.89 73 A 1 -ATOM 1410 H HH11 . ARG A1 1 83 ? -16.791 7.863 -37.106 1.0 20.03 73 A 1 -ATOM 1411 H HH12 . ARG A1 1 83 ? -16.567 8.495 -38.436 1.0 20.03 73 A 1 -ATOM 1412 H HH21 . ARG A1 1 83 ? -14.905 11.122 -37.356 1.0 21.68 73 A 1 -ATOM 1413 H HH22 . ARG A1 1 83 ? -15.422 10.466 -38.589 1.0 21.68 73 A 1 -ATOM 1414 N N . ARG A1 1 84 ? -20.794 11.553 -34.345 1.0 14.7 74 A 1 -ATOM 1415 C CA . ARG A1 1 84 ? -22.117 11.399 -34.938 1.0 16.31 74 A 1 -ATOM 1416 C C . ARG A1 1 84 ? -22.19 10.263 -35.952 1.0 17.61 74 A 1 -ATOM 1417 O O . ARG A1 1 84 ? -23.254 9.669 -36.119 1.0 17.79 74 A 1 -ATOM 1418 C CB . ARG A1 1 84 ? -22.572 12.714 -35.597 1.0 16.4 74 A 1 -ATOM 1419 C CG . ARG A1 1 84 ? -21.778 13.146 -36.79 1.0 18.14 74 A 1 -ATOM 1420 C CD . ARG A1 1 84 ? -22.313 14.448 -37.433 1.0 19.42 74 A 1 -ATOM 1421 N NE . ARG A1 1 84 ? -21.499 14.684 -38.618 1.0 19.31 74 A 1 -ATOM 1422 C CZ . ARG A1 1 84 ? -20.47 15.55 -38.675 1.0 18.91 74 A 1 -ATOM 1423 N NH1 . ARG A1 1 84 ? -20.164 16.363 -37.654 1.0 19.12 74 A 1 -ATOM 1424 N NH2 . ARG A1 1 84 ? -19.702 15.554 -39.792 1.0 19.61 74 A 1 -ATOM 1425 H H . ARG A1 1 84 ? -20.423 12.318 -34.477 1.0 17.64 74 A 1 -ATOM 1426 H HA . ARG A1 1 84 ? -22.731 11.187 -34.217 1.0 19.57 74 A 1 -ATOM 1427 H HB2 . ARG A1 1 84 ? -23.492 12.608 -35.885 1.0 19.68 74 A 1 -ATOM 1428 H HB3 . ARG A1 1 84 ? -22.51 13.422 -34.937 1.0 19.68 74 A 1 -ATOM 1429 H HG2 . ARG A1 1 84 ? -20.86 13.303 -36.518 1.0 21.76 74 A 1 -ATOM 1430 H HG3 . ARG A1 1 84 ? -21.81 12.446 -37.461 1.0 21.76 74 A 1 -ATOM 1431 H HD2 . ARG A1 1 84 ? -23.242 14.343 -37.691 1.0 23.3 74 A 1 -ATOM 1432 H HD3 . ARG A1 1 84 ? -22.221 15.194 -36.82 1.0 23.3 74 A 1 -ATOM 1433 H HE . ARG A1 1 84 ? -21.688 14.239 -39.33 1.0 23.17 74 A 1 -ATOM 1434 H HH11 . ARG A1 1 84 ? -20.631 16.341 -36.932 1.0 22.94 74 A 1 -ATOM 1435 H HH12 . ARG A1 1 84 ? -19.5 16.906 -37.721 1.0 22.94 74 A 1 -ATOM 1436 H HH21 . ARG A1 1 84 ? -19.879 15.014 -40.437 1.0 23.54 74 A 1 -ATOM 1437 H HH22 . ARG A1 1 84 ? -19.039 16.097 -39.856 1.0 23.54 74 A 1 -ATOM 1438 N N . ASP A1 1 85 ? -21.08 9.941 -36.615 1.0 16.53 75 A 1 -ATOM 1439 C CA . ASP A1 1 85 ? -21.121 8.846 -37.59 1.0 18.15 75 A 1 -ATOM 1440 C C . ASP A1 1 85 ? -21.168 7.458 -36.959 1.0 18.43 75 A 1 -ATOM 1441 O O . ASP A1 1 85 ? -21.384 6.484 -37.686 1.0 19.96 75 A 1 -ATOM 1442 C CB . ASP A1 1 85 ? -19.951 8.937 -38.567 1.0 17.92 75 A 1 -ATOM 1443 C CG . ASP A1 1 85 ? -20.131 9.955 -39.651 1.0 22.01 75 A 1 -ATOM 1444 O OD1 . ASP A1 1 85 ? -21.228 10.518 -39.746 1.0 23.76 75 A 1 -ATOM 1445 O OD2 . ASP A1 1 85 ? -19.163 10.122 -40.432 1.0 21.74 75 A 1 -ATOM 1446 H H . ASP A1 1 85 ? -20.317 10.325 -36.522 1.0 19.83 75 A 1 -ATOM 1447 H HA . ASP A1 1 85 ? -21.936 8.953 -38.106 1.0 21.78 75 A 1 -ATOM 1448 H HB2 . ASP A1 1 85 ? -19.151 9.173 -38.072 1.0 21.5 75 A 1 -ATOM 1449 H HB3 . ASP A1 1 85 ? -19.835 8.073 -38.993 1.0 21.5 75 A 1 -ATOM 1450 N N . ASN A1 1 86 ? -21.003 7.302 -35.672 1.0 18.38 76 A 1 -ATOM 1451 C CA . ASN A1 1 86 ? -21.101 5.984 -35.017 1.0 17.57 76 A 1 -ATOM 1452 C C . ASN A1 1 86 ? -22.558 5.644 -34.813 1.0 20.12 76 A 1 -ATOM 1453 O O . ASN A1 1 86 ? -23.203 6.083 -33.86 1.0 20.09 76 A 1 -ATOM 1454 C CB . ASN A1 1 86 ? -20.365 5.984 -33.695 1.0 17.52 76 A 1 -ATOM 1455 C CG . ASN A1 1 86 ? -20.488 4.657 -32.986 1.0 19.65 76 A 1 -ATOM 1456 O OD1 . ASN A1 1 86 ? -20.999 3.673 -33.586 1.0 22.43 76 A 1 -ATOM 1457 N ND2 . ASN A1 1 86 ? -20.082 4.594 -31.751 1.0 18.76 76 A 1 -ATOM 1458 H H . ASN A1 1 86 ? -20.83 7.946 -35.129 1.0 22.05 76 A 1 -ATOM 1459 H HA . ASN A1 1 86 ? -20.705 5.32 -35.603 1.0 21.09 76 A 1 -ATOM 1460 H HB2 . ASN A1 1 86 ? -19.424 6.159 -33.852 1.0 21.03 76 A 1 -ATOM 1461 H HB3 . ASN A1 1 86 ? -20.739 6.671 -33.121 1.0 21.03 76 A 1 -ATOM 1462 H HD21 . ASN A1 1 86 ? -20.138 3.854 -31.318 1.0 22.52 76 A 1 -ATOM 1463 H HD22 . ASN A1 1 86 ? -19.759 5.293 -31.369 1.0 22.52 76 A 1 -ATOM 1464 N N . LYS A1 1 87 ? -23.133 4.904 -35.747 1.0 20.15 77 A 1 -ATOM 1465 C CA . LYS A1 1 87 ? -24.521 4.505 -35.635 1.0 22.31 77 A 1 -ATOM 1466 C C . LYS A1 1 87 ? -24.721 3.262 -34.775 1.0 21.09 77 A 1 -ATOM 1467 O O . LYS A1 1 87 ? -25.875 2.879 -34.567 1.0 28.77 77 A 1 -ATOM 1468 C CB . LYS A1 1 87 ? -25.125 4.283 -37.033 1.0 26.86 77 A 1 -ATOM 1469 C CG . LYS A1 1 87 ? -24.921 5.409 -37.985 1.0 27.3 77 A 1 -ATOM 1470 C CD . LYS A1 1 87 ? -25.397 6.763 -37.475 1.0 63.69 77 A 1 -ATOM 1471 C CE . LYS A1 1 87 ? -25.074 7.879 -38.475 1.0 84.3 77 A 1 -ATOM 1472 N NZ . LYS A1 1 87 ? -25.661 9.193 -38.086 1.0 76.04 77 A 1 -ATOM 1473 H H . LYS A1 1 87 ? -22.739 4.62 -36.457 1.0 24.18 77 A 1 -ATOM 1474 H HA . LYS A1 1 87 ? -25.015 5.227 -35.216 1.0 26.77 77 A 1 -ATOM 1475 H HB2 . LYS A1 1 87 ? -24.717 3.494 -37.422 1.0 32.23 77 A 1 -ATOM 1476 H HB3 . LYS A1 1 87 ? -26.081 4.15 -36.938 1.0 32.23 77 A 1 -ATOM 1477 H HG2 . LYS A1 1 87 ? -23.973 5.486 -38.176 1.0 32.76 77 A 1 -ATOM 1478 H HG3 . LYS A1 1 87 ? -25.409 5.217 -38.802 1.0 32.76 77 A 1 -ATOM 1479 H HD2 . LYS A1 1 87 ? -26.358 6.738 -37.344 1.0 76.43 77 A 1 -ATOM 1480 H HD3 . LYS A1 1 87 ? -24.953 6.965 -36.636 1.0 76.43 77 A 1 -ATOM 1481 H HE2 . LYS A1 1 87 ? -24.111 7.985 -38.53 1.0 101.16 77 A 1 -ATOM 1482 H HE3 . LYS A1 1 87 ? -25.43 7.637 -39.344 1.0 101.16 77 A 1 -ATOM 1483 H HZ1 . LYS A1 1 87 ? -25.444 9.813 -38.686 1.0 91.25 77 A 1 -ATOM 1484 H HZ2 . LYS A1 1 87 ? -26.548 9.13 -38.044 1.0 91.25 77 A 1 -ATOM 1485 H HZ3 . LYS A1 1 87 ? -25.351 9.441 -37.29 1.0 91.25 77 A 1 -ATOM 1486 N N A ASN A1 1 88 ? -23.665 2.597 -34.297 0.5 25.78 78 A 1 -ATOM 1487 N N B ASN A1 1 88 ? -23.62 2.631 -34.295 0.5 18.86 78 A 1 -ATOM 1488 C CA A ASN A1 1 88 ? -23.857 1.389 -33.476 0.5 22.56 78 A 1 -ATOM 1489 C CA B ASN A1 1 88 ? -23.63 1.427 -33.458 0.5 23.5 78 A 1 -ATOM 1490 C C A ASN A1 1 88 ? -24.401 1.764 -32.088 0.5 21.89 78 A 1 -ATOM 1491 C C B ASN A1 1 88 ? -23.695 1.752 -31.968 0.5 23.67 78 A 1 -ATOM 1492 O O A ASN A1 1 88 ? -25.16 1.005 -31.472 0.5 28.45 78 A 1 -ATOM 1493 O O B ASN A1 1 88 ? -23.135 1.016 -31.149 0.5 28.08 78 A 1 -ATOM 1494 C CB A ASN A1 1 88 ? -22.504 0.648 -33.422 0.5 23.87 78 A 1 -ATOM 1495 C CB B ASN A1 1 88 ? -22.361 0.591 -33.667 0.5 31.48 78 A 1 -ATOM 1496 C CG A ASN A1 1 88 ? -22.593 -0.811 -32.996 0.5 29.29 78 A 1 -ATOM 1497 C CG B ASN A1 1 88 ? -22.286 -0.061 -35.017 0.5 33.48 78 A 1 -ATOM 1498 O OD1 A ASN A1 1 88 ? -23.619 -1.461 -33.129 0.5 30.1 78 A 1 -ATOM 1499 O OD1 B ASN A1 1 88 ? -23.304 -0.253 -35.687 0.5 41.53 78 A 1 -ATOM 1500 N ND2 A ASN A1 1 88 ? -21.459 -1.347 -32.532 0.5 28.16 78 A 1 -ATOM 1501 N ND2 B ASN A1 1 88 ? -21.067 -0.426 -35.422 0.5 40.74 78 A 1 -ATOM 1502 H H A ASN A1 1 88 ? -22.844 2.815 -34.428 0.5 30.93 78 A 1 -ATOM 1503 H H B ASN A1 1 88 ? -22.82 2.904 -34.455 0.5 22.64 78 A 1 -ATOM 1504 H HA A ASN A1 1 88 ? -24.507 0.779 -33.859 0.5 27.08 78 A 1 -ATOM 1505 H HA B ASN A1 1 88 ? -24.407 0.914 -33.732 0.5 28.19 78 A 1 -ATOM 1506 H HB2 A ASN A1 1 88 ? -22.105 0.67 -34.306 0.5 28.64 78 A 1 -ATOM 1507 H HB2 B ASN A1 1 88 ? -21.587 1.168 -33.574 0.5 37.78 78 A 1 -ATOM 1508 H HB3 A ASN A1 1 88 ? -21.928 1.103 -32.787 0.5 28.64 78 A 1 -ATOM 1509 H HB3 B ASN A1 1 88 ? -22.335 -0.111 -32.998 0.5 37.78 78 A 1 -ATOM 1510 H HD21 A ASN A1 1 88 ? -21.445 -2.168 -32.275 0.5 33.8 78 A 1 -ATOM 1511 H HD21 B ASN A1 1 88 ? -20.963 -0.804 -36.188 0.5 48.88 78 A 1 -ATOM 1512 H HD22 A ASN A1 1 88 ? -20.744 -0.871 -32.489 0.5 33.8 78 A 1 -ATOM 1513 H HD22 B ASN A1 1 88 ? -20.385 -0.283 -34.918 0.5 48.88 78 A 1 -ATOM 1514 N N A LEU A1 1 89 ? -24.096 2.948 -31.62 0.41 25.62 79 A 1 -ATOM 1515 N N B LEU A1 1 89 ? -24.305 2.866 -31.603 0.59 21.49 79 A 1 -ATOM 1516 C CA A LEU A1 1 89 ? -24.366 3.305 -30.24 0.41 19.82 79 A 1 -ATOM 1517 C CA B LEU A1 1 89 ? -24.377 3.295 -30.211 0.59 20.75 79 A 1 -ATOM 1518 C C A LEU A1 1 89 ? -25.819 3.749 -30.034 0.41 16.97 79 A 1 -ATOM 1519 C C B LEU A1 1 89 ? -25.766 3.837 -29.956 0.59 22.62 79 A 1 -ATOM 1520 O O A LEU A1 1 89 ? -26.38 4.497 -30.839 0.41 20.31 79 A 1 -ATOM 1521 O O B LEU A1 1 89 ? -26.188 4.778 -30.646 0.59 21.0 79 A 1 -ATOM 1522 C CB . LEU A1 1 89 ? -23.384 4.415 -29.919 1.0 20.59 79 A 1 -ATOM 1523 C CG . LEU A1 1 89 ? -23.366 4.875 -28.459 1.0 20.2 79 A 1 -ATOM 1524 C CD1 . LEU A1 1 89 ? -22.958 3.73 -27.503 1.0 21.62 79 A 1 -ATOM 1525 C CD2 . LEU A1 1 89 ? -22.428 6.025 -28.346 1.0 20.41 79 A 1 -ATOM 1526 H H A LEU A1 1 89 ? -23.728 3.573 -32.081 0.5 30.75 79 A 1 -ATOM 1527 H H B LEU A1 1 89 ? -24.694 3.403 -32.151 0.5 25.79 79 A 1 -ATOM 1528 H HA A LEU A1 1 89 ? -24.257 2.555 -29.634 0.41 23.79 79 A 1 -ATOM 1529 H HA B LEU A1 1 89 ? -24.192 2.532 -29.642 0.59 24.9 79 A 1 -ATOM 1530 H HB2 A LEU A1 1 89 ? -22.491 4.104 -30.135 0.41 24.7 79 A 1 -ATOM 1531 H HB2 B LEU A1 1 89 ? -22.493 4.103 -30.14 0.59 24.7 79 A 1 -ATOM 1532 H HB3 A LEU A1 1 89 ? -23.608 5.186 -30.463 0.41 24.7 79 A 1 -ATOM 1533 H HB3 B LEU A1 1 89 ? -23.613 5.182 -30.466 0.59 24.7 79 A 1 -ATOM 1534 H HG . LEU A1 1 89 ? -24.256 5.148 -28.188 1.0 24.24 79 A 1 -ATOM 1535 H HD11 . LEU A1 1 89 ? -22.819 4.095 -26.615 1.0 25.94 79 A 1 -ATOM 1536 H HD12 . LEU A1 1 89 ? -23.668 3.069 -27.482 1.0 25.94 79 A 1 -ATOM 1537 H HD13 . LEU A1 1 89 ? -22.139 3.325 -27.827 1.0 25.94 79 A 1 -ATOM 1538 H HD21 . LEU A1 1 89 ? -22.401 6.321 -27.423 1.0 24.49 79 A 1 -ATOM 1539 H HD22 . LEU A1 1 89 ? -21.544 5.741 -28.628 1.0 24.49 79 A 1 -ATOM 1540 H HD23 . LEU A1 1 89 ? -22.741 6.745 -28.916 1.0 24.49 79 A 1 -ATOM 1541 N N . LYS A1 1 90 ? -26.444 3.292 -28.952 1.0 19.55 80 A 1 -ATOM 1542 C CA . LYS A1 1 90 ? -27.749 3.816 -28.57 1.0 19.16 80 A 1 -ATOM 1543 C C . LYS A1 1 90 ? -27.542 5.194 -27.911 1.0 17.18 80 A 1 -ATOM 1544 O O . LYS A1 1 90 ? -26.717 5.379 -27.034 1.0 17.73 80 A 1 -ATOM 1545 C CB . LYS A1 1 90 ? -28.427 2.855 -27.586 1.0 20.38 80 A 1 -ATOM 1546 C CG . LYS A1 1 90 ? -29.758 3.355 -27.028 1.0 27.39 80 A 1 -ATOM 1547 C CD . LYS A1 1 90 ? -30.847 3.366 -28.04 1.0 68.87 80 A 1 -ATOM 1548 C CE . LYS A1 1 90 ? -32.201 3.651 -27.4 1.0 54.25 80 A 1 -ATOM 1549 N NZ . LYS A1 1 90 ? -33.222 3.847 -28.464 1.0 93.55 80 A 1 -ATOM 1550 H HA . LYS A1 1 90 ? -28.325 3.908 -29.345 1.0 22.99 80 A 1 -ATOM 1551 H HB2 . LYS A1 1 90 ? -28.597 2.015 -28.04 1.0 24.45 80 A 1 -ATOM 1552 H HB3 . LYS A1 1 90 ? -27.83 2.711 -26.834 1.0 24.45 80 A 1 -ATOM 1553 H HG2 . LYS A1 1 90 ? -30.033 2.775 -26.3 1.0 32.86 80 A 1 -ATOM 1554 H HG3 . LYS A1 1 90 ? -29.643 4.262 -26.704 1.0 32.86 80 A 1 -ATOM 1555 H HD2 . LYS A1 1 90 ? -30.669 4.057 -28.697 1.0 82.65 80 A 1 -ATOM 1556 H HD3 . LYS A1 1 90 ? -30.892 2.5 -28.474 1.0 82.65 80 A 1 -ATOM 1557 H HE2 . LYS A1 1 90 ? -32.467 2.901 -26.845 1.0 65.1 80 A 1 -ATOM 1558 H HE3 . LYS A1 1 90 ? -32.148 4.458 -26.864 1.0 65.1 80 A 1 -ATOM 1559 H HZ1 . LYS A1 1 90 ? -34.016 4.009 -28.097 1.0 112.27 80 A 1 -ATOM 1560 H HZ2 . LYS A1 1 90 ? -32.996 4.537 -28.979 1.0 112.27 80 A 1 -ATOM 1561 H HZ3 . LYS A1 1 90 ? -33.28 3.117 -28.969 1.0 112.27 80 A 1 -ATOM 1562 N N . ARG A1 1 91 ? -28.304 6.176 -28.349 1.0 16.95 81 A 1 -ATOM 1563 C CA . ARG A1 1 91 ? -28.193 7.527 -27.832 1.0 16.38 81 A 1 -ATOM 1564 C C . ARG A1 1 91 ? -29.261 7.78 -26.774 1.0 16.3 81 A 1 -ATOM 1565 O O . ARG A1 1 91 ? -30.337 7.185 -26.774 1.0 18.37 81 A 1 -ATOM 1566 C CB . ARG A1 1 91 ? -28.31 8.5 -29.004 1.0 17.48 81 A 1 -ATOM 1567 C CG . ARG A1 1 91 ? -27.266 8.255 -30.107 1.0 18.08 81 A 1 -ATOM 1568 C CD . ARG A1 1 91 ? -25.897 8.677 -29.715 1.0 18.13 81 A 1 -ATOM 1569 N NE . ARG A1 1 91 ? -24.977 8.354 -30.825 1.0 17.18 81 A 1 -ATOM 1570 C CZ . ARG A1 1 91 ? -23.824 8.933 -31.028 1.0 17.88 81 A 1 -ATOM 1571 N NH1 . ARG A1 1 91 ? -23.393 9.904 -30.245 1.0 16.98 81 A 1 -ATOM 1572 N NH2 . ARG A1 1 91 ? -23.06 8.552 -32.077 1.0 18.16 81 A 1 -ATOM 1573 H H . ARG A1 1 91 ? -28.906 6.085 -28.957 1.0 20.35 81 A 1 -ATOM 1574 H HA . ARG A1 1 91 ? -27.342 7.674 -27.391 1.0 19.66 81 A 1 -ATOM 1575 H HB2 . ARG A1 1 91 ? -29.19 8.408 -29.402 1.0 20.97 81 A 1 -ATOM 1576 H HB3 . ARG A1 1 91 ? -28.189 9.404 -28.675 1.0 20.97 81 A 1 -ATOM 1577 H HG2 . ARG A1 1 91 ? -27.238 7.306 -30.31 1.0 21.69 81 A 1 -ATOM 1578 H HG3 . ARG A1 1 91 ? -27.518 8.756 -30.898 1.0 21.69 81 A 1 -ATOM 1579 H HD2 . ARG A1 1 91 ? -25.877 9.634 -29.552 1.0 21.76 81 A 1 -ATOM 1580 H HD3 . ARG A1 1 91 ? -25.616 8.2 -28.918 1.0 21.76 81 A 1 -ATOM 1581 H HE . ARG A1 1 91 ? -25.218 7.741 -31.377 1.0 20.62 81 A 1 -ATOM 1582 H HH11 . ARG A1 1 91 ? -23.875 10.169 -29.583 1.0 20.37 81 A 1 -ATOM 1583 H HH12 . ARG A1 1 91 ? -22.63 10.272 -30.396 1.0 20.37 81 A 1 -ATOM 1584 H HH21 . ARG A1 1 91 ? -23.334 7.932 -32.606 1.0 21.79 81 A 1 -ATOM 1585 H HH22 . ARG A1 1 91 ? -22.3 8.93 -32.215 1.0 21.79 81 A 1 -ATOM 1586 N N . TYR A1 1 92 ? -28.919 8.672 -25.85 1.0 15.62 82 A 1 -ATOM 1587 C CA . TYR A1 1 92 ? -29.819 9.028 -24.769 1.0 15.92 82 A 1 -ATOM 1588 C C . TYR A1 1 92 ? -29.619 10.489 -24.401 1.0 14.19 82 A 1 -ATOM 1589 O O . TYR A1 1 92 ? -28.598 11.122 -24.662 1.0 14.75 82 A 1 -ATOM 1590 C CB . TYR A1 1 92 ? -29.522 8.187 -23.478 1.0 14.89 82 A 1 -ATOM 1591 C CG . TYR A1 1 92 ? -28.219 8.54 -22.795 1.0 14.99 82 A 1 -ATOM 1592 C CD1 . TYR A1 1 92 ? -27.031 7.891 -23.142 1.0 15.54 82 A 1 -ATOM 1593 C CD2 . TYR A1 1 92 ? -28.145 9.526 -21.815 1.0 15.45 82 A 1 -ATOM 1594 C CE1 . TYR A1 1 92 ? -25.829 8.206 -22.543 1.0 14.69 82 A 1 -ATOM 1595 C CE2 . TYR A1 1 92 ? -26.927 9.887 -21.215 1.0 13.92 82 A 1 -ATOM 1596 C CZ . TYR A1 1 92 ? -25.778 9.216 -21.569 1.0 14.31 82 A 1 -ATOM 1597 O OH . TYR A1 1 92 ? -24.555 9.481 -21.008 1.0 14.7 82 A 1 -ATOM 1598 H H . TYR A1 1 92 ? -28.166 9.085 -25.831 1.0 18.74 82 A 1 -ATOM 1599 H HA . TYR A1 1 92 ? -30.728 8.882 -25.077 1.0 19.11 82 A 1 -ATOM 1600 H HB2 . TYR A1 1 92 ? -30.238 8.334 -22.84 1.0 17.87 82 A 1 -ATOM 1601 H HB3 . TYR A1 1 92 ? -29.482 7.249 -23.722 1.0 17.87 82 A 1 -ATOM 1602 H HD1 . TYR A1 1 92 ? -27.052 7.229 -23.795 1.0 18.65 82 A 1 -ATOM 1603 H HD2 . TYR A1 1 92 ? -28.924 9.959 -21.549 1.0 18.53 82 A 1 -ATOM 1604 H HE1 . TYR A1 1 92 ? -25.054 7.75 -22.784 1.0 17.63 82 A 1 -ATOM 1605 H HE2 . TYR A1 1 92 ? -26.897 10.571 -20.586 1.0 16.71 82 A 1 -ATOM 1606 H HH . TYR A1 1 92 ? -24.616 10.133 -20.481 1.0 17.64 82 A 1 -ATOM 1607 N N . ARG A1 1 93 ? -30.651 11.003 -23.745 1.0 15.64 83 A 1 -ATOM 1608 C CA . ARG A1 1 93 ? -30.632 12.292 -23.071 1.0 16.36 83 A 1 -ATOM 1609 C C . ARG A1 1 93 ? -31.374 12.172 -21.775 1.0 16.74 83 A 1 -ATOM 1610 O O . ARG A1 1 93 ? -32.48 11.657 -21.732 1.0 17.71 83 A 1 -ATOM 1611 C CB . ARG A1 1 93 ? -31.494 13.302 -23.869 1.0 22.41 83 A 1 -ATOM 1612 C CG . ARG A1 1 93 ? -30.876 13.75 -25.12 1.0 22.02 83 A 1 -ATOM 1613 C CD . ARG A1 1 93 ? -31.826 14.719 -25.785 1.0 22.22 83 A 1 -ATOM 1614 N NE . ARG A1 1 93 ? -31.118 15.293 -26.878 1.0 18.23 83 A 1 -ATOM 1615 C CZ . ARG A1 1 93 ? -31.615 15.475 -28.082 1.0 19.48 83 A 1 -ATOM 1616 N NH1 . ARG A1 1 93 ? -32.829 15.058 -28.405 1.0 20.36 83 A 1 -ATOM 1617 N NH2 . ARG A1 1 93 ? -30.874 16.069 -28.985 1.0 18.83 83 A 1 -ATOM 1618 H H . ARG A1 1 93 ? -31.41 10.605 -23.672 1.0 18.77 83 A 1 -ATOM 1619 H HA . ARG A1 1 93 ? -29.711 12.572 -22.95 1.0 19.64 83 A 1 -ATOM 1620 H HB2 . ARG A1 1 93 ? -32.34 12.883 -24.091 1.0 26.89 83 A 1 -ATOM 1621 H HB3 . ARG A1 1 93 ? -31.647 14.086 -23.318 1.0 26.89 83 A 1 -ATOM 1622 H HG2 . ARG A1 1 93 ? -30.036 14.199 -24.937 1.0 26.43 83 A 1 -ATOM 1623 H HG3 . ARG A1 1 93 ? -30.726 12.994 -25.709 1.0 26.43 83 A 1 -ATOM 1624 H HD2 . ARG A1 1 93 ? -32.611 14.255 -26.113 1.0 26.67 83 A 1 -ATOM 1625 H HD3 . ARG A1 1 93 ? -32.088 15.417 -25.164 1.0 26.67 83 A 1 -ATOM 1626 H HE . ARG A1 1 93 ? -30.305 15.539 -26.741 1.0 21.88 83 A 1 -ATOM 1627 H HH11 . ARG A1 1 93 ? -33.315 14.655 -27.821 1.0 24.43 83 A 1 -ATOM 1628 H HH12 . ARG A1 1 93 ? -33.132 15.189 -29.199 1.0 24.43 83 A 1 -ATOM 1629 H HH21 . ARG A1 1 93 ? -30.08 16.331 -28.784 1.0 22.59 83 A 1 -ATOM 1630 H HH22 . ARG A1 1 93 ? -31.182 16.197 -29.777 1.0 22.59 83 A 1 -ATOM 1631 N N . MET A1 1 94 ? -30.788 12.74 -20.714 1.0 15.23 84 A 1 -ATOM 1632 C CA . MET A1 1 94 ? -31.452 12.822 -19.399 1.0 15.13 84 A 1 -ATOM 1633 C C . MET A1 1 94 ? -32.308 14.07 -19.314 1.0 15.62 84 A 1 -ATOM 1634 O O . MET A1 1 94 ? -31.917 15.138 -19.811 1.0 16.74 84 A 1 -ATOM 1635 C CB . MET A1 1 94 ? -30.413 12.845 -18.289 1.0 14.98 84 A 1 -ATOM 1636 C CG . MET A1 1 94 ? -29.632 11.567 -18.21 1.0 15.5 84 A 1 -ATOM 1637 S SD . MET A1 1 94 ? -28.323 11.539 -16.929 1.0 15.81 84 A 1 -ATOM 1638 C CE . MET A1 1 94 ? -29.273 11.667 -15.41 1.0 16.82 84 A 1 -ATOM 1639 H H . MET A1 1 94 ? -30.002 13.088 -20.727 1.0 18.28 84 A 1 -ATOM 1640 H HA . MET A1 1 94 ? -32.017 12.043 -19.28 1.0 18.15 84 A 1 -ATOM 1641 H HB2 . MET A1 1 94 ? -29.79 13.57 -18.453 1.0 17.98 84 A 1 -ATOM 1642 H HB3 . MET A1 1 94 ? -30.86 12.979 -17.439 1.0 17.98 84 A 1 -ATOM 1643 H HG2 . MET A1 1 94 ? -30.247 10.843 -18.013 1.0 18.6 84 A 1 -ATOM 1644 H HG3 . MET A1 1 94 ? -29.204 11.415 -19.067 1.0 18.6 84 A 1 -ATOM 1645 H HE1 . MET A1 1 94 ? -28.666 11.633 -14.654 1.0 20.18 84 A 1 -ATOM 1646 H HE2 . MET A1 1 94 ? -29.756 12.508 -15.409 1.0 20.18 84 A 1 -ATOM 1647 H HE3 . MET A1 1 94 ? -29.898 10.926 -15.365 1.0 20.18 84 A 1 -ATOM 1648 N N . THR A1 1 95 ? -33.43 13.973 -18.637 1.0 17.11 85 A 1 -ATOM 1649 C CA . THR A1 1 95 ? -34.204 15.158 -18.413 1.0 16.78 85 A 1 -ATOM 1650 C C . THR A1 1 95 ? -33.522 16.062 -17.385 1.0 18.12 85 A 1 -ATOM 1651 O O . THR A1 1 95 ? -32.725 15.6 -16.557 1.0 17.78 85 A 1 -ATOM 1652 C CB . THR A1 1 95 ? -35.608 14.811 -17.893 1.0 18.59 85 A 1 -ATOM 1653 O OG1 . THR A1 1 95 ? -35.473 14.24 -16.592 1.0 19.1 85 A 1 -ATOM 1654 C CG2 . THR A1 1 95 ? -36.39 13.835 -18.775 1.0 20.46 85 A 1 -ATOM 1655 H H . THR A1 1 95 ? -33.754 13.248 -18.307 1.0 20.53 85 A 1 -ATOM 1656 H HA . THR A1 1 95 ? -34.288 15.63 -19.256 1.0 20.14 85 A 1 -ATOM 1657 H HB . THR A1 1 95 ? -36.126 15.631 -17.887 1.0 22.31 85 A 1 -ATOM 1658 H HG1 . THR A1 1 95 ? -35.815 14.75 -16.018 1.0 22.92 85 A 1 -ATOM 1659 H HG21 . THR A1 1 95 ? -37.261 13.661 -18.385 1.0 24.55 85 A 1 -ATOM 1660 H HG22 . THR A1 1 95 ? -36.511 14.212 -19.661 1.0 24.55 85 A 1 -ATOM 1661 H HG23 . THR A1 1 95 ? -35.906 12.998 -18.853 1.0 24.55 85 A 1 -ATOM 1662 N N . PRO A1 1 96 ? -33.929 17.326 -17.332 1.0 18.46 86 A 1 -ATOM 1663 C CA . PRO A1 1 96 ? -33.405 18.186 -16.265 1.0 19.91 86 A 1 -ATOM 1664 C C . PRO A1 1 96 ? -33.725 17.657 -14.881 1.0 21.3 86 A 1 -ATOM 1665 O O . PRO A1 1 96 ? -32.847 17.719 -13.998 1.0 20.85 86 A 1 -ATOM 1666 C CB . PRO A1 1 96 ? -34.046 19.553 -16.558 1.0 22.04 86 A 1 -ATOM 1667 C CG . PRO A1 1 96 ? -34.35 19.533 -18.042 1.0 23.86 86 A 1 -ATOM 1668 C CD . PRO A1 1 96 ? -34.649 18.111 -18.372 1.0 21.99 86 A 1 -ATOM 1669 H HA . PRO A1 1 96 ? -32.444 18.285 -16.35 1.0 23.89 86 A 1 -ATOM 1670 H HB2 . PRO A1 1 96 ? -34.859 19.655 -16.039 1.0 26.45 86 A 1 -ATOM 1671 H HB3 . PRO A1 1 96 ? -33.422 20.263 -16.341 1.0 26.45 86 A 1 -ATOM 1672 H HG2 . PRO A1 1 96 ? -35.117 20.097 -18.227 1.0 28.63 86 A 1 -ATOM 1673 H HG3 . PRO A1 1 96 ? -33.579 19.847 -18.539 1.0 28.63 86 A 1 -ATOM 1674 H HD2 . PRO A1 1 96 ? -35.603 17.944 -18.325 1.0 26.39 86 A 1 -ATOM 1675 H HD3 . PRO A1 1 96 ? -34.317 17.89 -19.256 1.0 26.39 86 A 1 -ATOM 1676 N N . GLU A1 1 97 ? -34.913 17.095 -14.678 1.0 20.88 87 A 1 -ATOM 1677 C CA . GLU A1 1 97 ? -35.248 16.53 -13.376 1.0 23.25 87 A 1 -ATOM 1678 C C . GLU A1 1 97 ? -34.32 15.384 -13.028 1.0 22.29 87 A 1 -ATOM 1679 O O . GLU A1 1 97 ? -33.896 15.249 -11.868 1.0 22.46 87 A 1 -ATOM 1680 C CB . GLU A1 1 97 ? -36.726 16.062 -13.378 1.0 24.95 87 A 1 -ATOM 1681 C CG . GLU A1 1 97 ? -37.172 15.456 -12.039 1.0 28.58 87 A 1 -ATOM 1682 C CD . GLU A1 1 97 ? -37.193 13.916 -11.941 1.0 45.22 87 A 1 -ATOM 1683 O OE1 . GLU A1 1 97 ? -37.011 13.143 -12.932 1.0 28.91 87 A 1 -ATOM 1684 O OE2 . GLU A1 1 97 ? -37.407 13.448 -10.804 1.0 52.28 87 A 1 -ATOM 1685 H H . GLU A1 1 97 ? -35.535 17.029 -15.269 1.0 25.06 87 A 1 -ATOM 1686 H HA . GLU A1 1 97 ? -35.146 17.214 -12.696 1.0 27.9 87 A 1 -ATOM 1687 H HB2 . GLU A1 1 97 ? -37.296 16.824 -13.565 1.0 29.94 87 A 1 -ATOM 1688 H HB3 . GLU A1 1 97 ? -36.839 15.385 -14.064 1.0 29.94 87 A 1 -ATOM 1689 H HG2 . GLU A1 1 97 ? -36.568 15.774 -11.349 1.0 34.3 87 A 1 -ATOM 1690 H HG3 . GLU A1 1 97 ? -38.074 15.762 -11.857 1.0 34.3 87 A 1 -ATOM 1691 N N . GLU A1 1 98 ? -34.071 14.482 -13.981 1.0 20.18 88 A 1 -ATOM 1692 C CA . GLU A1 1 98 ? -33.161 13.373 -13.714 1.0 19.89 88 A 1 -ATOM 1693 C C . GLU A1 1 98 ? -31.803 13.903 -13.314 1.0 18.11 88 A 1 -ATOM 1694 O O . GLU A1 1 98 ? -31.186 13.405 -12.387 1.0 18.98 88 A 1 -ATOM 1695 C CB . GLU A1 1 98 ? -33.014 12.467 -14.946 1.0 19.19 88 A 1 -ATOM 1696 C CG . GLU A1 1 98 ? -34.106 11.498 -15.15 1.0 21.43 88 A 1 -ATOM 1697 C CD . GLU A1 1 98 ? -33.849 10.736 -16.427 1.0 24.23 88 A 1 -ATOM 1698 O OE1 . GLU A1 1 98 ? -33.757 11.338 -17.533 1.0 22.3 88 A 1 -ATOM 1699 O OE2 . GLU A1 1 98 ? -33.855 9.489 -16.373 1.0 26.44 88 A 1 -ATOM 1700 H H . GLU A1 1 98 ? -34.409 14.491 -14.772 1.0 24.21 88 A 1 -ATOM 1701 H HA . GLU A1 1 98 ? -33.532 12.837 -12.996 1.0 23.87 88 A 1 -ATOM 1702 H HB2 . GLU A1 1 98 ? -32.975 13.028 -15.736 1.0 23.03 88 A 1 -ATOM 1703 H HB3 . GLU A1 1 98 ? -32.192 11.961 -14.857 1.0 23.03 88 A 1 -ATOM 1704 H HG2 . GLU A1 1 98 ? -34.137 10.873 -14.409 1.0 25.72 88 A 1 -ATOM 1705 H HG3 . GLU A1 1 98 ? -34.953 11.965 -15.226 1.0 25.72 88 A 1 -ATOM 1706 N N . ILE A1 1 99 ? -31.31 14.899 -14.045 1.0 16.94 89 A 1 -ATOM 1707 C CA . ILE A1 1 99 ? -29.969 15.431 -13.787 1.0 17.09 89 A 1 -ATOM 1708 C C . ILE A1 1 99 ? -29.89 16.103 -12.414 1.0 15.71 89 A 1 -ATOM 1709 O O . ILE A1 1 99 ? -28.961 15.853 -11.647 1.0 16.59 89 A 1 -ATOM 1710 C CB . ILE A1 1 99 ? -29.544 16.386 -14.905 1.0 15.41 89 A 1 -ATOM 1711 C CG1 . ILE A1 1 99 ? -29.521 15.7 -16.272 1.0 15.57 89 A 1 -ATOM 1712 C CG2 . ILE A1 1 99 ? -28.183 17.005 -14.57 1.0 15.85 89 A 1 -ATOM 1713 C CD1 . ILE A1 1 99 ? -29.507 16.642 -17.451 1.0 15.94 89 A 1 -ATOM 1714 H H . ILE A1 1 99 ? -31.725 15.283 -14.692 1.0 20.33 89 A 1 -ATOM 1715 H HA . ILE A1 1 99 ? -29.353 14.682 -13.777 1.0 20.5 89 A 1 -ATOM 1716 H HB . ILE A1 1 99 ? -30.208 17.091 -14.961 1.0 18.49 89 A 1 -ATOM 1717 H HG12 . ILE A1 1 99 ? -28.724 15.151 -16.328 1.0 18.69 89 A 1 -ATOM 1718 H HG13 . ILE A1 1 99 ? -30.313 15.145 -16.352 1.0 18.69 89 A 1 -ATOM 1719 H HG21 . ILE A1 1 99 ? -27.815 17.411 -15.371 1.0 19.02 89 A 1 -ATOM 1720 H HG22 . ILE A1 1 99 ? -28.303 17.679 -13.883 1.0 19.02 89 A 1 -ATOM 1721 H HG23 . ILE A1 1 99 ? -27.59 16.308 -14.249 1.0 19.02 89 A 1 -ATOM 1722 H HD11 . ILE A1 1 99 ? -29.593 16.127 -18.268 1.0 19.13 89 A 1 -ATOM 1723 H HD12 . ILE A1 1 99 ? -30.25 17.26 -17.37 1.0 19.13 89 A 1 -ATOM 1724 H HD13 . ILE A1 1 99 ? -28.669 17.131 -17.454 1.0 19.13 89 A 1 -ATOM 1725 N N . VAL A1 1 100 ? -30.836 16.987 -12.131 1.0 16.79 90 A 1 -ATOM 1726 C CA . VAL A1 1 100 ? -30.813 17.704 -10.843 1.0 17.53 90 A 1 -ATOM 1727 C C . VAL A1 1 100 ? -30.925 16.727 -9.695 1.0 17.23 90 A 1 -ATOM 1728 O O . VAL A1 1 100 ? -30.188 16.839 -8.684 1.0 17.2 90 A 1 -ATOM 1729 C CB . VAL A1 1 100 ? -31.91 18.774 -10.819 1.0 17.86 90 A 1 -ATOM 1730 C CG1 . VAL A1 1 100 ? -32.101 19.362 -9.426 1.0 19.56 90 A 1 -ATOM 1731 C CG2 . VAL A1 1 100 ? -31.616 19.875 -11.823 1.0 20.33 90 A 1 -ATOM 1732 H H . VAL A1 1 100 ? -31.492 17.192 -12.648 1.0 20.15 90 A 1 -ATOM 1733 H HA . VAL A1 1 100 ? -29.962 18.159 -10.746 1.0 21.04 90 A 1 -ATOM 1734 H HB . VAL A1 1 100 ? -32.743 18.343 -11.069 1.0 21.44 90 A 1 -ATOM 1735 H HG11 . VAL A1 1 100 ? -32.625 20.175 -9.496 1.0 23.47 90 A 1 -ATOM 1736 H HG12 . VAL A1 1 100 ? -32.566 18.716 -8.872 1.0 23.47 90 A 1 -ATOM 1737 H HG13 . VAL A1 1 100 ? -31.232 19.56 -9.045 1.0 23.47 90 A 1 -ATOM 1738 H HG21 . VAL A1 1 100 ? -32.33 20.53 -11.79 1.0 24.39 90 A 1 -ATOM 1739 H HG22 . VAL A1 1 100 ? -30.772 20.293 -11.594 1.0 24.39 90 A 1 -ATOM 1740 H HG23 . VAL A1 1 100 ? -31.563 19.487 -12.71 1.0 24.39 90 A 1 -ATOM 1741 N N . GLU A1 1 101 ? -31.857 15.771 -9.782 1.0 17.42 91 A 1 -ATOM 1742 C CA . GLU A1 1 101 ? -32.002 14.834 -8.655 1.0 19.21 91 A 1 -ATOM 1743 C C . GLU A1 1 101 ? -30.795 13.934 -8.482 1.0 18.69 91 A 1 -ATOM 1744 O O . GLU A1 1 101 ? -30.398 13.577 -7.36 1.0 19.18 91 A 1 -ATOM 1745 C CB . GLU A1 1 101 ? -33.324 14.059 -8.787 1.0 21.48 91 A 1 -ATOM 1746 C CG . GLU A1 1 101 ? -34.532 14.953 -8.603 1.0 25.57 91 A 1 -ATOM 1747 C CD . GLU A1 1 101 ? -34.43 15.831 -7.335 1.0 35.3 91 A 1 -ATOM 1748 O OE1 . GLU A1 1 101 ? -34.153 15.286 -6.237 1.0 28.5 91 A 1 -ATOM 1749 O OE2 . GLU A1 1 101 ? -34.551 17.071 -7.472 1.0 34.9 91 A 1 -ATOM 1750 H H . GLU A1 1 101 ? -32.391 15.647 -10.445 1.0 20.9 91 A 1 -ATOM 1751 H HA . GLU A1 1 101 ? -32.06 15.337 -7.828 1.0 23.05 91 A 1 -ATOM 1752 H HB2 . GLU A1 1 101 ? -33.373 13.662 -9.671 1.0 25.78 91 A 1 -ATOM 1753 H HB3 . GLU A1 1 101 ? -33.354 13.365 -8.11 1.0 25.78 91 A 1 -ATOM 1754 H HG2 . GLU A1 1 101 ? -34.612 15.54 -9.371 1.0 30.69 91 A 1 -ATOM 1755 H HG3 . GLU A1 1 101 ? -35.326 14.401 -8.524 1.0 30.69 91 A 1 -ATOM 1756 N N . ARG A1 1 102 ? -30.167 13.552 -9.581 1.0 17.85 92 A 1 -ATOM 1757 C CA . ARG A1 1 102 ? -28.951 12.768 -9.49 1.0 17.65 92 A 1 -ATOM 1758 C C . ARG A1 1 102 ? -27.815 13.566 -8.894 1.0 16.65 92 A 1 -ATOM 1759 O O . ARG A1 1 102 ? -27.04 13.053 -8.062 1.0 17.54 92 A 1 -ATOM 1760 C CB . ARG A1 1 102 ? -28.602 12.215 -10.868 1.0 17.86 92 A 1 -ATOM 1761 C CG . ARG A1 1 102 ? -27.485 11.262 -10.881 1.0 18.98 92 A 1 -ATOM 1762 C CD . ARG A1 1 102 ? -27.745 9.949 -10.188 1.0 19.95 92 A 1 -ATOM 1763 N NE . ARG A1 1 102 ? -26.622 9.087 -10.366 1.0 19.6 92 A 1 -ATOM 1764 C CZ . ARG A1 1 102 ? -26.511 7.851 -9.915 1.0 19.2 92 A 1 -ATOM 1765 N NH1 . ARG A1 1 102 ? -27.499 7.247 -9.294 1.0 21.48 92 A 1 -ATOM 1766 N NH2 . ARG A1 1 102 ? -25.399 7.229 -10.235 1.0 21.52 92 A 1 -ATOM 1767 H H . ARG A1 1 102 ? -30.421 13.73 -10.383 1.0 21.42 92 A 1 -ATOM 1768 H HA . ARG A1 1 102 ? -29.097 12.014 -8.897 1.0 21.18 92 A 1 -ATOM 1769 H HB2 . ARG A1 1 102 ? -29.38 11.757 -11.222 1.0 21.44 92 A 1 -ATOM 1770 H HB3 . ARG A1 1 102 ? -28.361 12.955 -11.446 1.0 21.44 92 A 1 -ATOM 1771 H HG2 . ARG A1 1 102 ? -27.264 11.062 -11.804 1.0 22.77 92 A 1 -ATOM 1772 H HG3 . ARG A1 1 102 ? -26.726 11.675 -10.44 1.0 22.77 92 A 1 -ATOM 1773 H HD2 . ARG A1 1 102 ? -27.878 10.099 -9.239 1.0 23.94 92 A 1 -ATOM 1774 H HD3 . ARG A1 1 102 ? -28.529 9.526 -10.571 1.0 23.94 92 A 1 -ATOM 1775 H HE . ARG A1 1 102 ? -25.955 9.401 -10.809 1.0 23.52 92 A 1 -ATOM 1776 H HH11 . ARG A1 1 102 ? -28.245 7.658 -9.172 1.0 25.77 92 A 1 -ATOM 1777 H HH12 . ARG A1 1 102 ? -27.4 6.442 -9.01 1.0 25.77 92 A 1 -ATOM 1778 H HH21 . ARG A1 1 102 ? -24.804 7.629 -10.709 1.0 25.83 92 A 1 -ATOM 1779 H HH22 . ARG A1 1 102 ? -25.266 6.421 -9.971 1.0 25.83 92 A 1 -ATOM 1780 N N . ALA A1 1 103 ? -27.717 14.828 -9.251 1.0 15.86 93 A 1 -ATOM 1781 C CA . ALA A1 1 103 ? -26.745 15.715 -8.631 1.0 15.06 93 A 1 -ATOM 1782 C C . ALA A1 1 103 ? -27.015 15.856 -7.142 1.0 16.83 93 A 1 -ATOM 1783 O O . ALA A1 1 103 ? -26.067 15.788 -6.347 1.0 16.4 93 A 1 -ATOM 1784 C CB . ALA A1 1 103 ? -26.761 17.09 -9.275 1.0 16.52 93 A 1 -ATOM 1785 H H . ALA A1 1 103 ? -28.201 15.205 -9.854 1.0 19.03 93 A 1 -ATOM 1786 H HA . ALA A1 1 103 ? -25.865 15.331 -8.768 1.0 18.08 93 A 1 -ATOM 1787 H HB1 . ALA A1 1 103 ? -26.107 17.654 -8.832 1.0 19.82 93 A 1 -ATOM 1788 H HB2 . ALA A1 1 103 ? -26.537 17.001 -10.215 1.0 19.82 93 A 1 -ATOM 1789 H HB3 . ALA A1 1 103 ? -27.647 17.473 -9.18 1.0 19.82 93 A 1 -ATOM 1790 N N . ARG A1 1 104 ? -28.281 16.01 -6.75 1.0 15.59 94 A 1 -ATOM 1791 C CA . ARG A1 1 104 ? -28.584 16.096 -5.321 1.0 17.86 94 A 1 -ATOM 1792 C C . ARG A1 1 104 ? -28.084 14.869 -4.575 1.0 17.77 94 A 1 -ATOM 1793 O O . ARG A1 1 104 ? -27.555 14.987 -3.463 1.0 17.57 94 A 1 -ATOM 1794 C CB . ARG A1 1 104 ? -30.09 16.259 -5.188 1.0 18.79 94 A 1 -ATOM 1795 C CG . ARG A1 1 104 ? -30.51 16.538 -3.763 1.0 19.86 94 A 1 -ATOM 1796 C CD . ARG A1 1 104 ? -32.026 16.571 -3.558 1.0 23.56 94 A 1 -ATOM 1797 N NE . ARG A1 1 104 ? -32.723 17.33 -4.563 1.0 24.05 94 A 1 -ATOM 1798 C CZ . ARG A1 1 104 ? -32.682 18.656 -4.675 1.0 26.69 94 A 1 -ATOM 1799 N NH1 . ARG A1 1 104 ? -33.33 19.259 -5.671 1.0 27.31 94 A 1 -ATOM 1800 N NH2 . ARG A1 1 104 ? -32.066 19.406 -3.77 1.0 28.92 94 A 1 -ATOM 1801 H H . ARG A1 1 104 ? -28.96 16.067 -7.274 1.0 18.71 94 A 1 -ATOM 1802 H HA . ARG A1 1 104 ? -28.142 16.859 -4.917 1.0 21.43 94 A 1 -ATOM 1803 H HB2 . ARG A1 1 104 ? -30.379 17.001 -5.741 1.0 22.55 94 A 1 -ATOM 1804 H HB3 . ARG A1 1 104 ? -30.525 15.441 -5.477 1.0 22.55 94 A 1 -ATOM 1805 H HG2 . ARG A1 1 104 ? -30.15 15.843 -3.19 1.0 23.83 94 A 1 -ATOM 1806 H HG3 . ARG A1 1 104 ? -30.158 17.402 -3.498 1.0 23.83 94 A 1 -ATOM 1807 H HD2 . ARG A1 1 104 ? -32.365 15.663 -3.583 1.0 28.27 94 A 1 -ATOM 1808 H HD3 . ARG A1 1 104 ? -32.217 16.974 -2.696 1.0 28.27 94 A 1 -ATOM 1809 H HE . ARG A1 1 104 ? -33.2 16.896 -5.132 1.0 28.86 94 A 1 -ATOM 1810 H HH11 . ARG A1 1 104 ? -33.774 18.791 -6.24 1.0 32.78 94 A 1 -ATOM 1811 H HH12 . ARG A1 1 104 ? -33.305 20.115 -5.745 1.0 32.78 94 A 1 -ATOM 1812 H HH21 . ARG A1 1 104 ? -31.683 19.036 -3.095 1.0 34.71 94 A 1 -ATOM 1813 H HH22 . ARG A1 1 104 ? -32.05 20.261 -3.859 1.0 34.71 94 A 1 -ATOM 1814 N N . LEU A1 1 105 ? -28.234 13.679 -5.148 1.0 17.01 95 A 1 -ATOM 1815 C CA . LEU A1 1 105 ? -27.759 12.48 -4.495 1.0 17.43 95 A 1 -ATOM 1816 C C . LEU A1 1 105 ? -26.245 12.478 -4.359 1.0 16.61 95 A 1 -ATOM 1817 O O . LEU A1 1 105 ? -25.715 12.113 -3.298 1.0 17.64 95 A 1 -ATOM 1818 C CB . LEU A1 1 105 ? -28.241 11.266 -5.281 1.0 19.54 95 A 1 -ATOM 1819 C CG . LEU A1 1 105 ? -28.135 9.959 -4.545 1.0 22.21 95 A 1 -ATOM 1820 C CD1 . LEU A1 1 105 ? -29.04 9.943 -3.295 1.0 24.47 95 A 1 -ATOM 1821 C CD2 . LEU A1 1 105 ? -28.571 8.894 -5.56 1.0 28.69 95 A 1 -ATOM 1822 H H . LEU A1 1 105 ? -28.606 13.545 -5.911 1.0 20.41 95 A 1 -ATOM 1823 H HA . LEU A1 1 105 ? -28.125 12.434 -3.598 1.0 20.92 95 A 1 -ATOM 1824 H HB2 . LEU A1 1 105 ? -29.174 11.398 -5.51 1.0 23.45 95 A 1 -ATOM 1825 H HB3 . LEU A1 1 105 ? -27.709 11.191 -6.089 1.0 23.45 95 A 1 -ATOM 1826 H HG . LEU A1 1 105 ? -27.238 9.794 -4.216 1.0 26.65 95 A 1 -ATOM 1827 H HD11 . LEU A1 1 105 ? -29.112 9.033 -2.969 1.0 29.37 95 A 1 -ATOM 1828 H HD12 . LEU A1 1 105 ? -28.646 10.509 -2.613 1.0 29.37 95 A 1 -ATOM 1829 H HD13 . LEU A1 1 105 ? -29.918 10.278 -3.536 1.0 29.37 95 A 1 -ATOM 1830 H HD21 . LEU A1 1 105 ? -28.552 8.023 -5.132 1.0 34.42 95 A 1 -ATOM 1831 H HD22 . LEU A1 1 105 ? -29.471 9.094 -5.862 1.0 34.42 95 A 1 -ATOM 1832 H HD23 . LEU A1 1 105 ? -27.96 8.905 -6.313 1.0 34.42 95 A 1 -ATOM 1833 N N . ALA A1 1 106 ? -25.521 12.917 -5.393 1.0 15.44 96 A 1 -ATOM 1834 C CA . ALA A1 1 106 ? -24.07 13.006 -5.255 1.0 16.0 96 A 1 -ATOM 1835 C C . ALA A1 1 106 ? -23.652 13.971 -4.166 1.0 16.36 96 A 1 -ATOM 1836 O O . ALA A1 1 106 ? -22.719 13.688 -3.412 1.0 16.63 96 A 1 -ATOM 1837 C CB . ALA A1 1 106 ? -23.449 13.466 -6.588 1.0 14.84 96 A 1 -ATOM 1838 H H . ALA A1 1 106 ? -25.836 13.16 -6.156 1.0 18.53 96 A 1 -ATOM 1839 H HA . ALA A1 1 106 ? -23.743 12.122 -5.024 1.0 19.21 96 A 1 -ATOM 1840 H HB1 . ALA A1 1 106 ? -22.52 13.703 -6.439 1.0 17.81 96 A 1 -ATOM 1841 H HB2 . ALA A1 1 106 ? -23.506 12.742 -7.23 1.0 17.81 96 A 1 -ATOM 1842 H HB3 . ALA A1 1 106 ? -23.938 14.238 -6.915 1.0 17.81 96 A 1 -ATOM 1843 N N . VAL A1 1 107 ? -24.341 15.124 -4.074 1.0 16.46 97 A 1 -ATOM 1844 C CA . VAL A1 1 107 ? -24.052 16.077 -2.997 1.0 16.86 97 A 1 -ATOM 1845 C C . VAL A1 1 107 ? -24.272 15.43 -1.641 1.0 18.03 97 A 1 -ATOM 1846 O O . VAL A1 1 107 ? -23.455 15.596 -0.741 1.0 18.63 97 A 1 -ATOM 1847 C CB . VAL A1 1 107 ? -24.883 17.332 -3.232 1.0 16.98 97 A 1 -ATOM 1848 C CG1 . VAL A1 1 107 ? -24.796 18.309 -2.072 1.0 20.67 97 A 1 -ATOM 1849 C CG2 . VAL A1 1 107 ? -24.49 18.031 -4.52 1.0 18.41 97 A 1 -ATOM 1850 H H . VAL A1 1 107 ? -24.965 15.369 -4.613 1.0 19.75 97 A 1 -ATOM 1851 H HA . VAL A1 1 107 ? -23.118 16.338 -3.009 1.0 20.24 97 A 1 -ATOM 1852 H HB . VAL A1 1 107 ? -25.804 17.04 -3.306 1.0 20.38 97 A 1 -ATOM 1853 H HG11 . VAL A1 1 107 ? -25.22 19.143 -2.329 1.0 24.8 97 A 1 -ATOM 1854 H HG12 . VAL A1 1 107 ? -25.251 17.929 -1.304 1.0 24.8 97 A 1 -ATOM 1855 H HG13 . VAL A1 1 107 ? -23.862 18.465 -1.86 1.0 24.8 97 A 1 -ATOM 1856 H HG21 . VAL A1 1 107 ? -25.0 18.853 -4.602 1.0 22.09 97 A 1 -ATOM 1857 H HG22 . VAL A1 1 107 ? -23.541 18.232 -4.493 1.0 22.09 97 A 1 -ATOM 1858 H HG23 . VAL A1 1 107 ? -24.683 17.446 -5.269 1.0 22.09 97 A 1 -ATOM 1859 N N . GLN A1 1 108 ? -25.355 14.658 -1.505 1.0 18.27 98 A 1 -ATOM 1860 C CA . GLN A1 1 108 ? -25.642 13.987 -0.235 1.0 18.74 98 A 1 -ATOM 1861 C C . GLN A1 1 108 ? -24.575 12.951 0.071 1.0 18.55 98 A 1 -ATOM 1862 O O . GLN A1 1 108 ? -24.306 12.694 1.253 1.0 20.9 98 A 1 -ATOM 1863 C CB . GLN A1 1 108 ? -27.027 13.4 -0.304 1.0 19.1 98 A 1 -ATOM 1864 C CG . GLN A1 1 108 ? -28.065 14.512 -0.226 1.0 19.98 98 A 1 -ATOM 1865 C CD . GLN A1 1 108 ? -29.493 14.093 -0.449 1.0 24.26 98 A 1 -ATOM 1866 O OE1 . GLN A1 1 108 ? -29.771 12.97 -0.858 1.0 25.89 98 A 1 -ATOM 1867 N NE2 . GLN A1 1 108 ? -30.428 15.004 -0.171 1.0 23.13 98 A 1 -ATOM 1868 H H . GLN A1 1 108 ? -25.932 14.507 -2.125 1.0 21.93 98 A 1 -ATOM 1869 H HA . GLN A1 1 108 ? -25.634 14.616 0.504 1.0 22.48 98 A 1 -ATOM 1870 H HB2 . GLN A1 1 108 ? -27.14 12.927 -1.143 1.0 22.93 98 A 1 -ATOM 1871 H HB3 . GLN A1 1 108 ? -27.163 12.793 0.44 1.0 22.93 98 A 1 -ATOM 1872 H HG2 . GLN A1 1 108 ? -28.018 14.91 0.657 1.0 23.98 98 A 1 -ATOM 1873 H HG3 . GLN A1 1 108 ? -27.852 15.175 -0.901 1.0 23.98 98 A 1 -ATOM 1874 H HE21 . GLN A1 1 108 ? -30.198 15.78 0.119 1.0 27.76 98 A 1 -ATOM 1875 H HE22 . GLN A1 1 108 ? -31.259 14.815 -0.281 1.0 27.76 98 A 1 -ATOM 1876 N N . PHE A1 1 109 ? -24.049 12.262 -0.922 1.0 19.14 99 A 1 -ATOM 1877 C CA . PHE A1 1 109 ? -22.95 11.33 -0.751 1.0 19.16 99 A 1 -ATOM 1878 C C . PHE A1 1 109 ? -21.632 12.002 -0.48 1.0 20.68 99 A 1 -ATOM 1879 O O . PHE A1 1 109 ? -20.646 11.312 -0.205 1.0 23.33 99 A 1 -ATOM 1880 C CB . PHE A1 1 109 ? -22.811 10.436 -1.999 1.0 18.38 99 A 1 -ATOM 1881 C CG . PHE A1 1 109 ? -23.651 9.193 -2.0 1.0 20.54 99 A 1 -ATOM 1882 C CD1 . PHE A1 1 109 ? -24.975 9.224 -2.318 1.0 26.44 99 A 1 -ATOM 1883 C CD2 . PHE A1 1 109 ? -23.082 7.959 -1.744 1.0 25.82 99 A 1 -ATOM 1884 C CE1 . PHE A1 1 109 ? -25.751 8.051 -2.354 1.0 27.25 99 A 1 -ATOM 1885 C CE2 . PHE A1 1 109 ? -23.848 6.794 -1.781 1.0 29.92 99 A 1 -ATOM 1886 C CZ . PHE A1 1 109 ? -25.183 6.849 -2.083 1.0 23.96 99 A 1 -ATOM 1887 H H . PHE A1 1 109 ? -24.32 12.315 -1.737 1.0 22.97 99 A 1 -ATOM 1888 H HA . PHE A1 1 109 ? -23.157 10.766 0.01 1.0 23.0 99 A 1 -ATOM 1889 H HB2 . PHE A1 1 109 ? -23.065 10.957 -2.777 1.0 22.05 99 A 1 -ATOM 1890 H HB3 . PHE A1 1 109 ? -21.884 10.158 -2.074 1.0 22.05 99 A 1 -ATOM 1891 H HD1 . PHE A1 1 109 ? -25.375 10.039 -2.517 1.0 31.73 99 A 1 -ATOM 1892 H HD2 . PHE A1 1 109 ? -22.175 7.904 -1.546 1.0 30.99 99 A 1 -ATOM 1893 H HE1 . PHE A1 1 109 ? -26.655 8.1 -2.564 1.0 32.69 99 A 1 -ATOM 1894 H HE2 . PHE A1 1 109 ? -23.45 5.974 -1.598 1.0 35.91 99 A 1 -ATOM 1895 H HZ . PHE A1 1 109 ? -25.694 6.072 -2.103 1.0 28.76 99 A 1 -ATOM 1896 N N . GLY A1 1 110 ? -21.568 13.337 -0.568 1.0 20.14 100 A 1 -ATOM 1897 C CA . GLY A1 1 110 ? -20.394 14.085 -0.178 1.0 20.48 100 A 1 -ATOM 1898 C C . GLY A1 1 110 ? -19.597 14.761 -1.272 1.0 20.13 100 A 1 -ATOM 1899 O O . GLY A1 1 110 ? -18.539 15.328 -0.989 1.0 21.86 100 A 1 -ATOM 1900 H H . GLY A1 1 110 ? -22.21 13.83 -0.858 1.0 24.16 100 A 1 -ATOM 1901 H HA2 . GLY A1 1 110 ? -20.673 14.779 0.44 1.0 24.58 100 A 1 -ATOM 1902 H HA3 . GLY A1 1 110 ? -19.791 13.478 0.28 1.0 24.58 100 A 1 -ATOM 1903 N N . ALA A1 1 111 ? -20.005 14.675 -2.56 1.0 19.63 101 A 1 -ATOM 1904 C CA . ALA A1 1 111 ? -19.303 15.392 -3.622 1.0 18.21 101 A 1 -ATOM 1905 C C . ALA A1 1 111 ? -19.462 16.889 -3.41 1.0 16.3 101 A 1 -ATOM 1906 O O . ALA A1 1 111 ? -20.561 17.382 -3.225 1.0 19.7 101 A 1 -ATOM 1907 C CB . ALA A1 1 111 ? -19.892 15.002 -4.973 1.0 21.16 101 A 1 -ATOM 1908 H H . ALA A1 1 111 ? -20.678 14.212 -2.829 1.0 23.55 101 A 1 -ATOM 1909 H HA . ALA A1 1 111 ? -18.359 15.167 -3.613 1.0 21.85 101 A 1 -ATOM 1910 H HB1 . ALA A1 1 111 ? -19.428 15.487 -5.673 1.0 25.4 101 A 1 -ATOM 1911 H HB2 . ALA A1 1 111 ? -19.78 14.047 -5.103 1.0 25.4 101 A 1 -ATOM 1912 H HB3 . ALA A1 1 111 ? -20.835 15.228 -4.984 1.0 25.4 101 A 1 -ATOM 1913 N N . LYS A1 1 112 ? -18.339 17.596 -3.546 1.0 15.96 102 A 1 -ATOM 1914 C CA . LYS A1 1 112 ? -18.362 19.051 -3.39 1.0 16.22 102 A 1 -ATOM 1915 C C . LYS A1 1 112 ? -18.31 19.818 -4.695 1.0 14.89 102 A 1 -ATOM 1916 O O . LYS A1 1 112 ? -18.438 21.064 -4.682 1.0 15.68 102 A 1 -ATOM 1917 C CB . LYS A1 1 112 ? -17.237 19.49 -2.461 1.0 17.91 102 A 1 -ATOM 1918 C CG . LYS A1 1 112 ? -17.488 18.882 -1.023 1.0 22.19 102 A 1 -ATOM 1919 C CD . LYS A1 1 112 ? -16.602 19.533 0.016 1.0 29.85 102 A 1 -ATOM 1920 C CE . LYS A1 1 112 ? -17.034 19.13 1.469 1.0 36.89 102 A 1 -ATOM 1921 N NZ . LYS A1 1 112 ? -17.071 17.667 1.653 1.0 87.05 102 A 1 -ATOM 1922 H H . LYS A1 1 112 ? -17.567 17.262 -3.725 1.0 19.15 102 A 1 -ATOM 1923 H HA . LYS A1 1 112 ? -19.2 19.304 -2.971 1.0 19.46 102 A 1 -ATOM 1924 H HB2 . LYS A1 1 112 ? -16.387 19.165 -2.797 1.0 21.49 102 A 1 -ATOM 1925 H HB3 . LYS A1 1 112 ? -17.221 20.457 -2.396 1.0 21.49 102 A 1 -ATOM 1926 H HG2 . LYS A1 1 112 ? -18.412 19.028 -0.769 1.0 26.63 102 A 1 -ATOM 1927 H HG3 . LYS A1 1 112 ? -17.293 17.932 -1.037 1.0 26.63 102 A 1 -ATOM 1928 H HD2 . LYS A1 1 112 ? -15.684 19.249 -0.12 1.0 35.81 102 A 1 -ATOM 1929 H HD3 . LYS A1 1 112 ? -16.665 20.498 -0.066 1.0 35.81 102 A 1 -ATOM 1930 H HE2 . LYS A1 1 112 ? -16.401 19.499 2.104 1.0 44.27 102 A 1 -ATOM 1931 H HE3 . LYS A1 1 112 ? -17.922 19.479 1.645 1.0 44.27 102 A 1 -ATOM 1932 H HZ1 . LYS A1 1 112 ? -17.643 17.301 1.078 1.0 104.47 102 A 1 -ATOM 1933 H HZ2 . LYS A1 1 112 ? -16.262 17.322 1.515 1.0 104.47 102 A 1 -ATOM 1934 H HZ3 . LYS A1 1 112 ? -17.33 17.471 2.482 1.0 104.47 102 A 1 -ATOM 1935 N N . THR A1 1 113 ? -18.147 19.102 -5.8 1.0 13.98 103 A 1 -ATOM 1936 C CA . THR A1 1 113 ? -18.277 19.636 -7.141 1.0 13.19 103 A 1 -ATOM 1937 C C . THR A1 1 113 ? -19.093 18.639 -7.935 1.0 12.81 103 A 1 -ATOM 1938 O O . THR A1 1 113 ? -18.889 17.436 -7.841 1.0 13.78 103 A 1 -ATOM 1939 C CB . THR A1 1 113 ? -16.914 19.774 -7.834 1.0 13.09 103 A 1 -ATOM 1940 O OG1 . THR A1 1 113 ? -16.083 20.701 -7.143 1.0 14.76 103 A 1 -ATOM 1941 C CG2 . THR A1 1 113 ? -17.037 20.292 -9.259 1.0 14.76 103 A 1 -ATOM 1942 H H . THR A1 1 113 ? -17.953 18.264 -5.795 1.0 16.77 103 A 1 -ATOM 1943 H HA . THR A1 1 113 ? -18.704 20.507 -7.112 1.0 15.82 103 A 1 -ATOM 1944 H HB . THR A1 1 113 ? -16.522 18.887 -7.841 1.0 15.71 103 A 1 -ATOM 1945 H HG1 . THR A1 1 113 ? -15.928 20.424 -6.365 1.0 17.72 103 A 1 -ATOM 1946 H HG21 . THR A1 1 113 ? -16.162 20.532 -9.601 1.0 17.71 103 A 1 -ATOM 1947 H HG22 . THR A1 1 113 ? -17.422 19.607 -9.829 1.0 17.71 103 A 1 -ATOM 1948 H HG23 . THR A1 1 113 ? -17.609 21.075 -9.279 1.0 17.71 103 A 1 -ATOM 1949 N N . ILE A1 1 114 ? -20.011 19.156 -8.745 1.0 13.08 104 A 1 -ATOM 1950 C CA . ILE A1 1 114 ? -20.727 18.394 -9.758 1.0 13.61 104 A 1 -ATOM 1951 C C . ILE A1 1 114 ? -20.203 18.828 -11.121 1.0 12.8 104 A 1 -ATOM 1952 O O . ILE A1 1 114 ? -20.152 20.037 -11.415 1.0 13.46 104 A 1 -ATOM 1953 C CB . ILE A1 1 114 ? -22.234 18.629 -9.687 1.0 14.2 104 A 1 -ATOM 1954 C CG1 . ILE A1 1 114 ? -22.779 18.297 -8.312 1.0 16.81 104 A 1 -ATOM 1955 C CG2 . ILE A1 1 114 ? -22.953 17.853 -10.797 1.0 15.44 104 A 1 -ATOM 1956 C CD1 . ILE A1 1 114 ? -22.628 16.865 -7.898 1.0 15.82 104 A 1 -ATOM 1957 H H . ILE A1 1 114 ? -20.245 19.983 -8.724 1.0 15.7 104 A 1 -ATOM 1958 H HA . ILE A1 1 114 ? -20.552 17.449 -9.624 1.0 16.33 104 A 1 -ATOM 1959 H HB . ILE A1 1 114 ? -22.402 19.573 -9.832 1.0 17.04 104 A 1 -ATOM 1960 H HG12 . ILE A1 1 114 ? -22.312 18.839 -7.658 1.0 20.17 104 A 1 -ATOM 1961 H HG13 . ILE A1 1 114 ? -23.727 18.505 -8.299 1.0 20.17 104 A 1 -ATOM 1962 H HG21 . ILE A1 1 114 ? -23.906 17.849 -10.614 1.0 18.53 104 A 1 -ATOM 1963 H HG22 . ILE A1 1 114 ? -22.782 18.288 -11.648 1.0 18.53 104 A 1 -ATOM 1964 H HG23 . ILE A1 1 114 ? -22.616 16.944 -10.817 1.0 18.53 104 A 1 -ATOM 1965 H HD11 . ILE A1 1 114 ? -23.05 16.74 -7.034 1.0 18.98 104 A 1 -ATOM 1966 H HD12 . ILE A1 1 114 ? -23.056 16.299 -8.56 1.0 18.98 104 A 1 -ATOM 1967 H HD13 . ILE A1 1 114 ? -21.684 16.651 -7.84 1.0 18.98 104 A 1 -ATOM 1968 N N . VAL A1 1 115 ? -19.837 17.852 -11.934 1.0 12.77 105 A 1 -ATOM 1969 C CA . VAL A1 1 115 ? -19.363 18.063 -13.323 1.0 12.82 105 A 1 -ATOM 1970 C C . VAL A1 1 115 ? -20.46 17.593 -14.247 1.0 13.05 105 A 1 -ATOM 1971 O O . VAL A1 1 115 ? -20.88 16.447 -14.172 1.0 14.67 105 A 1 -ATOM 1972 C CB . VAL A1 1 115 ? -18.09 17.272 -13.601 1.0 11.95 105 A 1 -ATOM 1973 C CG1 . VAL A1 1 115 ? -17.596 17.57 -15.017 1.0 14.34 105 A 1 -ATOM 1974 C CG2 . VAL A1 1 115 ? -16.99 17.586 -12.616 1.0 14.13 105 A 1 -ATOM 1975 H H . VAL A1 1 115 ? -19.848 17.022 -11.709 1.0 15.32 105 A 1 -ATOM 1976 H HA . VAL A1 1 115 ? -19.194 19.007 -13.467 1.0 15.38 105 A 1 -ATOM 1977 H HB . VAL A1 1 115 ? -18.304 16.331 -13.509 1.0 14.34 105 A 1 -ATOM 1978 H HG11 . VAL A1 1 115 ? -16.705 17.202 -15.125 1.0 17.21 105 A 1 -ATOM 1979 H HG12 . VAL A1 1 115 ? -18.202 17.161 -15.655 1.0 17.21 105 A 1 -ATOM 1980 H HG13 . VAL A1 1 115 ? -17.576 18.53 -15.149 1.0 17.21 105 A 1 -ATOM 1981 H HG21 . VAL A1 1 115 ? -16.265 16.955 -12.741 1.0 16.95 105 A 1 -ATOM 1982 H HG22 . VAL A1 1 115 ? -16.674 18.489 -12.774 1.0 16.95 105 A 1 -ATOM 1983 H HG23 . VAL A1 1 115 ? -17.342 17.511 -11.715 1.0 16.95 105 A 1 -ATOM 1984 N N . LEU A1 1 116 ? -20.96 18.492 -15.086 1.0 12.48 106 A 1 -ATOM 1985 C CA . LEU A1 1 116 ? -21.943 18.126 -16.114 1.0 12.64 106 A 1 -ATOM 1986 C C . LEU A1 1 116 ? -21.177 18.025 -17.439 1.0 12.87 106 A 1 -ATOM 1987 O O . LEU A1 1 116 ? -20.604 19.026 -17.876 1.0 13.06 106 A 1 -ATOM 1988 C CB . LEU A1 1 116 ? -23.036 19.159 -16.206 1.0 13.39 106 A 1 -ATOM 1989 C CG . LEU A1 1 116 ? -23.807 19.411 -14.887 1.0 14.35 106 A 1 -ATOM 1990 C CD1 . LEU A1 1 116 ? -24.824 20.505 -15.138 1.0 17.73 106 A 1 -ATOM 1991 C CD2 . LEU A1 1 116 ? -24.475 18.144 -14.418 1.0 16.07 106 A 1 -ATOM 1992 H H . LEU A1 1 116 ? -20.748 19.325 -15.083 1.0 14.98 106 A 1 -ATOM 1993 H HA . LEU A1 1 116 ? -22.364 17.276 -15.908 1.0 15.17 106 A 1 -ATOM 1994 H HB2 . LEU A1 1 116 ? -22.639 20.001 -16.478 1.0 16.06 106 A 1 -ATOM 1995 H HB3 . LEU A1 1 116 ? -23.68 18.866 -16.869 1.0 16.06 106 A 1 -ATOM 1996 H HG . LEU A1 1 116 ? -23.203 19.689 -14.181 1.0 17.22 106 A 1 -ATOM 1997 H HD11 . LEU A1 1 116 ? -25.312 20.677 -14.318 1.0 21.28 106 A 1 -ATOM 1998 H HD12 . LEU A1 1 116 ? -24.36 21.309 -15.421 1.0 21.28 106 A 1 -ATOM 1999 H HD13 . LEU A1 1 116 ? -25.436 20.214 -15.832 1.0 21.28 106 A 1 -ATOM 2000 H HD21 . LEU A1 1 116 ? -25.064 18.354 -13.676 1.0 19.28 106 A 1 -ATOM 2001 H HD22 . LEU A1 1 116 ? -24.987 17.767 -15.15 1.0 19.28 106 A 1 -ATOM 2002 H HD23 . LEU A1 1 116 ? -23.794 17.515 -14.132 1.0 19.28 106 A 1 -ATOM 2003 N N . GLN A1 1 117 ? -21.102 16.839 -17.999 1.0 12.2 107 A 1 -ATOM 2004 C CA . GLN A1 1 117 ? -20.397 16.613 -19.265 1.0 12.65 107 A 1 -ATOM 2005 C C . GLN A1 1 117 ? -21.364 15.971 -20.235 1.0 12.44 107 A 1 -ATOM 2006 O O . GLN A1 1 117 ? -22.228 15.173 -19.866 1.0 13.26 107 A 1 -ATOM 2007 C CB . GLN A1 1 117 ? -19.168 15.733 -19.052 1.0 12.51 107 A 1 -ATOM 2008 C CG . GLN A1 1 117 ? -18.257 15.708 -20.301 1.0 13.33 107 A 1 -ATOM 2009 C CD . GLN A1 1 117 ? -17.039 14.862 -20.122 1.0 14.7 107 A 1 -ATOM 2010 O OE1 . GLN A1 1 117 ? -17.104 13.634 -20.291 1.0 16.38 107 A 1 -ATOM 2011 N NE2 . GLN A1 1 117 ? -15.912 15.477 -19.813 1.0 13.98 107 A 1 -ATOM 2012 H H . GLN A1 1 117 ? -21.454 16.129 -17.668 1.0 14.64 107 A 1 -ATOM 2013 H HA . GLN A1 1 117 ? -20.087 17.448 -19.649 1.0 15.17 107 A 1 -ATOM 2014 H HB2 . GLN A1 1 117 ? -18.653 16.078 -18.306 1.0 15.01 107 A 1 -ATOM 2015 H HB3 . GLN A1 1 117 ? -19.454 14.825 -18.866 1.0 15.01 107 A 1 -ATOM 2016 H HG2 . GLN A1 1 117 ? -18.759 15.353 -21.051 1.0 16.0 107 A 1 -ATOM 2017 H HG3 . GLN A1 1 117 ? -17.965 16.613 -20.496 1.0 16.0 107 A 1 -ATOM 2018 H HE21 . GLN A1 1 117 ? -15.899 16.332 -19.722 1.0 16.78 107 A 1 -ATOM 2019 H HE22 . GLN A1 1 117 ? -15.19 15.022 -19.702 1.0 16.78 107 A 1 -ATOM 2020 N N . SER A1 1 118 ? -21.204 16.32 -21.519 1.0 12.68 108 A 1 -ATOM 2021 C CA . SER A1 1 118 ? -22.047 15.737 -22.55 1.0 13.6 108 A 1 -ATOM 2022 C C . SER A1 1 118 ? -21.337 15.803 -23.891 1.0 13.37 108 A 1 -ATOM 2023 O O . SER A1 1 118 ? -20.369 16.531 -24.091 1.0 13.4 108 A 1 -ATOM 2024 C CB . SER A1 1 118 ? -23.37 16.482 -22.639 1.0 13.97 108 A 1 -ATOM 2025 O OG . SER A1 1 118 ? -23.208 17.819 -22.981 1.0 14.77 108 A 1 -ATOM 2026 H H . SER A1 1 118 ? -20.621 16.883 -21.805 1.0 15.22 108 A 1 -ATOM 2027 H HA . SER A1 1 118 ? -22.199 14.804 -22.332 1.0 16.32 108 A 1 -ATOM 2028 H HB2 . SER A1 1 118 ? -23.92 16.055 -23.314 1.0 16.76 108 A 1 -ATOM 2029 H HB3 . SER A1 1 118 ? -23.809 16.435 -21.775 1.0 16.76 108 A 1 -ATOM 2030 H HG . SER A1 1 118 ? -22.918 17.881 -23.767 1.0 17.73 108 A 1 -ATOM 2031 N N . GLY A1 1 119 ? -21.914 15.086 -24.847 1.0 13.33 109 A 1 -ATOM 2032 C CA . GLY A1 1 119 ? -21.678 15.434 -26.241 1.0 13.09 109 A 1 -ATOM 2033 C C . GLY A1 1 119 ? -22.16 16.839 -26.514 1.0 14.04 109 A 1 -ATOM 2034 O O . GLY A1 1 119 ? -22.906 17.449 -25.74 1.0 13.31 109 A 1 -ATOM 2035 H H . GLY A1 1 119 ? -22.432 14.412 -24.719 1.0 16.0 109 A 1 -ATOM 2036 H HA2 . GLY A1 1 119 ? -20.729 15.383 -26.438 1.0 15.71 109 A 1 -ATOM 2037 H HA3 . GLY A1 1 119 ? -22.154 14.819 -26.82 1.0 15.71 109 A 1 -ATOM 2038 N N . GLU A1 1 120 ? -21.776 17.392 -27.66 1.0 13.75 110 A 1 -ATOM 2039 C CA . GLU A1 1 120 ? -22.276 18.693 -28.063 1.0 13.45 110 A 1 -ATOM 2040 C C . GLU A1 1 120 ? -23.704 18.503 -28.568 1.0 14.77 110 A 1 -ATOM 2041 O O . GLU A1 1 120 ? -23.951 18.304 -29.77 1.0 15.41 110 A 1 -ATOM 2042 C CB . GLU A1 1 120 ? -21.378 19.309 -29.125 1.0 14.23 110 A 1 -ATOM 2043 C CG . GLU A1 1 120 ? -20.036 19.747 -28.621 1.0 14.93 110 A 1 -ATOM 2044 C CD . GLU A1 1 120 ? -19.29 20.711 -29.55 1.0 14.55 110 A 1 -ATOM 2045 O OE1 . GLU A1 1 120 ? -19.896 21.129 -30.565 1.0 15.56 110 A 1 -ATOM 2046 O OE2 . GLU A1 1 120 ? -18.13 21.0 -29.247 1.0 15.58 110 A 1 -ATOM 2047 H H . GLU A1 1 120 ? -21.228 17.031 -28.217 1.0 16.5 110 A 1 -ATOM 2048 H HA . GLU A1 1 120 ? -22.292 19.291 -27.3 1.0 16.14 110 A 1 -ATOM 2049 H HB2 . GLU A1 1 120 ? -21.23 18.653 -29.823 1.0 17.07 110 A 1 -ATOM 2050 H HB3 . GLU A1 1 120 ? -21.823 20.089 -29.491 1.0 17.07 110 A 1 -ATOM 2051 H HG2 . GLU A1 1 120 ? -20.157 20.196 -27.77 1.0 17.91 110 A 1 -ATOM 2052 H HG3 . GLU A1 1 120 ? -19.478 18.962 -28.505 1.0 17.91 110 A 1 -ATOM 2053 N N . ASP A1 1 121 ? -24.663 18.573 -27.633 1.0 14.65 111 A 1 -ATOM 2054 C CA . ASP A1 1 121 ? -26.062 18.225 -27.874 1.0 14.74 111 A 1 -ATOM 2055 C C . ASP A1 1 121 ? -26.884 19.505 -27.89 1.0 16.49 111 A 1 -ATOM 2056 O O . ASP A1 1 121 ? -27.129 20.115 -26.845 1.0 15.77 111 A 1 -ATOM 2057 C CB . ASP A1 1 121 ? -26.57 17.284 -26.799 1.0 14.79 111 A 1 -ATOM 2058 C CG . ASP A1 1 121 ? -28.012 16.911 -27.0 1.0 16.53 111 A 1 -ATOM 2059 O OD1 . ASP A1 1 121 ? -28.7 17.493 -27.889 1.0 16.22 111 A 1 -ATOM 2060 O OD2 . ASP A1 1 121 ? -28.508 16.039 -26.28 1.0 15.68 111 A 1 -ATOM 2061 H H . ASP A1 1 121 ? -24.518 18.83 -26.825 1.0 17.58 111 A 1 -ATOM 2062 H HA . ASP A1 1 121 ? -26.147 17.78 -28.732 1.0 17.69 111 A 1 -ATOM 2063 H HB2 . ASP A1 1 121 ? -26.043 16.47 -26.815 1.0 17.75 111 A 1 -ATOM 2064 H HB3 . ASP A1 1 121 ? -26.488 17.717 -25.935 1.0 17.75 111 A 1 -ATOM 2065 N N . PRO A1 1 122 ? -27.289 19.994 -29.082 1.0 15.75 112 A 1 -ATOM 2066 C CA . PRO A1 1 122 ? -27.978 21.275 -29.163 1.0 16.31 112 A 1 -ATOM 2067 C C . PRO A1 1 122 ? -29.253 21.354 -28.382 1.0 17.19 112 A 1 -ATOM 2068 O O . PRO A1 1 122 ? -29.76 22.443 -28.114 1.0 17.55 112 A 1 -ATOM 2069 C CB . PRO A1 1 122 ? -28.195 21.427 -30.685 1.0 17.38 112 A 1 -ATOM 2070 C CG . PRO A1 1 122 ? -27.151 20.599 -31.305 1.0 21.55 112 A 1 -ATOM 2071 C CD . PRO A1 1 122 ? -27.012 19.401 -30.409 1.0 16.84 112 A 1 -ATOM 2072 H HA . PRO A1 1 122 ? -27.405 21.99 -28.846 1.0 19.57 112 A 1 -ATOM 2073 H HB2 . PRO A1 1 122 ? -29.079 21.107 -30.926 1.0 20.85 112 A 1 -ATOM 2074 H HB3 . PRO A1 1 122 ? -28.098 22.357 -30.941 1.0 20.85 112 A 1 -ATOM 2075 H HG2 . PRO A1 1 122 ? -27.426 20.334 -32.196 1.0 25.86 112 A 1 -ATOM 2076 H HG3 . PRO A1 1 122 ? -26.319 21.096 -31.348 1.0 25.86 112 A 1 -ATOM 2077 H HD2 . PRO A1 1 122 ? -27.662 18.717 -30.632 1.0 20.21 112 A 1 -ATOM 2078 H HD3 . PRO A1 1 122 ? -26.115 19.033 -30.45 1.0 20.21 112 A 1 -ATOM 2079 N N . TYR A1 1 123 ? -29.88 20.231 -28.015 1.0 16.21 113 A 1 -ATOM 2080 C CA . TYR A1 1 123 ? -31.145 20.297 -27.293 1.0 17.36 113 A 1 -ATOM 2081 C C . TYR A1 1 123 ? -31.087 21.237 -26.093 1.0 16.04 113 A 1 -ATOM 2082 O O . TYR A1 1 123 ? -32.039 21.942 -25.785 1.0 17.76 113 A 1 -ATOM 2083 C CB . TYR A1 1 123 ? -31.607 18.903 -26.806 1.0 16.93 113 A 1 -ATOM 2084 C CG . TYR A1 1 123 ? -32.848 18.983 -25.987 1.0 17.71 113 A 1 -ATOM 2085 C CD1 . TYR A1 1 123 ? -34.102 19.036 -26.579 1.0 20.26 113 A 1 -ATOM 2086 C CD2 . TYR A1 1 123 ? -32.763 19.093 -24.604 1.0 17.93 113 A 1 -ATOM 2087 C CE1 . TYR A1 1 123 ? -35.236 19.162 -25.809 1.0 23.02 113 A 1 -ATOM 2088 C CE2 . TYR A1 1 123 ? -33.893 19.213 -23.844 1.0 20.55 113 A 1 -ATOM 2089 C CZ . TYR A1 1 123 ? -35.095 19.26 -24.455 1.0 20.76 113 A 1 -ATOM 2090 O OH . TYR A1 1 123 ? -36.265 19.397 -23.744 1.0 25.67 113 A 1 -ATOM 2091 H H . TYR A1 1 123 ? -29.595 19.435 -28.169 1.0 19.46 113 A 1 -ATOM 2092 H HA . TYR A1 1 123 ? -31.796 20.632 -27.93 1.0 20.84 113 A 1 -ATOM 2093 H HB2 . TYR A1 1 123 ? -31.786 18.34 -27.574 1.0 20.32 113 A 1 -ATOM 2094 H HB3 . TYR A1 1 123 ? -30.908 18.509 -26.261 1.0 20.32 113 A 1 -ATOM 2095 H HD1 . TYR A1 1 123 ? -34.177 18.987 -27.505 1.0 24.31 113 A 1 -ATOM 2096 H HD2 . TYR A1 1 123 ? -31.929 19.085 -24.191 1.0 21.51 113 A 1 -ATOM 2097 H HE1 . TYR A1 1 123 ? -36.079 19.179 -26.202 1.0 27.63 113 A 1 -ATOM 2098 H HE2 . TYR A1 1 123 ? -33.834 19.262 -22.918 1.0 24.66 113 A 1 -ATOM 2099 H HH . TYR A1 1 123 ? -36.095 19.487 -22.926 1.0 30.81 113 A 1 -ATOM 2100 N N . TYR A1 1 124 ? -29.988 21.172 -25.344 1.0 15.72 114 A 1 -ATOM 2101 C CA . TYR A1 1 124 ? -29.925 21.795 -24.024 1.0 16.29 114 A 1 -ATOM 2102 C C . TYR A1 1 124 ? -29.482 23.237 -24.064 1.0 17.53 114 A 1 -ATOM 2103 O O . TYR A1 1 124 ? -29.503 23.936 -23.035 1.0 17.82 114 A 1 -ATOM 2104 C CB . TYR A1 1 124 ? -28.936 21.021 -23.113 1.0 15.61 114 A 1 -ATOM 2105 C CG . TYR A1 1 124 ? -29.356 19.614 -22.806 1.0 14.3 114 A 1 -ATOM 2106 C CD1 . TYR A1 1 124 ? -29.015 18.567 -23.624 1.0 15.43 114 A 1 -ATOM 2107 C CD2 . TYR A1 1 124 ? -30.017 19.315 -21.624 1.0 16.05 114 A 1 -ATOM 2108 C CE1 . TYR A1 1 124 ? -29.375 17.285 -23.356 1.0 15.16 114 A 1 -ATOM 2109 C CE2 . TYR A1 1 124 ? -30.363 18.016 -21.329 1.0 16.03 114 A 1 -ATOM 2110 C CZ . TYR A1 1 124 ? -30.049 17.008 -22.186 1.0 15.52 114 A 1 -ATOM 2111 O OH . TYR A1 1 124 ? -30.33 15.695 -21.919 1.0 17.17 114 A 1 -ATOM 2112 H H . TYR A1 1 124 ? -29.264 20.772 -25.579 1.0 18.86 114 A 1 -ATOM 2113 H HA . TYR A1 1 124 ? -30.812 21.754 -23.634 1.0 19.54 114 A 1 -ATOM 2114 H HB2 . TYR A1 1 124 ? -28.074 20.981 -23.556 1.0 18.73 114 A 1 -ATOM 2115 H HB3 . TYR A1 1 124 ? -28.855 21.495 -22.271 1.0 18.73 114 A 1 -ATOM 2116 H HD1 . TYR A1 1 124 ? -28.518 18.742 -24.39 1.0 18.52 114 A 1 -ATOM 2117 H HD2 . TYR A1 1 124 ? -30.228 19.996 -21.027 1.0 19.26 114 A 1 -ATOM 2118 H HE1 . TYR A1 1 124 ? -29.169 16.603 -23.954 1.0 18.19 114 A 1 -ATOM 2119 H HE2 . TYR A1 1 124 ? -30.815 17.826 -20.539 1.0 19.24 114 A 1 -ATOM 2120 H HH . TYR A1 1 124 ? -30.745 15.632 -21.192 1.0 20.6 114 A 1 -ATOM 2121 N N . MET A1 1 125 ? -29.059 23.721 -25.211 1.0 18.28 115 A 1 -ATOM 2122 C CA . MET A1 1 125 ? -28.132 24.859 -25.255 1.0 18.49 115 A 1 -ATOM 2123 C C . MET A1 1 125 ? -28.874 26.105 -25.703 1.0 21.2 115 A 1 -ATOM 2124 O O . MET A1 1 125 ? -29.493 26.071 -26.781 1.0 21.1 115 A 1 -ATOM 2125 C CB . MET A1 1 125 ? -26.977 24.623 -26.209 1.0 18.29 115 A 1 -ATOM 2126 C CG . MET A1 1 125 ? -26.278 23.302 -26.019 1.0 16.72 115 A 1 -ATOM 2127 S SD . MET A1 1 125 ? -25.729 23.013 -24.343 1.0 18.06 115 A 1 -ATOM 2128 C CE . MET A1 1 125 ? -24.923 21.481 -24.586 1.0 18.06 115 A 1 -ATOM 2129 H H . MET A1 1 125 ? -29.286 23.417 -25.982 1.0 21.94 115 A 1 -ATOM 2130 H HA . MET A1 1 125 ? -27.762 24.973 -24.365 1.0 22.19 115 A 1 -ATOM 2131 H HB2 . MET A1 1 125 ? -27.316 24.648 -27.117 1.0 21.95 115 A 1 -ATOM 2132 H HB3 . MET A1 1 125 ? -26.32 25.325 -26.08 1.0 21.95 115 A 1 -ATOM 2133 H HG2 . MET A1 1 125 ? -26.89 22.588 -26.257 1.0 20.06 115 A 1 -ATOM 2134 H HG3 . MET A1 1 125 ? -25.498 23.276 -26.595 1.0 20.06 115 A 1 -ATOM 2135 H HE1 . MET A1 1 125 ? -24.59 21.16 -23.733 1.0 21.67 115 A 1 -ATOM 2136 H HE2 . MET A1 1 125 ? -25.558 20.846 -24.953 1.0 21.67 115 A 1 -ATOM 2137 H HE3 . MET A1 1 125 ? -24.186 21.606 -25.203 1.0 21.67 115 A 1 -ATOM 2138 N N . PRO A1 1 126 ? -28.848 27.242 -24.972 1.0 18.85 116 A 1 -ATOM 2139 C CA . PRO A1 1 126 ? -28.198 27.417 -23.659 1.0 19.25 116 A 1 -ATOM 2140 C C . PRO A1 1 126 ? -29.114 27.275 -22.473 1.0 18.86 116 A 1 -ATOM 2141 O O . PRO A1 1 126 ? -28.591 27.163 -21.358 1.0 17.76 116 A 1 -ATOM 2142 C CB . PRO A1 1 126 ? -27.734 28.885 -23.739 1.0 20.32 116 A 1 -ATOM 2143 C CG . PRO A1 1 126 ? -28.788 29.584 -24.541 1.0 21.89 116 A 1 -ATOM 2144 C CD . PRO A1 1 126 ? -29.257 28.548 -25.54 1.0 20.64 116 A 1 -ATOM 2145 H HA . PRO A1 1 126 ? -27.467 26.786 -23.57 1.0 23.1 116 A 1 -ATOM 2146 H HB2 . PRO A1 1 126 ? -27.671 29.261 -22.847 1.0 24.38 116 A 1 -ATOM 2147 H HB3 . PRO A1 1 126 ? -26.872 28.935 -24.181 1.0 24.38 116 A 1 -ATOM 2148 H HG2 . PRO A1 1 126 ? -29.515 29.864 -23.962 1.0 26.27 116 A 1 -ATOM 2149 H HG3 . PRO A1 1 126 ? -28.407 30.355 -24.991 1.0 26.27 116 A 1 -ATOM 2150 H HD2 . PRO A1 1 126 ? -30.222 28.585 -25.638 1.0 24.76 116 A 1 -ATOM 2151 H HD3 . PRO A1 1 126 ? -28.831 28.69 -26.4 1.0 24.76 116 A 1 -ATOM 2152 N N . ASP A1 1 127 ? -30.407 27.38 -22.618 1.0 18.94 117 A 1 -ATOM 2153 C CA . ASP A1 1 127 ? -31.258 27.71 -21.491 1.0 19.75 117 A 1 -ATOM 2154 C C . ASP A1 1 127 ? -31.505 26.513 -20.584 1.0 18.99 117 A 1 -ATOM 2155 O O . ASP A1 1 127 ? -31.697 26.69 -19.378 1.0 20.4 117 A 1 -ATOM 2156 C CB . ASP A1 1 127 ? -32.604 28.267 -21.96 1.0 23.81 117 A 1 -ATOM 2157 C CG . ASP A1 1 127 ? -32.46 29.595 -22.67 1.0 27.12 117 A 1 -ATOM 2158 O OD1 . ASP A1 1 127 ? -31.499 30.356 -22.405 1.0 26.44 117 A 1 -ATOM 2159 O OD2 . ASP A1 1 127 ? -33.327 29.924 -23.519 1.0 33.63 117 A 1 -ATOM 2160 H H . ASP A1 1 127 ? -30.827 27.267 -23.36 1.0 22.73 117 A 1 -ATOM 2161 H HA . ASP A1 1 127 ? -30.809 28.402 -20.98 1.0 23.69 117 A 1 -ATOM 2162 H HB2 . ASP A1 1 127 ? -33.011 27.638 -22.576 1.0 28.57 117 A 1 -ATOM 2163 H HB3 . ASP A1 1 127 ? -33.18 28.398 -21.19 1.0 28.57 117 A 1 -ATOM 2164 N N . VAL A1 1 128 ? -31.536 25.292 -21.111 1.0 18.95 118 A 1 -ATOM 2165 C CA . VAL A1 1 128 ? -31.775 24.143 -20.252 1.0 18.63 118 A 1 -ATOM 2166 C C . VAL A1 1 128 ? -30.578 23.98 -19.309 1.0 18.64 118 A 1 -ATOM 2167 O O . VAL A1 1 128 ? -30.745 23.726 -18.103 1.0 17.85 118 A 1 -ATOM 2168 C CB . VAL A1 1 128 ? -32.042 22.856 -21.04 1.0 19.76 118 A 1 -ATOM 2169 C CG1 . VAL A1 1 128 ? -32.447 21.737 -20.118 1.0 20.84 118 A 1 -ATOM 2170 C CG2 . VAL A1 1 128 ? -33.15 23.053 -22.11 1.0 21.88 118 A 1 -ATOM 2171 H H . VAL A1 1 128 ? -31.425 25.108 -21.944 1.0 22.74 118 A 1 -ATOM 2172 H HA . VAL A1 1 128 ? -32.583 24.313 -19.743 1.0 22.36 118 A 1 -ATOM 2173 H HB . VAL A1 1 128 ? -31.216 22.623 -21.492 1.0 23.71 118 A 1 -ATOM 2174 H HG11 . VAL A1 1 128 ? -32.702 20.966 -20.649 1.0 25.0 118 A 1 -ATOM 2175 H HG12 . VAL A1 1 128 ? -31.697 21.511 -19.546 1.0 25.0 118 A 1 -ATOM 2176 H HG13 . VAL A1 1 128 ? -33.199 22.029 -19.578 1.0 25.0 118 A 1 -ATOM 2177 H HG21 . VAL A1 1 128 ? -33.316 22.206 -22.552 1.0 26.26 118 A 1 -ATOM 2178 H HG22 . VAL A1 1 128 ? -33.96 23.362 -21.673 1.0 26.26 118 A 1 -ATOM 2179 H HG23 . VAL A1 1 128 ? -32.852 23.711 -22.757 1.0 26.26 118 A 1 -ATOM 2180 N N . ILE A1 1 129 ? -29.363 24.141 -19.826 1.0 16.04 119 A 1 -ATOM 2181 C CA . ILE A1 1 129 ? -28.16 24.112 -18.982 1.0 16.29 119 A 1 -ATOM 2182 C C . ILE A1 1 129 ? -28.243 25.182 -17.917 1.0 15.88 119 A 1 -ATOM 2183 O O . ILE A1 1 129 ? -27.981 24.904 -16.737 1.0 15.79 119 A 1 -ATOM 2184 C CB . ILE A1 1 129 ? -26.903 24.344 -19.833 1.0 16.22 119 A 1 -ATOM 2185 C CG1 . ILE A1 1 129 ? -26.707 23.256 -20.891 1.0 16.97 119 A 1 -ATOM 2186 C CG2 . ILE A1 1 129 ? -25.667 24.489 -18.964 1.0 14.94 119 A 1 -ATOM 2187 C CD1 . ILE A1 1 129 ? -26.678 21.857 -20.357 1.0 18.29 119 A 1 -ATOM 2188 H H . ILE A1 1 129 ? -29.201 24.269 -20.661 1.0 19.25 119 A 1 -ATOM 2189 H HA . ILE A1 1 129 ? -28.112 23.239 -18.563 1.0 19.55 119 A 1 -ATOM 2190 H HB . ILE A1 1 129 ? -27.043 25.179 -20.307 1.0 19.47 119 A 1 -ATOM 2191 H HG12 . ILE A1 1 129 ? -27.437 23.31 -21.528 1.0 20.36 119 A 1 -ATOM 2192 H HG13 . ILE A1 1 129 ? -25.862 23.414 -21.341 1.0 20.36 119 A 1 -ATOM 2193 H HG21 . ILE A1 1 129 ? -24.878 24.338 -19.509 1.0 17.93 119 A 1 -ATOM 2194 H HG22 . ILE A1 1 129 ? -25.645 25.385 -18.592 1.0 17.93 119 A 1 -ATOM 2195 H HG23 . ILE A1 1 129 ? -25.704 23.835 -18.249 1.0 17.93 119 A 1 -ATOM 2196 H HD11 . ILE A1 1 129 ? -26.396 21.255 -21.063 1.0 21.95 119 A 1 -ATOM 2197 H HD12 . ILE A1 1 129 ? -26.052 21.814 -19.617 1.0 21.95 119 A 1 -ATOM 2198 H HD13 . ILE A1 1 129 ? -27.567 21.617 -20.053 1.0 21.95 119 A 1 -ATOM 2199 N N . SER A1 1 130 ? -28.621 26.41 -18.268 1.0 16.3 120 A 1 -ATOM 2200 C CA . SER A1 1 130 ? -28.699 27.469 -17.257 1.0 15.71 120 A 1 -ATOM 2201 C C . SER A1 1 130 ? -29.637 27.087 -16.136 1.0 18.12 120 A 1 -ATOM 2202 O O . SER A1 1 130 ? -29.318 27.286 -14.968 1.0 19.04 120 A 1 -ATOM 2203 C CB . SER A1 1 130 ? -29.164 28.768 -17.869 1.0 18.76 120 A 1 -ATOM 2204 O OG . SER A1 1 130 ? -28.172 29.208 -18.769 1.0 19.8 120 A 1 -ATOM 2205 H H . SER A1 1 130 ? -28.834 26.653 -19.065 1.0 19.56 120 A 1 -ATOM 2206 H HA . SER A1 1 130 ? -27.807 27.602 -16.899 1.0 18.85 120 A 1 -ATOM 2207 H HB2 . SER A1 1 130 ? -29.997 28.625 -18.345 1.0 22.52 120 A 1 -ATOM 2208 H HB3 . SER A1 1 130 ? -29.29 29.431 -17.172 1.0 22.52 120 A 1 -ATOM 2209 H HG . SER A1 1 130 ? -28.412 29.926 -19.132 1.0 23.75 120 A 1 -ATOM 2210 N N . ASP A1 1 131 ? -30.768 26.516 -16.452 1.0 18.03 121 A 1 -ATOM 2211 C CA . ASP A1 1 131 ? -31.736 26.153 -15.436 1.0 21.53 121 A 1 -ATOM 2212 C C . ASP A1 1 131 ? -31.179 25.072 -14.53 1.0 19.58 121 A 1 -ATOM 2213 O O . ASP A1 1 131 ? -31.334 25.134 -13.298 1.0 20.13 121 A 1 -ATOM 2214 C CB . ASP A1 1 131 ? -33.02 25.587 -16.077 1.0 25.56 121 A 1 -ATOM 2215 C CG . ASP A1 1 131 ? -33.826 26.597 -16.854 1.0 54.82 121 A 1 -ATOM 2216 O OD1 . ASP A1 1 131 ? -33.747 27.796 -16.551 1.0 34.2 121 A 1 -ATOM 2217 O OD2 . ASP A1 1 131 ? -34.588 26.151 -17.746 1.0 41.48 121 A 1 -ATOM 2218 H H . ASP A1 1 131 ? -31.011 26.322 -17.254 1.0 21.64 121 A 1 -ATOM 2219 H HA . ASP A1 1 131 ? -31.948 26.956 -14.935 1.0 25.83 121 A 1 -ATOM 2220 H HB2 . ASP A1 1 131 ? -32.774 24.876 -16.689 1.0 30.67 121 A 1 -ATOM 2221 H HB3 . ASP A1 1 131 ? -33.589 25.237 -15.374 1.0 30.67 121 A 1 -ATOM 2222 N N . ILE A1 1 132 ? -30.54 24.065 -15.112 1.0 16.61 122 A 1 -ATOM 2223 C CA . ILE A1 1 132 ? -29.942 22.991 -14.327 1.0 18.11 122 A 1 -ATOM 2224 C C . ILE A1 1 132 ? -28.866 23.538 -13.399 1.0 16.92 122 A 1 -ATOM 2225 O O . ILE A1 1 132 ? -28.793 23.17 -12.214 1.0 17.4 122 A 1 -ATOM 2226 C CB . ILE A1 1 132 ? -29.383 21.899 -15.25 1.0 17.21 122 A 1 -ATOM 2227 C CG1 . ILE A1 1 132 ? -30.544 21.168 -15.934 1.0 18.78 122 A 1 -ATOM 2228 C CG2 . ILE A1 1 132 ? -28.549 20.896 -14.458 1.0 17.25 122 A 1 -ATOM 2229 C CD1 . ILE A1 1 132 ? -30.1 20.363 -17.2 1.0 19.21 122 A 1 -ATOM 2230 H H . ILE A1 1 132 ? -30.438 23.978 -15.961 1.0 19.94 122 A 1 -ATOM 2231 H HA . ILE A1 1 132 ? -30.635 22.595 -13.776 1.0 21.73 122 A 1 -ATOM 2232 H HB . ILE A1 1 132 ? -28.816 22.319 -15.915 1.0 20.65 122 A 1 -ATOM 2233 H HG12 . ILE A1 1 132 ? -30.937 20.543 -15.305 1.0 22.53 122 A 1 -ATOM 2234 H HG13 . ILE A1 1 132 ? -31.207 21.82 -16.212 1.0 22.53 122 A 1 -ATOM 2235 H HG21 . ILE A1 1 132 ? -28.434 20.092 -14.988 1.0 20.7 122 A 1 -ATOM 2236 H HG22 . ILE A1 1 132 ? -27.684 21.289 -14.262 1.0 20.7 122 A 1 -ATOM 2237 H HG23 . ILE A1 1 132 ? -29.01 20.684 -13.631 1.0 20.7 122 A 1 -ATOM 2238 H HD11 . ILE A1 1 132 ? -30.883 19.968 -17.614 1.0 23.05 122 A 1 -ATOM 2239 H HD12 . ILE A1 1 132 ? -29.665 20.968 -17.822 1.0 23.05 122 A 1 -ATOM 2240 H HD13 . ILE A1 1 132 ? -29.481 19.666 -16.93 1.0 23.05 122 A 1 -ATOM 2241 N N . VAL A1 1 133 ? -27.961 24.353 -13.922 1.0 15.95 123 A 1 -ATOM 2242 C CA . VAL A1 1 133 ? -26.894 24.953 -13.131 1.0 16.3 123 A 1 -ATOM 2243 C C . VAL A1 1 133 ? -27.455 25.736 -11.963 1.0 17.8 123 A 1 -ATOM 2244 O O . VAL A1 1 133 ? -26.947 25.594 -10.831 1.0 17.54 123 A 1 -ATOM 2245 C CB . VAL A1 1 133 ? -25.994 25.826 -14.02 1.0 16.81 123 A 1 -ATOM 2246 C CG1 . VAL A1 1 133 ? -25.044 26.622 -13.17 1.0 16.85 123 A 1 -ATOM 2247 C CG2 . VAL A1 1 133 ? -25.229 25.007 -15.014 1.0 16.34 123 A 1 -ATOM 2248 H H . VAL A1 1 133 ? -27.94 24.581 -14.75 1.0 19.14 123 A 1 -ATOM 2249 H HA . VAL A1 1 133 ? -26.352 24.235 -12.767 1.0 19.56 123 A 1 -ATOM 2250 H HB . VAL A1 1 133 ? -26.564 26.433 -14.519 1.0 20.18 123 A 1 -ATOM 2251 H HG11 . VAL A1 1 133 ? -24.301 26.918 -13.718 1.0 20.23 123 A 1 -ATOM 2252 H HG12 . VAL A1 1 133 ? -25.513 27.389 -12.805 1.0 20.23 123 A 1 -ATOM 2253 H HG13 . VAL A1 1 133 ? -24.719 26.06 -12.449 1.0 20.23 123 A 1 -ATOM 2254 H HG21 . VAL A1 1 133 ? -24.713 25.601 -15.581 1.0 19.61 123 A 1 -ATOM 2255 H HG22 . VAL A1 1 133 ? -24.636 24.406 -14.537 1.0 19.61 123 A 1 -ATOM 2256 H HG23 . VAL A1 1 133 ? -25.855 24.497 -15.551 1.0 19.61 123 A 1 -ATOM 2257 N N . LYS A1 1 134 ? -28.479 26.538 -12.171 1.0 17.29 124 A 1 -ATOM 2258 C CA . LYS A1 1 134 ? -29.066 27.31 -11.083 1.0 18.56 124 A 1 -ATOM 2259 C C . LYS A1 1 134 ? -29.567 26.39 -9.993 1.0 18.72 124 A 1 -ATOM 2260 O O . LYS A1 1 134 ? -29.358 26.663 -8.775 1.0 20.13 124 A 1 -ATOM 2261 C CB . LYS A1 1 134 ? -30.196 28.168 -11.628 1.0 21.03 124 A 1 -ATOM 2262 C CG . LYS A1 1 134 ? -29.718 29.417 -12.337 1.0 24.5 124 A 1 -ATOM 2263 C CD . LYS A1 1 134 ? -30.874 30.249 -12.911 1.0 33.56 124 A 1 -ATOM 2264 C CE . LYS A1 1 134 ? -30.336 31.35 -13.855 1.0 52.79 124 A 1 -ATOM 2265 N NZ . LYS A1 1 134 ? -31.418 32.046 -14.625 1.0 67.53 124 A 1 -ATOM 2266 H H . LYS A1 1 134 ? -28.859 26.659 -12.933 1.0 20.75 124 A 1 -ATOM 2267 H HA . LYS A1 1 134 ? -28.399 27.899 -10.698 1.0 22.27 124 A 1 -ATOM 2268 H HB2 . LYS A1 1 134 ? -30.708 27.644 -12.263 1.0 25.23 124 A 1 -ATOM 2269 H HB3 . LYS A1 1 134 ? -30.763 28.443 -10.891 1.0 25.23 124 A 1 -ATOM 2270 H HG2 . LYS A1 1 134 ? -29.232 29.973 -11.708 1.0 29.4 124 A 1 -ATOM 2271 H HG3 . LYS A1 1 134 ? -29.138 29.163 -13.072 1.0 29.4 124 A 1 -ATOM 2272 H HD2 . LYS A1 1 134 ? -31.469 29.673 -13.416 1.0 40.28 124 A 1 -ATOM 2273 H HD3 . LYS A1 1 134 ? -31.359 30.674 -12.186 1.0 40.28 124 A 1 -ATOM 2274 H HE2 . LYS A1 1 134 ? -29.869 32.017 -13.328 1.0 63.35 124 A 1 -ATOM 2275 H HE3 . LYS A1 1 134 ? -29.727 30.947 -14.494 1.0 63.35 124 A 1 -ATOM 2276 H HZ1 . LYS A1 1 134 ? -31.064 32.674 -15.148 1.0 81.04 124 A 1 -ATOM 2277 H HZ2 . LYS A1 1 134 ? -31.855 31.46 -15.133 1.0 81.04 124 A 1 -ATOM 2278 H HZ3 . LYS A1 1 134 ? -31.994 32.428 -14.064 1.0 81.04 124 A 1 -ATOM 2279 N N . GLU A1 1 135 ? -30.19 25.274 -10.379 1.0 18.74 125 A 1 -ATOM 2280 C CA . GLU A1 1 135 ? -30.693 24.349 -9.356 1.0 19.77 125 A 1 -ATOM 2281 C C . GLU A1 1 135 ? -29.561 23.703 -8.6 1.0 17.22 125 A 1 -ATOM 2282 O O . GLU A1 1 135 ? -29.648 23.534 -7.379 1.0 19.06 125 A 1 -ATOM 2283 C CB . GLU A1 1 135 ? -31.586 23.271 -9.971 1.0 21.49 125 A 1 -ATOM 2284 C CG . GLU A1 1 135 ? -32.895 23.816 -10.465 1.0 23.31 125 A 1 -ATOM 2285 C CD . GLU A1 1 135 ? -33.636 24.498 -9.346 1.0 46.33 125 A 1 -ATOM 2286 O OE1 . GLU A1 1 135 ? -33.863 23.851 -8.318 1.0 31.61 125 A 1 -ATOM 2287 O OE2 . GLU A1 1 135 ? -33.893 25.699 -9.44 1.0 36.83 125 A 1 -ATOM 2288 H H . GLU A1 1 135 ? -30.331 25.036 -11.193 1.0 22.49 125 A 1 -ATOM 2289 H HA . GLU A1 1 135 ? -31.235 24.862 -8.736 1.0 23.72 125 A 1 -ATOM 2290 H HB2 . GLU A1 1 135 ? -31.123 22.87 -10.723 1.0 25.78 125 A 1 -ATOM 2291 H HB3 . GLU A1 1 135 ? -31.775 22.597 -9.3 1.0 25.78 125 A 1 -ATOM 2292 H HG2 . GLU A1 1 135 ? -32.732 24.464 -11.169 1.0 27.97 125 A 1 -ATOM 2293 H HG3 . GLU A1 1 135 ? -33.442 23.09 -10.803 1.0 27.97 125 A 1 -ATOM 2294 N N . ILE A1 1 136 ? -28.478 23.299 -9.25 1.0 16.87 126 A 1 -ATOM 2295 C CA . ILE A1 1 136 ? -27.406 22.628 -8.556 1.0 16.82 126 A 1 -ATOM 2296 C C . ILE A1 1 136 ? -26.659 23.602 -7.672 1.0 16.47 126 A 1 -ATOM 2297 O O . ILE A1 1 136 ? -26.235 23.246 -6.551 1.0 17.0 126 A 1 -ATOM 2298 C CB . ILE A1 1 136 ? -26.489 21.878 -9.539 1.0 16.66 126 A 1 -ATOM 2299 C CG1 . ILE A1 1 136 ? -27.303 20.81 -10.251 1.0 17.13 126 A 1 -ATOM 2300 C CG2 . ILE A1 1 136 ? -25.303 21.289 -8.789 1.0 16.76 126 A 1 -ATOM 2301 C CD1 . ILE A1 1 136 ? -26.543 20.113 -11.396 1.0 16.7 126 A 1 -ATOM 2302 H H . ILE A1 1 136 ? -28.345 23.404 -10.094 1.0 20.25 126 A 1 -ATOM 2303 H HA . ILE A1 1 136 ? -27.789 21.95 -7.977 1.0 20.19 126 A 1 -ATOM 2304 H HB . ILE A1 1 136 ? -26.137 22.487 -10.207 1.0 19.99 126 A 1 -ATOM 2305 H HG12 . ILE A1 1 136 ? -27.557 20.13 -9.607 1.0 20.56 126 A 1 -ATOM 2306 H HG13 . ILE A1 1 136 ? -28.096 21.221 -10.629 1.0 20.56 126 A 1 -ATOM 2307 H HG21 . ILE A1 1 136 ? -24.832 20.676 -9.374 1.0 20.11 126 A 1 -ATOM 2308 H HG22 . ILE A1 1 136 ? -24.712 22.009 -8.519 1.0 20.11 126 A 1 -ATOM 2309 H HG23 . ILE A1 1 136 ? -25.628 20.817 -8.006 1.0 20.11 126 A 1 -ATOM 2310 H HD11 . ILE A1 1 136 ? -27.16 19.552 -11.89 1.0 20.03 126 A 1 -ATOM 2311 H HD12 . ILE A1 1 136 ? -26.168 20.789 -11.983 1.0 20.03 126 A 1 -ATOM 2312 H HD13 . ILE A1 1 136 ? -25.832 19.572 -11.019 1.0 20.03 126 A 1 -ATOM 2313 N N . LYS A1 1 137 ? -26.519 24.854 -8.07 1.0 16.93 127 A 1 -ATOM 2314 C CA . LYS A1 1 137 ? -25.833 25.821 -7.245 1.0 16.98 127 A 1 -ATOM 2315 C C . LYS A1 1 137 ? -26.57 26.077 -5.933 1.0 17.71 127 A 1 -ATOM 2316 O O . LYS A1 1 137 ? -25.908 26.372 -4.92 1.0 19.25 127 A 1 -ATOM 2317 C CB . LYS A1 1 137 ? -25.619 27.137 -7.997 1.0 17.84 127 A 1 -ATOM 2318 C CG . LYS A1 1 137 ? -24.492 27.029 -9.077 1.0 17.36 127 A 1 -ATOM 2319 C CD . LYS A1 1 137 ? -23.122 26.709 -8.519 1.0 19.07 127 A 1 -ATOM 2320 C CE . LYS A1 1 137 ? -22.619 27.882 -7.761 1.0 20.9 127 A 1 -ATOM 2321 N NZ . LYS A1 1 137 ? -21.329 27.563 -7.14 1.0 21.64 127 A 1 -ATOM 2322 H H . LYS A1 1 137 ? -26.812 25.167 -8.815 1.0 20.32 127 A 1 -ATOM 2323 H HA . LYS A1 1 137 ? -24.957 25.46 -7.036 1.0 20.38 127 A 1 -ATOM 2324 H HB2 . LYS A1 1 137 ? -26.443 27.385 -8.445 1.0 21.41 127 A 1 -ATOM 2325 H HB3 . LYS A1 1 137 ? -25.365 27.826 -7.364 1.0 21.41 127 A 1 -ATOM 2326 H HG2 . LYS A1 1 137 ? -24.726 26.324 -9.701 1.0 20.84 127 A 1 -ATOM 2327 H HG3 . LYS A1 1 137 ? -24.427 27.877 -9.544 1.0 20.84 127 A 1 -ATOM 2328 H HD2 . LYS A1 1 137 ? -23.179 25.948 -7.919 1.0 22.89 127 A 1 -ATOM 2329 H HD3 . LYS A1 1 137 ? -22.507 26.515 -9.243 1.0 22.89 127 A 1 -ATOM 2330 H HE2 . LYS A1 1 137 ? -22.497 28.633 -8.364 1.0 25.08 127 A 1 -ATOM 2331 H HE3 . LYS A1 1 137 ? -23.251 28.116 -7.063 1.0 25.08 127 A 1 -ATOM 2332 H HZ1 . LYS A1 1 137 ? -21.424 26.884 -6.573 1.0 25.97 127 A 1 -ATOM 2333 H HZ2 . LYS A1 1 137 ? -20.738 27.336 -7.765 1.0 25.97 127 A 1 -ATOM 2334 H HZ3 . LYS A1 1 137 ? -21.022 28.27 -6.695 1.0 25.97 127 A 1 -ATOM 2335 N N . LYS A1 1 138 ? -27.876 25.872 -5.888 1.0 17.14 128 A 1 -ATOM 2336 C CA . LYS A1 1 138 ? -28.618 25.978 -4.634 1.0 17.79 128 A 1 -ATOM 2337 C C . LYS A1 1 138 ? -28.208 24.897 -3.629 1.0 17.59 128 A 1 -ATOM 2338 O O . LYS A1 1 138 ? -28.516 25.045 -2.436 1.0 18.27 128 A 1 -ATOM 2339 C CB . LYS A1 1 138 ? -30.125 25.887 -4.903 1.0 19.53 128 A 1 -ATOM 2340 C CG . LYS A1 1 138 ? -30.653 27.036 -5.743 1.0 20.47 128 A 1 -ATOM 2341 C CD . LYS A1 1 138 ? -32.128 26.89 -6.009 1.0 24.65 128 A 1 -ATOM 2342 C CE . LYS A1 1 138 ? -32.611 27.993 -6.943 1.0 29.55 128 A 1 -ATOM 2343 N NZ . LYS A1 1 138 ? -34.01 27.755 -7.363 1.0 39.49 128 A 1 -ATOM 2344 H H . LYS A1 1 138 ? -28.361 25.668 -6.568 1.0 20.57 128 A 1 -ATOM 2345 H HA . LYS A1 1 138 ? -28.435 26.845 -4.239 1.0 21.35 128 A 1 -ATOM 2346 H HB2 . LYS A1 1 138 ? -30.31 25.061 -5.378 1.0 23.44 128 A 1 -ATOM 2347 H HB3 . LYS A1 1 138 ? -30.596 25.895 -4.056 1.0 23.44 128 A 1 -ATOM 2348 H HG2 . LYS A1 1 138 ? -30.51 27.872 -5.272 1.0 24.57 128 A 1 -ATOM 2349 H HG3 . LYS A1 1 138 ? -30.189 27.052 -6.595 1.0 24.57 128 A 1 -ATOM 2350 H HD2 . LYS A1 1 138 ? -32.299 26.032 -6.429 1.0 29.58 128 A 1 -ATOM 2351 H HD3 . LYS A1 1 138 ? -32.617 26.955 -5.175 1.0 29.58 128 A 1 -ATOM 2352 H HE2 . LYS A1 1 138 ? -32.568 28.847 -6.485 1.0 35.46 128 A 1 -ATOM 2353 H HE3 . LYS A1 1 138 ? -32.051 28.014 -7.736 1.0 35.46 128 A 1 -ATOM 2354 H HZ1 . LYS A1 1 138 ? -34.278 28.404 -7.909 1.0 47.38 128 A 1 -ATOM 2355 H HZ2 . LYS A1 1 138 ? -34.072 26.976 -7.788 1.0 47.38 128 A 1 -ATOM 2356 H HZ3 . LYS A1 1 138 ? -34.542 27.739 -6.65 1.0 47.38 128 A 1 -ATOM 2357 N N . MET A1 1 139 ? -27.548 23.847 -4.051 1.0 17.96 129 A 1 -ATOM 2358 C CA . MET A1 1 139 ? -27.159 22.735 -3.185 1.0 17.99 129 A 1 -ATOM 2359 C C . MET A1 1 139 ? -25.878 23.031 -2.452 1.0 20.55 129 A 1 -ATOM 2360 O O . MET A1 1 139 ? -25.442 22.179 -1.669 1.0 22.4 129 A 1 -ATOM 2361 C CB . MET A1 1 139 ? -27.044 21.46 -4.008 1.0 18.54 129 A 1 -ATOM 2362 C CG . MET A1 1 139 ? -28.289 21.087 -4.769 1.0 18.58 129 A 1 -ATOM 2363 S SD . MET A1 1 139 ? -28.029 19.662 -5.815 1.0 18.99 129 A 1 -ATOM 2364 C CE . MET A1 1 139 ? -29.589 19.709 -6.729 1.0 22.17 129 A 1 -ATOM 2365 H H . MET A1 1 139 ? -27.299 23.739 -4.867 1.0 21.55 129 A 1 -ATOM 2366 H HA . MET A1 1 139 ? -27.852 22.567 -2.527 1.0 21.59 129 A 1 -ATOM 2367 H HB2 . MET A1 1 139 ? -26.329 21.573 -4.654 1.0 22.25 129 A 1 -ATOM 2368 H HB3 . MET A1 1 139 ? -26.836 20.725 -3.409 1.0 22.25 129 A 1 -ATOM 2369 H HG2 . MET A1 1 139 ? -28.998 20.878 -4.14 1.0 22.29 129 A 1 -ATOM 2370 H HG3 . MET A1 1 139 ? -28.555 21.832 -5.331 1.0 22.29 129 A 1 -ATOM 2371 H HE1 . MET A1 1 139 ? -29.606 18.977 -7.365 1.0 26.61 129 A 1 -ATOM 2372 H HE2 . MET A1 1 139 ? -30.325 19.621 -6.103 1.0 26.61 129 A 1 -ATOM 2373 H HE3 . MET A1 1 139 ? -29.654 20.556 -7.199 1.0 26.61 129 A 1 -ATOM 2374 N N . GLY A1 1 140 ? -25.212 24.152 -2.691 1.0 16.86 130 A 1 -ATOM 2375 C CA . GLY A1 1 140 ? -24.04 24.516 -1.921 1.0 18.96 130 A 1 -ATOM 2376 C C . GLY A1 1 140 ? -22.727 23.95 -2.397 1.0 18.87 130 A 1 -ATOM 2377 O O . GLY A1 1 140 ? -21.744 23.892 -1.638 1.0 20.3 130 A 1 -ATOM 2378 H H . GLY A1 1 140 ? -25.422 24.722 -3.3 1.0 20.23 130 A 1 -ATOM 2379 H HA2 . GLY A1 1 140 ? -23.959 25.482 -1.928 1.0 22.75 130 A 1 -ATOM 2380 H HA3 . GLY A1 1 140 ? -24.17 24.216 -1.008 1.0 22.75 130 A 1 -ATOM 2381 N N . VAL A1 1 141 ? -22.65 23.574 -3.659 1.0 16.33 131 A 1 -ATOM 2382 C CA . VAL A1 1 141 ? -21.482 22.943 -4.27 1.0 16.2 131 A 1 -ATOM 2383 C C . VAL A1 1 141 ? -20.997 23.767 -5.466 1.0 15.36 131 A 1 -ATOM 2384 O O . VAL A1 1 141 ? -21.696 24.641 -5.97 1.0 17.31 131 A 1 -ATOM 2385 C CB . VAL A1 1 141 ? -21.766 21.487 -4.682 1.0 16.54 131 A 1 -ATOM 2386 C CG1 . VAL A1 1 141 ? -22.029 20.654 -3.438 1.0 19.47 131 A 1 -ATOM 2387 C CG2 . VAL A1 1 141 ? -22.888 21.44 -5.733 1.0 18.49 131 A 1 -ATOM 2388 H H . VAL A1 1 141 ? -23.294 23.678 -4.219 1.0 19.59 131 A 1 -ATOM 2389 H HA . VAL A1 1 141 ? -20.762 22.948 -3.619 1.0 19.44 131 A 1 -ATOM 2390 H HB . VAL A1 1 141 ? -20.996 21.087 -5.115 1.0 19.84 131 A 1 -ATOM 2391 H HG11 . VAL A1 1 141 ? -22.086 19.719 -3.691 1.0 23.36 131 A 1 -ATOM 2392 H HG12 . VAL A1 1 141 ? -21.301 20.783 -2.811 1.0 23.36 131 A 1 -ATOM 2393 H HG13 . VAL A1 1 141 ? -22.865 20.94 -3.038 1.0 23.36 131 A 1 -ATOM 2394 H HG21 . VAL A1 1 141 ? -23.115 20.514 -5.912 1.0 22.19 131 A 1 -ATOM 2395 H HG22 . VAL A1 1 141 ? -23.664 21.909 -5.388 1.0 22.19 131 A 1 -ATOM 2396 H HG23 . VAL A1 1 141 ? -22.578 21.868 -6.546 1.0 22.19 131 A 1 -ATOM 2397 N N . ALA A1 1 142 ? -19.8 23.446 -5.924 1.0 14.53 132 A 1 -ATOM 2398 C CA . ALA A1 1 142 ? -19.285 24.01 -7.175 1.0 14.5 132 A 1 -ATOM 2399 C C . ALA A1 1 142 ? -19.84 23.24 -8.361 1.0 14.41 132 A 1 -ATOM 2400 O O . ALA A1 1 142 ? -20.17 22.058 -8.255 1.0 14.0 132 A 1 -ATOM 2401 C CB . ALA A1 1 142 ? -17.772 23.902 -7.196 1.0 15.14 132 A 1 -ATOM 2402 H H . ALA A1 1 142 ? -19.26 22.903 -5.533 1.0 17.44 132 A 1 -ATOM 2403 H HA . ALA A1 1 142 ? -19.545 24.941 -7.249 1.0 17.4 132 A 1 -ATOM 2404 H HB1 . ALA A1 1 142 ? -17.442 24.259 -8.035 1.0 18.17 132 A 1 -ATOM 2405 H HB2 . ALA A1 1 142 ? -17.409 24.41 -6.454 1.0 18.17 132 A 1 -ATOM 2406 H HB3 . ALA A1 1 142 ? -17.521 22.968 -7.112 1.0 18.17 132 A 1 -ATOM 2407 N N . VAL A1 1 143 ? -19.96 23.939 -9.484 1.0 14.13 133 A 1 -ATOM 2408 C CA . VAL A1 1 143 ? -20.405 23.344 -10.743 1.0 13.94 133 A 1 -ATOM 2409 C C . VAL A1 1 143 ? -19.333 23.551 -11.796 1.0 14.39 133 A 1 -ATOM 2410 O O . VAL A1 1 143 ? -18.883 24.686 -12.05 1.0 14.63 133 A 1 -ATOM 2411 C CB . VAL A1 1 143 ? -21.728 23.926 -11.204 1.0 14.94 133 A 1 -ATOM 2412 C CG1 . VAL A1 1 143 ? -22.057 23.464 -12.623 1.0 16.57 133 A 1 -ATOM 2413 C CG2 . VAL A1 1 143 ? -22.834 23.507 -10.242 1.0 16.54 133 A 1 -ATOM 2414 H H . VAL A1 1 143 ? -19.787 24.78 -9.544 1.0 16.96 133 A 1 -ATOM 2415 H HA . VAL A1 1 143 ? -20.515 22.389 -10.612 1.0 16.73 133 A 1 -ATOM 2416 H HB . VAL A1 1 143 ? -21.665 24.894 -11.213 1.0 17.92 133 A 1 -ATOM 2417 H HG11 . VAL A1 1 143 ? -23.0 23.616 -12.794 1.0 19.88 133 A 1 -ATOM 2418 H HG12 . VAL A1 1 143 ? -21.521 23.971 -13.252 1.0 19.88 133 A 1 -ATOM 2419 H HG13 . VAL A1 1 143 ? -21.855 22.519 -12.702 1.0 19.88 133 A 1 -ATOM 2420 H HG21 . VAL A1 1 143 ? -23.672 23.898 -10.535 1.0 19.85 133 A 1 -ATOM 2421 H HG22 . VAL A1 1 143 ? -22.902 22.539 -10.242 1.0 19.85 133 A 1 -ATOM 2422 H HG23 . VAL A1 1 143 ? -22.614 23.823 -9.352 1.0 19.85 133 A 1 -ATOM 2423 N N . THR A1 1 144 ? -18.962 22.461 -12.445 1.0 12.72 134 A 1 -ATOM 2424 C CA . THR A1 1 144 ? -18.064 22.447 -13.596 1.0 12.7 134 A 1 -ATOM 2425 C C . THR A1 1 144 ? -18.851 21.987 -14.805 1.0 13.16 134 A 1 -ATOM 2426 O O . THR A1 1 144 ? -19.548 20.973 -14.742 1.0 14.3 134 A 1 -ATOM 2427 C CB . THR A1 1 144 ? -16.914 21.512 -13.383 1.0 13.07 134 A 1 -ATOM 2428 O OG1 . THR A1 1 144 ? -16.163 22.04 -12.249 1.0 14.42 134 A 1 -ATOM 2429 C CG2 . THR A1 1 144 ? -15.999 21.41 -14.599 1.0 13.95 134 A 1 -ATOM 2430 H H . THR A1 1 144 ? -19.229 21.672 -12.228 1.0 15.27 134 A 1 -ATOM 2431 H HA . THR A1 1 144 ? -17.714 23.339 -13.743 1.0 15.24 134 A 1 -ATOM 2432 H HB . THR A1 1 144 ? -17.237 20.611 -13.225 1.0 15.68 134 A 1 -ATOM 2433 H HG1 . THR A1 1 144 ? -15.493 21.557 -12.098 1.0 17.31 134 A 1 -ATOM 2434 H HG21 . THR A1 1 144 ? -15.185 20.939 -14.363 1.0 16.74 134 A 1 -ATOM 2435 H HG22 . THR A1 1 144 ? -16.447 20.927 -15.311 1.0 16.74 134 A 1 -ATOM 2436 H HG23 . THR A1 1 144 ? -15.769 22.297 -14.917 1.0 16.74 134 A 1 -ATOM 2437 N N . LEU A1 1 145 ? -18.748 22.731 -15.921 1.0 13.36 135 A 1 -ATOM 2438 C CA . LEU A1 1 145 ? -19.361 22.335 -17.195 1.0 12.46 135 A 1 -ATOM 2439 C C . LEU A1 1 145 ? -18.287 21.798 -18.119 1.0 12.7 135 A 1 -ATOM 2440 O O . LEU A1 1 145 ? -17.165 22.285 -18.139 1.0 12.96 135 A 1 -ATOM 2441 C CB . LEU A1 1 145 ? -20.052 23.529 -17.832 1.0 13.9 135 A 1 -ATOM 2442 C CG . LEU A1 1 145 ? -21.195 24.155 -17.011 1.0 13.81 135 A 1 -ATOM 2443 C CD1 . LEU A1 1 145 ? -21.793 25.313 -17.754 1.0 15.57 135 A 1 -ATOM 2444 C CD2 . LEU A1 1 145 ? -22.251 23.12 -16.737 1.0 15.0 135 A 1 -ATOM 2445 H H . LEU A1 1 145 ? -18.323 23.477 -15.962 1.0 16.04 135 A 1 -ATOM 2446 H HA . LEU A1 1 145 ? -20.024 21.64 -17.058 1.0 14.96 135 A 1 -ATOM 2447 H HB2 . LEU A1 1 145 ? -19.389 24.222 -17.977 1.0 16.68 135 A 1 -ATOM 2448 H HB3 . LEU A1 1 145 ? -20.428 23.246 -18.68 1.0 16.68 135 A 1 -ATOM 2449 H HG . LEU A1 1 145 ? -20.847 24.48 -16.166 1.0 16.58 135 A 1 -ATOM 2450 H HD11 . LEU A1 1 145 ? -22.506 25.697 -17.22 1.0 18.69 135 A 1 -ATOM 2451 H HD12 . LEU A1 1 145 ? -21.104 25.976 -17.913 1.0 18.69 135 A 1 -ATOM 2452 H HD13 . LEU A1 1 145 ? -22.148 24.996 -18.6 1.0 18.69 135 A 1 -ATOM 2453 H HD21 . LEU A1 1 145 ? -23.026 23.555 -16.35 1.0 18.0 135 A 1 -ATOM 2454 H HD22 . LEU A1 1 145 ? -22.495 22.689 -17.571 1.0 18.0 135 A 1 -ATOM 2455 H HD23 . LEU A1 1 145 ? -21.896 22.463 -16.118 1.0 18.0 135 A 1 -ATOM 2456 N N . SER A1 1 146 ? -18.672 20.805 -18.931 1.0 12.28 136 A 1 -ATOM 2457 C CA . SER A1 1 146 ? -17.774 20.235 -19.944 1.0 12.79 136 A 1 -ATOM 2458 C C . SER A1 1 146 ? -18.641 19.836 -21.141 1.0 12.24 136 A 1 -ATOM 2459 O O . SER A1 1 146 ? -18.982 18.688 -21.331 1.0 12.39 136 A 1 -ATOM 2460 C CB . SER A1 1 146 ? -17.047 19.061 -19.299 1.0 12.59 136 A 1 -ATOM 2461 O OG . SER A1 1 146 ? -16.072 18.477 -20.167 1.0 13.06 136 A 1 -ATOM 2462 H H . SER A1 1 146 ? -19.452 20.443 -18.914 1.0 14.73 136 A 1 -ATOM 2463 H HA . SER A1 1 146 ? -17.13 20.873 -20.289 1.0 15.34 136 A 1 -ATOM 2464 H HB2 . SER A1 1 146 ? -16.599 19.377 -18.499 1.0 15.11 136 A 1 -ATOM 2465 H HB3 . SER A1 1 146 ? -17.7 18.382 -19.068 1.0 15.11 136 A 1 -ATOM 2466 H HG . SER A1 1 146 ? -15.478 19.041 -20.351 1.0 15.67 136 A 1 -ATOM 2467 N N . LEU A1 1 147 ? -19.044 20.849 -21.906 1.0 12.26 137 A 1 -ATOM 2468 C CA . LEU A1 1 147 ? -20.071 20.708 -22.934 1.0 12.74 137 A 1 -ATOM 2469 C C . LEU A1 1 147 ? -19.539 20.945 -24.34 1.0 13.2 137 A 1 -ATOM 2470 O O . LEU A1 1 147 ? -20.326 20.889 -25.271 1.0 14.1 137 A 1 -ATOM 2471 C CB . LEU A1 1 147 ? -21.248 21.666 -22.664 1.0 13.04 137 A 1 -ATOM 2472 C CG . LEU A1 1 147 ? -21.771 21.701 -21.208 1.0 12.19 137 A 1 -ATOM 2473 C CD1 . LEU A1 1 147 ? -22.877 22.696 -21.096 1.0 14.3 137 A 1 -ATOM 2474 C CD2 . LEU A1 1 147 ? -22.177 20.309 -20.731 1.0 15.39 137 A 1 -ATOM 2475 H H . LEU A1 1 147 ? -18.731 21.648 -21.846 1.0 14.71 137 A 1 -ATOM 2476 H HA . LEU A1 1 147 ? -20.418 19.803 -22.895 1.0 15.28 137 A 1 -ATOM 2477 H HB2 . LEU A1 1 147 ? -20.963 22.566 -22.889 1.0 15.65 137 A 1 -ATOM 2478 H HB3 . LEU A1 1 147 ? -21.99 21.402 -23.23 1.0 15.65 137 A 1 -ATOM 2479 H HG . LEU A1 1 147 ? -21.064 21.986 -20.609 1.0 14.63 137 A 1 -ATOM 2480 H HD11 . LEU A1 1 147 ? -23.217 22.689 -20.188 1.0 17.16 137 A 1 -ATOM 2481 H HD12 . LEU A1 1 147 ? -22.533 23.576 -21.314 1.0 17.16 137 A 1 -ATOM 2482 H HD13 . LEU A1 1 147 ? -23.583 22.454 -21.716 1.0 17.16 137 A 1 -ATOM 2483 H HD21 . LEU A1 1 147 ? -22.568 20.379 -19.847 1.0 18.46 137 A 1 -ATOM 2484 H HD22 . LEU A1 1 147 ? -22.825 19.939 -21.351 1.0 18.46 137 A 1 -ATOM 2485 H HD23 . LEU A1 1 147 ? -21.389 19.744 -20.7 1.0 18.46 137 A 1 -ATOM 2486 N N . GLY A1 1 148 ? -18.263 21.22 -24.49 1.0 13.1 138 A 1 -ATOM 2487 C CA . GLY A1 1 148 ? -17.7 21.478 -25.82 1.0 13.04 138 A 1 -ATOM 2488 C C . GLY A1 1 148 ? -17.673 22.943 -26.17 1.0 13.25 138 A 1 -ATOM 2489 O O . GLY A1 1 148 ? -17.632 23.838 -25.307 1.0 13.85 138 A 1 -ATOM 2490 H H . GLY A1 1 148 ? -17.694 21.267 -23.846 1.0 15.72 138 A 1 -ATOM 2491 H HA2 . GLY A1 1 148 ? -16.79 21.141 -25.852 1.0 15.65 138 A 1 -ATOM 2492 H HA3 . GLY A1 1 148 ? -18.231 21.015 -26.486 1.0 15.65 138 A 1 -ATOM 2493 N N . GLU A1 1 149 ? -17.631 23.17 -27.487 1.0 13.38 139 A 1 -ATOM 2494 C CA . GLU A1 1 149 ? -17.408 24.481 -28.099 1.0 13.65 139 A 1 -ATOM 2495 C C . GLU A1 1 149 ? -18.739 25.13 -28.435 1.0 15.2 139 A 1 -ATOM 2496 O O . GLU A1 1 149 ? -19.528 24.605 -29.22 1.0 16.11 139 A 1 -ATOM 2497 C CB . GLU A1 1 149 ? -16.609 24.311 -29.394 1.0 13.93 139 A 1 -ATOM 2498 C CG . GLU A1 1 149 ? -15.241 23.744 -29.161 1.0 15.54 139 A 1 -ATOM 2499 C CD . GLU A1 1 149 ? -14.51 23.319 -30.398 1.0 14.31 139 A 1 -ATOM 2500 O OE1 . GLU A1 1 149 ? -14.749 23.922 -31.467 1.0 16.27 139 A 1 -ATOM 2501 O OE2 . GLU A1 1 149 ? -13.648 22.444 -30.306 1.0 15.33 139 A 1 -ATOM 2502 H H . GLU A1 1 149 ? -17.733 22.55 -28.074 1.0 16.05 139 A 1 -ATOM 2503 H HA . GLU A1 1 149 ? -16.929 25.045 -27.471 1.0 16.38 139 A 1 -ATOM 2504 H HB2 . GLU A1 1 149 ? -17.088 23.708 -29.983 1.0 16.72 139 A 1 -ATOM 2505 H HB3 . GLU A1 1 149 ? -16.507 25.177 -29.818 1.0 16.72 139 A 1 -ATOM 2506 H HG2 . GLU A1 1 149 ? -14.7 24.419 -28.722 1.0 18.65 139 A 1 -ATOM 2507 H HG3 . GLU A1 1 149 ? -15.325 22.964 -28.591 1.0 18.65 139 A 1 -ATOM 2508 N N . TRP A1 1 150 ? -19.013 26.305 -27.813 1.0 16.31 140 A 1 -ATOM 2509 C CA . TRP A1 1 150 ? -20.259 27.047 -27.982 1.0 15.36 140 A 1 -ATOM 2510 C C . TRP A1 1 150 ? -19.942 28.525 -28.117 1.0 16.76 140 A 1 -ATOM 2511 O O . TRP A1 1 150 ? -18.855 28.961 -27.728 1.0 19.63 140 A 1 -ATOM 2512 C CB . TRP A1 1 150 ? -21.244 26.757 -26.801 1.0 16.48 140 A 1 -ATOM 2513 C CG . TRP A1 1 150 ? -21.649 25.302 -26.78 1.0 15.82 140 A 1 -ATOM 2514 C CD1 . TRP A1 1 150 ? -21.092 24.313 -26.014 1.0 14.09 140 A 1 -ATOM 2515 C CD2 . TRP A1 1 150 ? -22.613 24.66 -27.619 1.0 15.34 140 A 1 -ATOM 2516 N NE1 . TRP A1 1 150 ? -21.625 23.091 -26.352 1.0 15.09 140 A 1 -ATOM 2517 C CE2 . TRP A1 1 150 ? -22.563 23.277 -27.344 1.0 16.02 140 A 1 -ATOM 2518 C CE3 . TRP A1 1 150 ? -23.48 25.121 -28.63 1.0 17.63 140 A 1 -ATOM 2519 C CZ2 . TRP A1 1 150 ? -23.379 22.365 -27.983 1.0 17.53 140 A 1 -ATOM 2520 C CZ3 . TRP A1 1 150 ? -24.295 24.219 -29.238 1.0 19.93 140 A 1 -ATOM 2521 C CH2 . TRP A1 1 150 ? -24.224 22.844 -28.962 1.0 18.65 140 A 1 -ATOM 2522 H H . TRP A1 1 150 ? -18.467 26.693 -27.274 1.0 19.57 140 A 1 -ATOM 2523 H HA . TRP A1 1 150 ? -20.712 26.767 -28.793 1.0 18.43 140 A 1 -ATOM 2524 H HB2 . TRP A1 1 150 ? -20.809 26.967 -25.959 1.0 19.78 140 A 1 -ATOM 2525 H HB3 . TRP A1 1 150 ? -22.042 27.297 -26.906 1.0 19.78 140 A 1 -ATOM 2526 H HD1 . TRP A1 1 150 ? -20.445 24.447 -25.359 1.0 16.91 140 A 1 -ATOM 2527 H HE1 . TRP A1 1 150 ? -21.41 22.336 -26.002 1.0 18.1 140 A 1 -ATOM 2528 H HE3 . TRP A1 1 150 ? -23.494 26.018 -28.875 1.0 21.16 140 A 1 -ATOM 2529 H HZ2 . TRP A1 1 150 ? -23.36 21.462 -27.761 1.0 21.04 140 A 1 -ATOM 2530 H HZ3 . TRP A1 1 150 ? -24.92 24.522 -29.857 1.0 23.92 140 A 1 -ATOM 2531 H HH2 . TRP A1 1 150 ? -24.753 22.251 -29.445 1.0 22.38 140 A 1 -ATOM 2532 N N . PRO A1 1 151 ? -20.932 29.315 -28.539 1.0 18.3 141 A 1 -ATOM 2533 C CA . PRO A1 1 151 ? -20.713 30.748 -28.626 1.0 19.87 141 A 1 -ATOM 2534 C C . PRO A1 1 151 ? -20.437 31.384 -27.293 1.0 19.85 141 A 1 -ATOM 2535 O O . PRO A1 1 151 ? -20.884 30.932 -26.234 1.0 19.12 141 A 1 -ATOM 2536 C CB . PRO A1 1 151 ? -22.035 31.273 -29.203 1.0 22.63 141 A 1 -ATOM 2537 C CG . PRO A1 1 151 ? -22.593 30.093 -29.955 1.0 22.0 141 A 1 -ATOM 2538 C CD . PRO A1 1 151 ? -22.229 28.915 -29.105 1.0 18.04 141 A 1 -ATOM 2539 H HA . PRO A1 1 151 ? -19.972 30.927 -29.227 1.0 23.85 141 A 1 -ATOM 2540 H HB2 . PRO A1 1 151 ? -22.628 31.546 -28.486 1.0 27.15 141 A 1 -ATOM 2541 H HB3 . PRO A1 1 151 ? -21.867 32.021 -29.798 1.0 27.15 141 A 1 -ATOM 2542 H HG2 . PRO A1 1 151 ? -23.555 30.177 -30.043 1.0 26.4 141 A 1 -ATOM 2543 H HG3 . PRO A1 1 151 ? -22.184 30.031 -30.832 1.0 26.4 141 A 1 -ATOM 2544 H HD2 . PRO A1 1 151 ? -22.885 28.775 -28.405 1.0 21.65 141 A 1 -ATOM 2545 H HD3 . PRO A1 1 151 ? -22.141 28.112 -29.642 1.0 21.65 141 A 1 -ATOM 2546 N N . ARG A1 1 152 ? -19.733 32.509 -27.357 1.0 20.55 142 A 1 -ATOM 2547 C CA A ARG A1 1 152 ? -19.456 33.275 -26.146 0.54 24.03 142 A 1 -ATOM 2548 C CA B ARG A1 1 152 ? -19.457 33.271 -26.145 0.46 19.67 142 A 1 -ATOM 2549 C C . ARG A1 1 152 ? -20.733 33.568 -25.36 1.0 18.71 142 A 1 -ATOM 2550 O O . ARG A1 1 152 ? -20.745 33.537 -24.126 1.0 20.15 142 A 1 -ATOM 2551 C CB A ARG A1 1 152 ? -18.765 34.59 -26.515 0.54 35.57 142 A 1 -ATOM 2552 C CB B ARG A1 1 152 ? -18.763 34.59 -26.498 0.46 18.66 142 A 1 -ATOM 2553 C CG A ARG A1 1 152 ? -18.522 35.519 -25.344 0.54 28.36 142 A 1 -ATOM 2554 C CG B ARG A1 1 152 ? -18.684 35.581 -25.332 0.46 27.14 142 A 1 -ATOM 2555 C CD A ARG A1 1 152 ? -17.933 36.847 -25.787 0.54 33.91 142 A 1 -ATOM 2556 C CD B ARG A1 1 152 ? -18.059 36.898 -25.752 0.46 35.05 142 A 1 -ATOM 2557 N NE A ARG A1 1 152 ? -17.591 37.643 -24.61 0.54 54.69 142 A 1 -ATOM 2558 N NE B ARG A1 1 152 ? -16.989 37.29 -24.836 0.46 40.24 142 A 1 -ATOM 2559 C CZ A ARG A1 1 152 ? -16.359 37.808 -24.134 0.54 46.38 142 A 1 -ATOM 2560 C CZ B ARG A1 1 152 ? -17.153 37.986 -23.714 0.46 55.66 142 A 1 -ATOM 2561 N NH1 A ARG A1 1 152 ? -16.177 38.542 -23.046 0.54 88.15 142 A 1 -ATOM 2562 N NH1 B ARG A1 1 152 ? -16.094 38.276 -22.975 0.46 82.11 142 A 1 -ATOM 2563 N NH2 A ARG A1 1 152 ? -15.314 37.265 -24.748 0.54 34.07 142 A 1 -ATOM 2564 N NH2 B ARG A1 1 152 ? -18.357 38.396 -23.324 0.46 41.89 142 A 1 -ATOM 2565 H H A ARG A1 1 152 ? -19.409 32.848 -28.078 0.54 24.66 142 A 1 -ATOM 2566 H H B ARG A1 1 152 ? -19.41 32.849 -28.078 0.46 24.66 142 A 1 -ATOM 2567 H HA A ARG A1 1 152 ? -18.864 32.754 -25.581 0.54 28.83 142 A 1 -ATOM 2568 H HA B ARG A1 1 152 ? -18.865 32.742 -25.587 0.46 23.6 142 A 1 -ATOM 2569 H HB2 A ARG A1 1 152 ? -17.904 34.387 -26.912 0.54 42.69 142 A 1 -ATOM 2570 H HB2 B ARG A1 1 152 ? -17.857 34.398 -26.784 0.46 22.39 142 A 1 -ATOM 2571 H HB3 A ARG A1 1 152 ? -19.321 35.063 -27.154 0.54 42.69 142 A 1 -ATOM 2572 H HB3 B ARG A1 1 152 ? -19.255 35.017 -27.217 0.46 22.39 142 A 1 -ATOM 2573 H HG2 A ARG A1 1 152 ? -19.364 35.695 -24.895 0.54 34.04 142 A 1 -ATOM 2574 H HG2 B ARG A1 1 152 ? -19.579 35.761 -25.004 0.46 32.57 142 A 1 -ATOM 2575 H HG3 A ARG A1 1 152 ? -17.899 35.101 -24.729 0.54 34.04 142 A 1 -ATOM 2576 H HG3 B ARG A1 1 152 ? -18.142 35.2 -24.624 0.46 32.57 142 A 1 -ATOM 2577 H HD2 A ARG A1 1 152 ? -17.129 36.693 -26.307 0.54 40.7 142 A 1 -ATOM 2578 H HD2 B ARG A1 1 152 ? -17.683 36.808 -26.642 0.46 42.06 142 A 1 -ATOM 2579 H HD3 A ARG A1 1 152 ? -18.583 37.334 -26.317 0.54 40.7 142 A 1 -ATOM 2580 H HD3 B ARG A1 1 152 ? -18.736 37.593 -25.748 0.46 42.06 142 A 1 -ATOM 2581 H HE A ARG A1 1 152 ? -18.234 38.034 -24.193 0.54 65.63 142 A 1 -ATOM 2582 H HE B ARG A1 1 152 ? -16.189 37.05 -25.039 0.46 48.29 142 A 1 -ATOM 2583 H HH11 A ARG A1 1 152 ? -16.851 38.905 -22.655 0.54 105.78 142 A 1 -ATOM 2584 H HH11 B ARG A1 1 152 ? -15.312 38.014 -23.222 0.46 98.53 142 A 1 -ATOM 2585 H HH12 A ARG A1 1 152 ? -15.385 38.654 -22.731 0.54 105.78 142 A 1 -ATOM 2586 H HH12 B ARG A1 1 152 ? -16.186 38.725 -22.248 0.46 98.53 142 A 1 -ATOM 2587 H HH21 A ARG A1 1 152 ? -15.429 36.8 -25.462 0.54 40.88 142 A 1 -ATOM 2588 H HH21 B ARG A1 1 152 ? -19.049 38.212 -23.799 0.46 50.27 142 A 1 -ATOM 2589 H HH22 A ARG A1 1 152 ? -14.523 37.379 -24.431 0.54 40.88 142 A 1 -ATOM 2590 H HH22 B ARG A1 1 152 ? -18.443 38.845 -22.595 0.46 50.27 142 A 1 -ATOM 2591 N N . GLU A1 1 153 ? -21.824 33.888 -26.053 1.0 19.83 143 A 1 -ATOM 2592 C CA . GLU A1 1 153 ? -23.067 34.181 -25.364 1.0 20.98 143 A 1 -ATOM 2593 C C . GLU A1 1 153 ? -23.522 33.048 -24.467 1.0 18.41 143 A 1 -ATOM 2594 O O . GLU A1 1 153 ? -24.141 33.308 -23.416 1.0 20.53 143 A 1 -ATOM 2595 C CB . GLU A1 1 153 ? -24.164 34.529 -26.391 1.0 25.9 143 A 1 -ATOM 2596 C CG . GLU A1 1 153 ? -25.612 34.427 -25.925 1.0 74.38 143 A 1 -ATOM 2597 C CD . GLU A1 1 153 ? -26.642 34.793 -27.01 1.0 98.04 143 A 1 -ATOM 2598 O OE1 . GLU A1 1 153 ? -26.723 34.095 -28.048 1.0 55.09 143 A 1 -ATOM 2599 O OE2 . GLU A1 1 153 ? -27.382 35.782 -26.812 1.0 86.62 143 A 1 -ATOM 2600 H H . GLU A1 1 153 ? -21.866 33.94 -26.91 1.0 23.79 143 A 1 -ATOM 2601 H HA . GLU A1 1 153 ? -22.916 34.951 -24.793 1.0 25.18 143 A 1 -ATOM 2602 H HB2 . GLU A1 1 153 ? -24.025 35.445 -26.679 1.0 31.08 143 A 1 -ATOM 2603 H HB3 . GLU A1 1 153 ? -24.069 33.926 -27.146 1.0 31.08 143 A 1 -ATOM 2604 H HG2 . GLU A1 1 153 ? -25.787 33.514 -25.647 1.0 89.26 143 A 1 -ATOM 2605 H HG3 . GLU A1 1 153 ? -25.743 35.032 -25.178 1.0 89.26 143 A 1 -ATOM 2606 N N . TYR A1 1 154 ? -23.333 31.807 -24.921 1.0 18.19 144 A 1 -ATOM 2607 C CA . TYR A1 1 154 ? -23.728 30.663 -24.099 1.0 17.84 144 A 1 -ATOM 2608 C C . TYR A1 1 154 ? -22.85 30.59 -22.869 1.0 17.2 144 A 1 -ATOM 2609 O O . TYR A1 1 154 ? -23.36 30.434 -21.765 1.0 17.6 144 A 1 -ATOM 2610 C CB . TYR A1 1 154 ? -23.636 29.348 -24.903 1.0 17.7 144 A 1 -ATOM 2611 C CG . TYR A1 1 154 ? -24.696 29.168 -26.02 1.0 18.06 144 A 1 -ATOM 2612 C CD1 . TYR A1 1 154 ? -25.426 30.225 -26.51 1.0 20.74 144 A 1 -ATOM 2613 C CD2 . TYR A1 1 154 ? -24.843 27.932 -26.592 1.0 18.91 144 A 1 -ATOM 2614 C CE1 . TYR A1 1 154 ? -26.334 30.021 -27.552 1.0 22.51 144 A 1 -ATOM 2615 C CE2 . TYR A1 1 154 ? -25.736 27.708 -27.618 1.0 20.33 144 A 1 -ATOM 2616 C CZ . TYR A1 1 154 ? -26.451 28.745 -28.069 1.0 22.15 144 A 1 -ATOM 2617 O OH . TYR A1 1 154 ? -27.369 28.583 -29.111 1.0 25.92 144 A 1 -ATOM 2618 H H . TYR A1 1 154 ? -22.988 31.605 -25.682 1.0 21.83 144 A 1 -ATOM 2619 H HA . TYR A1 1 154 ? -24.654 30.771 -23.831 1.0 21.4 144 A 1 -ATOM 2620 H HB2 . TYR A1 1 154 ? -22.764 29.31 -25.326 1.0 21.23 144 A 1 -ATOM 2621 H HB3 . TYR A1 1 154 ? -23.739 28.606 -24.287 1.0 21.23 144 A 1 -ATOM 2622 H HD1 . TYR A1 1 154 ? -25.315 31.075 -26.148 1.0 24.89 144 A 1 -ATOM 2623 H HD2 . TYR A1 1 154 ? -24.326 27.225 -26.279 1.0 22.7 144 A 1 -ATOM 2624 H HE1 . TYR A1 1 154 ? -26.844 30.722 -27.887 1.0 27.01 144 A 1 -ATOM 2625 H HE2 . TYR A1 1 154 ? -25.839 26.86 -27.987 1.0 24.4 144 A 1 -ATOM 2626 H HH . TYR A1 1 154 ? -27.352 27.79 -29.388 1.0 31.1 144 A 1 -ATOM 2627 N N . TYR A1 1 155 ? -21.541 30.688 -23.044 1.0 16.5 145 A 1 -ATOM 2628 C CA . TYR A1 1 155 ? -20.648 30.648 -21.89 1.0 16.82 145 A 1 -ATOM 2629 C C . TYR A1 1 155 ? -20.982 31.763 -20.91 1.0 18.28 145 A 1 -ATOM 2630 O O . TYR A1 1 155 ? -20.912 31.557 -19.69 1.0 17.87 145 A 1 -ATOM 2631 C CB . TYR A1 1 155 ? -19.204 30.759 -22.364 1.0 17.41 145 A 1 -ATOM 2632 C CG . TYR A1 1 155 ? -18.668 29.616 -23.204 1.0 15.84 145 A 1 -ATOM 2633 C CD1 . TYR A1 1 155 ? -19.118 28.321 -23.072 1.0 16.39 145 A 1 -ATOM 2634 C CD2 . TYR A1 1 155 ? -17.616 29.844 -24.098 1.0 16.88 145 A 1 -ATOM 2635 C CE1 . TYR A1 1 155 ? -18.596 27.288 -23.819 1.0 15.35 145 A 1 -ATOM 2636 C CE2 . TYR A1 1 155 ? -17.089 28.836 -24.813 1.0 18.93 145 A 1 -ATOM 2637 C CZ . TYR A1 1 155 ? -17.549 27.56 -24.693 1.0 15.99 145 A 1 -ATOM 2638 O OH . TYR A1 1 155 ? -16.933 26.56 -25.431 1.0 16.36 145 A 1 -ATOM 2639 H H . TYR A1 1 155 ? -21.148 30.777 -23.804 1.0 19.8 145 A 1 -ATOM 2640 H HA . TYR A1 1 155 ? -20.751 29.801 -21.427 1.0 20.18 145 A 1 -ATOM 2641 H HB2 . TYR A1 1 155 ? -19.126 31.564 -22.899 1.0 20.89 145 A 1 -ATOM 2642 H HB3 . TYR A1 1 155 ? -18.636 30.825 -21.58 1.0 20.89 145 A 1 -ATOM 2643 H HD1 . TYR A1 1 155 ? -19.795 28.138 -22.46 1.0 19.67 145 A 1 -ATOM 2644 H HD2 . TYR A1 1 155 ? -17.277 30.704 -24.198 1.0 20.25 145 A 1 -ATOM 2645 H HE1 . TYR A1 1 155 ? -18.937 26.426 -23.74 1.0 18.42 145 A 1 -ATOM 2646 H HE2 . TYR A1 1 155 ? -16.394 29.014 -25.405 1.0 22.71 145 A 1 -ATOM 2647 H HH . TYR A1 1 155 ? -17.285 25.817 -25.258 1.0 19.64 145 A 1 -ATOM 2648 N N . GLU A1 1 156 ? -21.352 32.94 -21.413 1.0 17.63 146 A 1 -ATOM 2649 C CA A GLU A1 1 156 ? -21.739 34.067 -20.566 0.41 20.64 146 A 1 -ATOM 2650 C CA B GLU A1 1 156 ? -21.714 34.048 -20.535 0.59 19.4 146 A 1 -ATOM 2651 C C . GLU A1 1 156 ? -22.99 33.74 -19.765 1.0 18.42 146 A 1 -ATOM 2652 O O . GLU A1 1 156 ? -23.055 33.97 -18.544 1.0 19.55 146 A 1 -ATOM 2653 C CB A GLU A1 1 156 ? -22.021 35.292 -21.451 0.41 28.7 146 A 1 -ATOM 2654 C CB B GLU A1 1 156 ? -21.871 35.31 -21.389 0.59 20.2 146 A 1 -ATOM 2655 C CG A GLU A1 1 156 ? -20.799 36.081 -21.895 0.41 42.03 146 A 1 -ATOM 2656 C CG B GLU A1 1 156 ? -22.072 36.603 -20.611 0.59 45.33 146 A 1 -ATOM 2657 C CD A GLU A1 1 156 ? -21.13 37.291 -22.779 0.41 52.58 146 A 1 -ATOM 2658 C CD B GLU A1 1 156 ? -21.837 37.86 -21.444 0.59 33.02 146 A 1 -ATOM 2659 O OE1 A GLU A1 1 156 ? -22.151 37.28 -23.523 0.41 28.21 146 A 1 -ATOM 2660 O OE1 B GLU A1 1 156 ? -22.096 37.838 -22.663 0.59 51.38 146 A 1 -ATOM 2661 O OE2 A GLU A1 1 156 ? -20.344 38.258 -22.719 0.41 51.09 146 A 1 -ATOM 2662 O OE2 B GLU A1 1 156 ? -21.411 38.873 -20.851 0.59 44.83 146 A 1 -ATOM 2663 H H A GLU A1 1 156 ? -21.388 33.117 -22.254 0.41 21.16 146 A 1 -ATOM 2664 H H B GLU A1 1 156 ? -21.401 33.122 -22.252 0.59 21.16 146 A 1 -ATOM 2665 H HA A GLU A1 1 156 ? -21.012 34.264 -19.954 0.41 24.77 146 A 1 -ATOM 2666 H HA B GLU A1 1 156 ? -21.015 34.202 -19.881 0.59 23.28 146 A 1 -ATOM 2667 H HB2 A GLU A1 1 156 ? -22.474 34.989 -22.254 0.41 34.44 146 A 1 -ATOM 2668 H HB2 B GLU A1 1 156 ? -21.07 35.417 -21.926 0.59 24.25 146 A 1 -ATOM 2669 H HB3 A GLU A1 1 156 ? -22.592 35.9 -20.957 0.41 34.44 146 A 1 -ATOM 2670 H HB3 B GLU A1 1 156 ? -22.643 35.195 -21.964 0.59 24.25 146 A 1 -ATOM 2671 H HG2 A GLU A1 1 156 ? -20.336 36.408 -21.107 0.41 50.44 146 A 1 -ATOM 2672 H HG2 B GLU A1 1 156 ? -22.984 36.632 -20.281 0.59 54.4 146 A 1 -ATOM 2673 H HG3 A GLU A1 1 156 ? -20.216 35.495 -22.402 0.41 50.44 146 A 1 -ATOM 2674 H HG3 B GLU A1 1 156 ? -21.449 36.621 -19.867 0.59 54.4 146 A 1 -ATOM 2675 N N . LYS A1 1 157 ? -24.016 33.203 -20.43 1.0 19.21 147 A 1 -ATOM 2676 C CA . LYS A1 1 157 ? -25.249 32.836 -19.746 1.0 19.18 147 A 1 -ATOM 2677 C C . LYS A1 1 157 ? -24.989 31.792 -18.656 1.0 18.43 147 A 1 -ATOM 2678 O O . LYS A1 1 157 ? -25.565 31.857 -17.549 1.0 19.11 147 A 1 -ATOM 2679 C CB . LYS A1 1 157 ? -26.265 32.295 -20.757 1.0 18.36 147 A 1 -ATOM 2680 C CG . LYS A1 1 157 ? -26.979 33.384 -21.538 1.0 21.85 147 A 1 -ATOM 2681 C CD . LYS A1 1 157 ? -27.726 32.852 -22.742 1.0 24.12 147 A 1 -ATOM 2682 C CE . LYS A1 1 157 ? -28.501 34.013 -23.459 1.0 38.79 147 A 1 -ATOM 2683 N NZ . LYS A1 1 157 ? -29.134 33.541 -24.723 1.0 93.87 147 A 1 -ATOM 2684 H H . LYS A1 1 157 ? -24.021 33.042 -21.274 1.0 23.05 147 A 1 -ATOM 2685 H HA . LYS A1 1 157 ? -25.621 33.628 -19.328 1.0 23.01 147 A 1 -ATOM 2686 H HB2 . LYS A1 1 157 ? -25.802 31.728 -21.393 1.0 22.03 147 A 1 -ATOM 2687 H HB3 . LYS A1 1 157 ? -26.936 31.781 -20.282 1.0 22.03 147 A 1 -ATOM 2688 H HG2 . LYS A1 1 157 ? -27.621 33.82 -20.957 1.0 26.22 147 A 1 -ATOM 2689 H HG3 . LYS A1 1 157 ? -26.325 34.028 -21.853 1.0 26.22 147 A 1 -ATOM 2690 H HD2 . LYS A1 1 157 ? -27.096 32.466 -23.371 1.0 28.95 147 A 1 -ATOM 2691 H HD3 . LYS A1 1 157 ? -28.366 32.181 -22.459 1.0 28.95 147 A 1 -ATOM 2692 H HE2 . LYS A1 1 157 ? -29.199 34.344 -22.872 1.0 46.55 147 A 1 -ATOM 2693 H HE3 . LYS A1 1 157 ? -27.883 34.728 -23.675 1.0 46.55 147 A 1 -ATOM 2694 H HZ1 . LYS A1 1 157 ? -29.559 34.214 -25.121 1.0 112.64 147 A 1 -ATOM 2695 H HZ2 . LYS A1 1 157 ? -28.512 33.225 -25.275 1.0 112.64 147 A 1 -ATOM 2696 H HZ3 . LYS A1 1 157 ? -29.719 32.894 -24.547 1.0 112.64 147 A 1 -ATOM 2697 N N . TRP A1 1 158 ? -24.106 30.829 -18.918 1.0 16.35 148 A 1 -ATOM 2698 C CA . TRP A1 1 158 ? -23.86 29.78 -17.935 1.0 16.27 148 A 1 -ATOM 2699 C C . TRP A1 1 158 ? -23.059 30.315 -16.764 1.0 17.1 148 A 1 -ATOM 2700 O O . TRP A1 1 158 ? -23.251 29.846 -15.64 1.0 17.52 148 A 1 -ATOM 2701 C CB . TRP A1 1 158 ? -23.138 28.607 -18.607 1.0 16.34 148 A 1 -ATOM 2702 C CG . TRP A1 1 158 ? -23.954 27.967 -19.697 1.0 16.21 148 A 1 -ATOM 2703 C CD1 . TRP A1 1 158 ? -25.321 28.033 -19.821 1.0 16.52 148 A 1 -ATOM 2704 C CD2 . TRP A1 1 158 ? -23.462 27.278 -20.828 1.0 15.66 148 A 1 -ATOM 2705 N NE1 . TRP A1 1 158 ? -25.726 27.398 -20.971 1.0 16.87 148 A 1 -ATOM 2706 C CE2 . TRP A1 1 158 ? -24.606 26.871 -21.585 1.0 16.11 148 A 1 -ATOM 2707 C CE3 . TRP A1 1 158 ? -22.186 26.865 -21.237 1.0 15.1 148 A 1 -ATOM 2708 C CZ2 . TRP A1 1 158 ? -24.479 26.168 -22.774 1.0 16.38 148 A 1 -ATOM 2709 C CZ3 . TRP A1 1 158 ? -22.082 26.174 -22.453 1.0 15.17 148 A 1 -ATOM 2710 C CH2 . TRP A1 1 158 ? -23.228 25.801 -23.185 1.0 15.86 148 A 1 -ATOM 2711 H H . TRP A1 1 158 ? -23.647 30.763 -19.642 1.0 19.62 148 A 1 -ATOM 2712 H HA . TRP A1 1 158 ? -24.702 29.445 -17.591 1.0 19.53 148 A 1 -ATOM 2713 H HB2 . TRP A1 1 158 ? -22.311 28.929 -19.0 1.0 19.61 148 A 1 -ATOM 2714 H HB3 . TRP A1 1 158 ? -22.946 27.93 -17.939 1.0 19.61 148 A 1 -ATOM 2715 H HD1 . TRP A1 1 158 ? -25.89 28.448 -19.214 1.0 19.83 148 A 1 -ATOM 2716 H HE1 . TRP A1 1 158 ? -26.534 27.338 -21.258 1.0 20.25 148 A 1 -ATOM 2717 H HE3 . TRP A1 1 158 ? -21.435 27.043 -20.719 1.0 18.13 148 A 1 -ATOM 2718 H HZ2 . TRP A1 1 158 ? -25.229 25.951 -23.28 1.0 19.66 148 A 1 -ATOM 2719 H HZ3 . TRP A1 1 158 ? -21.24 25.957 -22.783 1.0 18.21 148 A 1 -ATOM 2720 H HH2 . TRP A1 1 158 ? -23.131 25.297 -23.961 1.0 19.03 148 A 1 -ATOM 2721 N N . LYS A1 1 159 ? -22.195 31.299 -16.985 1.0 16.3 149 A 1 -ATOM 2722 C CA . LYS A1 1 159 ? -21.485 31.952 -15.899 1.0 16.91 149 A 1 -ATOM 2723 C C . LYS A1 1 159 ? -22.465 32.732 -15.015 1.0 18.67 149 A 1 -ATOM 2724 O O . LYS A1 1 159 ? -22.436 32.596 -13.783 1.0 18.85 149 A 1 -ATOM 2725 C CB . LYS A1 1 159 ? -20.389 32.865 -16.442 1.0 18.2 149 A 1 -ATOM 2726 C CG . LYS A1 1 159 ? -19.453 33.394 -15.346 1.0 19.07 149 A 1 -ATOM 2727 C CD . LYS A1 1 159 ? -18.543 32.31 -14.833 1.0 20.13 149 A 1 -ATOM 2728 C CE . LYS A1 1 159 ? -17.531 32.868 -13.79 1.0 23.07 149 A 1 -ATOM 2729 N NZ . LYS A1 1 159 ? -18.147 33.507 -12.612 1.0 29.88 149 A 1 -ATOM 2730 H H . LYS A1 1 159 ? -22.0 31.609 -17.763 1.0 19.56 149 A 1 -ATOM 2731 H HA . LYS A1 1 159 ? -21.046 31.28 -15.356 1.0 20.29 149 A 1 -ATOM 2732 H HB2 . LYS A1 1 159 ? -19.852 32.368 -17.08 1.0 21.84 149 A 1 -ATOM 2733 H HB3 . LYS A1 1 159 ? -20.801 33.627 -16.877 1.0 21.84 149 A 1 -ATOM 2734 H HG2 . LYS A1 1 159 ? -18.904 34.107 -15.708 1.0 22.89 149 A 1 -ATOM 2735 H HG3 . LYS A1 1 159 ? -19.981 33.725 -14.603 1.0 22.89 149 A 1 -ATOM 2736 H HD2 . LYS A1 1 159 ? -19.074 31.62 -14.405 1.0 24.16 149 A 1 -ATOM 2737 H HD3 . LYS A1 1 159 ? -18.043 31.932 -15.573 1.0 24.16 149 A 1 -ATOM 2738 H HE2 . LYS A1 1 159 ? -16.981 32.135 -13.47 1.0 27.69 149 A 1 -ATOM 2739 H HE3 . LYS A1 1 159 ? -16.975 33.534 -14.225 1.0 27.69 149 A 1 -ATOM 2740 H HZ1 . LYS A1 1 159 ? -17.514 33.794 -12.056 1.0 35.86 149 A 1 -ATOM 2741 H HZ2 . LYS A1 1 159 ? -18.644 34.2 -12.866 1.0 35.86 149 A 1 -ATOM 2742 H HZ3 . LYS A1 1 159 ? -18.664 32.922 -12.184 1.0 35.86 149 A 1 -ATOM 2743 N N . GLU A1 1 160 ? -23.382 33.478 -15.617 1.0 19.44 150 A 1 -ATOM 2744 C CA . GLU A1 1 160 ? -24.371 34.2 -14.849 1.0 19.87 150 A 1 -ATOM 2745 C C . GLU A1 1 160 ? -25.287 33.248 -14.122 1.0 20.67 150 A 1 -ATOM 2746 O O . GLU A1 1 160 ? -25.742 33.56 -13.021 1.0 22.53 150 A 1 -ATOM 2747 C CB . GLU A1 1 160 ? -25.19 35.06 -15.793 1.0 25.21 150 A 1 -ATOM 2748 C CG . GLU A1 1 160 ? -24.41 36.123 -16.52 1.0 66.89 150 A 1 -ATOM 2749 C CD . GLU A1 1 160 ? -24.952 37.515 -16.275 0.0 23.15 150 A 1 -ATOM 2750 O OE1 . GLU A1 1 160 ? -25.232 37.851 -15.103 0.85 81.32 150 A 1 -ATOM 2751 O OE2 . GLU A1 1 160 ? -25.098 38.267 -17.261 0.51 60.67 150 A 1 -ATOM 2752 H H . GLU A1 1 160 ? -23.449 33.58 -16.468 1.0 23.33 150 A 1 -ATOM 2753 H HA . GLU A1 1 160 ? -23.93 34.767 -14.197 1.0 23.84 150 A 1 -ATOM 2754 H HB2 . GLU A1 1 160 ? -25.593 34.485 -16.462 1.0 30.26 150 A 1 -ATOM 2755 H HB3 . GLU A1 1 160 ? -25.882 35.507 -15.279 1.0 30.26 150 A 1 -ATOM 2756 H HG2 . GLU A1 1 160 ? -23.489 36.102 -16.218 1.0 80.27 150 A 1 -ATOM 2757 H HG3 . GLU A1 1 160 ? -24.451 35.948 -17.473 1.0 80.27 150 A 1 -ATOM 2758 N N . ALA A1 1 161 ? -25.53 32.057 -14.674 1.0 20.33 151 A 1 -ATOM 2759 C CA . ALA A1 1 161 ? -26.33 31.036 -13.984 1.0 18.6 151 A 1 -ATOM 2760 C C . ALA A1 1 161 ? -25.615 30.484 -12.774 1.0 20.53 151 A 1 -ATOM 2761 O O . ALA A1 1 161 ? -26.228 29.767 -11.964 1.0 20.3 151 A 1 -ATOM 2762 C CB . ALA A1 1 161 ? -26.664 29.878 -14.935 1.0 20.2 151 A 1 -ATOM 2763 H H . ALA A1 1 161 ? -25.245 31.812 -15.448 1.0 24.39 151 A 1 -ATOM 2764 H HA . ALA A1 1 161 ? -27.163 31.445 -13.701 1.0 22.32 151 A 1 -ATOM 2765 H HB1 . ALA A1 1 161 ? -27.187 29.217 -14.455 1.0 24.24 151 A 1 -ATOM 2766 H HB2 . ALA A1 1 161 ? -27.174 30.222 -15.685 1.0 24.24 151 A 1 -ATOM 2767 H HB3 . ALA A1 1 161 ? -25.838 29.481 -15.252 1.0 24.24 151 A 1 -ATOM 2768 N N . GLY A1 1 162 ? -24.303 30.682 -12.7 1.0 18.11 152 A 1 -ATOM 2769 C CA . GLY A1 1 162 ? -23.556 30.271 -11.514 1.0 18.74 152 A 1 -ATOM 2770 C C . GLY A1 1 162 ? -22.476 29.23 -11.756 1.0 18.37 152 A 1 -ATOM 2771 O O . GLY A1 1 162 ? -21.821 28.8 -10.794 1.0 18.52 152 A 1 -ATOM 2772 H H . GLY A1 1 162 ? -23.828 31.049 -13.316 1.0 21.73 152 A 1 -ATOM 2773 H HA2 . GLY A1 1 162 ? -23.13 31.053 -11.131 1.0 22.49 152 A 1 -ATOM 2774 H HA3 . GLY A1 1 162 ? -24.18 29.902 -10.869 1.0 22.49 152 A 1 -ATOM 2775 N N . ALA A1 1 163 ? -22.196 28.798 -12.978 1.0 16.5 153 A 1 -ATOM 2776 C CA . ALA A1 1 163 ? -21.151 27.834 -13.194 1.0 15.67 153 A 1 -ATOM 2777 C C . ALA A1 1 163 ? -19.81 28.401 -12.734 1.0 16.22 153 A 1 -ATOM 2778 O O . ALA A1 1 163 ? -19.501 29.563 -12.946 1.0 18.06 153 A 1 -ATOM 2779 C CB . ALA A1 1 163 ? -21.065 27.453 -14.691 1.0 17.49 153 A 1 -ATOM 2780 H H . ALA A1 1 163 ? -22.601 29.052 -13.693 1.0 19.8 153 A 1 -ATOM 2781 H HA . ALA A1 1 163 ? -21.348 27.031 -12.686 1.0 18.8 153 A 1 -ATOM 2782 H HB1 . ALA A1 1 163 ? -20.353 26.805 -14.812 1.0 20.99 153 A 1 -ATOM 2783 H HB2 . ALA A1 1 163 ? -21.912 27.07 -14.969 1.0 20.99 153 A 1 -ATOM 2784 H HB3 . ALA A1 1 163 ? -20.877 28.251 -15.21 1.0 20.99 153 A 1 -ATOM 2785 N N . ASP A1 1 164 ? -19.012 27.543 -12.111 1.0 14.26 154 A 1 -ATOM 2786 C CA . ASP A1 1 164 ? -17.727 27.929 -11.563 1.0 15.25 154 A 1 -ATOM 2787 C C . ASP A1 1 164 ? -16.536 27.631 -12.466 1.0 15.19 154 A 1 -ATOM 2788 O O . ASP A1 1 164 ? -15.568 28.394 -12.495 1.0 16.34 154 A 1 -ATOM 2789 C CB . ASP A1 1 164 ? -17.485 27.217 -10.205 1.0 15.06 154 A 1 -ATOM 2790 C CG . ASP A1 1 164 ? -18.524 27.546 -9.18 1.0 16.18 154 A 1 -ATOM 2791 O OD1 . ASP A1 1 164 ? -18.406 28.658 -8.613 1.0 19.4 154 A 1 -ATOM 2792 O OD2 . ASP A1 1 164 ? -19.463 26.757 -9.039 1.0 15.6 154 A 1 -ATOM 2793 H H . ASP A1 1 164 ? -19.201 26.712 -11.993 1.0 17.11 154 A 1 -ATOM 2794 H HA . ASP A1 1 164 ? -17.757 28.889 -11.423 1.0 18.3 154 A 1 -ATOM 2795 H HB2 . ASP A1 1 164 ? -17.497 26.257 -10.345 1.0 18.07 154 A 1 -ATOM 2796 H HB3 . ASP A1 1 164 ? -16.623 27.49 -9.855 1.0 18.07 154 A 1 -ATOM 2797 N N . ARG A1 1 165 ? -16.572 26.499 -13.154 1.0 14.8 155 A 1 -ATOM 2798 C CA . ARG A1 1 165 ? -15.444 25.98 -13.905 1.0 13.33 155 A 1 -ATOM 2799 C C . ARG A1 1 165 ? -15.91 25.436 -15.237 1.0 13.77 155 A 1 -ATOM 2800 O O . ARG A1 1 165 ? -17.068 25.094 -15.407 1.0 13.47 155 A 1 -ATOM 2801 C CB . ARG A1 1 165 ? -14.681 24.904 -13.127 1.0 14.2 155 A 1 -ATOM 2802 C CG . ARG A1 1 165 ? -14.612 25.105 -11.618 1.0 14.41 155 A 1 -ATOM 2803 C CD . ARG A1 1 165 ? -13.564 24.192 -10.987 1.0 15.04 155 A 1 -ATOM 2804 N NE . ARG A1 1 165 ? -13.521 24.432 -9.54 1.0 16.4 155 A 1 -ATOM 2805 C CZ . ARG A1 1 165 ? -13.987 23.617 -8.612 1.0 15.77 155 A 1 -ATOM 2806 N NH1 . ARG A1 1 165 ? -14.338 22.376 -8.855 1.0 15.47 155 A 1 -ATOM 2807 N NH2 . ARG A1 1 165 ? -14.089 24.072 -7.386 1.0 16.42 155 A 1 -ATOM 2808 H H . ARG A1 1 165 ? -17.267 25.995 -13.202 1.0 17.75 155 A 1 -ATOM 2809 H HA . ARG A1 1 165 ? -14.834 26.712 -14.086 1.0 16.0 155 A 1 -ATOM 2810 H HB2 . ARG A1 1 165 ? -15.114 24.05 -13.284 1.0 17.04 155 A 1 -ATOM 2811 H HB3 . ARG A1 1 165 ? -13.769 24.879 -13.457 1.0 17.04 155 A 1 -ATOM 2812 H HG2 . ARG A1 1 165 ? -14.371 26.025 -11.426 1.0 17.29 155 A 1 -ATOM 2813 H HG3 . ARG A1 1 165 ? -15.475 24.899 -11.225 1.0 17.29 155 A 1 -ATOM 2814 H HD2 . ARG A1 1 165 ? -13.798 23.264 -11.144 1.0 18.05 155 A 1 -ATOM 2815 H HD3 . ARG A1 1 165 ? -12.691 24.382 -11.363 1.0 18.05 155 A 1 -ATOM 2816 H HE . ARG A1 1 165 ? -13.16 25.166 -9.274 1.0 19.68 155 A 1 -ATOM 2817 H HH11 . ARG A1 1 165 ? -14.269 22.058 -9.651 1.0 18.56 155 A 1 -ATOM 2818 H HH12 . ARG A1 1 165 ? -14.637 21.881 -8.219 1.0 18.56 155 A 1 -ATOM 2819 H HH21 . ARG A1 1 165 ? -13.855 24.88 -7.206 1.0 19.7 155 A 1 -ATOM 2820 H HH22 . ARG A1 1 165 ? -14.39 23.563 -6.761 1.0 19.7 155 A 1 -ATOM 2821 N N . TYR A1 1 166 ? -14.955 25.348 -16.178 1.0 13.41 156 A 1 -ATOM 2822 C CA . TYR A1 1 166 ? -15.267 24.763 -17.48 1.0 12.42 156 A 1 -ATOM 2823 C C . TYR A1 1 166 ? -14.078 23.924 -17.901 1.0 13.99 156 A 1 -ATOM 2824 O O . TYR A1 1 166 ? -12.963 24.433 -17.95 1.0 14.26 156 A 1 -ATOM 2825 C CB . TYR A1 1 166 ? -15.578 25.838 -18.501 1.0 12.86 156 A 1 -ATOM 2826 C CG . TYR A1 1 166 ? -16.41 25.339 -19.688 1.0 13.25 156 A 1 -ATOM 2827 C CD1 . TYR A1 1 166 ? -15.872 24.49 -20.65 1.0 12.84 156 A 1 -ATOM 2828 C CD2 . TYR A1 1 166 ? -17.739 25.655 -19.811 1.0 13.69 156 A 1 -ATOM 2829 C CE1 . TYR A1 1 166 ? -16.622 24.019 -21.719 1.0 13.24 156 A 1 -ATOM 2830 C CE2 . TYR A1 1 166 ? -18.513 25.173 -20.855 1.0 13.09 156 A 1 -ATOM 2831 C CZ . TYR A1 1 166 ? -17.937 24.373 -21.797 1.0 13.34 156 A 1 -ATOM 2832 O OH . TYR A1 1 166 ? -18.765 23.904 -22.806 1.0 14.09 156 A 1 -ATOM 2833 H H . TYR A1 1 166 ? -14.143 25.615 -16.082 1.0 16.09 156 A 1 -ATOM 2834 H HA . TYR A1 1 166 ? -16.046 24.187 -17.425 1.0 14.9 156 A 1 -ATOM 2835 H HB2 . TYR A1 1 166 ? -16.077 26.547 -18.066 1.0 15.44 156 A 1 -ATOM 2836 H HB3 . TYR A1 1 166 ? -14.743 26.187 -18.851 1.0 15.44 156 A 1 -ATOM 2837 H HD1 . TYR A1 1 166 ? -14.982 24.23 -20.575 1.0 15.41 156 A 1 -ATOM 2838 H HD2 . TYR A1 1 166 ? -18.132 26.208 -19.175 1.0 16.43 156 A 1 -ATOM 2839 H HE1 . TYR A1 1 166 ? -16.236 23.476 -22.368 1.0 15.89 156 A 1 -ATOM 2840 H HE2 . TYR A1 1 166 ? -19.415 25.394 -20.913 1.0 15.7 156 A 1 -ATOM 2841 H HH . TYR A1 1 166 ? -18.322 23.441 -23.349 1.0 16.91 156 A 1 -ATOM 2842 N N . LEU A1 1 167 ? -14.326 22.668 -18.224 1.0 11.99 157 A 1 -ATOM 2843 C CA . LEU A1 1 167 ? -13.301 21.737 -18.683 1.0 12.83 157 A 1 -ATOM 2844 C C . LEU A1 1 167 ? -13.458 21.56 -20.191 1.0 13.34 157 A 1 -ATOM 2845 O O . LEU A1 1 167 ? -14.47 21.005 -20.642 1.0 13.63 157 A 1 -ATOM 2846 C CB . LEU A1 1 167 ? -13.426 20.4 -17.98 1.0 14.17 157 A 1 -ATOM 2847 C CG . LEU A1 1 167 ? -12.46 19.343 -18.478 1.0 14.28 157 A 1 -ATOM 2848 C CD1 . LEU A1 1 167 ? -11.04 19.664 -18.163 1.0 16.61 157 A 1 -ATOM 2849 C CD2 . LEU A1 1 167 ? -12.86 18.061 -17.846 1.0 19.46 157 A 1 -ATOM 2850 H H . LEU A1 1 167 ? -15.108 22.314 -18.186 1.0 14.39 157 A 1 -ATOM 2851 H HA . LEU A1 1 167 ? -12.425 22.107 -18.493 1.0 15.4 157 A 1 -ATOM 2852 H HB2 . LEU A1 1 167 ? -13.258 20.531 -17.034 1.0 17.01 157 A 1 -ATOM 2853 H HB3 . LEU A1 1 167 ? -14.326 20.064 -18.114 1.0 17.01 157 A 1 -ATOM 2854 H HG . LEU A1 1 167 ? -12.5 19.288 -19.446 1.0 17.14 157 A 1 -ATOM 2855 H HD11 . LEU A1 1 167 ? -10.482 18.914 -18.423 1.0 19.94 157 A 1 -ATOM 2856 H HD12 . LEU A1 1 167 ? -10.779 20.458 -18.655 1.0 19.94 157 A 1 -ATOM 2857 H HD13 . LEU A1 1 167 ? -10.957 19.823 -17.209 1.0 19.94 157 A 1 -ATOM 2858 H HD21 . LEU A1 1 167 ? -12.798 17.351 -18.504 1.0 23.36 157 A 1 -ATOM 2859 H HD22 . LEU A1 1 167 ? -12.264 17.876 -17.103 1.0 23.36 157 A 1 -ATOM 2860 H HD23 . LEU A1 1 167 ? -13.772 18.137 -17.526 1.0 23.36 157 A 1 -ATOM 2861 N N . LEU A1 1 168 ? -12.489 22.052 -20.937 1.0 12.45 158 A 1 -ATOM 2862 C CA . LEU A1 1 168 ? -12.464 21.971 -22.415 1.0 12.01 158 A 1 -ATOM 2863 C C . LEU A1 1 168 ? -11.056 21.501 -22.773 1.0 12.52 158 A 1 -ATOM 2864 O O . LEU A1 1 168 ? -10.172 22.297 -23.081 1.0 12.77 158 A 1 -ATOM 2865 C CB . LEU A1 1 168 ? -12.812 23.313 -23.004 1.0 13.9 158 A 1 -ATOM 2866 C CG . LEU A1 1 168 ? -13.013 23.292 -24.541 1.0 13.57 158 A 1 -ATOM 2867 C CD1 . LEU A1 1 168 ? -14.305 22.688 -24.886 1.0 16.21 158 A 1 -ATOM 2868 C CD2 . LEU A1 1 168 ? -12.974 24.712 -25.095 1.0 18.41 158 A 1 -ATOM 2869 H H . LEU A1 1 168 ? -11.802 22.456 -20.612 1.0 14.94 158 A 1 -ATOM 2870 H HA . LEU A1 1 168 ? -13.103 21.325 -22.756 1.0 14.42 158 A 1 -ATOM 2871 H HB2 . LEU A1 1 168 ? -13.637 23.624 -22.601 1.0 16.68 158 A 1 -ATOM 2872 H HB3 . LEU A1 1 168 ? -12.092 23.934 -22.808 1.0 16.68 158 A 1 -ATOM 2873 H HG . LEU A1 1 168 ? -12.3 22.767 -24.938 1.0 16.29 158 A 1 -ATOM 2874 H HD11 . LEU A1 1 168 ? -14.431 22.737 -25.847 1.0 19.45 158 A 1 -ATOM 2875 H HD12 . LEU A1 1 168 ? -14.307 21.761 -24.599 1.0 19.45 158 A 1 -ATOM 2876 H HD13 . LEU A1 1 168 ? -15.012 23.175 -24.435 1.0 19.45 158 A 1 -ATOM 2877 H HD21 . LEU A1 1 168 ? -13.09 24.679 -26.057 1.0 22.09 158 A 1 -ATOM 2878 H HD22 . LEU A1 1 168 ? -13.691 25.227 -24.693 1.0 22.09 158 A 1 -ATOM 2879 H HD23 . LEU A1 1 168 ? -12.118 25.112 -24.878 1.0 22.09 158 A 1 -ATOM 2880 N N . ARG A1 1 169 ? -10.852 20.185 -22.674 1.0 13.09 159 A 1 -ATOM 2881 C CA . ARG A1 1 169 ? -9.519 19.619 -22.93 1.0 12.94 159 A 1 -ATOM 2882 C C . ARG A1 1 169 ? -9.072 20.043 -24.331 1.0 13.57 159 A 1 -ATOM 2883 O O . ARG A1 1 169 ? -9.855 19.99 -25.278 1.0 14.37 159 A 1 -ATOM 2884 C CB . ARG A1 1 169 ? -9.57 18.102 -22.758 1.0 13.63 159 A 1 -ATOM 2885 C CG . ARG A1 1 169 ? -9.823 17.728 -21.292 1.0 13.48 159 A 1 -ATOM 2886 C CD . ARG A1 1 169 ? -10.055 16.256 -21.059 1.0 15.89 159 A 1 -ATOM 2887 N NE . ARG A1 1 169 ? -8.803 15.522 -21.301 1.0 14.63 159 A 1 -ATOM 2888 C CZ . ARG A1 1 169 ? -8.677 14.201 -21.368 1.0 15.24 159 A 1 -ATOM 2889 N NH1 . ARG A1 1 169 ? -7.541 13.625 -21.688 1.0 16.68 159 A 1 -ATOM 2890 N NH2 . ARG A1 1 169 ? -9.723 13.474 -21.105 1.0 16.5 159 A 1 -ATOM 2891 H H . ARG A1 1 169 ? -11.454 19.607 -22.465 1.0 15.7 159 A 1 -ATOM 2892 H HA . ARG A1 1 169 ? -8.858 19.944 -22.299 1.0 15.53 159 A 1 -ATOM 2893 H HB2 . ARG A1 1 169 ? -10.29 17.74 -23.298 1.0 16.36 159 A 1 -ATOM 2894 H HB3 . ARG A1 1 169 ? -8.723 17.717 -23.033 1.0 16.36 159 A 1 -ATOM 2895 H HG2 . ARG A1 1 169 ? -9.051 17.99 -20.766 1.0 16.18 159 A 1 -ATOM 2896 H HG3 . ARG A1 1 169 ? -10.611 18.201 -20.982 1.0 16.18 159 A 1 -ATOM 2897 H HD2 . ARG A1 1 169 ? -10.335 16.107 -20.142 1.0 19.06 159 A 1 -ATOM 2898 H HD3 . ARG A1 1 169 ? -10.734 15.928 -21.67 1.0 19.06 159 A 1 -ATOM 2899 H HE . ARG A1 1 169 ? -8.089 15.989 -21.408 1.0 17.56 159 A 1 -ATOM 2900 H HH11 . ARG A1 1 169 ? -6.849 14.106 -21.861 1.0 20.02 159 A 1 -ATOM 2901 H HH12 . ARG A1 1 169 ? -7.488 12.768 -21.723 1.0 20.02 159 A 1 -ATOM 2902 H HH21 . ARG A1 1 169 ? -10.466 13.852 -20.896 1.0 19.8 159 A 1 -ATOM 2903 H HH22 . ARG A1 1 169 ? -9.67 12.617 -21.141 1.0 19.8 159 A 1 -ATOM 2904 N N . HIS A1 1 170 ? -7.824 20.536 -24.447 1.0 13.58 160 A 1 -ATOM 2905 C CA . HIS A1 1 170 ? -7.404 21.02 -25.761 1.0 13.51 160 A 1 -ATOM 2906 C C . HIS A1 1 170 ? -7.076 19.92 -26.766 1.0 13.54 160 A 1 -ATOM 2907 O O . HIS A1 1 170 ? -6.96 20.206 -27.973 1.0 14.17 160 A 1 -ATOM 2908 C CB . HIS A1 1 170 ? -6.276 22.035 -25.631 1.0 14.22 160 A 1 -ATOM 2909 C CG . HIS A1 1 170 ? -4.955 21.449 -25.304 1.0 14.53 160 A 1 -ATOM 2910 N ND1 . HIS A1 1 170 ? -4.508 21.144 -24.016 1.0 15.2 160 A 1 -ATOM 2911 C CD2 . HIS A1 1 170 ? -3.946 21.094 -26.139 1.0 16.05 160 A 1 -ATOM 2912 C CE1 . HIS A1 1 170 ? -3.303 20.632 -24.114 1.0 14.74 160 A 1 -ATOM 2913 N NE2 . HIS A1 1 170 ? -2.927 20.613 -25.392 1.0 15.69 160 A 1 -ATOM 2914 H H . HIS A1 1 170 ? -7.244 20.594 -23.816 1.0 16.29 160 A 1 -ATOM 2915 H HA . HIS A1 1 170 ? -8.151 21.5 -26.153 1.0 16.22 160 A 1 -ATOM 2916 H HB2 . HIS A1 1 170 ? -6.186 22.508 -26.473 1.0 17.07 160 A 1 -ATOM 2917 H HB3 . HIS A1 1 170 ? -6.502 22.659 -24.923 1.0 17.07 160 A 1 -ATOM 2918 H HD2 . HIS A1 1 170 ? -3.954 21.168 -27.066 1.0 19.26 160 A 1 -ATOM 2919 H HE1 . HIS A1 1 170 ? -2.79 20.328 -23.4 1.0 17.69 160 A 1 -ATOM 2920 H HE2 . HIS A1 1 170 ? -2.168 20.343 -25.69 1.0 18.83 160 A 1 -ATOM 2921 N N . GLU A1 1 171 ? -6.902 18.693 -26.301 1.0 13.91 161 A 1 -ATOM 2922 C CA . GLU A1 1 171 ? -6.73 17.463 -27.078 1.0 14.36 161 A 1 -ATOM 2923 C C . GLU A1 1 171 ? -5.338 17.311 -27.657 1.0 13.81 161 A 1 -ATOM 2924 O O . GLU A1 1 171 ? -4.609 16.377 -27.36 1.0 14.04 161 A 1 -ATOM 2925 C CB . GLU A1 1 171 ? -7.824 17.327 -28.146 1.0 15.16 161 A 1 -ATOM 2926 C CG . GLU A1 1 171 ? -9.246 17.641 -27.712 1.0 14.74 161 A 1 -ATOM 2927 C CD . GLU A1 1 171 ? -9.766 16.888 -26.529 1.0 16.22 161 A 1 -ATOM 2928 O OE1 . GLU A1 1 171 ? -9.065 16.106 -25.895 1.0 16.7 161 A 1 -ATOM 2929 O OE2 . GLU A1 1 171 ? -10.97 17.087 -26.274 1.0 16.96 161 A 1 -ATOM 2930 H H . GLU A1 1 171 ? -6.876 18.523 -25.459 1.0 16.69 161 A 1 -ATOM 2931 H HA . GLU A1 1 171 ? -6.832 16.715 -26.469 1.0 17.24 161 A 1 -ATOM 2932 H HB2 . GLU A1 1 171 ? -7.61 17.932 -28.874 1.0 18.2 161 A 1 -ATOM 2933 H HB3 . GLU A1 1 171 ? -7.821 16.411 -28.464 1.0 18.2 161 A 1 -ATOM 2934 H HG2 . GLU A1 1 171 ? -9.292 18.584 -27.491 1.0 17.69 161 A 1 -ATOM 2935 H HG3 . GLU A1 1 171 ? -9.838 17.446 -28.456 1.0 17.69 161 A 1 -ATOM 2936 N N . THR A1 1 172 ? -4.974 18.248 -28.521 1.0 14.83 162 A 1 -ATOM 2937 C CA . THR A1 1 172 ? -3.628 18.361 -29.103 1.0 15.52 162 A 1 -ATOM 2938 C C . THR A1 1 172 ? -3.39 19.817 -29.486 1.0 14.14 162 A 1 -ATOM 2939 O O . THR A1 1 172 ? -4.259 20.443 -30.098 1.0 15.14 162 A 1 -ATOM 2940 C CB . THR A1 1 172 ? -3.434 17.421 -30.309 1.0 15.04 162 A 1 -ATOM 2941 O OG1 . THR A1 1 172 ? -2.164 17.689 -30.907 1.0 16.04 162 A 1 -ATOM 2942 C CG2 . THR A1 1 172 ? -4.484 17.581 -31.401 1.0 16.66 162 A 1 -ATOM 2943 H H . THR A1 1 172 ? -5.506 18.862 -28.804 1.0 17.79 162 A 1 -ATOM 2944 H HA . THR A1 1 172 ? -2.962 18.11 -28.445 1.0 18.63 162 A 1 -ATOM 2945 H HB . THR A1 1 172 ? -3.505 16.514 -29.971 1.0 18.05 162 A 1 -ATOM 2946 H HG1 . THR A1 1 172 ? -1.55 17.553 -30.351 1.0 19.25 162 A 1 -ATOM 2947 H HG21 . THR A1 1 172 ? -4.308 16.961 -32.125 1.0 19.99 162 A 1 -ATOM 2948 H HG22 . THR A1 1 172 ? -5.367 17.402 -31.04 1.0 19.99 162 A 1 -ATOM 2949 H HG23 . THR A1 1 172 ? -4.465 18.486 -31.75 1.0 19.99 162 A 1 -ATOM 2950 N N . ALA A1 1 173 ? -2.216 20.32 -29.16 1.0 14.73 163 A 1 -ATOM 2951 C CA . ALA A1 1 173 ? -1.826 21.656 -29.551 1.0 15.07 163 A 1 -ATOM 2952 C C . ALA A1 1 173 ? -1.236 21.7 -30.946 1.0 18.64 163 A 1 -ATOM 2953 O O . ALA A1 1 173 ? -0.85 22.786 -31.406 1.0 20.15 163 A 1 -ATOM 2954 C CB . ALA A1 1 173 ? -0.843 22.211 -28.521 1.0 17.8 163 A 1 -ATOM 2955 H H . ALA A1 1 173 ? -1.619 19.9 -28.705 1.0 17.67 163 A 1 -ATOM 2956 H HA . ALA A1 1 173 ? -2.601 22.24 -29.556 1.0 18.09 163 A 1 -ATOM 2957 H HB1 . ALA A1 1 173 ? -0.574 23.104 -28.79 1.0 21.36 163 A 1 -ATOM 2958 H HB2 . ALA A1 1 173 ? -1.278 22.244 -27.654 1.0 21.36 163 A 1 -ATOM 2959 H HB3 . ALA A1 1 173 ? -0.067 21.63 -28.48 1.0 21.36 163 A 1 -ATOM 2960 N N . ASN A1 1 174 ? -1.115 20.596 -31.659 1.0 16.02 164 A 1 -ATOM 2961 C CA . ASN A1 1 174 ? -0.619 20.624 -33.039 1.0 15.99 164 A 1 -ATOM 2962 C C . ASN A1 1 174 ? -1.806 20.975 -33.933 1.0 15.66 164 A 1 -ATOM 2963 O O . ASN A1 1 174 ? -2.766 20.205 -34.016 1.0 15.69 164 A 1 -ATOM 2964 C CB . ASN A1 1 174 ? -0.11 19.208 -33.355 1.0 16.61 164 A 1 -ATOM 2965 C CG . ASN A1 1 174 ? 0.37 19.065 -34.777 1.0 16.91 164 A 1 -ATOM 2966 O OD1 . ASN A1 1 174 ? -0.224 19.61 -35.727 1.0 17.5 164 A 1 -ATOM 2967 N ND2 . ASN A1 1 174 ? 1.457 18.382 -34.951 1.0 20.74 164 A 1 -ATOM 2968 H H . ASN A1 1 174 ? -1.313 19.81 -31.373 1.0 19.22 164 A 1 -ATOM 2969 H HA . ASN A1 1 174 ? 0.09 21.269 -33.185 1.0 19.18 164 A 1 -ATOM 2970 H HB2 . ASN A1 1 174 ? 0.632 19.0 -32.766 1.0 19.93 164 A 1 -ATOM 2971 H HB3 . ASN A1 1 174 ? -0.831 18.574 -33.217 1.0 19.93 164 A 1 -ATOM 2972 H HD21 . ASN A1 1 174 ? 1.773 18.271 -35.742 1.0 24.89 164 A 1 -ATOM 2973 H HD22 . ASN A1 1 174 ? 1.862 18.04 -34.274 1.0 24.89 164 A 1 -ATOM 2974 N N . PRO A1 1 175 ? -1.822 22.15 -34.587 1.0 16.01 165 A 1 -ATOM 2975 C CA . PRO A1 1 175 ? -3.031 22.543 -35.294 1.0 16.67 165 A 1 -ATOM 2976 C C . PRO A1 1 175 ? -3.313 21.701 -36.524 1.0 15.88 165 A 1 -ATOM 2977 O O . PRO A1 1 175 ? -4.493 21.571 -36.88 1.0 16.76 165 A 1 -ATOM 2978 C CB . PRO A1 1 175 ? -2.752 24.006 -35.68 1.0 18.89 165 A 1 -ATOM 2979 C CG . PRO A1 1 175 ? -1.281 24.162 -35.632 1.0 25.21 165 A 1 -ATOM 2980 C CD . PRO A1 1 175 ? -0.78 23.171 -34.612 1.0 17.94 165 A 1 -ATOM 2981 H HA . PRO A1 1 175 ? -3.79 22.501 -34.693 1.0 20.01 165 A 1 -ATOM 2982 H HB2 . PRO A1 1 175 ? -3.088 24.178 -36.574 1.0 22.66 165 A 1 -ATOM 2983 H HB3 . PRO A1 1 175 ? -3.182 24.599 -35.044 1.0 22.66 165 A 1 -ATOM 2984 H HG2 . PRO A1 1 175 ? -0.906 23.971 -36.506 1.0 30.25 165 A 1 -ATOM 2985 H HG3 . PRO A1 1 175 ? -1.059 25.068 -35.366 1.0 30.25 165 A 1 -ATOM 2986 H HD2 . PRO A1 1 175 ? 0.068 22.791 -34.889 1.0 21.52 165 A 1 -ATOM 2987 H HD3 . PRO A1 1 175 ? -0.687 23.59 -33.742 1.0 21.52 165 A 1 -ATOM 2988 N N . VAL A1 1 176 ? -2.284 21.131 -37.143 1.0 16.36 166 A 1 -ATOM 2989 C CA . VAL A1 1 176 ? -2.493 20.266 -38.29 1.0 16.56 166 A 1 -ATOM 2990 C C . VAL A1 1 176 ? -3.184 18.988 -37.83 1.0 16.62 166 A 1 -ATOM 2991 O O . VAL A1 1 176 ? -4.201 18.562 -38.395 1.0 17.35 166 A 1 -ATOM 2992 C CB . VAL A1 1 176 ? -1.149 20.038 -39.011 1.0 17.3 166 A 1 -ATOM 2993 C CG1 . VAL A1 1 176 ? -1.276 18.967 -40.08 1.0 18.43 166 A 1 -ATOM 2994 C CG2 . VAL A1 1 176 ? -0.65 21.321 -39.607 1.0 17.97 166 A 1 -ATOM 2995 H H . VAL A1 1 176 ? -1.46 21.23 -36.917 1.0 19.63 166 A 1 -ATOM 2996 H HA . VAL A1 1 176 ? -3.082 20.681 -38.94 1.0 19.87 166 A 1 -ATOM 2997 H HB . VAL A1 1 176 ? -0.5 19.729 -38.359 1.0 20.76 166 A 1 -ATOM 2998 H HG11 . VAL A1 1 176 ? -0.463 18.952 -40.61 1.0 22.12 166 A 1 -ATOM 2999 H HG12 . VAL A1 1 176 ? -1.408 18.107 -39.652 1.0 22.12 166 A 1 -ATOM 3000 H HG13 . VAL A1 1 176 ? -2.035 19.176 -40.647 1.0 22.12 166 A 1 -ATOM 3001 H HG21 . VAL A1 1 176 ? 0.198 21.155 -40.048 1.0 21.56 166 A 1 -ATOM 3002 H HG22 . VAL A1 1 176 ? -1.3 21.644 -40.25 1.0 21.56 166 A 1 -ATOM 3003 H HG23 . VAL A1 1 176 ? -0.532 21.973 -38.899 1.0 21.56 166 A 1 -ATOM 3004 N N . LEU A1 1 177 ? -2.618 18.331 -36.829 1.0 16.21 167 A 1 -ATOM 3005 C CA . LEU A1 1 177 ? -3.235 17.12 -36.291 1.0 16.88 167 A 1 -ATOM 3006 C C . LEU A1 1 177 ? -4.613 17.423 -35.751 1.0 15.39 167 A 1 -ATOM 3007 O O . LEU A1 1 177 ? -5.534 16.586 -35.845 1.0 15.81 167 A 1 -ATOM 3008 C CB . LEU A1 1 177 ? -2.342 16.569 -35.202 1.0 18.25 167 A 1 -ATOM 3009 C CG . LEU A1 1 177 ? -2.755 15.207 -34.72 1.0 19.18 167 A 1 -ATOM 3010 C CD1 . LEU A1 1 177 ? -2.801 14.194 -35.769 1.0 22.07 167 A 1 -ATOM 3011 C CD2 . LEU A1 1 177 ? -1.824 14.793 -33.538 1.0 23.66 167 A 1 -ATOM 3012 H H . LEU A1 1 177 ? -1.884 18.559 -36.444 1.0 19.45 167 A 1 -ATOM 3013 H HA . LEU A1 1 177 ? -3.327 16.451 -36.987 1.0 20.25 167 A 1 -ATOM 3014 H HB2 . LEU A1 1 177 ? -1.437 16.502 -35.544 1.0 21.89 167 A 1 -ATOM 3015 H HB3 . LEU A1 1 177 ? -2.366 17.173 -34.443 1.0 21.89 167 A 1 -ATOM 3016 H HG . LEU A1 1 177 ? -3.673 15.255 -34.41 1.0 23.02 167 A 1 -ATOM 3017 H HD11 . LEU A1 1 177 ? -2.878 13.318 -35.359 1.0 26.49 167 A 1 -ATOM 3018 H HD12 . LEU A1 1 177 ? -3.569 14.362 -36.337 1.0 26.49 167 A 1 -ATOM 3019 H HD13 . LEU A1 1 177 ? -1.985 14.243 -36.291 1.0 26.49 167 A 1 -ATOM 3020 H HD21 . LEU A1 1 177 ? -2.09 13.917 -33.218 1.0 28.39 167 A 1 -ATOM 3021 H HD22 . LEU A1 1 177 ? -0.907 14.766 -33.852 1.0 28.39 167 A 1 -ATOM 3022 H HD23 . LEU A1 1 177 ? -1.911 15.445 -32.825 1.0 28.39 167 A 1 -ATOM 3023 N N . HIS A1 1 178 ? -4.773 18.551 -35.048 1.0 14.71 168 A 1 -ATOM 3024 C CA . HIS A1 1 178 ? -6.075 18.856 -34.433 1.0 14.19 168 A 1 -ATOM 3025 C C . HIS A1 1 178 ? -7.177 18.816 -35.474 1.0 14.82 168 A 1 -ATOM 3026 O O . HIS A1 1 178 ? -8.227 18.225 -35.269 1.0 15.09 168 A 1 -ATOM 3027 C CB . HIS A1 1 178 ? -5.99 20.221 -33.726 1.0 14.57 168 A 1 -ATOM 3028 C CG . HIS A1 1 178 ? -7.098 20.491 -32.764 1.0 13.59 168 A 1 -ATOM 3029 N ND1 . HIS A1 1 178 ? -6.899 20.484 -31.401 1.0 14.19 168 A 1 -ATOM 3030 C CD2 . HIS A1 1 178 ? -8.412 20.734 -32.95 1.0 13.43 168 A 1 -ATOM 3031 C CE1 . HIS A1 1 178 ? -8.056 20.745 -30.806 1.0 14.89 168 A 1 -ATOM 3032 N NE2 . HIS A1 1 178 ? -9.001 20.89 -31.71 1.0 14.51 168 A 1 -ATOM 3033 H H . HIS A1 1 178 ? -4.163 19.141 -34.915 1.0 17.65 168 A 1 -ATOM 3034 H HA . HIS A1 1 178 ? -6.295 18.194 -33.76 1.0 17.03 168 A 1 -ATOM 3035 H HB2 . HIS A1 1 178 ? -5.157 20.26 -33.231 1.0 17.48 168 A 1 -ATOM 3036 H HB3 . HIS A1 1 178 ? -6.009 20.919 -34.398 1.0 17.48 168 A 1 -ATOM 3037 H HD1 . HIS A1 1 178 ? -6.151 20.335 -31.003 1.0 17.02 168 A 1 -ATOM 3038 H HD2 . HIS A1 1 178 ? -8.846 20.788 -33.771 1.0 16.12 168 A 1 -ATOM 3039 H HE1 . HIS A1 1 178 ? -8.18 20.816 -29.887 1.0 17.86 168 A 1 -ATOM 3040 N N . ARG A1 1 179 ? -6.93 19.47 -36.637 1.0 14.75 169 A 1 -ATOM 3041 C CA . ARG A1 1 179 ? -7.937 19.523 -37.699 1.0 15.36 169 A 1 -ATOM 3042 C C . ARG A1 1 179 ? -8.155 18.168 -38.322 1.0 16.14 169 A 1 -ATOM 3043 O O . ARG A1 1 179 ? -9.291 17.844 -38.662 1.0 17.41 169 A 1 -ATOM 3044 C CB . ARG A1 1 179 ? -7.515 20.546 -38.744 1.0 17.93 169 A 1 -ATOM 3045 C CG . ARG A1 1 179 ? -8.44 20.653 -39.991 1.0 19.83 169 A 1 -ATOM 3046 C CD . ARG A1 1 179 ? -9.819 21.096 -39.601 1.0 18.64 169 A 1 -ATOM 3047 N NE . ARG A1 1 179 ? -10.652 21.177 -40.824 0.91 20.36 169 A 1 -ATOM 3048 C CZ . ARG A1 1 179 ? -11.823 21.772 -40.869 0.7 16.7 169 A 1 -ATOM 3049 N NH1 . ARG A1 1 179 ? -12.34 22.354 -39.801 1.0 20.35 169 A 1 -ATOM 3050 N NH2 . ARG A1 1 179 ? -12.509 21.803 -42.008 0.79 20.76 169 A 1 -ATOM 3051 H H . ARG A1 1 179 ? -6.197 19.88 -36.823 1.0 17.7 169 A 1 -ATOM 3052 H HA . ARG A1 1 179 ? -8.785 19.805 -37.323 1.0 18.44 169 A 1 -ATOM 3053 H HB2 . ARG A1 1 179 ? -7.495 21.42 -38.324 1.0 21.52 169 A 1 -ATOM 3054 H HB3 . ARG A1 1 179 ? -6.63 20.31 -39.062 1.0 21.52 169 A 1 -ATOM 3055 H HG2 . ARG A1 1 179 ? -8.074 21.302 -40.611 1.0 23.8 169 A 1 -ATOM 3056 H HG3 . ARG A1 1 179 ? -8.507 19.785 -40.42 1.0 23.8 169 A 1 -ATOM 3057 H HD2 . ARG A1 1 179 ? -10.214 20.454 -38.99 1.0 22.37 169 A 1 -ATOM 3058 H HD3 . ARG A1 1 179 ? -9.782 21.97 -39.183 1.0 22.37 169 A 1 -ATOM 3059 H HE . ARG A1 1 179 ? -10.352 20.815 -41.545 0.94 24.44 169 A 1 -ATOM 3060 H HH11 . ARG A1 1 179 ? -11.909 22.349 -39.057 1.0 24.42 169 A 1 -ATOM 3061 H HH12 . ARG A1 1 179 ? -13.108 22.738 -39.85 1.0 24.42 169 A 1 -ATOM 3062 H HH21 . ARG A1 1 179 ? -12.186 21.435 -42.715 0.84 24.91 169 A 1 -ATOM 3063 H HH22 . ARG A1 1 179 ? -13.275 22.192 -42.038 0.84 24.91 169 A 1 -ATOM 3064 N N . LYS A1 1 180 ? -7.113 17.367 -38.478 1.0 15.5 170 A 1 -ATOM 3065 C CA . LYS A1 1 180 ? -7.266 16.027 -39.022 1.0 16.18 170 A 1 -ATOM 3066 C C . LYS A1 1 180 ? -8.154 15.184 -38.112 1.0 16.83 170 A 1 -ATOM 3067 O O . LYS A1 1 180 ? -8.998 14.415 -38.576 1.0 18.26 170 A 1 -ATOM 3068 C CB . LYS A1 1 180 ? -5.931 15.36 -39.212 1.0 18.26 170 A 1 -ATOM 3069 C CG . LYS A1 1 180 ? -5.102 15.969 -40.334 0.91 20.92 170 A 1 -ATOM 3070 C CD . LYS A1 1 180 ? -3.747 15.312 -40.453 0.97 29.52 170 A 1 -ATOM 3071 C CE . LYS A1 1 180 ? -2.912 15.822 -41.649 1.0 33.57 170 A 1 -ATOM 3072 N NZ . LYS A1 1 180 ? -1.579 15.197 -41.5 0.56 29.19 170 A 1 -ATOM 3073 H H . LYS A1 1 180 ? -6.303 17.574 -38.277 1.0 18.6 170 A 1 -ATOM 3074 H HA . LYS A1 1 180 ? -7.678 16.094 -39.898 1.0 19.42 170 A 1 -ATOM 3075 H HB2 . LYS A1 1 180 ? -5.423 15.44 -38.39 1.0 21.91 170 A 1 -ATOM 3076 H HB3 . LYS A1 1 180 ? -6.076 14.425 -39.423 1.0 21.91 170 A 1 -ATOM 3077 H HG2 . LYS A1 1 180 ? -5.569 15.853 -41.176 0.89 25.11 170 A 1 -ATOM 3078 H HG3 . LYS A1 1 180 ? -4.967 16.913 -40.156 0.88 25.11 170 A 1 -ATOM 3079 H HD2 . LYS A1 1 180 ? -3.242 15.488 -39.643 0.97 35.42 170 A 1 -ATOM 3080 H HD3 . LYS A1 1 180 ? -3.871 14.357 -40.565 0.98 35.42 170 A 1 -ATOM 3081 H HE2 . LYS A1 1 180 ? -3.312 15.548 -42.489 1.0 40.28 170 A 1 -ATOM 3082 H HE3 . LYS A1 1 180 ? -2.827 16.788 -41.621 1.0 40.28 170 A 1 -ATOM 3083 H HZ1 . LYS A1 1 180 ? -1.212 15.441 -40.726 0.52 35.02 170 A 1 -ATOM 3084 H HZ2 . LYS A1 1 180 ? -1.655 14.31 -41.516 0.52 35.02 170 A 1 -ATOM 3085 H HZ3 . LYS A1 1 180 ? -1.046 15.453 -42.165 0.52 35.02 170 A 1 -ATOM 3086 N N . LEU A1 1 181 ? -7.993 15.308 -36.778 1.0 15.03 171 A 1 -ATOM 3087 C CA . LEU A1 1 181 ? -8.727 14.463 -35.836 1.0 15.13 171 A 1 -ATOM 3088 C C . LEU A1 1 181 ? -10.085 15.032 -35.473 1.0 14.47 171 A 1 -ATOM 3089 O O . LEU A1 1 181 ? -10.953 14.286 -34.989 1.0 15.46 171 A 1 -ATOM 3090 C CB . LEU A1 1 181 ? -7.883 14.281 -34.58 1.0 15.33 171 A 1 -ATOM 3091 C CG . LEU A1 1 181 ? -6.603 13.56 -34.792 1.0 17.8 171 A 1 -ATOM 3092 C CD1 . LEU A1 1 181 ? -5.837 13.555 -33.437 1.0 21.67 171 A 1 -ATOM 3093 C CD2 . LEU A1 1 181 ? -6.786 12.175 -35.255 1.0 26.61 171 A 1 -ATOM 3094 H H . LEU A1 1 181 ? -7.465 15.874 -36.403 1.0 18.04 171 A 1 -ATOM 3095 H HA . LEU A1 1 181 ? -8.883 13.588 -36.225 1.0 18.16 171 A 1 -ATOM 3096 H HB2 . LEU A1 1 181 ? -7.669 15.157 -34.223 1.0 18.4 171 A 1 -ATOM 3097 H HB3 . LEU A1 1 181 ? -8.399 13.776 -33.932 1.0 18.4 171 A 1 -ATOM 3098 H HG . LEU A1 1 181 ? -6.102 14.011 -35.49 1.0 21.36 171 A 1 -ATOM 3099 H HD11 . LEU A1 1 181 ? -4.992 13.093 -33.553 1.0 26.0 171 A 1 -ATOM 3100 H HD12 . LEU A1 1 181 ? -5.677 14.471 -33.161 1.0 26.0 171 A 1 -ATOM 3101 H HD13 . LEU A1 1 181 ? -6.375 13.099 -32.771 1.0 26.0 171 A 1 -ATOM 3102 H HD21 . LEU A1 1 181 ? -5.935 11.712 -35.209 1.0 31.93 171 A 1 -ATOM 3103 H HD22 . LEU A1 1 181 ? -7.433 11.734 -34.683 1.0 31.93 171 A 1 -ATOM 3104 H HD23 . LEU A1 1 181 ? -7.107 12.187 -36.17 1.0 31.93 171 A 1 -ATOM 3105 N N . ARG A1 1 182 ? -10.309 16.324 -35.693 1.0 14.44 172 A 1 -ATOM 3106 C CA . ARG A1 1 182 ? -11.513 17.049 -35.271 1.0 15.36 172 A 1 -ATOM 3107 C C . ARG A1 1 182 ? -11.984 17.856 -36.478 1.0 16.65 172 A 1 -ATOM 3108 O O . ARG A1 1 182 ? -11.844 19.077 -36.527 1.0 16.03 172 A 1 -ATOM 3109 C CB . ARG A1 1 182 ? -11.227 17.919 -34.047 1.0 14.93 172 A 1 -ATOM 3110 C CG . ARG A1 1 182 ? -10.549 17.103 -32.93 1.0 14.04 172 A 1 -ATOM 3111 C CD . ARG A1 1 182 ? -10.448 17.867 -31.618 1.0 15.15 172 A 1 -ATOM 3112 N NE . ARG A1 1 182 ? -11.805 18.034 -31.068 1.0 15.22 172 A 1 -ATOM 3113 C CZ . ARG A1 1 182 ? -12.451 19.183 -30.883 1.0 15.25 172 A 1 -ATOM 3114 N NH1 . ARG A1 1 182 ? -11.868 20.348 -31.065 1.0 14.87 172 A 1 -ATOM 3115 N NH2 . ARG A1 1 182 ? -13.757 19.121 -30.546 1.0 16.02 172 A 1 -ATOM 3116 H H . ARG A1 1 182 ? -9.751 16.832 -36.105 1.0 17.33 172 A 1 -ATOM 3117 H HA . ARG A1 1 182 ? -12.221 16.439 -35.012 1.0 18.43 172 A 1 -ATOM 3118 H HB2 . ARG A1 1 182 ? -10.636 18.645 -34.299 1.0 17.92 172 A 1 -ATOM 3119 H HB3 . ARG A1 1 182 ? -12.062 18.274 -33.704 1.0 17.92 172 A 1 -ATOM 3120 H HG2 . ARG A1 1 182 ? -11.066 16.298 -32.768 1.0 16.85 172 A 1 -ATOM 3121 H HG3 . ARG A1 1 182 ? -9.65 16.869 -33.21 1.0 16.85 172 A 1 -ATOM 3122 H HD2 . ARG A1 1 182 ? -9.908 17.37 -30.984 1.0 18.19 172 A 1 -ATOM 3123 H HD3 . ARG A1 1 182 ? -10.058 18.742 -31.771 1.0 18.19 172 A 1 -ATOM 3124 H HE . ARG A1 1 182 ? -12.223 17.316 -30.845 1.0 18.26 172 A 1 -ATOM 3125 H HH11 . ARG A1 1 182 ? -11.045 20.383 -31.311 1.0 17.85 172 A 1 -ATOM 3126 H HH12 . ARG A1 1 182 ? -12.31 21.074 -30.937 1.0 17.85 172 A 1 -ATOM 3127 H HH21 . ARG A1 1 182 ? -14.143 18.358 -30.458 1.0 19.22 172 A 1 -ATOM 3128 H HH22 . ARG A1 1 182 ? -14.203 19.845 -30.418 1.0 19.22 172 A 1 -ATOM 3129 N N . PRO A1 1 183 ? -12.56 17.179 -37.467 1.0 16.51 173 A 1 -ATOM 3130 C CA . PRO A1 1 183 ? -12.758 17.788 -38.794 1.0 15.91 173 A 1 -ATOM 3131 C C . PRO A1 1 183 ? -13.825 18.842 -38.819 1.0 17.73 173 A 1 -ATOM 3132 O O . PRO A1 1 183 ? -13.948 19.528 -39.849 1.0 20.77 173 A 1 -ATOM 3133 C CB . PRO A1 1 183 ? -13.121 16.576 -39.667 1.0 18.74 173 A 1 -ATOM 3134 C CG . PRO A1 1 183 ? -13.742 15.596 -38.693 1.0 20.41 173 A 1 -ATOM 3135 C CD . PRO A1 1 183 ? -12.9 15.753 -37.44 1.0 18.35 173 A 1 -ATOM 3136 H HA . PRO A1 1 183 ? -11.934 18.178 -39.123 1.0 19.1 173 A 1 -ATOM 3137 H HB2 . PRO A1 1 183 ? -13.755 16.837 -40.354 1.0 22.49 173 A 1 -ATOM 3138 H HB3 . PRO A1 1 183 ? -12.322 16.207 -40.075 1.0 22.49 173 A 1 -ATOM 3139 H HG2 . PRO A1 1 183 ? -14.668 15.83 -38.525 1.0 24.49 173 A 1 -ATOM 3140 H HG3 . PRO A1 1 183 ? -13.686 14.693 -39.043 1.0 24.49 173 A 1 -ATOM 3141 H HD2 . PRO A1 1 183 ? -13.411 15.531 -36.646 1.0 22.02 173 A 1 -ATOM 3142 H HD3 . PRO A1 1 183 ? -12.102 15.203 -37.484 1.0 22.02 173 A 1 -ATOM 3143 N N . ASP A1 1 184 ? -14.589 19.016 -37.754 1.0 16.83 174 A 1 -ATOM 3144 C CA . ASP A1 1 184 ? -15.603 20.044 -37.645 1.0 17.62 174 A 1 -ATOM 3145 C C . ASP A1 1 184 ? -15.039 21.372 -37.208 1.0 18.66 174 A 1 -ATOM 3146 O O . ASP A1 1 184 ? -15.772 22.365 -37.245 1.0 21.15 174 A 1 -ATOM 3147 C CB . ASP A1 1 184 ? -16.651 19.627 -36.58 1.0 17.72 174 A 1 -ATOM 3148 C CG . ASP A1 1 184 ? -17.26 18.324 -36.912 1.0 17.86 174 A 1 -ATOM 3149 O OD1 . ASP A1 1 184 ? -18.078 18.254 -37.85 1.0 21.8 174 A 1 -ATOM 3150 O OD2 . ASP A1 1 184 ? -16.927 17.331 -36.246 1.0 21.03 174 A 1 -ATOM 3151 H H . ASP A1 1 184 ? -14.537 18.527 -37.049 1.0 20.19 174 A 1 -ATOM 3152 H HA . ASP A1 1 184 ? -16.031 20.142 -38.511 1.0 21.14 174 A 1 -ATOM 3153 H HB2 . ASP A1 1 184 ? -16.219 19.551 -35.715 1.0 21.26 174 A 1 -ATOM 3154 H HB3 . ASP A1 1 184 ? -17.355 20.293 -36.543 1.0 21.26 174 A 1 -ATOM 3155 N N . THR A1 1 185 ? -13.802 21.415 -36.728 1.0 15.82 175 A 1 -ATOM 3156 C CA . THR A1 1 185 ? -13.351 22.579 -35.989 1.0 15.75 175 A 1 -ATOM 3157 C C . THR A1 1 185 ? -11.857 22.743 -36.13 1.0 16.0 175 A 1 -ATOM 3158 O O . THR A1 1 185 ? -11.293 22.313 -37.139 1.0 16.61 175 A 1 -ATOM 3159 C CB . THR A1 1 185 ? -13.907 22.485 -34.557 1.0 15.43 175 A 1 -ATOM 3160 O OG1 . THR A1 1 185 ? -13.567 23.704 -33.872 1.0 16.44 175 A 1 -ATOM 3161 C CG2 . THR A1 1 185 ? -13.387 21.28 -33.783 1.0 15.42 175 A 1 -ATOM 3162 H H . THR A1 1 185 ? -13.216 20.791 -36.817 1.0 18.99 175 A 1 -ATOM 3163 H HA . THR A1 1 185 ? -13.697 23.416 -36.337 1.0 18.91 175 A 1 -ATOM 3164 H HB . THR A1 1 185 ? -14.868 22.363 -34.596 1.0 18.52 175 A 1 -ATOM 3165 H HG1 . THR A1 1 185 ? -13.831 23.669 -33.075 1.0 19.73 175 A 1 -ATOM 3166 H HG21 . THR A1 1 185 ? -13.76 21.275 -32.887 1.0 18.5 175 A 1 -ATOM 3167 H HG22 . THR A1 1 185 ? -13.642 20.461 -34.235 1.0 18.5 175 A 1 -ATOM 3168 H HG23 . THR A1 1 185 ? -12.42 21.318 -33.721 1.0 18.5 175 A 1 -ATOM 3169 N N . SER A1 1 186 ? -11.191 23.381 -35.167 1.0 16.36 176 A 1 -ATOM 3170 C CA . SER A1 1 186 ? -9.781 23.702 -35.312 1.0 16.12 176 A 1 -ATOM 3171 C C . SER A1 1 186 ? -9.211 24.004 -33.955 1.0 15.75 176 A 1 -ATOM 3172 O O . SER A1 1 186 ? -9.952 24.336 -33.002 1.0 15.6 176 A 1 -ATOM 3173 C CB . SER A1 1 186 ? -9.587 24.908 -36.21 1.0 16.76 176 A 1 -ATOM 3174 O OG . SER A1 1 186 ? -10.182 26.057 -35.62 1.0 18.4 176 A 1 -ATOM 3175 H H . SER A1 1 186 ? -11.538 23.637 -34.422 1.0 19.63 176 A 1 -ATOM 3176 H HA . SER A1 1 186 ? -9.32 22.936 -35.69 1.0 19.35 176 A 1 -ATOM 3177 H HB2 . SER A1 1 186 ? -8.637 25.067 -36.329 1.0 20.12 176 A 1 -ATOM 3178 H HB3 . SER A1 1 186 ? -10.005 24.737 -37.068 1.0 20.12 176 A 1 -ATOM 3179 H HG . SER A1 1 186 ? -10.083 26.722 -36.123 1.0 22.08 176 A 1 -ATOM 3180 N N . PHE A1 1 187 ? -7.891 23.931 -33.861 1.0 15.84 177 A 1 -ATOM 3181 C CA . PHE A1 1 187 ? -7.234 24.321 -32.62 1.0 16.52 177 A 1 -ATOM 3182 C C . PHE A1 1 187 ? -7.499 25.792 -32.329 1.0 17.1 177 A 1 -ATOM 3183 O O . PHE A1 1 187 ? -7.735 26.168 -31.186 1.0 17.16 177 A 1 -ATOM 3184 C CB . PHE A1 1 187 ? -5.734 24.055 -32.702 1.0 16.95 177 A 1 -ATOM 3185 C CG . PHE A1 1 187 ? -5.017 24.52 -31.466 1.0 18.37 177 A 1 -ATOM 3186 C CD1 . PHE A1 1 187 ? -5.061 23.83 -30.321 1.0 20.83 177 A 1 -ATOM 3187 C CD2 . PHE A1 1 187 ? -4.358 25.718 -31.523 1.0 23.95 177 A 1 -ATOM 3188 C CE1 . PHE A1 1 187 ? -4.428 24.321 -29.153 1.0 21.32 177 A 1 -ATOM 3189 C CE2 . PHE A1 1 187 ? -3.707 26.205 -30.371 1.0 28.46 177 A 1 -ATOM 3190 C CZ . PHE A1 1 187 ? -3.74 25.48 -29.238 1.0 23.62 177 A 1 -ATOM 3191 H H . PHE A1 1 187 ? -7.363 23.665 -34.485 1.0 19.0 177 A 1 -ATOM 3192 H HA . PHE A1 1 187 ? -7.585 23.786 -31.892 1.0 19.83 177 A 1 -ATOM 3193 H HB2 . PHE A1 1 187 ? -5.584 23.102 -32.8 1.0 20.35 177 A 1 -ATOM 3194 H HB3 . PHE A1 1 187 ? -5.366 24.529 -33.464 1.0 20.35 177 A 1 -ATOM 3195 H HD1 . PHE A1 1 187 ? -5.514 23.018 -30.291 1.0 25.0 177 A 1 -ATOM 3196 H HD2 . PHE A1 1 187 ? -4.34 26.206 -32.315 1.0 28.73 177 A 1 -ATOM 3197 H HE1 . PHE A1 1 187 ? -4.485 23.857 -28.349 1.0 25.59 177 A 1 -ATOM 3198 H HE2 . PHE A1 1 187 ? -3.259 27.019 -30.394 1.0 34.16 177 A 1 -ATOM 3199 H HZ . PHE A1 1 187 ? -3.275 25.786 -28.492 1.0 28.34 177 A 1 -ATOM 3200 N N . GLU A1 1 188 ? -7.492 26.647 -33.362 1.0 17.04 178 A 1 -ATOM 3201 C CA . GLU A1 1 188 ? -7.808 28.06 -33.145 1.0 18.15 178 A 1 -ATOM 3202 C C . GLU A1 1 188 ? -9.16 28.228 -32.487 1.0 17.91 178 A 1 -ATOM 3203 O O . GLU A1 1 188 ? -9.293 29.028 -31.561 1.0 17.8 178 A 1 -ATOM 3204 C CB . GLU A1 1 188 ? -7.761 28.77 -34.496 1.0 20.38 178 A 1 -ATOM 3205 C CG . GLU A1 1 188 ? -8.205 30.247 -34.468 1.0 27.3 178 A 1 -ATOM 3206 C CD . GLU A1 1 188 ? -8.187 30.909 -35.877 0.76 32.55 178 A 1 -ATOM 3207 O OE1 . GLU A1 1 188 ? -7.788 30.254 -36.853 0.63 34.22 178 A 1 -ATOM 3208 O OE2 . GLU A1 1 188 ? -8.583 32.087 -35.985 0.72 32.33 178 A 1 -ATOM 3209 H H . GLU A1 1 188 ? -7.312 26.437 -34.176 1.0 20.45 178 A 1 -ATOM 3210 H HA . GLU A1 1 188 ? -7.154 28.463 -32.553 1.0 21.78 178 A 1 -ATOM 3211 H HB2 . GLU A1 1 188 ? -6.849 28.746 -34.825 1.0 24.46 178 A 1 -ATOM 3212 H HB3 . GLU A1 1 188 ? -8.347 28.301 -35.111 1.0 24.46 178 A 1 -ATOM 3213 H HG2 . GLU A1 1 188 ? -9.111 30.297 -34.125 1.0 32.76 178 A 1 -ATOM 3214 H HG3 . GLU A1 1 188 ? -7.604 30.746 -33.894 1.0 32.76 178 A 1 -ATOM 3215 N N . ASN A1 1 189 ? -10.178 27.491 -32.924 1.0 16.85 179 A 1 -ATOM 3216 C CA A ASN A1 1 189 ? -11.495 27.583 -32.287 0.58 19.45 179 A 1 -ATOM 3217 C CA B ASN A1 1 189 ? -11.463 27.666 -32.264 0.42 14.99 179 A 1 -ATOM 3218 C C . ASN A1 1 189 ? -11.41 27.162 -30.838 1.0 18.07 179 A 1 -ATOM 3219 O O . ASN A1 1 189 ? -11.966 27.817 -29.948 1.0 18.18 179 A 1 -ATOM 3220 C CB A ASN A1 1 189 ? -12.513 26.664 -32.991 0.58 19.73 179 A 1 -ATOM 3221 C CB B ASN A1 1 189 ? -12.631 27.048 -33.042 0.42 15.31 179 A 1 -ATOM 3222 C CG A ASN A1 1 189 ? -13.05 27.237 -34.274 0.58 20.73 179 A 1 -ATOM 3223 C CG B ASN A1 1 189 ? -13.968 27.593 -32.564 0.42 18.49 179 A 1 -ATOM 3224 O OD1 A ASN A1 1 189 ? -12.799 28.391 -34.62 0.58 24.47 179 A 1 -ATOM 3225 O OD1 B ASN A1 1 189 ? -14.249 28.795 -32.716 0.42 26.37 179 A 1 -ATOM 3226 N ND2 A ASN A1 1 189 ? -13.811 26.408 -35.01 0.58 21.55 179 A 1 -ATOM 3227 N ND2 B ASN A1 1 189 ? -14.796 26.735 -31.969 0.42 16.91 179 A 1 -ATOM 3228 H H A ASN A1 1 189 ? -10.137 26.936 -33.58 0.58 20.22 179 A 1 -ATOM 3229 H H B ASN A1 1 189 ? -10.151 26.917 -33.564 0.42 20.22 179 A 1 -ATOM 3230 H HA A ASN A1 1 189 ? -11.794 28.503 -32.359 0.58 23.34 179 A 1 -ATOM 3231 H HA B ASN A1 1 189 ? -11.653 28.618 -32.25 0.42 17.98 179 A 1 -ATOM 3232 H HB2 A ASN A1 1 189 ? -12.082 25.821 -33.199 0.58 23.68 179 A 1 -ATOM 3233 H HB2 B ASN A1 1 189 ? -12.536 27.256 -33.984 0.42 18.38 179 A 1 -ATOM 3234 H HB3 A ASN A1 1 189 ? -13.264 26.515 -32.395 0.58 23.68 179 A 1 -ATOM 3235 H HB3 B ASN A1 1 189 ? -12.63 26.086 -32.913 0.42 18.38 179 A 1 -ATOM 3236 H HD21 A ASN A1 1 189 ? -14.146 26.679 -35.754 0.58 25.86 179 A 1 -ATOM 3237 H HD21 B ASN A1 1 189 ? -15.562 27.004 -31.684 0.42 20.3 179 A 1 -ATOM 3238 H HD22 A ASN A1 1 189 ? -13.963 25.607 -34.737 0.58 25.86 179 A 1 -ATOM 3239 H HD22 B ASN A1 1 189 ? -14.565 25.912 -31.87 0.42 20.3 179 A 1 -ATOM 3240 N N . ARG A1 1 190 ? -10.77 26.025 -30.606 1.0 16.49 180 A 1 -ATOM 3241 C CA . ARG A1 1 190 ? -10.691 25.475 -29.262 1.0 15.82 180 A 1 -ATOM 3242 C C . ARG A1 1 190 ? -10.0 26.475 -28.332 1.0 15.08 180 A 1 -ATOM 3243 O O . ARG A1 1 190 ? -10.439 26.727 -27.188 1.0 15.55 180 A 1 -ATOM 3244 C CB . ARG A1 1 190 ? -9.909 24.154 -29.315 1.0 17.32 180 A 1 -ATOM 3245 C CG . ARG A1 1 190 ? -10.059 23.255 -28.067 1.0 20.29 180 A 1 -ATOM 3246 C CD . ARG A1 1 190 ? -11.112 22.356 -28.231 1.0 17.85 180 A 1 -ATOM 3247 N NE . ARG A1 1 190 ? -11.308 21.313 -27.191 1.0 14.56 180 A 1 -ATOM 3248 C CZ . ARG A1 1 190 ? -12.457 20.689 -27.056 1.0 13.4 180 A 1 -ATOM 3249 N NH1 . ARG A1 1 190 ? -13.505 20.969 -27.827 1.0 14.54 180 A 1 -ATOM 3250 N NH2 . ARG A1 1 190 ? -12.59 19.783 -26.098 1.0 14.1 180 A 1 -ATOM 3251 H H . ARG A1 1 190 ? -10.374 25.554 -31.207 1.0 19.78 180 A 1 -ATOM 3252 H HA . ARG A1 1 190 ? -11.579 25.295 -28.917 1.0 18.98 180 A 1 -ATOM 3253 H HB2 . ARG A1 1 190 ? -10.219 23.645 -30.08 1.0 20.79 180 A 1 -ATOM 3254 H HB3 . ARG A1 1 190 ? -8.966 24.36 -29.413 1.0 20.79 180 A 1 -ATOM 3255 H HG2 . ARG A1 1 190 ? -9.241 22.75 -27.931 1.0 24.35 180 A 1 -ATOM 3256 H HG3 . ARG A1 1 190 ? -10.242 23.806 -27.29 1.0 24.35 180 A 1 -ATOM 3257 H HD2 . ARG A1 1 190 ? -11.935 22.868 -28.268 1.0 21.42 180 A 1 -ATOM 3258 H HD3 . ARG A1 1 190 ? -10.974 21.888 -29.069 1.0 21.42 180 A 1 -ATOM 3259 H HE . ARG A1 1 190 ? -10.656 21.113 -26.666 1.0 17.47 180 A 1 -ATOM 3260 H HH11 . ARG A1 1 190 ? -13.442 21.573 -28.435 1.0 17.45 180 A 1 -ATOM 3261 H HH12 . ARG A1 1 190 ? -14.245 20.545 -27.717 1.0 17.45 180 A 1 -ATOM 3262 H HH21 . ARG A1 1 190 ? -11.93 19.61 -25.575 1.0 16.91 180 A 1 -ATOM 3263 H HH22 . ARG A1 1 190 ? -13.337 19.368 -26.0 1.0 16.91 180 A 1 -ATOM 3264 N N . LEU A1 1 191 ? -8.88 27.026 -28.769 1.0 15.44 181 A 1 -ATOM 3265 C CA . LEU A1 1 191 ? -8.187 28.027 -27.984 1.0 16.84 181 A 1 -ATOM 3266 C C . LEU A1 1 191 ? -9.027 29.287 -27.765 1.0 16.31 181 A 1 -ATOM 3267 O O . LEU A1 1 191 ? -9.084 29.814 -26.645 1.0 16.84 181 A 1 -ATOM 3268 C CB . LEU A1 1 191 ? -6.867 28.371 -28.656 1.0 18.34 181 A 1 -ATOM 3269 C CG . LEU A1 1 191 ? -6.082 29.534 -28.038 1.0 19.33 181 A 1 -ATOM 3270 C CD1 . LEU A1 1 191 ? -5.744 29.236 -26.615 1.0 23.2 181 A 1 -ATOM 3271 C CD2 . LEU A1 1 191 ? -4.829 29.752 -28.848 1.0 26.11 181 A 1 -ATOM 3272 H H . LEU A1 1 191 ? -8.5 26.837 -29.517 1.0 18.53 181 A 1 -ATOM 3273 H HA . LEU A1 1 191 ? -8.005 27.656 -27.106 1.0 20.21 181 A 1 -ATOM 3274 H HB2 . LEU A1 1 191 ? -6.296 27.587 -28.62 1.0 22.0 181 A 1 -ATOM 3275 H HB3 . LEU A1 1 191 ? -7.05 28.605 -29.579 1.0 22.0 181 A 1 -ATOM 3276 H HG . LEU A1 1 191 ? -6.615 30.345 -28.047 1.0 23.19 181 A 1 -ATOM 3277 H HD11 . LEU A1 1 191 ? -5.153 29.927 -26.279 1.0 27.84 181 A 1 -ATOM 3278 H HD12 . LEU A1 1 191 ? -6.562 29.218 -26.094 1.0 27.84 181 A 1 -ATOM 3279 H HD13 . LEU A1 1 191 ? -5.304 28.373 -26.57 1.0 27.84 181 A 1 -ATOM 3280 H HD21 . LEU A1 1 191 ? -4.321 30.478 -28.454 1.0 31.33 181 A 1 -ATOM 3281 H HD22 . LEU A1 1 191 ? -4.302 28.938 -28.84 1.0 31.33 181 A 1 -ATOM 3282 H HD23 . LEU A1 1 191 ? -5.077 29.977 -29.759 1.0 31.33 181 A 1 -ATOM 3283 N N . ASN A1 1 192 ? -9.741 29.757 -28.783 1.0 16.83 182 A 1 -ATOM 3284 C CA . ASN A1 1 192 ? -10.603 30.907 -28.59 1.0 18.04 182 A 1 -ATOM 3285 C C . ASN A1 1 192 ? -11.645 30.64 -27.526 1.0 17.2 182 A 1 -ATOM 3286 O O . ASN A1 1 192 ? -11.946 31.521 -26.717 1.0 17.18 182 A 1 -ATOM 3287 C CB . ASN A1 1 192 ? -11.251 31.29 -29.907 1.0 18.85 182 A 1 -ATOM 3288 C CG . ASN A1 1 192 ? -10.29 32.007 -30.795 1.0 26.15 182 A 1 -ATOM 3289 O OD1 . ASN A1 1 192 ? -9.31 32.613 -30.307 1.0 28.13 182 A 1 -ATOM 3290 N ND2 . ASN A1 1 192 ? -10.561 31.998 -32.092 1.0 30.94 182 A 1 -ATOM 3291 H H . ASN A1 1 192 ? -9.742 29.432 -29.579 1.0 20.19 182 A 1 -ATOM 3292 H HA . ASN A1 1 192 ? -10.068 31.659 -28.292 1.0 21.65 182 A 1 -ATOM 3293 H HB2 . ASN A1 1 192 ? -11.55 30.488 -30.363 1.0 22.62 182 A 1 -ATOM 3294 H HB3 . ASN A1 1 192 ? -12.006 31.875 -29.736 1.0 22.62 182 A 1 -ATOM 3295 H HD21 . ASN A1 1 192 ? -10.036 32.398 -32.644 1.0 37.13 182 A 1 -ATOM 3296 H HD22 . ASN A1 1 192 ? -11.261 31.592 -32.383 1.0 37.13 182 A 1 -ATOM 3297 N N . CYS A1 1 193 ? -12.214 29.442 -27.499 1.0 15.78 183 A 1 -ATOM 3298 C CA . CYS A1 1 193 ? -13.152 29.079 -26.433 1.0 15.6 183 A 1 -ATOM 3299 C C . CYS A1 1 193 ? -12.469 29.127 -25.071 1.0 15.96 183 A 1 -ATOM 3300 O O . CYS A1 1 193 ? -13.009 29.728 -24.135 1.0 16.27 183 A 1 -ATOM 3301 C CB . CYS A1 1 193 ? -13.726 27.684 -26.684 1.0 14.69 183 A 1 -ATOM 3302 S SG . CYS A1 1 193 ? -14.872 27.56 -28.068 1.0 17.55 183 A 1 -ATOM 3303 H H . CYS A1 1 193 ? -12.079 28.822 -28.08 1.0 18.93 183 A 1 -ATOM 3304 H HA . CYS A1 1 193 ? -13.884 29.715 -26.437 1.0 18.72 183 A 1 -ATOM 3305 H HB2 . CYS A1 1 193 ? -12.99 27.077 -26.862 1.0 17.63 183 A 1 -ATOM 3306 H HB3 . CYS A1 1 193 ? -14.203 27.402 -25.887 1.0 17.63 183 A 1 -ATOM 3307 H HG . CYS A1 1 193 ? -14.31 27.9 -29.073 1.0 21.06 183 A 1 -ATOM 3308 N N . LEU A1 1 194 ? -11.285 28.527 -24.955 1.0 14.25 184 A 1 -ATOM 3309 C CA . LEU A1 1 194 ? -10.549 28.566 -23.674 1.0 15.1 184 A 1 -ATOM 3310 C C . LEU A1 1 194 ? -10.252 29.99 -23.251 1.0 15.98 184 A 1 -ATOM 3311 O O . LEU A1 1 194 ? -10.411 30.328 -22.046 1.0 16.97 184 A 1 -ATOM 3312 C CB . LEU A1 1 194 ? -9.233 27.794 -23.822 1.0 16.12 184 A 1 -ATOM 3313 C CG . LEU A1 1 194 ? -9.404 26.256 -23.814 1.0 14.93 184 A 1 -ATOM 3314 C CD1 . LEU A1 1 194 ? -8.178 25.552 -24.271 1.0 17.83 184 A 1 -ATOM 3315 C CD2 . LEU A1 1 194 ? -9.756 25.751 -22.425 1.0 16.59 184 A 1 -ATOM 3316 H H . LEU A1 1 194 ? -10.886 28.097 -25.585 1.0 17.1 184 A 1 -ATOM 3317 H HA . LEU A1 1 194 ? -11.094 28.149 -22.988 1.0 18.12 184 A 1 -ATOM 3318 H HB2 . LEU A1 1 194 ? -8.82 28.042 -24.664 1.0 19.34 184 A 1 -ATOM 3319 H HB3 . LEU A1 1 194 ? -8.65 28.03 -23.084 1.0 19.34 184 A 1 -ATOM 3320 H HG . LEU A1 1 194 ? -10.126 26.054 -24.431 1.0 17.92 184 A 1 -ATOM 3321 H HD11 . LEU A1 1 194 ? -8.35 24.597 -24.287 1.0 21.39 184 A 1 -ATOM 3322 H HD12 . LEU A1 1 194 ? -7.949 25.862 -25.161 1.0 21.39 184 A 1 -ATOM 3323 H HD13 . LEU A1 1 194 ? -7.455 25.747 -23.655 1.0 21.39 184 A 1 -ATOM 3324 H HD21 . LEU A1 1 194 ? -9.774 24.781 -22.436 1.0 19.91 184 A 1 -ATOM 3325 H HD22 . LEU A1 1 194 ? -9.086 26.062 -21.796 1.0 19.91 184 A 1 -ATOM 3326 H HD23 . LEU A1 1 194 ? -10.629 26.094 -22.175 1.0 19.91 184 A 1 -ATOM 3327 N N . LEU A1 1 195 ? -9.84 30.876 -24.177 1.0 16.21 185 A 1 -ATOM 3328 C CA . LEU A1 1 195 ? -9.575 32.266 -23.819 1.0 17.67 185 A 1 -ATOM 3329 C C . LEU A1 1 195 ? -10.834 32.978 -23.382 1.0 18.33 185 A 1 -ATOM 3330 O O . LEU A1 1 195 ? -10.782 33.801 -22.449 1.0 18.65 185 A 1 -ATOM 3331 C CB . LEU A1 1 195 ? -8.911 33.013 -24.978 1.0 21.23 185 A 1 -ATOM 3332 C CG . LEU A1 1 195 ? -7.53 32.472 -25.35 1.0 21.47 185 A 1 -ATOM 3333 C CD1 . LEU A1 1 195 ? -7.058 33.138 -26.642 1.0 24.07 185 A 1 -ATOM 3334 C CD2 . LEU A1 1 195 ? -6.558 32.694 -24.217 1.0 28.07 185 A 1 -ATOM 3335 H H . LEU A1 1 195 ? -9.711 30.693 -25.008 1.0 19.45 185 A 1 -ATOM 3336 H HA . LEU A1 1 195 ? -8.953 32.269 -23.074 1.0 21.21 185 A 1 -ATOM 3337 H HB2 . LEU A1 1 195 ? -9.479 32.94 -25.761 1.0 25.47 185 A 1 -ATOM 3338 H HB3 . LEU A1 1 195 ? -8.808 33.945 -24.73 1.0 25.47 185 A 1 -ATOM 3339 H HG . LEU A1 1 195 ? -7.572 31.515 -25.503 1.0 25.76 185 A 1 -ATOM 3340 H HD11 . LEU A1 1 195 ? -6.173 32.807 -26.863 1.0 28.88 185 A 1 -ATOM 3341 H HD12 . LEU A1 1 195 ? -7.679 32.921 -27.355 1.0 28.88 185 A 1 -ATOM 3342 H HD13 . LEU A1 1 195 ? -7.028 34.098 -26.51 1.0 28.88 185 A 1 -ATOM 3343 H HD21 . LEU A1 1 195 ? -5.658 32.516 -24.534 1.0 33.68 185 A 1 -ATOM 3344 H HD22 . LEU A1 1 195 ? -6.627 33.613 -23.916 1.0 33.68 185 A 1 -ATOM 3345 H HD23 . LEU A1 1 195 ? -6.777 32.09 -23.49 1.0 33.68 185 A 1 -ATOM 3346 N N . THR A1 1 196 ? -11.962 32.699 -24.044 1.0 17.38 186 A 1 -ATOM 3347 C CA . THR A1 1 196 ? -13.225 33.334 -23.674 1.0 19.54 186 A 1 -ATOM 3348 C C . THR A1 1 196 ? -13.618 32.869 -22.282 1.0 18.14 186 A 1 -ATOM 3349 O O . THR A1 1 196 ? -14.003 33.68 -21.427 1.0 19.74 186 A 1 -ATOM 3350 C CB . THR A1 1 196 ? -14.281 32.969 -24.704 1.0 19.47 186 A 1 -ATOM 3351 O OG1 . THR A1 1 196 ? -13.924 33.542 -25.966 1.0 22.21 186 A 1 -ATOM 3352 C CG2 . THR A1 1 196 ? -15.639 33.499 -24.352 1.0 22.86 186 A 1 -ATOM 3353 H H . THR A1 1 196 ? -12.02 32.152 -24.705 1.0 20.86 186 A 1 -ATOM 3354 H HA . THR A1 1 196 ? -13.146 34.301 -23.667 1.0 23.45 186 A 1 -ATOM 3355 H HB . THR A1 1 196 ? -14.33 32.001 -24.744 1.0 23.36 186 A 1 -ATOM 3356 H HG1 . THR A1 1 196 ? -13.18 33.242 -26.217 1.0 26.65 186 A 1 -ATOM 3357 H HG21 . THR A1 1 196 ? -16.244 33.386 -25.101 1.0 27.43 186 A 1 -ATOM 3358 H HG22 . THR A1 1 196 ? -15.993 33.021 -23.586 1.0 27.43 186 A 1 -ATOM 3359 H HG23 . THR A1 1 196 ? -15.58 34.443 -24.134 1.0 27.43 186 A 1 -ATOM 3360 N N . LEU A1 1 197 ? -13.522 31.584 -22.016 1.0 16.88 187 A 1 -ATOM 3361 C CA . LEU A1 1 197 ? -13.878 31.074 -20.687 1.0 16.43 187 A 1 -ATOM 3362 C C . LEU A1 1 197 ? -13.042 31.748 -19.621 1.0 18.73 187 A 1 -ATOM 3363 O O . LEU A1 1 197 ? -13.569 32.13 -18.56 1.0 18.75 187 A 1 -ATOM 3364 C CB . LEU A1 1 197 ? -13.684 29.575 -20.687 1.0 15.56 187 A 1 -ATOM 3365 C CG . LEU A1 1 197 ? -14.685 28.791 -21.531 1.0 16.06 187 A 1 -ATOM 3366 C CD1 . LEU A1 1 197 ? -14.19 27.399 -21.815 1.0 17.01 187 A 1 -ATOM 3367 C CD2 . LEU A1 1 197 ? -16.074 28.743 -20.92 1.0 16.89 187 A 1 -ATOM 3368 H H . LEU A1 1 197 ? -13.257 30.984 -22.572 1.0 20.26 187 A 1 -ATOM 3369 H HA . LEU A1 1 197 ? -14.808 31.26 -20.482 1.0 19.71 187 A 1 -ATOM 3370 H HB2 . LEU A1 1 197 ? -12.799 29.382 -21.032 1.0 18.68 187 A 1 -ATOM 3371 H HB3 . LEU A1 1 197 ? -13.762 29.257 -19.774 1.0 18.68 187 A 1 -ATOM 3372 H HG . LEU A1 1 197 ? -14.768 29.267 -22.372 1.0 19.27 187 A 1 -ATOM 3373 H HD11 . LEU A1 1 197 ? -14.857 26.927 -22.337 1.0 20.41 187 A 1 -ATOM 3374 H HD12 . LEU A1 1 197 ? -13.359 27.455 -22.313 1.0 20.41 187 A 1 -ATOM 3375 H HD13 . LEU A1 1 197 ? -14.041 26.939 -20.974 1.0 20.41 187 A 1 -ATOM 3376 H HD21 . LEU A1 1 197 ? -16.652 28.214 -21.491 1.0 20.26 187 A 1 -ATOM 3377 H HD22 . LEU A1 1 197 ? -16.018 28.339 -20.04 1.0 20.26 187 A 1 -ATOM 3378 H HD23 . LEU A1 1 197 ? -16.418 29.647 -20.847 1.0 20.26 187 A 1 -ATOM 3379 N N . LYS A1 1 198 ? -11.743 31.909 -19.84 1.0 17.29 188 A 1 -ATOM 3380 C CA A LYS A1 1 198 ? -10.914 32.583 -18.844 0.72 18.4 188 A 1 -ATOM 3381 C CA B LYS A1 1 198 ? -10.939 32.595 -18.815 0.28 19.31 188 A 1 -ATOM 3382 C C . LYS A1 1 198 ? -11.357 34.039 -18.665 1.0 19.45 188 A 1 -ATOM 3383 O O . LYS A1 1 198 ? -11.458 34.544 -17.545 1.0 21.57 188 A 1 -ATOM 3384 C CB A LYS A1 1 198 ? -9.456 32.503 -19.229 0.72 19.04 188 A 1 -ATOM 3385 C CB B LYS A1 1 198 ? -9.457 32.659 -19.084 0.28 24.88 188 A 1 -ATOM 3386 C CG A LYS A1 1 198 ? -8.535 32.872 -18.023 0.72 42.5 188 A 1 -ATOM 3387 C CG B LYS A1 1 198 ? -8.773 31.409 -19.368 0.28 21.61 188 A 1 -ATOM 3388 C CD A LYS A1 1 198 ? -7.02 32.848 -18.297 0.72 64.04 188 A 1 -ATOM 3389 C CD B LYS A1 1 198 ? -7.906 31.675 -20.6 0.28 59.29 188 A 1 -ATOM 3390 C CE A LYS A1 1 198 ? -6.452 31.466 -18.639 0.72 55.02 188 A 1 -ATOM 3391 C CE B LYS A1 1 198 ? -6.507 31.137 -20.448 0.28 31.91 188 A 1 -ATOM 3392 N NZ A LYS A1 1 198 ? -6.54 31.121 -20.101 0.72 39.29 188 A 1 -ATOM 3393 N NZ B LYS A1 1 198 ? -6.023 31.481 -19.085 0.28 49.58 188 A 1 -ATOM 3394 H H . LYS A1 1 198 ? -11.32 31.645 -20.54 1.0 20.75 188 A 1 -ATOM 3395 H HA . LYS A1 1 198 ? -11.011 32.13 -17.992 1.0 23.17 188 A 1 -ATOM 3396 H HB2 A LYS A1 1 198 ? -9.247 31.599 -19.511 0.72 22.85 188 A 1 -ATOM 3397 H HB2 B LYS A1 1 198 ? -9.319 33.235 -19.852 0.28 29.86 188 A 1 -ATOM 3398 H HB3 A LYS A1 1 198 ? -9.279 33.126 -19.952 0.72 22.85 188 A 1 -ATOM 3399 H HB3 B LYS A1 1 198 ? -9.03 33.041 -18.301 0.28 29.86 188 A 1 -ATOM 3400 H HG2 A LYS A1 1 198 ? -8.758 33.771 -17.734 0.72 51.0 188 A 1 -ATOM 3401 H HG2 B LYS A1 1 198 ? -8.212 31.149 -18.621 0.28 25.93 188 A 1 -ATOM 3402 H HG3 A LYS A1 1 198 ? -8.705 32.241 -17.306 0.72 51.0 188 A 1 -ATOM 3403 H HG3 B LYS A1 1 198 ? -9.413 30.706 -19.563 0.28 25.93 188 A 1 -ATOM 3404 H HD2 A LYS A1 1 198 ? -6.832 33.433 -19.047 0.72 76.84 188 A 1 -ATOM 3405 H HD2 B LYS A1 1 198 ? -8.31 31.248 -21.371 0.28 71.15 188 A 1 -ATOM 3406 H HD3 A LYS A1 1 198 ? -6.558 33.165 -17.505 0.72 76.84 188 A 1 -ATOM 3407 H HD3 B LYS A1 1 198 ? -7.845 32.632 -20.744 0.28 71.15 188 A 1 -ATOM 3408 H HE2 A LYS A1 1 198 ? -5.517 31.44 -18.384 0.72 66.03 188 A 1 -ATOM 3409 H HE2 B LYS A1 1 198 ? -6.507 30.172 -20.552 0.28 38.29 188 A 1 -ATOM 3410 H HE3 A LYS A1 1 198 ? -6.949 30.794 -18.146 0.72 66.03 188 A 1 -ATOM 3411 H HE3 B LYS A1 1 198 ? -5.92 31.541 -21.106 0.28 38.29 188 A 1 -ATOM 3412 H HZ1 A LYS A1 1 198 ? -6.167 30.327 -20.249 0.72 47.15 188 A 1 -ATOM 3413 H HZ1 B LYS A1 1 198 ? -5.135 31.546 -19.085 0.28 59.49 188 A 1 -ATOM 3414 H HZ2 A LYS A1 1 198 ? -7.392 31.093 -20.357 0.72 47.15 188 A 1 -ATOM 3415 H HZ2 B LYS A1 1 198 ? -6.369 32.259 -18.826 0.28 59.49 188 A 1 -ATOM 3416 H HZ3 A LYS A1 1 198 ? -6.114 31.735 -20.584 0.72 47.15 188 A 1 -ATOM 3417 H HZ3 B LYS A1 1 198 ? -6.267 30.849 -18.507 0.28 59.49 188 A 1 -ATOM 3418 N N . GLU A1 1 199 ? -11.611 34.737 -19.772 1.0 19.18 189 A 1 -ATOM 3419 C CA . GLU A1 1 199 ? -11.983 36.132 -19.699 1.0 19.84 189 A 1 -ATOM 3420 C C . GLU A1 1 199 ? -13.281 36.308 -18.911 1.0 23.09 189 A 1 -ATOM 3421 O O . GLU A1 1 199 ? -13.453 37.3 -18.203 1.0 24.22 189 A 1 -ATOM 3422 C CB . GLU A1 1 199 ? -12.148 36.71 -21.11 1.0 23.41 189 A 1 -ATOM 3423 C CG . GLU A1 1 199 ? -12.503 38.166 -21.165 1.0 31.06 189 A 1 -ATOM 3424 C CD . GLU A1 1 199 ? -13.012 38.587 -22.532 1.0 62.68 189 A 1 -ATOM 3425 O OE1 . GLU A1 1 199 ? -12.983 37.759 -23.471 1.0 56.93 189 A 1 -ATOM 3426 O OE2 . GLU A1 1 199 ? -13.464 39.742 -22.659 1.0 93.12 189 A 1 -ATOM 3427 H H . GLU A1 1 199 ? -11.573 34.42 -20.571 1.0 23.01 189 A 1 -ATOM 3428 H HA . GLU A1 1 199 ? -11.276 36.624 -19.253 1.0 23.81 189 A 1 -ATOM 3429 H HB2 . GLU A1 1 199 ? -11.31 36.598 -21.586 1.0 28.09 189 A 1 -ATOM 3430 H HB3 . GLU A1 1 199 ? -12.854 36.222 -21.561 1.0 28.09 189 A 1 -ATOM 3431 H HG2 . GLU A1 1 199 ? -13.199 38.348 -20.515 1.0 37.28 189 A 1 -ATOM 3432 H HG3 . GLU A1 1 199 ? -11.714 38.693 -20.963 1.0 37.28 189 A 1 -ATOM 3433 N N . LEU A1 1 200 ? -14.196 35.344 -19.006 1.0 20.31 190 A 1 -ATOM 3434 C CA . LEU A1 1 200 ? -15.455 35.392 -18.284 1.0 22.03 190 A 1 -ATOM 3435 C C . LEU A1 1 200 ? -15.315 35.022 -16.804 1.0 20.35 190 A 1 -ATOM 3436 O O . LEU A1 1 200 ? -16.311 35.096 -16.074 1.0 24.22 190 A 1 -ATOM 3437 C CB . LEU A1 1 200 ? -16.474 34.434 -18.942 1.0 20.64 190 A 1 -ATOM 3438 C CG . LEU A1 1 200 ? -16.939 34.884 -20.339 1.0 21.97 190 A 1 -ATOM 3439 C CD1 . LEU A1 1 200 ? -17.764 33.86 -21.045 1.0 21.03 190 A 1 -ATOM 3440 C CD2 . LEU A1 1 200 ? -17.739 36.194 -20.26 1.0 30.45 190 A 1 -ATOM 3441 H H . LEU A1 1 200 ? -14.106 34.64 -19.492 1.0 24.37 190 A 1 -ATOM 3442 H HA . LEU A1 1 200 ? -15.801 36.297 -18.336 1.0 26.44 190 A 1 -ATOM 3443 H HB2 . LEU A1 1 200 ? -16.064 33.559 -19.033 1.0 24.76 190 A 1 -ATOM 3444 H HB3 . LEU A1 1 200 ? -17.258 34.375 -18.373 1.0 24.76 190 A 1 -ATOM 3445 H HG . LEU A1 1 200 ? -16.131 35.019 -20.859 1.0 26.36 190 A 1 -ATOM 3446 H HD11 . LEU A1 1 200 ? -17.996 34.194 -21.925 1.0 25.24 190 A 1 -ATOM 3447 H HD12 . LEU A1 1 200 ? -17.251 33.042 -21.126 1.0 25.24 190 A 1 -ATOM 3448 H HD13 . LEU A1 1 200 ? -18.571 33.696 -20.531 1.0 25.24 190 A 1 -ATOM 3449 H HD21 . LEU A1 1 200 ? -18.118 36.385 -21.132 1.0 36.54 190 A 1 -ATOM 3450 H HD22 . LEU A1 1 200 ? -18.448 36.092 -19.606 1.0 36.54 190 A 1 -ATOM 3451 H HD23 . LEU A1 1 200 ? -17.143 36.912 -19.993 1.0 36.54 190 A 1 -ATOM 3452 N N . GLY A1 1 201 ? -14.153 34.585 -16.387 1.0 19.9 191 A 1 -ATOM 3453 C CA . GLY A1 1 201 ? -13.873 34.295 -14.977 1.0 20.89 191 A 1 -ATOM 3454 C C . GLY A1 1 201 ? -14.11 32.867 -14.565 1.0 20.83 191 A 1 -ATOM 3455 O O . GLY A1 1 201 ? -14.092 32.56 -13.363 1.0 20.68 191 A 1 -ATOM 3456 H H . GLY A1 1 201 ? -13.482 34.44 -16.904 1.0 23.88 191 A 1 -ATOM 3457 H HA2 . GLY A1 1 201 ? -12.944 34.505 -14.796 1.0 25.06 191 A 1 -ATOM 3458 H HA3 . GLY A1 1 201 ? -14.438 34.859 -14.426 1.0 25.06 191 A 1 -ATOM 3459 N N . TYR A1 1 202 ? -14.299 31.946 -15.493 1.0 16.84 192 A 1 -ATOM 3460 C CA . TYR A1 1 202 ? -14.29 30.552 -15.138 1.0 15.87 192 A 1 -ATOM 3461 C C . TYR A1 1 202 ? -12.903 30.117 -14.69 1.0 16.97 192 A 1 -ATOM 3462 O O . TYR A1 1 202 ? -11.867 30.58 -15.216 1.0 18.7 192 A 1 -ATOM 3463 C CB . TYR A1 1 202 ? -14.621 29.712 -16.377 1.0 17.03 192 A 1 -ATOM 3464 C CG . TYR A1 1 202 ? -16.051 29.706 -16.834 1.0 15.56 192 A 1 -ATOM 3465 C CD1 . TYR A1 1 202 ? -16.499 30.628 -17.751 1.0 16.17 192 A 1 -ATOM 3466 C CD2 . TYR A1 1 202 ? -16.926 28.708 -16.426 1.0 16.42 192 A 1 -ATOM 3467 C CE1 . TYR A1 1 202 ? -17.784 30.586 -18.242 1.0 16.09 192 A 1 -ATOM 3468 C CE2 . TYR A1 1 202 ? -18.21 28.65 -16.915 1.0 15.89 192 A 1 -ATOM 3469 C CZ . TYR A1 1 202 ? -18.618 29.56 -17.839 1.0 15.74 192 A 1 -ATOM 3470 O OH . TYR A1 1 202 ? -19.907 29.435 -18.316 1.0 17.34 192 A 1 -ATOM 3471 H H . TYR A1 1 202 ? -14.434 32.106 -16.328 1.0 20.2 192 A 1 -ATOM 3472 H HA . TYR A1 1 202 ? -14.933 30.406 -14.426 1.0 19.04 192 A 1 -ATOM 3473 H HB2 . TYR A1 1 202 ? -14.09 30.048 -17.116 1.0 20.44 192 A 1 -ATOM 3474 H HB3 . TYR A1 1 202 ? -14.381 28.792 -16.187 1.0 20.44 192 A 1 -ATOM 3475 H HD1 . TYR A1 1 202 ? -15.921 31.294 -18.045 1.0 19.4 192 A 1 -ATOM 3476 H HD2 . TYR A1 1 202 ? -16.639 28.069 -15.814 1.0 19.71 192 A 1 -ATOM 3477 H HE1 . TYR A1 1 202 ? -18.086 31.236 -18.835 1.0 19.31 192 A 1 -ATOM 3478 H HE2 . TYR A1 1 202 ? -18.796 27.993 -16.616 1.0 19.06 192 A 1 -ATOM 3479 H HH . TYR A1 1 202 ? -20.074 30.055 -18.857 1.0 20.8 192 A 1 -ATOM 3480 N N . GLU A1 1 203 ? -12.854 29.172 -13.749 1.0 16.26 193 A 1 -ATOM 3481 C CA A GLU A1 1 203 ? -11.682 28.311 -13.631 0.58 16.3 193 A 1 -ATOM 3482 C CA B GLU A1 1 203 ? -11.687 28.307 -13.635 0.42 15.17 193 A 1 -ATOM 3483 C C . GLU A1 1 203 ? -11.68 27.407 -14.848 1.0 17.0 193 A 1 -ATOM 3484 O O . GLU A1 1 203 ? -12.674 26.711 -15.106 1.0 17.13 193 A 1 -ATOM 3485 C CB A GLU A1 1 203 ? -11.721 27.503 -12.334 0.58 16.74 193 A 1 -ATOM 3486 C CB B GLU A1 1 203 ? -11.779 27.454 -12.387 0.42 14.42 193 A 1 -ATOM 3487 C CG A GLU A1 1 203 ? -11.631 28.418 -11.104 0.58 14.98 193 A 1 -ATOM 3488 C CG B GLU A1 1 203 ? -11.183 28.078 -11.18 0.42 39.44 193 A 1 -ATOM 3489 C CD A GLU A1 1 203 ? -11.641 27.723 -9.744 0.58 26.4 193 A 1 -ATOM 3490 C CD B GLU A1 1 203 ? -11.397 27.181 -10.027 0.42 34.9 193 A 1 -ATOM 3491 O OE1 A GLU A1 1 203 ? -11.356 26.503 -9.65 0.58 17.05 193 A 1 -ATOM 3492 O OE1 B GLU A1 1 203 ? -12.464 27.327 -9.399 0.42 19.43 193 A 1 -ATOM 3493 O OE2 A GLU A1 1 203 ? -11.958 28.444 -8.742 0.58 20.37 193 A 1 -ATOM 3494 O OE2 B GLU A1 1 203 ? -10.55 26.267 -9.846 0.42 19.77 193 A 1 -ATOM 3495 H H A GLU A1 1 203 ? -13.477 29.014 -13.178 0.58 19.51 193 A 1 -ATOM 3496 H H B GLU A1 1 203 ? -13.475 29.017 -13.175 0.42 19.51 193 A 1 -ATOM 3497 H HA A GLU A1 1 203 ? -10.865 28.833 -13.596 0.58 19.57 193 A 1 -ATOM 3498 H HA B GLU A1 1 203 ? -10.877 28.838 -13.581 0.42 18.2 193 A 1 -ATOM 3499 H HB2 A GLU A1 1 203 ? -12.554 27.009 -12.288 0.58 20.08 193 A 1 -ATOM 3500 H HB2 B GLU A1 1 203 ? -12.714 27.281 -12.198 0.42 17.3 193 A 1 -ATOM 3501 H HB3 A GLU A1 1 203 ? -10.97 26.889 -12.314 0.58 20.08 193 A 1 -ATOM 3502 H HB3 B GLU A1 1 203 ? -11.312 26.619 -12.548 0.42 17.3 193 A 1 -ATOM 3503 H HG2 A GLU A1 1 203 ? -10.803 28.921 -11.161 0.58 17.97 193 A 1 -ATOM 3504 H HG2 B GLU A1 1 203 ? -10.23 28.205 -11.31 0.42 47.33 193 A 1 -ATOM 3505 H HG3 A GLU A1 1 203 ? -12.389 29.024 -11.121 0.58 17.97 193 A 1 -ATOM 3506 H HG3 B GLU A1 1 203 ? -11.611 28.93 -11.003 0.42 47.33 193 A 1 -ATOM 3507 N N A THR A1 1 204 ? -10.603 27.444 -15.618 0.59 14.17 194 A 1 -ATOM 3508 N N B THR A1 1 204 ? -10.655 27.525 -15.674 0.41 18.99 194 A 1 -ATOM 3509 C CA A THR A1 1 204 ? -10.578 26.886 -16.961 0.59 13.92 194 A 1 -ATOM 3510 C CA B THR A1 1 204 ? -10.663 26.835 -16.948 0.41 20.19 194 A 1 -ATOM 3511 C C A THR A1 1 204 ? -9.636 25.715 -17.021 0.59 16.15 194 A 1 -ATOM 3512 C C B THR A1 1 204 ? -9.679 25.692 -16.961 0.41 13.49 194 A 1 -ATOM 3513 O O A THR A1 1 204 ? -8.471 25.809 -16.598 0.59 16.86 194 A 1 -ATOM 3514 O O B THR A1 1 204 ? -8.537 25.796 -16.479 0.41 15.24 194 A 1 -ATOM 3515 C CB A THR A1 1 204 ? -10.168 27.981 -17.935 0.59 14.37 194 A 1 -ATOM 3516 C CB B THR A1 1 204 ? -10.402 27.76 -18.123 0.41 18.49 194 A 1 -ATOM 3517 O OG1 A THR A1 1 204 ? -11.071 29.094 -17.79 0.59 21.25 194 A 1 -ATOM 3518 O OG1 B THR A1 1 204 ? -9.054 28.211 -18.086 0.41 17.55 194 A 1 -ATOM 3519 C CG2 A THR A1 1 204 ? -10.262 27.535 -19.373 0.59 18.06 194 A 1 -ATOM 3520 C CG2 B THR A1 1 204 ? -11.353 28.933 -18.065 0.41 14.79 194 A 1 -ATOM 3521 H H A THR A1 1 204 ? -9.856 27.796 -15.378 0.59 17.01 194 A 1 -ATOM 3522 H H B THR A1 1 204 ? -9.952 27.995 -15.519 0.41 22.79 194 A 1 -ATOM 3523 H HA A THR A1 1 204 ? -11.45 26.543 -17.211 0.59 16.71 194 A 1 -ATOM 3524 H HA B THR A1 1 204 ? -11.551 26.463 -17.065 0.41 24.22 194 A 1 -ATOM 3525 H HB A THR A1 1 204 ? -9.248 28.222 -17.742 0.59 17.24 194 A 1 -ATOM 3526 H HB B THR A1 1 204 ? -10.545 27.292 -18.961 0.41 22.18 194 A 1 -ATOM 3527 H HG1 A THR A1 1 204 ? -10.833 29.724 -18.292 0.59 25.5 194 A 1 -ATOM 3528 H HG1 B THR A1 1 204 ? -8.91 28.737 -18.724 0.41 21.06 194 A 1 -ATOM 3529 H HG21 A THR A1 1 204 ? -10.551 28.274 -19.931 0.59 21.68 194 A 1 -ATOM 3530 H HG21 B THR A1 1 204 ? -11.308 29.438 -18.893 0.41 17.75 194 A 1 -ATOM 3531 H HG22 A THR A1 1 204 ? -9.396 27.227 -19.682 0.59 21.68 194 A 1 -ATOM 3532 H HG22 B THR A1 1 204 ? -12.261 28.619 -17.937 0.41 17.75 194 A 1 -ATOM 3533 H HG23 A THR A1 1 204 ? -10.902 26.81 -19.454 0.59 21.68 194 A 1 -ATOM 3534 H HG23 B THR A1 1 204 ? -11.115 29.517 -17.328 0.41 17.75 194 A 1 -ATOM 3535 N N . GLY A1 1 205 ? -10.13 24.606 -17.559 1.0 13.93 195 A 1 -ATOM 3536 C CA . GLY A1 1 205 ? -9.357 23.407 -17.717 1.0 13.8 195 A 1 -ATOM 3537 C C . GLY A1 1 205 ? -9.048 23.05 -19.148 1.0 13.04 195 A 1 -ATOM 3538 O O . GLY A1 1 205 ? -9.973 23.042 -19.993 1.0 13.89 195 A 1 -ATOM 3539 H H A GLY A1 1 205 ? -10.938 24.532 -17.845 0.59 16.72 195 A 1 -ATOM 3540 H H B GLY A1 1 205 ? -10.919 24.541 -17.895 0.41 16.72 195 A 1 -ATOM 3541 H HA2 . GLY A1 1 205 ? -8.514 23.514 -17.249 1.0 16.55 195 A 1 -ATOM 3542 H HA3 . GLY A1 1 205 ? -9.844 22.666 -17.324 1.0 16.55 195 A 1 -ATOM 3543 N N . ALA A1 1 206 ? -7.806 22.718 -19.44 1.0 13.08 196 A 1 -ATOM 3544 C CA . ALA A1 1 206 ? -7.401 22.198 -20.733 1.0 12.71 196 A 1 -ATOM 3545 C C . ALA A1 1 206 ? -6.81 20.819 -20.532 1.0 13.44 196 A 1 -ATOM 3546 O O . ALA A1 1 206 ? -7.172 20.154 -19.558 1.0 13.34 196 A 1 -ATOM 3547 C CB . ALA A1 1 206 ? -6.451 23.179 -21.436 1.0 15.34 196 A 1 -ATOM 3548 H H . ALA A1 1 206 ? -7.152 22.785 -18.886 1.0 15.69 196 A 1 -ATOM 3549 H HA . ALA A1 1 206 ? -8.156 22.107 -21.336 1.0 15.25 196 A 1 -ATOM 3550 H HB1 . ALA A1 1 206 ? -6.247 22.841 -22.322 1.0 18.41 196 A 1 -ATOM 3551 H HB2 . ALA A1 1 206 ? -6.884 24.045 -21.503 1.0 18.41 196 A 1 -ATOM 3552 H HB3 . ALA A1 1 206 ? -5.636 23.256 -20.916 1.0 18.41 196 A 1 -ATOM 3553 N N . GLY A1 1 207 ? -5.891 20.363 -21.401 1.0 13.18 197 A 1 -ATOM 3554 C CA . GLY A1 1 207 ? -5.284 19.054 -21.279 1.0 13.84 197 A 1 -ATOM 3555 C C . GLY A1 1 207 ? -5.395 18.274 -22.563 1.0 13.37 197 A 1 -ATOM 3556 O O . GLY A1 1 207 ? -6.34 18.419 -23.315 1.0 15.46 197 A 1 -ATOM 3557 H H . GLY A1 1 207 ? -5.606 20.811 -22.077 1.0 15.81 197 A 1 -ATOM 3558 H HA2 . GLY A1 1 207 ? -4.344 19.151 -21.056 1.0 16.61 197 A 1 -ATOM 3559 H HA3 . GLY A1 1 207 ? -5.725 18.555 -20.574 1.0 16.61 197 A 1 -ATOM 3560 N N . SER A1 1 208 ? -4.47 17.379 -22.75 1.0 15.08 198 A 1 -ATOM 3561 C CA . SER A1 1 208 ? -4.345 16.634 -24.009 1.0 16.12 198 A 1 -ATOM 3562 C C . SER A1 1 208 ? -4.596 15.147 -23.81 1.0 13.43 198 A 1 -ATOM 3563 O O . SER A1 1 208 ? -4.648 14.602 -22.686 1.0 15.02 198 A 1 -ATOM 3564 C CB . SER A1 1 208 ? -2.972 16.891 -24.642 1.0 18.92 198 A 1 -ATOM 3565 O OG . SER A1 1 208 ? -1.98 16.674 -23.62 1.0 21.07 198 A 1 -ATOM 3566 H H . SER A1 1 208 ? -3.88 17.167 -22.161 1.0 18.09 198 A 1 -ATOM 3567 H HA . SER A1 1 208 ? -5.032 16.937 -24.623 1.0 19.34 198 A 1 -ATOM 3568 H HB2 . SER A1 1 208 ? -2.827 16.274 -25.377 1.0 22.7 198 A 1 -ATOM 3569 H HB3 . SER A1 1 208 ? -2.922 17.805 -24.962 1.0 22.7 198 A 1 -ATOM 3570 H HG . SER A1 1 208 ? -2.013 15.879 -23.351 1.0 25.29 198 A 1 -ATOM 3571 N N . MET A1 1 209 ? -4.717 14.464 -24.941 1.0 13.63 199 A 1 -ATOM 3572 C CA . MET A1 1 209 ? -4.597 13.01 -24.998 1.0 14.49 199 A 1 -ATOM 3573 C C . MET A1 1 209 ? -3.187 12.678 -25.402 1.0 14.29 199 A 1 -ATOM 3574 O O . MET A1 1 209 ? -2.531 13.449 -26.136 1.0 15.85 199 A 1 -ATOM 3575 C CB . MET A1 1 209 ? -5.598 12.377 -25.989 1.0 16.11 199 A 1 -ATOM 3576 C CG . MET A1 1 209 ? -7.013 12.374 -25.503 1.0 15.5 199 A 1 -ATOM 3577 S SD . MET A1 1 209 ? -8.188 11.771 -26.729 1.0 17.22 199 A 1 -ATOM 3578 C CE . MET A1 1 209 ? -8.315 13.214 -27.726 1.0 17.48 199 A 1 -ATOM 3579 H H . MET A1 1 209 ? -4.872 14.827 -25.705 1.0 16.36 199 A 1 -ATOM 3580 H HA . MET A1 1 209 ? -4.807 12.629 -24.131 1.0 17.39 199 A 1 -ATOM 3581 H HB2 . MET A1 1 209 ? -5.571 12.877 -26.82 1.0 19.34 199 A 1 -ATOM 3582 H HB3 . MET A1 1 209 ? -5.338 11.456 -26.148 1.0 19.34 199 A 1 -ATOM 3583 H HG2 . MET A1 1 209 ? -7.076 11.8 -24.723 1.0 18.61 199 A 1 -ATOM 3584 H HG3 . MET A1 1 209 ? -7.266 13.28 -25.269 1.0 18.61 199 A 1 -ATOM 3585 H HE1 . MET A1 1 209 ? -8.875 13.018 -28.494 1.0 20.98 199 A 1 -ATOM 3586 H HE2 . MET A1 1 209 ? -8.711 13.927 -27.201 1.0 20.98 199 A 1 -ATOM 3587 H HE3 . MET A1 1 209 ? -7.429 13.473 -28.021 1.0 20.98 199 A 1 -ATOM 3588 N N . VAL A1 1 210 ? -2.674 11.574 -24.884 1.0 13.42 200 A 1 -ATOM 3589 C CA . VAL A1 1 210 ? -1.325 11.098 -25.158 1.0 13.8 200 A 1 -ATOM 3590 C C . VAL A1 1 210 ? -1.39 9.827 -25.962 1.0 14.42 200 A 1 -ATOM 3591 O O . VAL A1 1 210 ? -2.121 8.9 -25.63 1.0 15.0 200 A 1 -ATOM 3592 C CB . VAL A1 1 210 ? -0.574 10.874 -23.829 1.0 14.42 200 A 1 -ATOM 3593 C CG1 . VAL A1 1 210 ? 0.78 10.27 -24.078 1.0 17.25 200 A 1 -ATOM 3594 C CG2 . VAL A1 1 210 ? -0.532 12.124 -23.063 1.0 15.93 200 A 1 -ATOM 3595 H H . VAL A1 1 210 ? -3.106 11.059 -24.347 1.0 16.11 200 A 1 -ATOM 3596 H HA . VAL A1 1 210 ? -0.852 11.749 -25.7 1.0 16.56 200 A 1 -ATOM 3597 H HB . VAL A1 1 210 ? -1.048 10.231 -23.279 1.0 17.3 200 A 1 -ATOM 3598 H HG11 . VAL A1 1 210 ? 1.324 10.375 -23.282 1.0 20.7 200 A 1 -ATOM 3599 H HG12 . VAL A1 1 210 ? 0.673 9.327 -24.282 1.0 20.7 200 A 1 -ATOM 3600 H HG13 . VAL A1 1 210 ? 1.197 10.725 -24.826 1.0 20.7 200 A 1 -ATOM 3601 H HG21 . VAL A1 1 210 ? 0.012 11.991 -22.271 1.0 19.11 200 A 1 -ATOM 3602 H HG22 . VAL A1 1 210 ? -0.145 12.821 -23.616 1.0 19.11 200 A 1 -ATOM 3603 H HG23 . VAL A1 1 210 ? -1.435 12.368 -22.807 1.0 19.11 200 A 1 -ATOM 3604 N N . GLY A1 1 211 ? -0.669 9.813 -27.082 1.0 15.39 201 A 1 -ATOM 3605 C CA . GLY A1 1 211 ? -0.647 8.658 -27.962 1.0 15.42 201 A 1 -ATOM 3606 C C . GLY A1 1 211 ? -1.602 8.718 -29.106 1.0 15.63 201 A 1 -ATOM 3607 O O . GLY A1 1 211 ? -1.87 7.683 -29.719 1.0 16.86 201 A 1 -ATOM 3608 H H . GLY A1 1 211 ? -0.181 10.467 -27.352 1.0 18.46 201 A 1 -ATOM 3609 H HA2 . GLY A1 1 211 ? 0.246 8.564 -28.327 1.0 18.51 201 A 1 -ATOM 3610 H HA3 . GLY A1 1 211 ? -0.86 7.868 -27.441 1.0 18.51 201 A 1 -ATOM 3611 N N . LEU A1 1 212 ? -2.085 9.891 -29.454 1.0 15.86 202 A 1 -ATOM 3612 C CA . LEU A1 1 212 ? -2.93 10.023 -30.638 1.0 15.93 202 A 1 -ATOM 3613 C C . LEU A1 1 212 ? -2.153 9.617 -31.875 1.0 17.2 202 A 1 -ATOM 3614 O O . LEU A1 1 212 ? -0.945 9.792 -31.952 1.0 17.52 202 A 1 -ATOM 3615 C CB . LEU A1 1 212 ? -3.433 11.467 -30.789 1.0 16.81 202 A 1 -ATOM 3616 C CG . LEU A1 1 212 ? -4.432 11.918 -29.735 1.0 15.41 202 A 1 -ATOM 3617 C CD1 . LEU A1 1 212 ? -4.528 13.427 -29.764 1.0 16.92 202 A 1 -ATOM 3618 C CD2 . LEU A1 1 212 ? -5.746 11.317 -30.009 1.0 17.18 202 A 1 -ATOM 3619 H H . LEU A1 1 212 ? -1.945 10.626 -29.03 1.0 19.04 202 A 1 -ATOM 3620 H HA . LEU A1 1 212 ? -3.703 9.443 -30.549 1.0 19.11 202 A 1 -ATOM 3621 H HB2 . LEU A1 1 212 ? -2.669 12.063 -30.74 1.0 20.18 202 A 1 -ATOM 3622 H HB3 . LEU A1 1 212 ? -3.864 11.551 -31.654 1.0 20.18 202 A 1 -ATOM 3623 H HG . LEU A1 1 212 ? -4.146 11.636 -28.852 1.0 18.5 202 A 1 -ATOM 3624 H HD11 . LEU A1 1 212 ? -5.166 13.715 -29.092 1.0 20.31 202 A 1 -ATOM 3625 H HD12 . LEU A1 1 212 ? -3.654 13.802 -29.573 1.0 20.31 202 A 1 -ATOM 3626 H HD13 . LEU A1 1 212 ? -4.824 13.707 -30.644 1.0 20.31 202 A 1 -ATOM 3627 H HD21 . LEU A1 1 212 ? -6.384 11.642 -29.355 1.0 20.61 202 A 1 -ATOM 3628 H HD22 . LEU A1 1 212 ? -6.028 11.57 -30.902 1.0 20.61 202 A 1 -ATOM 3629 H HD23 . LEU A1 1 212 ? -5.671 10.352 -29.947 1.0 20.61 202 A 1 -ATOM 3630 N N . PRO A1 1 213 ? -2.842 9.103 -32.895 1.0 18.01 203 A 1 -ATOM 3631 C CA . PRO A1 1 213 ? -2.145 8.763 -34.147 1.0 18.71 203 A 1 -ATOM 3632 C C . PRO A1 1 213 ? -1.521 10.012 -34.762 1.0 19.41 203 A 1 -ATOM 3633 O O . PRO A1 1 213 ? -2.157 11.078 -34.766 1.0 24.53 203 A 1 -ATOM 3634 C CB . PRO A1 1 213 ? -3.265 8.22 -35.043 1.0 23.31 203 A 1 -ATOM 3635 C CG . PRO A1 1 213 ? -4.389 8.13 -34.291 1.0 24.34 203 A 1 -ATOM 3636 C CD . PRO A1 1 213 ? -4.27 8.833 -32.964 1.0 20.27 203 A 1 -ATOM 3637 H HA . PRO A1 1 213 ? -1.474 8.079 -33.997 1.0 22.45 203 A 1 -ATOM 3638 H HB2 . PRO A1 1 213 ? -3.403 8.829 -35.785 1.0 27.98 203 A 1 -ATOM 3639 H HB3 . PRO A1 1 213 ? -3.01 7.345 -35.375 1.0 27.98 203 A 1 -ATOM 3640 H HG2 . PRO A1 1 213 ? -5.116 8.527 -34.796 1.0 29.21 203 A 1 -ATOM 3641 H HG3 . PRO A1 1 213 ? -4.568 7.189 -34.136 1.0 29.21 203 A 1 -ATOM 3642 H HD2 . PRO A1 1 213 ? -4.783 9.656 -32.957 1.0 24.33 203 A 1 -ATOM 3643 H HD3 . PRO A1 1 213 ? -4.554 8.258 -32.236 1.0 24.33 203 A 1 -ATOM 3644 N N . GLY A1 1 214 ? -0.286 9.899 -35.145 1.0 21.5 204 A 1 -ATOM 3645 C CA . GLY A1 1 214 ? 0.464 10.995 -35.737 1.0 24.62 204 A 1 -ATOM 3646 C C . GLY A1 1 214 ? 1.11 11.939 -34.735 1.0 25.01 204 A 1 -ATOM 3647 O O . GLY A1 1 214 ? 1.816 12.865 -35.141 1.0 28.2 204 A 1 -ATOM 3648 H H . GLY A1 1 214 ? 0.171 9.174 -35.075 1.0 25.8 204 A 1 -ATOM 3649 H HA2 . GLY A1 1 214 ? 1.168 10.626 -36.293 1.0 29.54 204 A 1 -ATOM 3650 H HA3 . GLY A1 1 214 ? -0.136 11.518 -36.293 1.0 29.54 204 A 1 -ATOM 3651 N N . GLN A1 1 215 ? 0.916 11.741 -33.437 1.0 19.85 205 A 1 -ATOM 3652 C CA . GLN A1 1 215 ? 1.454 12.626 -32.436 1.0 21.81 205 A 1 -ATOM 3653 C C . GLN A1 1 215 ? 2.831 12.117 -32.048 1.0 19.64 205 A 1 -ATOM 3654 O O . GLN A1 1 215 ? 3.017 10.922 -31.807 1.0 23.67 205 A 1 -ATOM 3655 C CB . GLN A1 1 215 ? 0.516 12.546 -31.242 1.0 19.04 205 A 1 -ATOM 3656 C CG . GLN A1 1 215 ? 0.821 13.484 -30.093 1.0 17.29 205 A 1 -ATOM 3657 C CD . GLN A1 1 215 ? -0.148 13.252 -28.966 1.0 17.7 205 A 1 -ATOM 3658 O OE1 . GLN A1 1 215 ? -0.28 12.107 -28.552 1.0 19.51 205 A 1 -ATOM 3659 N NE2 . GLN A1 1 215 ? -0.811 14.267 -28.518 1.0 16.52 205 A 1 -ATOM 3660 H H . GLN A1 1 215 ? 0.465 11.085 -33.112 1.0 23.82 205 A 1 -ATOM 3661 H HA . GLN A1 1 215 ? 1.539 13.543 -32.739 1.0 26.17 205 A 1 -ATOM 3662 H HB2 . GLN A1 1 215 ? -0.381 12.749 -31.547 1.0 22.85 205 A 1 -ATOM 3663 H HB3 . GLN A1 1 215 ? 0.55 11.642 -30.89 1.0 22.85 205 A 1 -ATOM 3664 H HG2 . GLN A1 1 215 ? 1.72 13.321 -29.769 1.0 20.75 205 A 1 -ATOM 3665 H HG3 . GLN A1 1 215 ? 0.736 14.403 -30.391 1.0 20.75 205 A 1 -ATOM 3666 H HE21 . GLN A1 1 215 ? -0.692 15.046 -28.864 1.0 19.83 205 A 1 -ATOM 3667 H HE22 . GLN A1 1 215 ? -1.372 14.164 -27.874 1.0 19.83 205 A 1 -ATOM 3668 N N . THR A1 1 216 ? 3.796 13.019 -31.926 1.0 17.89 206 A 1 -ATOM 3669 C CA . THR A1 1 216 ? 5.172 12.704 -31.564 1.0 19.41 206 A 1 -ATOM 3670 C C . THR A1 1 216 ? 5.558 13.291 -30.207 1.0 18.6 206 A 1 -ATOM 3671 O O . THR A1 1 216 ? 4.801 14.067 -29.57 1.0 17.52 206 A 1 -ATOM 3672 C CB . THR A1 1 216 ? 6.152 13.315 -32.597 1.0 19.84 206 A 1 -ATOM 3673 O OG1 . THR A1 1 216 ? 6.036 14.73 -32.489 1.0 21.87 206 A 1 -ATOM 3674 C CG2 . THR A1 1 216 ? 5.783 12.888 -33.999 1.0 23.91 206 A 1 -ATOM 3675 H H . THR A1 1 216 ? 3.673 13.861 -32.054 1.0 21.47 206 A 1 -ATOM 3676 H HA . THR A1 1 216 ? 5.239 11.737 -31.529 1.0 23.29 206 A 1 -ATOM 3677 H HB . THR A1 1 216 ? 7.062 13.021 -32.432 1.0 23.81 206 A 1 -ATOM 3678 H HG1 . THR A1 1 216 ? 6.552 15.103 -33.037 1.0 26.25 206 A 1 -ATOM 3679 H HG21 . THR A1 1 216 ? 6.458 13.191 -34.626 1.0 28.7 206 A 1 -ATOM 3680 H HG22 . THR A1 1 216 ? 5.722 11.921 -34.046 1.0 28.7 206 A 1 -ATOM 3681 H HG23 . THR A1 1 216 ? 4.928 13.271 -34.248 1.0 28.7 206 A 1 -ATOM 3682 N N . ILE A1 1 217 ? 6.769 12.948 -29.753 1.0 20.29 207 A 1 -ATOM 3683 C CA . ILE A1 1 217 ? 7.247 13.531 -28.511 1.0 18.86 207 A 1 -ATOM 3684 C C . ILE A1 1 217 ? 7.343 15.026 -28.63 1.0 18.74 207 A 1 -ATOM 3685 O O . ILE A1 1 217 ? 7.032 15.75 -27.686 1.0 17.73 207 A 1 -ATOM 3686 C CB . ILE A1 1 217 ? 8.599 12.917 -28.079 1.0 22.03 207 A 1 -ATOM 3687 C CG1 . ILE A1 1 217 ? 8.438 11.431 -27.837 1.0 28.02 207 A 1 -ATOM 3688 C CG2 . ILE A1 1 217 ? 9.187 13.653 -26.906 1.0 22.21 207 A 1 -ATOM 3689 C CD1 . ILE A1 1 217 ? 7.691 11.12 -26.603 1.0 31.06 207 A 1 -ATOM 3690 H H . ILE A1 1 217 ? 7.309 12.399 -30.136 1.0 24.34 207 A 1 -ATOM 3691 H HA . ILE A1 1 217 ? 6.597 13.318 -27.823 1.0 22.63 207 A 1 -ATOM 3692 H HB . ILE A1 1 217 ? 9.238 13.021 -28.801 1.0 26.43 207 A 1 -ATOM 3693 H HG12 . ILE A1 1 217 ? 7.957 11.042 -28.584 1.0 33.62 207 A 1 -ATOM 3694 H HG13 . ILE A1 1 217 ? 9.317 11.028 -27.763 1.0 33.62 207 A 1 -ATOM 3695 H HG21 . ILE A1 1 217 ? 9.891 13.112 -26.514 1.0 26.65 207 A 1 -ATOM 3696 H HG22 . ILE A1 1 217 ? 9.551 14.498 -27.213 1.0 26.65 207 A 1 -ATOM 3697 H HG23 . ILE A1 1 217 ? 8.489 13.812 -26.251 1.0 26.65 207 A 1 -ATOM 3698 H HD11 . ILE A1 1 217 ? 7.591 10.158 -26.529 1.0 37.27 207 A 1 -ATOM 3699 H HD12 . ILE A1 1 217 ? 8.184 11.462 -25.841 1.0 37.27 207 A 1 -ATOM 3700 H HD13 . ILE A1 1 217 ? 6.818 11.541 -26.648 1.0 37.27 207 A 1 -ATOM 3701 N N . ASP A1 1 218 ? 7.74 15.539 -29.798 1.0 18.49 208 A 1 -ATOM 3702 C CA . ASP A1 1 218 ? 7.784 16.984 -29.94 1.0 18.79 208 A 1 -ATOM 3703 C C . ASP A1 1 218 ? 6.399 17.609 -29.778 1.0 17.21 208 A 1 -ATOM 3704 O O . ASP A1 1 218 ? 6.275 18.715 -29.218 1.0 17.07 208 A 1 -ATOM 3705 C CB . ASP A1 1 218 ? 8.322 17.379 -31.336 1.0 20.3 208 A 1 -ATOM 3706 C CG . ASP A1 1 218 ? 9.781 17.134 -31.495 1.0 31.72 208 A 1 -ATOM 3707 O OD1 . ASP A1 1 218 ? 10.521 17.373 -30.557 1.0 31.36 208 A 1 -ATOM 3708 O OD2 . ASP A1 1 218 ? 10.193 16.743 -32.611 1.0 47.86 208 A 1 -ATOM 3709 H H . ASP A1 1 218 ? 7.977 15.087 -30.49 1.0 22.19 208 A 1 -ATOM 3710 H HA . ASP A1 1 218 ? 8.382 17.326 -29.258 1.0 22.55 208 A 1 -ATOM 3711 H HB2 . ASP A1 1 218 ? 7.857 16.858 -32.01 1.0 24.36 208 A 1 -ATOM 3712 H HB3 . ASP A1 1 218 ? 8.161 18.325 -31.479 1.0 24.36 208 A 1 -ATOM 3713 N N . ASP A1 1 219 ? 5.351 16.922 -30.217 1.0 15.88 209 A 1 -ATOM 3714 C CA . ASP A1 1 219 ? 4.009 17.43 -30.007 1.0 16.11 209 A 1 -ATOM 3715 C C . ASP A1 1 219 ? 3.649 17.44 -28.53 1.0 15.88 209 A 1 -ATOM 3716 O O . ASP A1 1 219 ? 3.008 18.377 -28.061 1.0 15.52 209 A 1 -ATOM 3717 C CB . ASP A1 1 219 ? 2.988 16.569 -30.727 1.0 17.01 209 A 1 -ATOM 3718 C CG . ASP A1 1 219 ? 3.073 16.668 -32.248 1.0 18.02 209 A 1 -ATOM 3719 O OD1 . ASP A1 1 219 ? 3.235 17.797 -32.796 1.0 18.82 209 A 1 -ATOM 3720 O OD2 . ASP A1 1 219 ? 2.942 15.597 -32.893 1.0 20.38 209 A 1 -ATOM 3721 H H . ASP A1 1 219 ? 5.391 16.17 -30.632 1.0 19.05 209 A 1 -ATOM 3722 H HA . ASP A1 1 219 ? 3.981 18.331 -30.366 1.0 19.33 209 A 1 -ATOM 3723 H HB2 . ASP A1 1 219 ? 3.131 15.642 -30.481 1.0 20.41 209 A 1 -ATOM 3724 H HB3 . ASP A1 1 219 ? 2.098 16.849 -30.461 1.0 20.41 209 A 1 -ATOM 3725 N N . LEU A1 1 220 ? 4.067 16.413 -27.767 1.0 14.86 210 A 1 -ATOM 3726 C CA . LEU A1 1 220 ? 3.791 16.378 -26.327 1.0 14.57 210 A 1 -ATOM 3727 C C . LEU A1 1 220 ? 4.491 17.523 -25.622 1.0 15.85 210 A 1 -ATOM 3728 O O . LEU A1 1 220 ? 3.938 18.126 -24.712 1.0 15.36 210 A 1 -ATOM 3729 C CB . LEU A1 1 220 ? 4.256 15.056 -25.735 1.0 16.21 210 A 1 -ATOM 3730 C CG . LEU A1 1 220 ? 3.616 13.771 -26.256 1.0 25.88 210 A 1 -ATOM 3731 C CD1 . LEU A1 1 220 ? 4.03 12.634 -25.333 1.0 24.9 210 A 1 -ATOM 3732 C CD2 . LEU A1 1 220 ? 2.175 13.803 -26.438 1.0 29.39 210 A 1 -ATOM 3733 H H . LEU A1 1 220 ? 4.507 15.734 -28.059 1.0 17.83 210 A 1 -ATOM 3734 H HA . LEU A1 1 220 ? 2.834 16.457 -26.19 1.0 17.49 210 A 1 -ATOM 3735 H HB2 . LEU A1 1 220 ? 5.209 14.979 -25.899 1.0 19.45 210 A 1 -ATOM 3736 H HB3 . LEU A1 1 220 ? 4.085 15.084 -24.78 1.0 19.45 210 A 1 -ATOM 3737 H HG . LEU A1 1 220 ? 3.941 13.634 -27.159 1.0 31.05 210 A 1 -ATOM 3738 H HD11 . LEU A1 1 220 ? 3.618 11.812 -25.641 1.0 29.88 210 A 1 -ATOM 3739 H HD12 . LEU A1 1 220 ? 4.996 12.548 -25.352 1.0 29.88 210 A 1 -ATOM 3740 H HD13 . LEU A1 1 220 ? 3.734 12.835 -24.431 1.0 29.88 210 A 1 -ATOM 3741 H HD21 . LEU A1 1 220 ? 1.878 12.937 -26.759 1.0 35.27 210 A 1 -ATOM 3742 H HD22 . LEU A1 1 220 ? 1.753 14.003 -25.588 1.0 35.27 210 A 1 -ATOM 3743 H HD23 . LEU A1 1 220 ? 1.954 14.489 -27.087 1.0 35.27 210 A 1 -ATOM 3744 N N . VAL A1 1 221 ? 5.715 17.857 -26.049 1.0 15.18 211 A 1 -ATOM 3745 C CA . VAL A1 1 221 ? 6.401 19.006 -25.5 1.0 15.63 211 A 1 -ATOM 3746 C C . VAL A1 1 221 ? 5.625 20.286 -25.784 1.0 15.36 211 A 1 -ATOM 3747 O O . VAL A1 1 221 ? 5.474 21.155 -24.909 1.0 16.51 211 A 1 -ATOM 3748 C CB . VAL A1 1 221 ? 7.838 19.099 -26.046 1.0 18.02 211 A 1 -ATOM 3749 C CG1 . VAL A1 1 221 ? 8.46 20.404 -25.59 1.0 19.99 211 A 1 -ATOM 3750 C CG2 . VAL A1 1 221 ? 8.652 17.896 -25.589 1.0 18.07 211 A 1 -ATOM 3751 H H . VAL A1 1 221 ? 6.158 17.431 -26.651 1.0 18.22 211 A 1 -ATOM 3752 H HA . VAL A1 1 221 ? 6.45 18.887 -24.539 1.0 18.75 211 A 1 -ATOM 3753 H HB . VAL A1 1 221 ? 7.834 19.089 -27.016 1.0 21.62 211 A 1 -ATOM 3754 H HG11 . VAL A1 1 221 ? 9.426 20.329 -25.64 1.0 23.99 211 A 1 -ATOM 3755 H HG12 . VAL A1 1 221 ? 8.153 21.119 -26.169 1.0 23.99 211 A 1 -ATOM 3756 H HG13 . VAL A1 1 221 ? 8.189 20.581 -24.675 1.0 23.99 211 A 1 -ATOM 3757 H HG21 . VAL A1 1 221 ? 9.558 17.981 -25.926 1.0 21.69 211 A 1 -ATOM 3758 H HG22 . VAL A1 1 221 ? 8.661 17.87 -24.619 1.0 21.69 211 A 1 -ATOM 3759 H HG23 . VAL A1 1 221 ? 8.244 17.088 -25.938 1.0 21.69 211 A 1 -ATOM 3760 N N . ASP A1 1 222 ? 5.091 20.428 -27.008 1.0 15.65 212 A 1 -ATOM 3761 C CA . ASP A1 1 222 ? 4.291 21.593 -27.323 1.0 15.52 212 A 1 -ATOM 3762 C C . ASP A1 1 222 ? 3.033 21.633 -26.432 1.0 14.99 212 A 1 -ATOM 3763 O O . ASP A1 1 222 ? 2.587 22.733 -26.065 1.0 15.71 212 A 1 -ATOM 3764 C CB . ASP A1 1 222 ? 3.887 21.535 -28.81 1.0 15.72 212 A 1 -ATOM 3765 C CG . ASP A1 1 222 ? 4.976 21.954 -29.763 1.0 19.01 212 A 1 -ATOM 3766 O OD1 . ASP A1 1 222 ? 5.881 22.699 -29.347 1.0 21.66 212 A 1 -ATOM 3767 O OD2 . ASP A1 1 222 ? 4.874 21.561 -30.959 1.0 19.04 212 A 1 -ATOM 3768 H H . ASP A1 1 222 ? 5.183 19.869 -27.655 1.0 18.78 212 A 1 -ATOM 3769 H HA . ASP A1 1 222 ? 4.804 22.402 -27.17 1.0 18.63 212 A 1 -ATOM 3770 H HB2 . ASP A1 1 222 ? 3.64 20.624 -29.029 1.0 18.86 212 A 1 -ATOM 3771 H HB3 . ASP A1 1 222 ? 3.131 22.127 -28.949 1.0 18.86 212 A 1 -ATOM 3772 N N . ASP A1 1 223 ? 2.41 20.484 -26.148 1.0 15.39 213 A 1 -ATOM 3773 C CA . ASP A1 1 223 ? 1.277 20.448 -25.201 1.0 14.05 213 A 1 -ATOM 3774 C C . ASP A1 1 223 ? 1.682 20.997 -23.837 1.0 15.22 213 A 1 -ATOM 3775 O O . ASP A1 1 223 ? 0.98 21.832 -23.271 1.0 15.47 213 A 1 -ATOM 3776 C CB . ASP A1 1 223 ? 0.745 19.03 -25.051 1.0 14.44 213 A 1 -ATOM 3777 C CG . ASP A1 1 223 ? -0.07 18.544 -26.238 1.0 15.38 213 A 1 -ATOM 3778 O OD1 . ASP A1 1 223 ? -0.875 19.341 -26.781 1.0 15.21 213 A 1 -ATOM 3779 O OD2 . ASP A1 1 223 ? 0.103 17.334 -26.595 1.0 16.66 213 A 1 -ATOM 3780 H H . ASP A1 1 223 ? 2.617 19.719 -26.482 1.0 18.47 213 A 1 -ATOM 3781 H HA . ASP A1 1 223 ? 0.567 21.001 -25.563 1.0 16.86 213 A 1 -ATOM 3782 H HB2 . ASP A1 1 223 ? 1.496 18.426 -24.942 1.0 17.33 213 A 1 -ATOM 3783 H HB3 . ASP A1 1 223 ? 0.174 18.994 -24.267 1.0 17.33 213 A 1 -ATOM 3784 N N . LEU A1 1 224 ? 2.829 20.544 -23.318 1.0 15.0 214 A 1 -ATOM 3785 C CA . LEU A1 1 224 ? 3.287 21.019 -22.007 1.0 14.61 214 A 1 -ATOM 3786 C C . LEU A1 1 224 ? 3.508 22.518 -22.036 1.0 16.15 214 A 1 -ATOM 3787 O O . LEU A1 1 224 ? 3.131 23.231 -21.104 1.0 16.08 214 A 1 -ATOM 3788 C CB . LEU A1 1 224 ? 4.57 20.315 -21.589 1.0 16.27 214 A 1 -ATOM 3789 C CG . LEU A1 1 224 ? 4.415 18.836 -21.284 1.0 15.0 214 A 1 -ATOM 3790 C CD1 . LEU A1 1 224 ? 5.812 18.257 -21.004 1.0 17.45 214 A 1 -ATOM 3791 C CD2 . LEU A1 1 224 ? 3.477 18.615 -20.072 1.0 16.27 214 A 1 -ATOM 3792 H H . LEU A1 1 224 ? 3.35 19.974 -23.696 1.0 18.0 214 A 1 -ATOM 3793 H HA . LEU A1 1 224 ? 2.606 20.806 -21.351 1.0 17.54 214 A 1 -ATOM 3794 H HB2 . LEU A1 1 224 ? 5.215 20.399 -22.308 1.0 19.52 214 A 1 -ATOM 3795 H HB3 . LEU A1 1 224 ? 4.909 20.745 -20.787 1.0 19.52 214 A 1 -ATOM 3796 H HG . LEU A1 1 224 ? 4.013 18.377 -22.038 1.0 18.01 214 A 1 -ATOM 3797 H HD11 . LEU A1 1 224 ? 5.727 17.313 -20.796 1.0 20.94 214 A 1 -ATOM 3798 H HD12 . LEU A1 1 224 ? 6.366 18.373 -21.792 1.0 20.94 214 A 1 -ATOM 3799 H HD13 . LEU A1 1 224 ? 6.204 18.727 -20.252 1.0 20.94 214 A 1 -ATOM 3800 H HD21 . LEU A1 1 224 ? 3.501 17.678 -19.822 1.0 19.53 214 A 1 -ATOM 3801 H HD22 . LEU A1 1 224 ? 3.783 19.162 -19.332 1.0 19.53 214 A 1 -ATOM 3802 H HD23 . LEU A1 1 224 ? 2.575 18.868 -20.32 1.0 19.53 214 A 1 -ATOM 3803 N N . LEU A1 1 225 ? 4.166 23.031 -23.08 1.0 15.41 215 A 1 -ATOM 3804 C CA . LEU A1 1 225 ? 4.442 24.456 -23.145 1.0 17.79 215 A 1 -ATOM 3805 C C . LEU A1 1 225 ? 3.184 25.271 -23.343 1.0 15.83 215 A 1 -ATOM 3806 O O . LEU A1 1 225 ? 3.113 26.406 -22.848 1.0 18.32 215 A 1 -ATOM 3807 C CB . LEU A1 1 225 ? 5.495 24.738 -24.221 1.0 17.91 215 A 1 -ATOM 3808 C CG . LEU A1 1 225 ? 6.84 24.135 -23.881 1.0 21.55 215 A 1 -ATOM 3809 C CD1 . LEU A1 1 225 ? 7.767 24.246 -25.09 1.0 28.55 215 A 1 -ATOM 3810 C CD2 . LEU A1 1 225 ? 7.406 24.843 -22.665 1.0 27.88 215 A 1 -ATOM 3811 H H . LEU A1 1 225 ? 4.457 22.578 -23.751 1.0 18.49 215 A 1 -ATOM 3812 H HA . LEU A1 1 225 ? 4.821 24.746 -22.301 1.0 21.35 215 A 1 -ATOM 3813 H HB2 . LEU A1 1 225 ? 5.197 24.359 -25.062 1.0 21.5 215 A 1 -ATOM 3814 H HB3 . LEU A1 1 225 ? 5.607 25.697 -24.31 1.0 21.5 215 A 1 -ATOM 3815 H HG . LEU A1 1 225 ? 6.758 23.192 -23.665 1.0 25.86 215 A 1 -ATOM 3816 H HD11 . LEU A1 1 225 ? 8.629 23.864 -24.864 1.0 34.26 215 A 1 -ATOM 3817 H HD12 . LEU A1 1 225 ? 7.375 23.762 -25.834 1.0 34.26 215 A 1 -ATOM 3818 H HD13 . LEU A1 1 225 ? 7.871 25.182 -25.323 1.0 34.26 215 A 1 -ATOM 3819 H HD21 . LEU A1 1 225 ? 8.362 24.684 -22.623 1.0 33.45 215 A 1 -ATOM 3820 H HD22 . LEU A1 1 225 ? 7.232 25.794 -22.743 1.0 33.45 215 A 1 -ATOM 3821 H HD23 . LEU A1 1 225 ? 6.978 24.493 -21.868 1.0 33.45 215 A 1 -ATOM 3822 N N . PHE A1 1 226 ? 2.196 24.737 -24.053 1.0 15.59 216 A 1 -ATOM 3823 C CA . PHE A1 1 226 ? 0.9 25.4 -24.185 1.0 16.73 216 A 1 -ATOM 3824 C C . PHE A1 1 226 ? 0.239 25.532 -22.823 1.0 14.95 216 A 1 -ATOM 3825 O O . PHE A1 1 226 ? -0.302 26.59 -22.47 1.0 17.25 216 A 1 -ATOM 3826 C CB . PHE A1 1 226 ? 0.043 24.604 -25.174 1.0 16.29 216 A 1 -ATOM 3827 C CG . PHE A1 1 226 ? -1.39 25.04 -25.223 1.0 15.08 216 A 1 -ATOM 3828 C CD1 . PHE A1 1 226 ? -1.751 26.185 -25.884 1.0 16.88 216 A 1 -ATOM 3829 C CD2 . PHE A1 1 226 ? -2.373 24.299 -24.606 1.0 17.78 216 A 1 -ATOM 3830 C CE1 . PHE A1 1 226 ? -3.058 26.573 -25.904 1.0 19.06 216 A 1 -ATOM 3831 C CE2 . PHE A1 1 226 ? -3.685 24.735 -24.647 1.0 16.46 216 A 1 -ATOM 3832 C CZ . PHE A1 1 226 ? -3.997 25.822 -25.326 1.0 17.05 216 A 1 -ATOM 3833 H H . PHE A1 1 226 ? 2.247 23.987 -24.471 1.0 18.71 216 A 1 -ATOM 3834 H HA . PHE A1 1 226 ? 1.003 26.297 -24.541 1.0 20.07 216 A 1 -ATOM 3835 H HB2 . PHE A1 1 226 ? 0.415 24.709 -26.064 1.0 19.55 216 A 1 -ATOM 3836 H HB3 . PHE A1 1 226 ? 0.059 23.669 -24.917 1.0 19.55 216 A 1 -ATOM 3837 H HD1 . PHE A1 1 226 ? -1.107 26.695 -26.319 1.0 20.25 216 A 1 -ATOM 3838 H HD2 . PHE A1 1 226 ? -2.156 23.509 -24.165 1.0 21.33 216 A 1 -ATOM 3839 H HE1 . PHE A1 1 226 ? -3.297 27.368 -26.323 1.0 22.88 216 A 1 -ATOM 3840 H HE2 . PHE A1 1 226 ? -4.346 24.263 -24.196 1.0 19.75 216 A 1 -ATOM 3841 H HZ . PHE A1 1 226 ? -4.89 26.07 -25.404 1.0 20.46 216 A 1 -ATOM 3842 N N . LEU A1 1 227 ? 0.254 24.456 -22.062 1.0 14.8 217 A 1 -ATOM 3843 C CA . LEU A1 1 227 ? -0.379 24.471 -20.727 1.0 14.58 217 A 1 -ATOM 3844 C C . LEU A1 1 227 ? 0.306 25.491 -19.841 1.0 17.19 217 A 1 -ATOM 3845 O O . LEU A1 1 227 ? -0.361 26.266 -19.15 1.0 17.77 217 A 1 -ATOM 3846 C CB . LEU A1 1 227 ? -0.323 23.072 -20.118 1.0 15.88 217 A 1 -ATOM 3847 C CG . LEU A1 1 227 ? -1.108 22.028 -20.813 1.0 16.17 217 A 1 -ATOM 3848 C CD1 . LEU A1 1 227 ? -0.757 20.637 -20.385 1.0 21.35 217 A 1 -ATOM 3849 C CD2 . LEU A1 1 227 ? -2.61 22.29 -20.735 1.0 15.96 217 A 1 -ATOM 3850 H H . LEU A1 1 227 ? 0.616 23.706 -22.278 1.0 17.76 217 A 1 -ATOM 3851 H HA . LEU A1 1 227 ? -1.315 24.715 -20.8 1.0 17.49 217 A 1 -ATOM 3852 H HB2 . LEU A1 1 227 ? 0.603 22.781 -20.116 1.0 19.05 217 A 1 -ATOM 3853 H HB3 . LEU A1 1 227 ? -0.656 23.125 -19.209 1.0 19.05 217 A 1 -ATOM 3854 H HG . LEU A1 1 227 ? -0.862 22.079 -21.75 1.0 19.4 217 A 1 -ATOM 3855 H HD11 . LEU A1 1 227 ? -1.404 20.018 -20.759 1.0 25.63 217 A 1 -ATOM 3856 H HD12 . LEU A1 1 227 ? 0.132 20.422 -20.708 1.0 25.63 217 A 1 -ATOM 3857 H HD13 . LEU A1 1 227 ? -0.777 20.59 -19.416 1.0 25.63 217 A 1 -ATOM 3858 H HD21 . LEU A1 1 227 ? -3.083 21.534 -21.117 1.0 19.15 217 A 1 -ATOM 3859 H HD22 . LEU A1 1 227 ? -2.863 22.402 -19.805 1.0 19.15 217 A 1 -ATOM 3860 H HD23 . LEU A1 1 227 ? -2.817 23.096 -21.233 1.0 19.15 217 A 1 -ATOM 3861 N N . LYS A1 1 228 ? 1.626 25.51 -19.862 1.0 16.4 218 A 1 -ATOM 3862 C CA . LYS A1 1 228 ? 2.392 26.465 -19.065 1.0 19.33 218 A 1 -ATOM 3863 C C . LYS A1 1 228 ? 2.084 27.894 -19.464 1.0 20.68 218 A 1 -ATOM 3864 O O . LYS A1 1 228 ? 1.922 28.769 -18.599 1.0 21.61 218 A 1 -ATOM 3865 C CB . LYS A1 1 228 ? 3.885 26.137 -19.23 1.0 22.02 218 A 1 -ATOM 3866 C CG . LYS A1 1 228 ? 4.874 27.049 -18.506 1.0 23.39 218 A 1 -ATOM 3867 C CD . LYS A1 1 228 ? 4.733 26.957 -17.06 1.0 27.01 218 A 1 -ATOM 3868 C CE . LYS A1 1 228 ? 5.954 27.565 -16.354 0.85 30.79 218 A 1 -ATOM 3869 N NZ . LYS A1 1 228 ? 5.612 27.692 -14.936 0.39 18.29 218 A 1 -ATOM 3870 H H . LYS A1 1 228 ? 2.112 24.978 -20.331 1.0 19.68 218 A 1 -ATOM 3871 H HA . LYS A1 1 228 ? 2.158 26.387 -18.127 1.0 23.19 218 A 1 -ATOM 3872 H HB2 . LYS A1 1 228 ? 4.033 25.238 -18.898 1.0 26.42 218 A 1 -ATOM 3873 H HB3 . LYS A1 1 228 ? 4.099 26.181 -20.175 1.0 26.42 218 A 1 -ATOM 3874 H HG2 . LYS A1 1 228 ? 5.779 26.789 -18.74 1.0 28.07 218 A 1 -ATOM 3875 H HG3 . LYS A1 1 228 ? 4.714 27.968 -18.769 1.0 28.07 218 A 1 -ATOM 3876 H HD2 . LYS A1 1 228 ? 3.942 27.443 -16.781 1.0 32.42 218 A 1 -ATOM 3877 H HD3 . LYS A1 1 228 ? 4.659 26.025 -16.8 1.0 32.42 218 A 1 -ATOM 3878 H HE2 . LYS A1 1 228 ? 6.724 26.984 -16.45 0.78 36.95 218 A 1 -ATOM 3879 H HE3 . LYS A1 1 228 ? 6.153 28.442 -16.718 0.79 36.95 218 A 1 -ATOM 3880 H HZ1 . LYS A1 1 228 ? 6.326 27.515 -14.434 0.36 21.95 218 A 1 -ATOM 3881 H HZ2 . LYS A1 1 228 ? 5.335 28.52 -14.762 0.42 21.95 218 A 1 -ATOM 3882 H HZ3 . LYS A1 1 228 ? 4.963 27.12 -14.727 0.43 21.95 218 A 1 -ATOM 3883 N N . GLU A1 1 229 ? 2.018 28.157 -20.773 1.0 19.05 219 A 1 -ATOM 3884 C CA . GLU A1 1 229 ? 1.783 29.506 -21.276 1.0 20.33 219 A 1 -ATOM 3885 C C . GLU A1 1 229 ? 0.503 30.1 -20.71 1.0 19.78 219 A 1 -ATOM 3886 O O . GLU A1 1 229 ? 0.461 31.288 -20.374 1.0 22.07 219 A 1 -ATOM 3887 C CB . GLU A1 1 229 ? 1.716 29.458 -22.821 1.0 21.67 219 A 1 -ATOM 3888 C CG . GLU A1 1 229 ? 1.252 30.773 -23.506 1.0 26.0 219 A 1 -ATOM 3889 C CD . GLU A1 1 229 ? 1.211 30.683 -25.037 1.0 43.85 219 A 1 -ATOM 3890 O OE1 . GLU A1 1 229 ? 1.317 29.564 -25.601 1.0 35.1 219 A 1 -ATOM 3891 O OE2 . GLU A1 1 229 ? 1.046 31.749 -25.663 1.0 55.7 219 A 1 -ATOM 3892 H H . GLU A1 1 229 ? 2.107 27.567 -21.392 1.0 22.86 219 A 1 -ATOM 3893 H HA . GLU A1 1 229 ? 2.516 30.082 -21.006 1.0 24.4 219 A 1 -ATOM 3894 H HB2 . GLU A1 1 229 ? 2.602 29.252 -23.159 1.0 26.0 219 A 1 -ATOM 3895 H HB3 . GLU A1 1 229 ? 1.093 28.761 -23.079 1.0 26.0 219 A 1 -ATOM 3896 H HG2 . GLU A1 1 229 ? 0.357 30.988 -23.197 1.0 31.21 219 A 1 -ATOM 3897 H HG3 . GLU A1 1 229 ? 1.865 31.485 -23.266 1.0 31.21 219 A 1 -ATOM 3898 N N . HIS A1 1 230 ? -0.549 29.301 -20.603 1.0 17.82 220 A 1 -ATOM 3899 C CA . HIS A1 1 230 ? -1.849 29.807 -20.213 1.0 19.87 220 A 1 -ATOM 3900 C C . HIS A1 1 230 ? -2.186 29.605 -18.745 1.0 19.42 220 A 1 -ATOM 3901 O O . HIS A1 1 230 ? -3.256 30.062 -18.311 1.0 21.77 220 A 1 -ATOM 3902 C CB . HIS A1 1 230 ? -2.916 29.187 -21.1 1.0 21.62 220 A 1 -ATOM 3903 C CG . HIS A1 1 230 ? -2.751 29.592 -22.529 1.0 22.23 220 A 1 -ATOM 3904 N ND1 . HIS A1 1 230 ? -3.063 30.862 -23.003 1.0 27.57 220 A 1 -ATOM 3905 C CD2 . HIS A1 1 230 ? -2.267 28.908 -23.586 1.0 20.79 220 A 1 -ATOM 3906 C CE1 . HIS A1 1 230 ? -2.78 30.921 -24.287 1.0 24.01 220 A 1 -ATOM 3907 N NE2 . HIS A1 1 230 ? -2.326 29.746 -24.676 1.0 24.01 220 A 1 -ATOM 3908 H H . HIS A1 1 230 ? -0.532 28.454 -20.753 1.0 21.39 220 A 1 -ATOM 3909 H HA . HIS A1 1 230 ? -1.859 30.767 -20.353 1.0 23.85 220 A 1 -ATOM 3910 H HB2 . HIS A1 1 230 ? -2.854 28.221 -21.048 1.0 25.95 220 A 1 -ATOM 3911 H HB3 . HIS A1 1 230 ? -3.791 29.48 -20.8 1.0 25.95 220 A 1 -ATOM 3912 H HD1 . HIS A1 1 230 ? -3.388 31.505 -22.533 1.0 33.09 220 A 1 -ATOM 3913 H HD2 . HIS A1 1 230 ? -1.952 28.033 -23.579 1.0 24.95 220 A 1 -ATOM 3914 H HE1 . HIS A1 1 230 ? -2.884 31.668 -24.83 1.0 28.82 220 A 1 -ATOM 3915 N N . ASP A1 1 231 ? -1.341 28.945 -17.996 1.0 17.38 221 A 1 -ATOM 3916 C CA . ASP A1 1 231 ? -1.525 28.868 -16.531 1.0 19.27 221 A 1 -ATOM 3917 C C . ASP A1 1 231 ? -2.908 28.323 -16.195 1.0 18.64 221 A 1 -ATOM 3918 O O . ASP A1 1 231 ? -3.615 28.878 -15.348 1.0 18.64 221 A 1 -ATOM 3919 C CB . ASP A1 1 231 ? -1.264 30.247 -15.906 1.0 21.99 221 A 1 -ATOM 3920 C CG . ASP A1 1 231 ? -1.367 30.247 -14.398 1.0 24.55 221 A 1 -ATOM 3921 O OD1 . ASP A1 1 231 ? -0.956 29.262 -13.784 1.0 23.23 221 A 1 -ATOM 3922 O OD2 . ASP A1 1 231 ? -1.797 31.293 -13.835 1.0 29.47 221 A 1 -ATOM 3923 H H . ASP A1 1 231 ? -0.65 28.528 -18.292 1.0 20.85 221 A 1 -ATOM 3924 H HA . ASP A1 1 231 ? -0.889 28.247 -16.143 1.0 23.13 221 A 1 -ATOM 3925 H HB2 . ASP A1 1 231 ? -0.37 30.536 -16.145 1.0 26.39 221 A 1 -ATOM 3926 H HB3 . ASP A1 1 231 ? -1.918 30.876 -16.249 1.0 26.39 221 A 1 -ATOM 3927 N N . PHE A1 1 232 ? -3.311 27.222 -16.853 1.0 16.9 222 A 1 -ATOM 3928 C CA . PHE A1 1 232 ? -4.659 26.719 -16.665 1.0 15.74 222 A 1 -ATOM 3929 C C . PHE A1 1 232 ? -4.893 26.294 -15.224 1.0 15.07 222 A 1 -ATOM 3930 O O . PHE A1 1 232 ? -4.029 25.741 -14.547 1.0 16.16 222 A 1 -ATOM 3931 C CB . PHE A1 1 232 ? -4.882 25.509 -17.591 1.0 16.41 222 A 1 -ATOM 3932 C CG . PHE A1 1 232 ? -5.007 25.902 -19.05 1.0 15.39 222 A 1 -ATOM 3933 C CD1 . PHE A1 1 232 ? -6.107 26.661 -19.493 1.0 15.06 222 A 1 -ATOM 3934 C CD2 . PHE A1 1 232 ? -4.019 25.592 -19.965 1.0 16.37 222 A 1 -ATOM 3935 C CE1 . PHE A1 1 232 ? -6.221 27.046 -20.825 1.0 16.53 222 A 1 -ATOM 3936 C CE2 . PHE A1 1 232 ? -4.144 25.983 -21.292 1.0 16.07 222 A 1 -ATOM 3937 C CZ . PHE A1 1 232 ? -5.189 26.693 -21.707 1.0 17.08 222 A 1 -ATOM 3938 H H . PHE A1 1 232 ? -2.826 26.768 -17.399 1.0 20.28 222 A 1 -ATOM 3939 H HA . PHE A1 1 232 ? -5.296 27.418 -16.879 1.0 18.89 222 A 1 -ATOM 3940 H HB2 . PHE A1 1 232 ? -4.128 24.904 -17.506 1.0 19.69 222 A 1 -ATOM 3941 H HB3 . PHE A1 1 232 ? -5.7 25.059 -17.329 1.0 19.69 222 A 1 -ATOM 3942 H HD1 . PHE A1 1 232 ? -6.767 26.908 -18.886 1.0 18.07 222 A 1 -ATOM 3943 H HD2 . PHE A1 1 232 ? -3.266 25.12 -19.691 1.0 19.64 222 A 1 -ATOM 3944 H HE1 . PHE A1 1 232 ? -6.961 27.524 -21.122 1.0 19.84 222 A 1 -ATOM 3945 H HE2 . PHE A1 1 232 ? -3.484 25.743 -21.902 1.0 19.28 222 A 1 -ATOM 3946 H HZ . PHE A1 1 232 ? -5.236 26.961 -22.597 1.0 20.5 222 A 1 -ATOM 3947 N N . ASP A1 1 233 ? -6.114 26.512 -14.803 1.0 14.07 223 A 1 -ATOM 3948 C CA . ASP A1 1 233 ? -6.53 26.137 -13.451 1.0 14.74 223 A 1 -ATOM 3949 C C . ASP A1 1 233 ? -6.606 24.656 -13.281 1.0 13.82 223 A 1 -ATOM 3950 O O . ASP A1 1 233 ? -6.345 24.141 -12.17 1.0 15.96 223 A 1 -ATOM 3951 C CB . ASP A1 1 233 ? -7.861 26.793 -13.101 1.0 14.56 223 A 1 -ATOM 3952 C CG . ASP A1 1 233 ? -7.797 28.277 -13.256 1.0 18.1 223 A 1 -ATOM 3953 O OD1 . ASP A1 1 233 ? -6.96 28.91 -12.558 1.0 18.24 223 A 1 -ATOM 3954 O OD2 . ASP A1 1 233 ? -8.504 28.848 -14.127 1.0 19.28 223 A 1 -ATOM 3955 H H . ASP A1 1 233 ? -6.735 26.877 -15.273 1.0 16.89 223 A 1 -ATOM 3956 H HA . ASP A1 1 233 ? -5.864 26.468 -12.829 1.0 17.69 223 A 1 -ATOM 3957 H HB2 . ASP A1 1 233 ? -8.551 26.454 -13.692 1.0 17.47 223 A 1 -ATOM 3958 H HB3 . ASP A1 1 233 ? -8.085 26.592 -12.179 1.0 17.47 223 A 1 -ATOM 3959 N N . MET A1 1 234 ? -7.01 23.943 -14.329 1.0 13.45 224 A 1 -ATOM 3960 C CA A MET A1 1 234 ? -7.125 22.5 -14.307 0.61 14.69 224 A 1 -ATOM 3961 C CA B MET A1 1 234 ? -7.126 22.502 -14.31 0.39 12.71 224 A 1 -ATOM 3962 C C . MET A1 1 234 ? -6.48 21.961 -15.564 1.0 12.55 224 A 1 -ATOM 3963 O O . MET A1 1 234 ? -6.535 22.6 -16.636 1.0 13.25 224 A 1 -ATOM 3964 C CB A MET A1 1 234 ? -8.58 21.953 -14.247 0.61 18.43 224 A 1 -ATOM 3965 C CB B MET A1 1 234 ? -8.587 22.049 -14.266 0.39 19.07 224 A 1 -ATOM 3966 C CG A MET A1 1 234 ? -9.471 22.598 -13.228 0.61 53.62 224 A 1 -ATOM 3967 C CG B MET A1 1 234 ? -9.343 22.617 -13.116 0.39 12.73 224 A 1 -ATOM 3968 S SD A MET A1 1 234 ? -10.493 23.873 -13.961 0.61 16.31 224 A 1 -ATOM 3969 S SD B MET A1 1 234 ? -11.129 22.466 -13.33 0.39 36.2 224 A 1 -ATOM 3970 C CE A MET A1 1 234 ? -11.834 22.957 -14.771 0.61 14.91 224 A 1 -ATOM 3971 C CE B MET A1 1 234 ? -11.422 23.695 -14.597 0.39 41.23 224 A 1 -ATOM 3972 H H A MET A1 1 234 ? -7.229 24.289 -15.085 0.61 16.14 224 A 1 -ATOM 3973 H H B MET A1 1 234 ? -7.229 24.29 -15.085 0.39 16.14 224 A 1 -ATOM 3974 H HA A MET A1 1 234 ? -6.686 22.19 -13.5 0.61 17.63 224 A 1 -ATOM 3975 H HA B MET A1 1 234 ? -6.685 22.15 -13.521 0.39 15.25 224 A 1 -ATOM 3976 H HB2 A MET A1 1 234 ? -8.992 22.086 -15.115 0.61 22.11 224 A 1 -ATOM 3977 H HB2 B MET A1 1 234 ? -9.028 22.331 -15.083 0.39 22.88 224 A 1 -ATOM 3978 H HB3 A MET A1 1 234 ? -8.541 21.007 -14.039 0.61 22.11 224 A 1 -ATOM 3979 H HB3 B MET A1 1 234 ? -8.613 21.082 -14.193 0.39 22.88 224 A 1 -ATOM 3980 H HG2 A MET A1 1 234 ? -10.052 21.926 -12.839 0.61 64.35 224 A 1 -ATOM 3981 H HG2 B MET A1 1 234 ? -9.094 22.144 -12.306 0.39 15.27 224 A 1 -ATOM 3982 H HG3 A MET A1 1 234 ? -8.925 23.004 -12.536 0.61 64.35 224 A 1 -ATOM 3983 H HG3 B MET A1 1 234 ? -9.128 23.559 -13.028 0.39 15.27 224 A 1 -ATOM 3984 H HE1 A MET A1 1 234 ? -12.436 23.588 -15.197 0.61 17.89 224 A 1 -ATOM 3985 H HE1 B MET A1 1 234 ? -12.371 23.727 -14.793 0.39 49.47 224 A 1 -ATOM 3986 H HE2 A MET A1 1 234 ? -11.454 22.363 -15.436 0.61 17.89 224 A 1 -ATOM 3987 H HE2 B MET A1 1 234 ? -11.121 24.559 -14.275 0.39 49.47 224 A 1 -ATOM 3988 H HE3 A MET A1 1 234 ? -12.314 22.442 -14.103 0.61 17.89 224 A 1 -ATOM 3989 H HE3 B MET A1 1 234 ? -10.928 23.449 -15.395 0.39 49.47 224 A 1 -ATOM 3990 N N . VAL A1 1 235 ? -5.933 20.756 -15.477 1.0 12.33 225 A 1 -ATOM 3991 C CA . VAL A1 1 235 ? -5.377 20.089 -16.647 1.0 12.22 225 A 1 -ATOM 3992 C C . VAL A1 1 235 ? -5.762 18.628 -16.604 1.0 12.38 225 A 1 -ATOM 3993 O O . VAL A1 1 235 ? -5.327 17.909 -15.688 1.0 13.45 225 A 1 -ATOM 3994 C CB . VAL A1 1 235 ? -3.863 20.205 -16.693 1.0 13.28 225 A 1 -ATOM 3995 C CG1 . VAL A1 1 235 ? -3.346 19.508 -17.986 1.0 14.18 225 A 1 -ATOM 3996 C CG2 . VAL A1 1 235 ? -3.392 21.609 -16.661 1.0 14.96 225 A 1 -ATOM 3997 H H . VAL A1 1 235 ? -5.872 20.303 -14.749 1.0 14.79 225 A 1 -ATOM 3998 H HA . VAL A1 1 235 ? -5.761 20.484 -17.446 1.0 14.66 225 A 1 -ATOM 3999 H HB . VAL A1 1 235 ? -3.503 19.775 -15.901 1.0 15.93 225 A 1 -ATOM 4000 H HG11 . VAL A1 1 235 ? -2.411 19.733 -18.114 1.0 17.02 225 A 1 -ATOM 4001 H HG12 . VAL A1 1 235 ? -3.445 18.548 -17.888 1.0 17.02 225 A 1 -ATOM 4002 H HG13 . VAL A1 1 235 ? -3.868 19.819 -18.742 1.0 17.02 225 A 1 -ATOM 4003 H HG21 . VAL A1 1 235 ? -2.424 21.619 -16.726 1.0 17.96 225 A 1 -ATOM 4004 H HG22 . VAL A1 1 235 ? -3.779 22.089 -17.41 1.0 17.96 225 A 1 -ATOM 4005 H HG23 . VAL A1 1 235 ? -3.671 22.017 -15.827 1.0 17.96 225 A 1 -ATOM 4006 N N . GLY A1 1 236 ? -6.537 18.175 -17.576 1.0 12.51 226 A 1 -ATOM 4007 C CA . GLY A1 1 236 ? -6.985 16.788 -17.72 1.0 12.35 226 A 1 -ATOM 4008 C C . GLY A1 1 236 ? -6.183 16.068 -18.795 1.0 12.4 226 A 1 -ATOM 4009 O O . GLY A1 1 236 ? -6.3 16.425 -19.985 1.0 13.17 226 A 1 -ATOM 4010 H H . GLY A1 1 236 ? -6.839 18.676 -18.206 1.0 15.01 226 A 1 -ATOM 4011 H HA2 . GLY A1 1 236 ? -6.871 16.319 -16.879 1.0 14.82 226 A 1 -ATOM 4012 H HA3 . GLY A1 1 236 ? -7.923 16.772 -17.967 1.0 14.82 226 A 1 -ATOM 4013 N N . ILE A1 1 237 ? -5.394 15.093 -18.403 1.0 12.64 227 A 1 -ATOM 4014 C CA . ILE A1 1 237 ? -4.533 14.337 -19.297 1.0 12.52 227 A 1 -ATOM 4015 C C . ILE A1 1 237 ? -4.847 12.871 -19.176 1.0 13.47 227 A 1 -ATOM 4016 O O . ILE A1 1 237 ? -5.032 12.339 -18.069 1.0 13.69 227 A 1 -ATOM 4017 C CB . ILE A1 1 237 ? -3.069 14.611 -18.951 1.0 14.42 227 A 1 -ATOM 4018 C CG1 . ILE A1 1 237 ? -2.674 16.027 -19.382 1.0 20.34 227 A 1 -ATOM 4019 C CG2 . ILE A1 1 237 ? -2.149 13.643 -19.613 1.0 17.71 227 A 1 -ATOM 4020 C CD1 . ILE A1 1 237 ? -1.311 16.52 -18.803 1.0 23.12 227 A 1 -ATOM 4021 H H . ILE A1 1 237 ? -5.334 14.834 -17.585 1.0 15.17 227 A 1 -ATOM 4022 H HA . ILE A1 1 237 ? -4.707 14.588 -20.218 1.0 15.02 227 A 1 -ATOM 4023 H HB . ILE A1 1 237 ? -2.988 14.516 -17.989 1.0 17.31 227 A 1 -ATOM 4024 H HG12 . ILE A1 1 237 ? -2.607 16.049 -20.349 1.0 24.41 227 A 1 -ATOM 4025 H HG13 . ILE A1 1 237 ? -3.36 16.644 -19.083 1.0 24.41 227 A 1 -ATOM 4026 H HG21 . ILE A1 1 237 ? -1.239 13.971 -19.54 1.0 21.26 227 A 1 -ATOM 4027 H HG22 . ILE A1 1 237 ? -2.227 12.782 -19.172 1.0 21.26 227 A 1 -ATOM 4028 H HG23 . ILE A1 1 237 ? -2.397 13.559 -20.547 1.0 21.26 227 A 1 -ATOM 4029 H HD11 . ILE A1 1 237 ? -1.241 17.479 -18.933 1.0 27.75 227 A 1 -ATOM 4030 H HD12 . ILE A1 1 237 ? -1.275 16.31 -17.857 1.0 27.75 227 A 1 -ATOM 4031 H HD13 . ILE A1 1 237 ? -0.589 16.07 -19.269 1.0 27.75 227 A 1 -ATOM 4032 N N . GLY A1 1 238 ? -4.879 12.165 -20.287 1.0 12.73 228 A 1 -ATOM 4033 C CA . GLY A1 1 238 ? -5.031 10.739 -20.271 1.0 12.89 228 A 1 -ATOM 4034 C C . GLY A1 1 238 ? -4.557 10.167 -21.593 1.0 12.97 228 A 1 -ATOM 4035 O O . GLY A1 1 238 ? -4.248 10.916 -22.543 1.0 13.75 228 A 1 -ATOM 4036 H H . GLY A1 1 238 ? -4.812 12.501 -21.076 1.0 15.27 228 A 1 -ATOM 4037 H HA2 . GLY A1 1 238 ? -4.505 10.356 -19.552 1.0 15.47 228 A 1 -ATOM 4038 H HA3 . GLY A1 1 238 ? -5.963 10.506 -20.14 1.0 15.47 228 A 1 -ATOM 4039 N N . PRO A1 1 239 ? -4.453 8.864 -21.675 1.0 13.0 229 A 1 -ATOM 4040 C CA . PRO A1 1 239 ? -4.065 8.192 -22.921 1.0 13.13 229 A 1 -ATOM 4041 C C . PRO A1 1 239 ? -5.226 8.189 -23.886 1.0 13.99 229 A 1 -ATOM 4042 O O . PRO A1 1 239 ? -6.395 8.13 -23.519 1.0 14.19 229 A 1 -ATOM 4043 C CB . PRO A1 1 239 ? -3.762 6.753 -22.464 1.0 15.51 229 A 1 -ATOM 4044 C CG . PRO A1 1 239 ? -4.757 6.559 -21.306 1.0 14.96 229 A 1 -ATOM 4045 C CD . PRO A1 1 239 ? -4.712 7.887 -20.59 1.0 13.24 229 A 1 -ATOM 4046 H HA . PRO A1 1 239 ? -3.273 8.588 -23.316 1.0 15.76 229 A 1 -ATOM 4047 H HB2 . PRO A1 1 239 ? -3.927 6.125 -23.184 1.0 18.61 229 A 1 -ATOM 4048 H HB3 . PRO A1 1 239 ? -2.843 6.678 -22.161 1.0 18.61 229 A 1 -ATOM 4049 H HG2 . PRO A1 1 239 ? -5.644 6.372 -21.65 1.0 17.95 229 A 1 -ATOM 4050 H HG3 . PRO A1 1 239 ? -4.466 5.836 -20.728 1.0 17.95 229 A 1 -ATOM 4051 H HD2 . PRO A1 1 239 ? -5.559 8.072 -20.156 1.0 15.89 229 A 1 -ATOM 4052 H HD3 . PRO A1 1 239 ? -3.995 7.901 -19.937 1.0 15.89 229 A 1 -ATOM 4053 N N . PHE A1 1 240 ? -4.878 8.238 -25.181 1.0 13.63 230 A 1 -ATOM 4054 C CA . PHE A1 1 240 ? -5.826 7.907 -26.233 1.0 13.73 230 A 1 -ATOM 4055 C C . PHE A1 1 240 ? -6.125 6.408 -26.157 1.0 13.94 230 A 1 -ATOM 4056 O O . PHE A1 1 240 ? -5.215 5.574 -26.15 1.0 14.75 230 A 1 -ATOM 4057 C CB . PHE A1 1 240 ? -5.205 8.236 -27.597 1.0 13.87 230 A 1 -ATOM 4058 C CG . PHE A1 1 240 ? -5.924 7.579 -28.764 1.0 14.22 230 A 1 -ATOM 4059 C CD1 . PHE A1 1 240 ? -7.254 7.842 -29.04 1.0 15.11 230 A 1 -ATOM 4060 C CD2 . PHE A1 1 240 ? -5.228 6.74 -29.572 1.0 15.69 230 A 1 -ATOM 4061 C CE1 . PHE A1 1 240 ? -7.913 7.21 -30.078 1.0 15.37 230 A 1 -ATOM 4062 C CE2 . PHE A1 1 240 ? -5.877 6.098 -30.662 1.0 17.23 230 A 1 -ATOM 4063 C CZ . PHE A1 1 240 ? -7.24 6.367 -30.891 1.0 15.77 230 A 1 -ATOM 4064 H H . PHE A1 1 240 ? -4.098 8.461 -25.468 1.0 16.35 230 A 1 -ATOM 4065 H HA . PHE A1 1 240 ? -6.647 8.413 -26.131 1.0 16.48 230 A 1 -ATOM 4066 H HB2 . PHE A1 1 240 ? -5.236 9.196 -27.731 1.0 16.64 230 A 1 -ATOM 4067 H HB3 . PHE A1 1 240 ? -4.285 7.929 -27.604 1.0 16.64 230 A 1 -ATOM 4068 H HD1 . PHE A1 1 240 ? -7.714 8.458 -28.517 1.0 18.13 230 A 1 -ATOM 4069 H HD2 . PHE A1 1 240 ? -4.325 6.584 -29.413 1.0 18.83 230 A 1 -ATOM 4070 H HE1 . PHE A1 1 240 ? -8.82 7.364 -30.216 1.0 18.44 230 A 1 -ATOM 4071 H HE2 . PHE A1 1 240 ? -5.411 5.513 -31.214 1.0 20.68 230 A 1 -ATOM 4072 H HZ . PHE A1 1 240 ? -7.678 5.963 -31.604 1.0 18.93 230 A 1 -ATOM 4073 N N . ILE A1 1 241 ? -7.404 6.059 -26.158 1.0 14.47 231 A 1 -ATOM 4074 C CA . ILE A1 1 241 ? -7.813 4.649 -26.151 1.0 14.97 231 A 1 -ATOM 4075 C C . ILE A1 1 241 ? -8.653 4.37 -27.39 1.0 15.02 231 A 1 -ATOM 4076 O O . ILE A1 1 241 ? -9.773 4.912 -27.505 1.0 15.37 231 A 1 -ATOM 4077 C CB . ILE A1 1 241 ? -8.597 4.307 -24.886 1.0 14.84 231 A 1 -ATOM 4078 C CG1 . ILE A1 1 241 ? -7.698 4.521 -23.628 1.0 17.49 231 A 1 -ATOM 4079 C CG2 . ILE A1 1 241 ? -9.049 2.875 -24.957 1.0 17.57 231 A 1 -ATOM 4080 C CD1 . ILE A1 1 241 ? -8.393 4.382 -22.296 1.0 19.43 231 A 1 -ATOM 4081 H H . ILE A1 1 241 ? -8.059 6.616 -26.162 1.0 17.36 231 A 1 -ATOM 4082 H HA . ILE A1 1 241 ? -7.017 4.094 -26.184 1.0 17.96 231 A 1 -ATOM 4083 H HB . ILE A1 1 241 ? -9.37 4.889 -24.82 1.0 17.81 231 A 1 -ATOM 4084 H HG12 . ILE A1 1 241 ? -6.984 3.865 -23.65 1.0 20.99 231 A 1 -ATOM 4085 H HG13 . ILE A1 1 241 ? -7.328 5.416 -23.668 1.0 20.99 231 A 1 -ATOM 4086 H HG21 . ILE A1 1 241 ? -9.358 2.597 -24.08 1.0 21.09 231 A 1 -ATOM 4087 H HG22 . ILE A1 1 241 ? -9.772 2.803 -25.6 1.0 21.09 231 A 1 -ATOM 4088 H HG23 . ILE A1 1 241 ? -8.303 2.321 -25.235 1.0 21.09 231 A 1 -ATOM 4089 H HD11 . ILE A1 1 241 ? -7.793 4.682 -21.594 1.0 23.32 231 A 1 -ATOM 4090 H HD12 . ILE A1 1 241 ? -9.195 4.928 -22.3 1.0 23.32 231 A 1 -ATOM 4091 H HD13 . ILE A1 1 241 ? -8.627 3.451 -22.156 1.0 23.32 231 A 1 -ATOM 4092 N N . PRO A1 1 242 ? -8.156 3.593 -28.354 1.0 15.24 232 A 1 -ATOM 4093 C CA . PRO A1 1 242 ? -8.876 3.44 -29.618 1.0 15.24 232 A 1 -ATOM 4094 C C . PRO A1 1 242 ? -10.233 2.797 -29.394 1.0 18.0 232 A 1 -ATOM 4095 O O . PRO A1 1 242 ? -10.397 1.848 -28.598 1.0 17.3 232 A 1 -ATOM 4096 C CB . PRO A1 1 242 ? -7.983 2.515 -30.454 1.0 17.99 232 A 1 -ATOM 4097 C CG . PRO A1 1 242 ? -6.614 2.638 -29.852 1.0 20.56 232 A 1 -ATOM 4098 C CD . PRO A1 1 242 ? -6.808 2.983 -28.393 1.0 16.65 232 A 1 -ATOM 4099 H HA . PRO A1 1 242 ? -8.965 4.301 -30.056 1.0 18.28 232 A 1 -ATOM 4100 H HB2 . PRO A1 1 242 ? -8.307 1.603 -30.395 1.0 21.59 232 A 1 -ATOM 4101 H HB3 . PRO A1 1 242 ? -7.982 2.807 -31.379 1.0 21.59 232 A 1 -ATOM 4102 H HG2 . PRO A1 1 242 ? -6.144 1.794 -29.942 1.0 24.67 232 A 1 -ATOM 4103 H HG3 . PRO A1 1 242 ? -6.122 3.34 -30.305 1.0 24.67 232 A 1 -ATOM 4104 H HD2 . PRO A1 1 242 ? -6.777 2.184 -27.843 1.0 19.97 232 A 1 -ATOM 4105 H HD3 . PRO A1 1 242 ? -6.136 3.616 -28.097 1.0 19.97 232 A 1 -ATOM 4106 N N . HIS A1 1 243 ? -11.218 3.288 -30.151 1.0 18.03 233 A 1 -ATOM 4107 C CA . HIS A1 1 243 ? -12.582 2.813 -30.066 1.0 15.88 233 A 1 -ATOM 4108 C C . HIS A1 1 243 ? -12.948 2.056 -31.334 1.0 19.0 233 A 1 -ATOM 4109 O O . HIS A1 1 243 ? -12.697 2.538 -32.452 1.0 18.08 233 A 1 -ATOM 4110 C CB . HIS A1 1 243 ? -13.514 3.979 -29.882 1.0 16.39 233 A 1 -ATOM 4111 C CG . HIS A1 1 243 ? -14.917 3.594 -29.603 1.0 16.16 233 A 1 -ATOM 4112 N ND1 . HIS A1 1 243 ? -15.678 2.871 -30.499 1.0 18.51 233 A 1 -ATOM 4113 C CD2 . HIS A1 1 243 ? -15.711 3.87 -28.553 1.0 16.48 233 A 1 -ATOM 4114 C CE1 . HIS A1 1 243 ? -16.883 2.703 -29.982 1.0 18.47 233 A 1 -ATOM 4115 N NE2 . HIS A1 1 243 ? -16.907 3.27 -28.793 1.0 18.01 233 A 1 -ATOM 4116 H H . HIS A1 1 243 ? -11.109 3.912 -30.732 1.0 21.63 233 A 1 -ATOM 4117 H HA . HIS A1 1 243 ? -12.678 2.211 -29.312 1.0 19.06 233 A 1 -ATOM 4118 H HB2 . HIS A1 1 243 ? -13.2 4.512 -29.134 1.0 19.67 233 A 1 -ATOM 4119 H HB3 . HIS A1 1 243 ? -13.51 4.511 -30.693 1.0 19.67 233 A 1 -ATOM 4120 H HD2 . HIS A1 1 243 ? -15.484 4.376 -27.806 1.0 19.78 233 A 1 -ATOM 4121 H HE1 . HIS A1 1 243 ? -17.593 2.261 -30.389 1.0 22.16 233 A 1 -ATOM 4122 H HE2 . HIS A1 1 243 ? -17.575 3.261 -28.251 1.0 21.61 233 A 1 -ATOM 4123 N N . PRO A1 1 244 ? -13.495 0.833 -31.243 1.0 18.66 234 A 1 -ATOM 4124 C CA . PRO A1 1 244 ? -13.684 0.0 -32.434 1.0 19.82 234 A 1 -ATOM 4125 C C . PRO A1 1 244 ? -14.649 0.547 -33.446 1.0 18.7 234 A 1 -ATOM 4126 O O . PRO A1 1 244 ? -14.607 0.108 -34.587 1.0 20.9 234 A 1 -ATOM 4127 C CB . PRO A1 1 244 ? -14.175 -1.326 -31.851 1.0 24.06 234 A 1 -ATOM 4128 C CG . PRO A1 1 244 ? -14.721 -0.987 -30.51 1.0 27.14 234 A 1 -ATOM 4129 C CD . PRO A1 1 244 ? -13.855 0.141 -29.988 1.0 18.39 234 A 1 -ATOM 4130 H HA . PRO A1 1 244 ? -12.828 -0.129 -32.872 1.0 23.78 234 A 1 -ATOM 4131 H HB2 . PRO A1 1 244 ? -14.865 -1.7 -32.421 1.0 28.88 234 A 1 -ATOM 4132 H HB3 . PRO A1 1 244 ? -13.434 -1.947 -31.777 1.0 28.88 234 A 1 -ATOM 4133 H HG2 . PRO A1 1 244 ? -15.645 -0.702 -30.594 1.0 32.57 234 A 1 -ATOM 4134 H HG3 . PRO A1 1 244 ? -14.665 -1.761 -29.928 1.0 32.57 234 A 1 -ATOM 4135 H HD2 . PRO A1 1 244 ? -14.355 0.724 -29.395 1.0 22.07 234 A 1 -ATOM 4136 H HD3 . PRO A1 1 244 ? -13.068 -0.199 -29.534 1.0 22.07 234 A 1 -ATOM 4137 N N . ASP A1 1 245 ? -15.549 1.44 -33.083 1.0 19.17 235 A 1 -ATOM 4138 C CA . ASP A1 1 245 ? -16.542 1.964 -33.999 1.0 21.21 235 A 1 -ATOM 4139 C C . ASP A1 1 245 ? -16.154 3.342 -34.487 1.0 20.76 235 A 1 -ATOM 4140 O O . ASP A1 1 245 ? -17.042 4.16 -34.742 1.0 22.47 235 A 1 -ATOM 4141 C CB . ASP A1 1 245 ? -17.913 1.963 -33.341 1.0 21.94 235 A 1 -ATOM 4142 C CG . ASP A1 1 245 ? -18.372 0.562 -32.955 1.0 24.64 235 A 1 -ATOM 4143 O OD1 . ASP A1 1 245 ? -18.132 -0.375 -33.757 1.0 31.79 235 A 1 -ATOM 4144 O OD2 . ASP A1 1 245 ? -18.962 0.402 -31.892 1.0 29.64 235 A 1 -ATOM 4145 H H . ASP A1 1 245 ? -15.606 1.767 -32.289 1.0 23.0 235 A 1 -ATOM 4146 H HA . ASP A1 1 245 ? -16.608 1.389 -34.778 1.0 25.46 235 A 1 -ATOM 4147 H HB2 . ASP A1 1 245 ? -17.878 2.501 -32.535 1.0 26.33 235 A 1 -ATOM 4148 H HB3 . ASP A1 1 245 ? -18.562 2.333 -33.959 1.0 26.33 235 A 1 -ATOM 4149 N N . THR A1 1 246 ? -14.858 3.585 -34.649 1.0 18.56 236 A 1 -ATOM 4150 C CA . THR A1 1 246 ? -14.325 4.853 -35.125 1.0 17.21 236 A 1 -ATOM 4151 C C . THR A1 1 246 ? -13.248 4.612 -36.156 1.0 17.7 236 A 1 -ATOM 4152 O O . THR A1 1 246 ? -12.703 3.498 -36.215 1.0 18.86 236 A 1 -ATOM 4153 C CB . THR A1 1 246 ? -13.697 5.685 -34.011 1.0 17.5 236 A 1 -ATOM 4154 O OG1 . THR A1 1 246 ? -12.445 5.081 -33.589 1.0 17.49 236 A 1 -ATOM 4155 C CG2 . THR A1 1 246 ? -14.633 5.876 -32.819 1.0 16.05 236 A 1 -ATOM 4156 H H . THR A1 1 246 ? -14.243 3.008 -34.483 1.0 22.27 236 A 1 -ATOM 4157 H HA . THR A1 1 246 ? -15.072 5.341 -35.505 1.0 20.65 236 A 1 -ATOM 4158 H HB . THR A1 1 246 ? -13.52 6.574 -34.356 1.0 21.01 236 A 1 -ATOM 4159 H HG1 . THR A1 1 246 ? -12.58 4.294 -33.327 1.0 20.99 236 A 1 -ATOM 4160 H HG21 . THR A1 1 246 ? -14.192 6.398 -32.131 1.0 19.26 236 A 1 -ATOM 4161 H HG22 . THR A1 1 246 ? -15.437 6.34 -33.1 1.0 19.26 236 A 1 -ATOM 4162 H HG23 . THR A1 1 246 ? -14.88 5.013 -32.45 1.0 19.26 236 A 1 -ATOM 4163 N N . PRO A1 1 247 ? -12.846 5.631 -36.924 1.0 17.76 237 A 1 -ATOM 4164 C CA . PRO A1 1 247 ? -11.785 5.453 -37.897 1.0 18.52 237 A 1 -ATOM 4165 C C . PRO A1 1 247 ? -10.441 5.123 -37.324 1.0 17.62 237 A 1 -ATOM 4166 O O . PRO A1 1 247 ? -9.593 4.616 -38.052 1.0 18.86 237 A 1 -ATOM 4167 C CB . PRO A1 1 247 ? -11.772 6.789 -38.65 1.0 20.65 237 A 1 -ATOM 4168 C CG . PRO A1 1 247 ? -13.162 7.373 -38.462 1.0 19.0 237 A 1 -ATOM 4169 C CD . PRO A1 1 247 ? -13.526 6.943 -37.089 1.0 18.59 237 A 1 -ATOM 4170 H HA . PRO A1 1 247 ? -12.031 4.74 -38.507 1.0 22.22 237 A 1 -ATOM 4171 H HB2 . PRO A1 1 247 ? -11.098 7.373 -38.269 1.0 24.78 237 A 1 -ATOM 4172 H HB3 . PRO A1 1 247 ? -11.586 6.635 -39.589 1.0 24.78 237 A 1 -ATOM 4173 H HG2 . PRO A1 1 247 ? -13.135 8.34 -38.534 1.0 22.79 237 A 1 -ATOM 4174 H HG3 . PRO A1 1 247 ? -13.774 7.008 -39.121 1.0 22.79 237 A 1 -ATOM 4175 H HD2 . PRO A1 1 247 ? -13.202 7.581 -36.434 1.0 22.3 237 A 1 -ATOM 4176 H HD3 . PRO A1 1 247 ? -14.488 6.842 -37.006 1.0 22.3 237 A 1 -ATOM 4177 N N . LEU A1 1 248 ? -10.246 5.364 -36.04 1.0 17.12 238 A 1 -ATOM 4178 C CA . LEU A1 1 248 ? -8.978 5.094 -35.366 1.0 16.7 238 A 1 -ATOM 4179 C C . LEU A1 1 248 ? -8.944 3.743 -34.654 1.0 17.55 238 A 1 -ATOM 4180 O O . LEU A1 1 248 ? -8.006 3.485 -33.86 1.0 17.33 238 A 1 -ATOM 4181 C CB . LEU A1 1 248 ? -8.631 6.225 -34.429 1.0 16.52 238 A 1 -ATOM 4182 C CG . LEU A1 1 248 ? -8.634 7.625 -35.088 1.0 16.67 238 A 1 -ATOM 4183 C CD1 . LEU A1 1 248 ? -8.211 8.644 -34.073 1.0 17.58 238 A 1 -ATOM 4184 C CD2 . LEU A1 1 248 ? -7.797 7.677 -36.357 1.0 17.65 238 A 1 -ATOM 4185 H H . LEU A1 1 248 ? -10.846 5.694 -35.52 1.0 20.55 238 A 1 -ATOM 4186 H HA . LEU A1 1 248 ? -8.278 5.059 -36.037 1.0 20.04 238 A 1 -ATOM 4187 H HB2 . LEU A1 1 248 ? -9.279 6.238 -33.708 1.0 19.83 238 A 1 -ATOM 4188 H HB3 . LEU A1 1 248 ? -7.742 6.069 -34.074 1.0 19.83 238 A 1 -ATOM 4189 H HG . LEU A1 1 248 ? -9.533 7.841 -35.382 1.0 20.01 238 A 1 -ATOM 4190 H HD11 . LEU A1 1 248 ? -8.319 9.53 -34.452 1.0 21.09 238 A 1 -ATOM 4191 H HD12 . LEU A1 1 248 ? -8.766 8.551 -33.283 1.0 21.09 238 A 1 -ATOM 4192 H HD13 . LEU A1 1 248 ? -7.281 8.493 -33.844 1.0 21.09 238 A 1 -ATOM 4193 H HD21 . LEU A1 1 248 ? -7.714 8.6 -36.643 1.0 21.18 238 A 1 -ATOM 4194 H HD22 . LEU A1 1 248 ? -6.919 7.308 -36.172 1.0 21.18 238 A 1 -ATOM 4195 H HD23 . LEU A1 1 248 ? -8.236 7.155 -37.047 1.0 21.18 238 A 1 -ATOM 4196 N N . ALA A1 1 249 ? -9.899 2.868 -34.944 1.0 17.9 239 A 1 -ATOM 4197 C CA . ALA A1 1 249 ? -10.007 1.581 -34.245 1.0 18.72 239 A 1 -ATOM 4198 C C . ALA A1 1 249 ? -8.712 0.779 -34.179 1.0 18.96 239 A 1 -ATOM 4199 O O . ALA A1 1 249 ? -8.478 0.118 -33.169 1.0 19.36 239 A 1 -ATOM 4200 C CB . ALA A1 1 249 ? -11.066 0.713 -34.959 1.0 21.07 239 A 1 -ATOM 4201 H H . ALA A1 1 249 ? -10.504 2.989 -35.543 1.0 21.48 239 A 1 -ATOM 4202 H HA . ALA A1 1 249 ? -10.261 1.786 -33.332 1.0 22.47 239 A 1 -ATOM 4203 H HB1 . ALA A1 1 249 ? -11.122 -0.147 -34.515 1.0 25.29 239 A 1 -ATOM 4204 H HB2 . ALA A1 1 249 ? -11.925 1.163 -34.917 1.0 25.29 239 A 1 -ATOM 4205 H HB3 . ALA A1 1 249 ? -10.803 0.59 -35.885 1.0 25.29 239 A 1 -ATOM 4206 N N . ASN A1 1 250 ? -7.893 0.816 -35.201 1.0 19.63 240 A 1 -ATOM 4207 C CA . ASN A1 1 250 ? -6.754 -0.072 -35.315 1.0 19.81 240 A 1 -ATOM 4208 C C . ASN A1 1 250 ? -5.443 0.62 -34.967 1.0 18.45 240 A 1 -ATOM 4209 O O . ASN A1 1 250 ? -4.376 0.029 -35.141 1.0 20.87 240 A 1 -ATOM 4210 C CB . ASN A1 1 250 ? -6.724 -0.698 -36.7 1.0 21.13 240 A 1 -ATOM 4211 C CG . ASN A1 1 250 ? -7.967 -1.496 -36.98 1.0 38.32 240 A 1 -ATOM 4212 O OD1 . ASN A1 1 250 ? -8.429 -2.262 -36.131 1.0 38.14 240 A 1 -ATOM 4213 N ND2 . ASN A1 1 250 ? -8.534 -1.32 -38.167 1.0 45.1 240 A 1 -ATOM 4214 H H . ASN A1 1 250 ? -7.974 1.36 -35.862 1.0 23.55 240 A 1 -ATOM 4215 H HA . ASN A1 1 250 ? -6.849 -0.805 -34.687 1.0 23.77 240 A 1 -ATOM 4216 H HB2 . ASN A1 1 250 ? -6.657 0.004 -37.366 1.0 25.36 240 A 1 -ATOM 4217 H HB3 . ASN A1 1 250 ? -5.96 -1.292 -36.766 1.0 25.36 240 A 1 -ATOM 4218 H HD21 . ASN A1 1 250 ? -9.247 -1.754 -38.372 1.0 54.12 240 A 1 -ATOM 4219 H HD22 . ASN A1 1 250 ? -8.188 -0.77 -38.731 1.0 54.12 240 A 1 -ATOM 4220 N N . GLU A1 1 251 ? -5.508 1.844 -34.472 1.0 17.48 241 A 1 -ATOM 4221 C CA . GLU A1 1 251 ? -4.313 2.597 -34.114 1.0 17.72 241 A 1 -ATOM 4222 C C . GLU A1 1 251 ? -3.775 2.162 -32.745 1.0 16.8 241 A 1 -ATOM 4223 O O . GLU A1 1 251 ? -4.451 1.498 -31.95 1.0 18.35 241 A 1 -ATOM 4224 C CB . GLU A1 1 251 ? -4.607 4.108 -34.149 1.0 17.52 241 A 1 -ATOM 4225 C CG . GLU A1 1 251 ? -5.101 4.568 -35.531 1.0 20.62 241 A 1 -ATOM 4226 C CD . GLU A1 1 251 ? -4.025 4.5 -36.567 1.0 30.05 241 A 1 -ATOM 4227 O OE1 . GLU A1 1 251 ? -2.863 4.825 -36.284 1.0 25.86 241 A 1 -ATOM 4228 O OE2 . GLU A1 1 251 ? -4.354 4.143 -37.723 1.0 45.44 241 A 1 -ATOM 4229 H H . GLU A1 1 251 ? -6.242 2.27 -34.33 1.0 20.98 241 A 1 -ATOM 4230 H HA . GLU A1 1 251 ? -3.609 2.422 -34.758 1.0 21.26 241 A 1 -ATOM 4231 H HB2 . GLU A1 1 251 ? -5.294 4.313 -33.496 1.0 21.02 241 A 1 -ATOM 4232 H HB3 . GLU A1 1 251 ? -3.794 4.595 -33.939 1.0 21.02 241 A 1 -ATOM 4233 H HG2 . GLU A1 1 251 ? -5.831 3.996 -35.815 1.0 24.74 241 A 1 -ATOM 4234 H HG3 . GLU A1 1 251 ? -5.405 5.487 -35.471 1.0 24.74 241 A 1 -ATOM 4235 N N . LYS A1 1 252 ? -2.524 2.544 -32.488 1.0 16.9 242 A 1 -ATOM 4236 C CA . LYS A1 1 252 ? -1.917 2.232 -31.192 1.0 16.43 242 A 1 -ATOM 4237 C C . LYS A1 1 252 ? -2.642 2.952 -30.059 1.0 16.79 242 A 1 -ATOM 4238 O O . LYS A1 1 252 ? -3.082 4.098 -30.167 1.0 17.7 242 A 1 -ATOM 4239 C CB . LYS A1 1 252 ? -0.478 2.702 -31.189 1.0 16.72 242 A 1 -ATOM 4240 C CG . LYS A1 1 252 ? 0.429 1.903 -32.052 1.0 19.69 242 A 1 -ATOM 4241 C CD . LYS A1 1 252 ? 1.806 2.537 -32.04 1.0 22.35 242 A 1 -ATOM 4242 C CE . LYS A1 1 252 ? 2.862 1.655 -32.723 1.0 28.53 242 A 1 -ATOM 4243 N NZ . LYS A1 1 252 ? 4.186 2.361 -32.767 1.0 34.97 242 A 1 -ATOM 4244 H H . LYS A1 1 252 ? -2.017 2.975 -33.032 1.0 20.28 242 A 1 -ATOM 4245 H HA . LYS A1 1 252 ? -1.965 1.275 -31.047 1.0 19.71 242 A 1 -ATOM 4246 H HB2 . LYS A1 1 252 ? -0.45 3.618 -31.505 1.0 20.06 242 A 1 -ATOM 4247 H HB3 . LYS A1 1 252 ? -0.138 2.653 -30.282 1.0 20.06 242 A 1 -ATOM 4248 H HG2 . LYS A1 1 252 ? 0.496 0.996 -31.712 1.0 23.62 242 A 1 -ATOM 4249 H HG3 . LYS A1 1 252 ? 0.094 1.891 -32.962 1.0 23.62 242 A 1 -ATOM 4250 H HD2 . LYS A1 1 252 ? 1.77 3.384 -32.511 1.0 26.82 242 A 1 -ATOM 4251 H HD3 . LYS A1 1 252 ? 2.082 2.68 -31.121 1.0 26.82 242 A 1 -ATOM 4252 H HE2 . LYS A1 1 252 ? 2.968 0.829 -32.225 1.0 34.24 242 A 1 -ATOM 4253 H HE3 . LYS A1 1 252 ? 2.585 1.461 -33.632 1.0 34.24 242 A 1 -ATOM 4254 H HZ1 . LYS A1 1 252 ? 4.791 1.849 -33.172 1.0 41.96 242 A 1 -ATOM 4255 H HZ2 . LYS A1 1 252 ? 4.109 3.126 -33.216 1.0 41.96 242 A 1 -ATOM 4256 H HZ3 . LYS A1 1 252 ? 4.464 2.538 -31.941 1.0 41.96 242 A 1 -ATOM 4257 N N . LYS A1 1 253 ? -2.772 2.235 -28.945 1.0 16.27 243 A 1 -ATOM 4258 C CA . LYS A1 1 253 ? -3.218 2.835 -27.69 1.0 15.4 243 A 1 -ATOM 4259 C C . LYS A1 1 253 ? -2.126 3.736 -27.115 1.0 15.11 243 A 1 -ATOM 4260 O O . LYS A1 1 253 ? -0.943 3.455 -27.277 1.0 16.75 243 A 1 -ATOM 4261 C CB . LYS A1 1 253 ? -3.553 1.691 -26.72 1.0 17.63 243 A 1 -ATOM 4262 C CG . LYS A1 1 253 ? -4.25 2.125 -25.474 1.0 18.9 243 A 1 -ATOM 4263 C CD . LYS A1 1 253 ? -4.553 0.913 -24.513 1.0 23.8 243 A 1 -ATOM 4264 C CE . LYS A1 1 253 ? -5.422 -0.088 -25.169 1.0 25.12 243 A 1 -ATOM 4265 N NZ . LYS A1 1 253 ? -5.796 -1.205 -24.195 1.0 23.31 243 A 1 -ATOM 4266 H H . LYS A1 1 253 ? -2.607 1.393 -28.889 1.0 19.53 243 A 1 -ATOM 4267 H HA . LYS A1 1 253 ? -4.005 3.388 -27.816 1.0 18.48 243 A 1 -ATOM 4268 H HB2 . LYS A1 1 253 ? -4.131 1.059 -27.175 1.0 21.15 243 A 1 -ATOM 4269 H HB3 . LYS A1 1 253 ? -2.727 1.256 -26.458 1.0 21.15 243 A 1 -ATOM 4270 H HG2 . LYS A1 1 253 ? -3.688 2.756 -24.997 1.0 22.68 243 A 1 -ATOM 4271 H HG3 . LYS A1 1 253 ? -5.093 2.544 -25.709 1.0 22.68 243 A 1 -ATOM 4272 H HD2 . LYS A1 1 253 ? -3.72 0.481 -24.267 1.0 28.56 243 A 1 -ATOM 4273 H HD3 . LYS A1 1 253 ? -5.005 1.237 -23.718 1.0 28.56 243 A 1 -ATOM 4274 H HE2 . LYS A1 1 253 ? -6.237 0.341 -25.472 1.0 30.14 243 A 1 -ATOM 4275 H HE3 . LYS A1 1 253 ? -4.953 -0.48 -25.922 1.0 30.14 243 A 1 -ATOM 4276 H HZ1 . LYS A1 1 253 ? -6.328 -1.794 -24.597 1.0 27.98 243 A 1 -ATOM 4277 H HZ2 . LYS A1 1 253 ? -5.061 -1.623 -23.915 1.0 27.98 243 A 1 -ATOM 4278 H HZ3 . LYS A1 1 253 ? -6.221 -0.866 -23.49 1.0 27.98 243 A 1 -ATOM 4279 N N . GLY A1 1 254 ? -2.512 4.79 -26.427 1.0 15.31 244 A 1 -ATOM 4280 C CA . GLY A1 1 254 ? -1.524 5.622 -25.731 1.0 15.71 244 A 1 -ATOM 4281 C C . GLY A1 1 254 ? -0.825 4.861 -24.622 1.0 14.49 244 A 1 -ATOM 4282 O O . GLY A1 1 254 ? -1.372 3.906 -24.043 1.0 18.19 244 A 1 -ATOM 4283 H H . GLY A1 1 254 ? -3.327 5.053 -26.343 1.0 18.37 244 A 1 -ATOM 4284 H HA2 . GLY A1 1 254 ? -0.856 5.927 -26.364 1.0 18.85 244 A 1 -ATOM 4285 H HA3 . GLY A1 1 254 ? -1.967 6.393 -25.343 1.0 18.85 244 A 1 -ATOM 4286 N N . ASP A1 1 255 ? 0.398 5.252 -24.372 1.0 15.17 245 A 1 -ATOM 4287 C CA . ASP A1 1 255 ? 1.233 4.543 -23.409 1.0 14.38 245 A 1 -ATOM 4288 C C . ASP A1 1 255 ? 1.019 5.103 -22.0 1.0 16.17 245 A 1 -ATOM 4289 O O . ASP A1 1 255 ? 1.125 6.307 -21.769 1.0 15.44 245 A 1 -ATOM 4290 C CB . ASP A1 1 255 ? 2.679 4.727 -23.805 1.0 16.68 245 A 1 -ATOM 4291 C CG . ASP A1 1 255 ? 3.634 3.93 -22.931 1.0 20.07 245 A 1 -ATOM 4292 O OD1 . ASP A1 1 255 ? 3.683 2.674 -23.058 1.0 21.65 245 A 1 -ATOM 4293 O OD2 . ASP A1 1 255 ? 4.324 4.589 -22.096 1.0 20.45 245 A 1 -ATOM 4294 H H . ASP A1 1 255 ? 0.778 5.928 -24.744 1.0 18.2 245 A 1 -ATOM 4295 H HA . ASP A1 1 255 ? 1.0 3.601 -23.395 1.0 17.26 245 A 1 -ATOM 4296 H HB2 . ASP A1 1 255 ? 2.796 4.433 -24.722 1.0 20.01 245 A 1 -ATOM 4297 H HB3 . ASP A1 1 255 ? 2.912 5.665 -23.725 1.0 20.01 245 A 1 -ATOM 4298 N N . PHE A1 1 256 ? 0.753 4.218 -21.038 1.0 15.31 246 A 1 -ATOM 4299 C CA . PHE A1 1 256 ? 0.506 4.644 -19.661 1.0 14.17 246 A 1 -ATOM 4300 C C . PHE A1 1 256 ? 1.694 5.378 -19.055 1.0 14.67 246 A 1 -ATOM 4301 O O . PHE A1 1 256 ? 1.531 6.459 -18.46 1.0 14.5 246 A 1 -ATOM 4302 C CB . PHE A1 1 256 ? 0.12 3.437 -18.816 1.0 15.82 246 A 1 -ATOM 4303 C CG . PHE A1 1 256 ? -0.117 3.779 -17.373 1.0 15.26 246 A 1 -ATOM 4304 C CD1 . PHE A1 1 256 ? -1.219 4.459 -17.007 1.0 16.33 246 A 1 -ATOM 4305 C CD2 . PHE A1 1 256 ? 0.787 3.434 -16.387 1.0 17.92 246 A 1 -ATOM 4306 C CE1 . PHE A1 1 256 ? -1.493 4.733 -15.647 1.0 17.91 246 A 1 -ATOM 4307 C CE2 . PHE A1 1 256 ? 0.547 3.681 -15.037 1.0 17.32 246 A 1 -ATOM 4308 C CZ . PHE A1 1 256 ? -0.574 4.371 -14.682 1.0 17.21 246 A 1 -ATOM 4309 H H . PHE A1 1 256 ? 0.71 3.368 -21.156 1.0 18.37 246 A 1 -ATOM 4310 H HA . PHE A1 1 256 ? -0.234 5.271 -19.664 1.0 17.01 246 A 1 -ATOM 4311 H HB2 . PHE A1 1 256 ? -0.697 3.053 -19.17 1.0 18.98 246 A 1 -ATOM 4312 H HB3 . PHE A1 1 256 ? 0.837 2.784 -18.854 1.0 18.98 246 A 1 -ATOM 4313 H HD1 . PHE A1 1 256 ? -1.812 4.754 -17.66 1.0 19.6 246 A 1 -ATOM 4314 H HD2 . PHE A1 1 256 ? 1.584 3.022 -16.633 1.0 21.5 246 A 1 -ATOM 4315 H HE1 . PHE A1 1 256 ? -2.286 5.154 -15.404 1.0 21.49 246 A 1 -ATOM 4316 H HE2 . PHE A1 1 256 ? 1.142 3.381 -14.388 1.0 20.78 246 A 1 -ATOM 4317 H HZ . PHE A1 1 256 ? -0.72 4.597 -13.792 1.0 20.65 246 A 1 -ATOM 4318 N N . THR A1 1 257 ? 2.889 4.834 -19.183 1.0 15.69 247 A 1 -ATOM 4319 C CA . THR A1 1 257 ? 4.035 5.488 -18.551 1.0 14.95 247 A 1 -ATOM 4320 C C . THR A1 1 257 ? 4.276 6.867 -19.123 1.0 15.91 247 A 1 -ATOM 4321 O O . THR A1 1 257 ? 4.545 7.821 -18.378 1.0 15.14 247 A 1 -ATOM 4322 C CB . THR A1 1 257 ? 5.261 4.599 -18.665 1.0 16.91 247 A 1 -ATOM 4323 O OG1 . THR A1 1 257 ? 4.986 3.369 -17.977 1.0 20.37 247 A 1 -ATOM 4324 C CG2 . THR A1 1 257 ? 6.48 5.236 -18.01 1.0 20.05 247 A 1 -ATOM 4325 H H . THR A1 1 257 ? 3.066 4.111 -19.614 1.0 18.83 247 A 1 -ATOM 4326 H HA . THR A1 1 257 ? 3.85 5.608 -17.607 1.0 17.94 247 A 1 -ATOM 4327 H HB . THR A1 1 257 ? 5.463 4.452 -19.603 1.0 20.3 247 A 1 -ATOM 4328 H HG1 . THR A1 1 257 ? 4.304 3.003 -18.304 1.0 24.44 247 A 1 -ATOM 4329 H HG21 . THR A1 1 257 ? 7.206 4.594 -17.965 1.0 24.06 247 A 1 -ATOM 4330 H HG22 . THR A1 1 257 ? 6.771 6.004 -18.527 1.0 24.06 247 A 1 -ATOM 4331 H HG23 . THR A1 1 257 ? 6.26 5.527 -17.111 1.0 24.06 247 A 1 -ATOM 4332 N N . LEU A1 1 258 ? 4.24 6.997 -20.457 1.0 15.0 248 A 1 -ATOM 4333 C CA . LEU A1 1 258 ? 4.396 8.313 -21.073 1.0 14.64 248 A 1 -ATOM 4334 C C . LEU A1 1 258 ? 3.337 9.274 -20.57 1.0 14.41 248 A 1 -ATOM 4335 O O . LEU A1 1 258 ? 3.629 10.455 -20.309 1.0 14.18 248 A 1 -ATOM 4336 C CB . LEU A1 1 258 ? 4.36 8.147 -22.599 1.0 16.17 248 A 1 -ATOM 4337 C CG . LEU A1 1 258 ? 4.684 9.407 -23.355 1.0 17.56 248 A 1 -ATOM 4338 C CD1 . LEU A1 1 258 ? 6.05 9.908 -23.067 1.0 19.07 248 A 1 -ATOM 4339 C CD2 . LEU A1 1 258 ? 4.542 9.074 -24.869 1.0 18.55 248 A 1 -ATOM 4340 H H . LEU A1 1 258 ? 4.13 6.35 -21.013 1.0 18.0 248 A 1 -ATOM 4341 H HA . LEU A1 1 258 ? 5.253 8.702 -20.839 1.0 17.57 248 A 1 -ATOM 4342 H HB2 . LEU A1 1 258 ? 5.01 7.473 -22.853 1.0 19.41 248 A 1 -ATOM 4343 H HB3 . LEU A1 1 258 ? 3.47 7.864 -22.86 1.0 19.41 248 A 1 -ATOM 4344 H HG . LEU A1 1 258 ? 4.081 10.118 -23.089 1.0 21.07 248 A 1 -ATOM 4345 H HD11 . LEU A1 1 258 ? 6.272 10.605 -23.704 1.0 22.89 248 A 1 -ATOM 4346 H HD12 . LEU A1 1 258 ? 6.071 10.265 -22.165 1.0 22.89 248 A 1 -ATOM 4347 H HD13 . LEU A1 1 258 ? 6.679 9.174 -23.147 1.0 22.89 248 A 1 -ATOM 4348 H HD21 . LEU A1 1 258 ? 4.799 9.852 -25.388 1.0 22.25 248 A 1 -ATOM 4349 H HD22 . LEU A1 1 258 ? 5.121 8.326 -25.083 1.0 22.25 248 A 1 -ATOM 4350 H HD23 . LEU A1 1 258 ? 3.619 8.842 -25.056 1.0 22.25 248 A 1 -ATOM 4351 N N . THR A1 1 259 ? 2.102 8.812 -20.442 1.0 13.96 249 A 1 -ATOM 4352 C CA . THR A1 1 259 ? 1.031 9.684 -19.949 1.0 13.04 249 A 1 -ATOM 4353 C C . THR A1 1 259 ? 1.303 10.106 -18.509 1.0 13.95 249 A 1 -ATOM 4354 O O . THR A1 1 259 ? 1.063 11.266 -18.131 1.0 14.18 249 A 1 -ATOM 4355 C CB . THR A1 1 259 ? -0.342 8.976 -20.088 1.0 13.73 249 A 1 -ATOM 4356 O OG1 . THR A1 1 259 ? -0.531 8.523 -21.444 1.0 15.0 249 A 1 -ATOM 4357 C CG2 . THR A1 1 259 ? -1.469 9.903 -19.759 1.0 14.37 249 A 1 -ATOM 4358 H H . THR A1 1 259 ? 1.853 8.01 -20.63 1.0 16.76 249 A 1 -ATOM 4359 H HA . THR A1 1 259 ? 0.992 10.487 -20.491 1.0 15.64 249 A 1 -ATOM 4360 H HB . THR A1 1 259 ? -0.356 8.227 -19.473 1.0 16.48 249 A 1 -ATOM 4361 H HG1 . THR A1 1 259 ? 0.049 7.948 -21.639 1.0 18.0 249 A 1 -ATOM 4362 H HG21 . THR A1 1 259 ? -2.318 9.472 -19.944 1.0 17.25 249 A 1 -ATOM 4363 H HG22 . THR A1 1 259 ? -1.436 10.145 -18.82 1.0 17.25 249 A 1 -ATOM 4364 H HG23 . THR A1 1 259 ? -1.402 10.71 -20.294 1.0 17.25 249 A 1 -ATOM 4365 N N . LEU A1 1 260 ? 1.734 9.169 -17.68 1.0 13.29 250 A 1 -ATOM 4366 C CA A LEU A1 1 260 ? 2.094 9.497 -16.299 0.46 14.02 250 A 1 -ATOM 4367 C CA B LEU A1 1 260 ? 2.076 9.497 -16.304 0.54 13.26 250 A 1 -ATOM 4368 C C . LEU A1 1 260 ? 3.189 10.542 -16.251 1.0 13.6 250 A 1 -ATOM 4369 O O . LEU A1 1 260 ? 3.176 11.455 -15.417 1.0 13.82 250 A 1 -ATOM 4370 C CB A LEU A1 1 260 ? 2.632 8.28 -15.556 0.46 16.59 250 A 1 -ATOM 4371 C CB B LEU A1 1 260 ? 2.458 8.188 -15.628 0.54 14.93 250 A 1 -ATOM 4372 C CG A LEU A1 1 260 ? 1.723 7.31 -14.88 0.46 14.58 250 A 1 -ATOM 4373 C CG B LEU A1 1 260 ? 2.6 8.152 -14.155 0.54 13.51 250 A 1 -ATOM 4374 C CD1 A LEU A1 1 260 ? 2.632 6.372 -14.11 0.46 18.44 250 A 1 -ATOM 4375 C CD1 B LEU A1 1 260 ? 1.315 8.519 -13.511 0.54 14.48 250 A 1 -ATOM 4376 C CD2 A LEU A1 1 260 ? 0.774 7.976 -13.882 0.46 13.41 250 A 1 -ATOM 4377 C CD2 B LEU A1 1 260 ? 3.002 6.735 -13.797 0.54 18.07 250 A 1 -ATOM 4378 H H A LEU A1 1 260 ? 1.829 8.339 -17.884 0.46 15.94 250 A 1 -ATOM 4379 H H B LEU A1 1 260 ? 1.837 8.34 -17.885 0.54 15.94 250 A 1 -ATOM 4380 H HA A LEU A1 1 260 ? 1.282 9.813 -15.872 0.46 16.82 250 A 1 -ATOM 4381 H HA B LEU A1 1 260 ? 1.33 9.889 -15.825 0.54 15.91 250 A 1 -ATOM 4382 H HB2 A LEU A1 1 260 ? 3.138 7.76 -16.2 0.46 19.91 250 A 1 -ATOM 4383 H HB2 B LEU A1 1 260 ? 1.777 7.536 -15.854 0.54 17.92 250 A 1 -ATOM 4384 H HB3 A LEU A1 1 260 ? 3.222 8.614 -14.863 0.46 19.91 250 A 1 -ATOM 4385 H HB3 B LEU A1 1 260 ? 3.314 7.913 -15.992 0.54 17.92 250 A 1 -ATOM 4386 H HG A LEU A1 1 260 ? 1.166 6.865 -15.538 0.46 17.49 250 A 1 -ATOM 4387 H HG B LEU A1 1 260 ? 3.264 8.783 -13.836 0.54 16.22 250 A 1 -ATOM 4388 H HD11 A LEU A1 1 260 ? 2.09 5.697 -13.672 0.46 22.12 250 A 1 -ATOM 4389 H HD11 B LEU A1 1 260 ? 1.368 8.318 -12.564 0.54 17.38 250 A 1 -ATOM 4390 H HD12 A LEU A1 1 260 ? 3.248 5.951 -14.729 0.46 22.12 250 A 1 -ATOM 4391 H HD12 B LEU A1 1 260 ? 1.157 9.467 -13.64 0.54 17.38 250 A 1 -ATOM 4392 H HD13 A LEU A1 1 260 ? 3.124 6.882 -13.448 0.46 22.12 250 A 1 -ATOM 4393 H HD13 B LEU A1 1 260 ? 0.6 8.006 -13.919 0.54 17.38 250 A 1 -ATOM 4394 H HD21 A LEU A1 1 260 ? 0.243 7.292 -13.446 0.46 16.09 250 A 1 -ATOM 4395 H HD21 B LEU A1 1 260 ? 2.955 6.627 -12.835 0.54 21.69 250 A 1 -ATOM 4396 H HD22 A LEU A1 1 260 ? 1.297 8.459 -13.223 0.46 16.09 250 A 1 -ATOM 4397 H HD22 B LEU A1 1 260 ? 2.393 6.116 -14.23 0.54 21.69 250 A 1 -ATOM 4398 H HD23 A LEU A1 1 260 ? 0.195 8.591 -14.359 0.46 16.09 250 A 1 -ATOM 4399 H HD23 B LEU A1 1 260 ? 3.908 6.577 -14.105 0.54 21.69 250 A 1 -ATOM 4400 N N . LYS A1 1 261 ? 4.175 10.462 -17.161 1.0 13.56 251 A 1 -ATOM 4401 C CA . LYS A1 1 261 ? 5.223 11.451 -17.199 1.0 14.31 251 A 1 -ATOM 4402 C C . LYS A1 1 261 ? 4.682 12.817 -17.615 1.0 13.64 251 A 1 -ATOM 4403 O O . LYS A1 1 261 ? 5.168 13.86 -17.144 1.0 15.12 251 A 1 -ATOM 4404 C CB . LYS A1 1 261 ? 6.342 10.959 -18.133 1.0 15.02 251 A 1 -ATOM 4405 C CG . LYS A1 1 261 ? 7.073 9.762 -17.552 1.0 15.81 251 A 1 -ATOM 4406 C CD . LYS A1 1 261 ? 8.047 9.12 -18.498 1.0 20.88 251 A 1 -ATOM 4407 C CE . LYS A1 1 261 ? 9.182 10.024 -18.769 1.0 20.88 251 A 1 -ATOM 4408 N NZ . LYS A1 1 261 ? 10.314 9.281 -19.448 1.0 19.32 251 A 1 -ATOM 4409 H H . LYS A1 1 261 ? 4.247 9.844 -17.755 1.0 16.27 251 A 1 -ATOM 4410 H HA . LYS A1 1 261 ? 5.611 11.565 -16.318 1.0 17.18 251 A 1 -ATOM 4411 H HB2 . LYS A1 1 261 ? 5.956 10.698 -18.983 1.0 18.03 251 A 1 -ATOM 4412 H HB3 . LYS A1 1 261 ? 6.984 11.674 -18.265 1.0 18.03 251 A 1 -ATOM 4413 H HG2 . LYS A1 1 261 ? 7.569 10.05 -16.77 1.0 18.98 251 A 1 -ATOM 4414 H HG3 . LYS A1 1 261 ? 6.42 9.09 -17.302 1.0 18.98 251 A 1 -ATOM 4415 H HD2 . LYS A1 1 261 ? 8.391 8.303 -18.106 1.0 25.06 251 A 1 -ATOM 4416 H HD3 . LYS A1 1 261 ? 7.602 8.924 -19.338 1.0 25.06 251 A 1 -ATOM 4417 H HE2 . LYS A1 1 261 ? 8.892 10.742 -19.353 1.0 25.06 251 A 1 -ATOM 4418 H HE3 . LYS A1 1 261 ? 9.511 10.389 -17.933 1.0 25.06 251 A 1 -ATOM 4419 H HZ1 . LYS A1 1 261 ? 10.987 9.839 -19.616 1.0 23.19 251 A 1 -ATOM 4420 H HZ2 . LYS A1 1 261 ? 10.606 8.625 -18.922 1.0 23.19 251 A 1 -ATOM 4421 H HZ3 . LYS A1 1 261 ? 10.031 8.931 -20.216 1.0 23.19 251 A 1 -ATOM 4422 N N . MET A1 1 262 ? 3.683 12.837 -18.483 1.0 13.93 252 A 1 -ATOM 4423 C CA . MET A1 1 262 ? 3.015 14.096 -18.825 1.0 13.87 252 A 1 -ATOM 4424 C C . MET A1 1 262 ? 2.304 14.695 -17.617 1.0 14.71 252 A 1 -ATOM 4425 O O . MET A1 1 262 ? 2.336 15.924 -17.432 1.0 14.43 252 A 1 -ATOM 4426 C CB . MET A1 1 262 ? 2.059 13.849 -20.0 1.0 13.79 252 A 1 -ATOM 4427 C CG . MET A1 1 262 ? 2.76 13.679 -21.33 1.0 14.53 252 A 1 -ATOM 4428 S SD . MET A1 1 262 ? 3.473 15.192 -21.987 1.0 15.0 252 A 1 -ATOM 4429 C CE . MET A1 1 262 ? 2.023 16.098 -22.437 1.0 16.03 252 A 1 -ATOM 4430 H H . MET A1 1 262 ? 3.37 12.146 -18.888 1.0 16.72 252 A 1 -ATOM 4431 H HA . MET A1 1 262 ? 3.672 14.747 -19.117 1.0 16.65 252 A 1 -ATOM 4432 H HB2 . MET A1 1 262 ? 1.553 13.04 -19.827 1.0 16.55 252 A 1 -ATOM 4433 H HB3 . MET A1 1 262 ? 1.457 14.606 -20.078 1.0 16.55 252 A 1 -ATOM 4434 H HG2 . MET A1 1 262 ? 3.48 13.038 -21.222 1.0 17.43 252 A 1 -ATOM 4435 H HG3 . MET A1 1 262 ? 2.119 13.351 -21.979 1.0 17.43 252 A 1 -ATOM 4436 H HE1 . MET A1 1 262 ? 2.288 16.919 -22.88 1.0 19.23 252 A 1 -ATOM 4437 H HE2 . MET A1 1 262 ? 1.485 15.557 -23.036 1.0 19.23 252 A 1 -ATOM 4438 H HE3 . MET A1 1 262 ? 1.518 16.304 -21.635 1.0 19.23 252 A 1 -ATOM 4439 N N . VAL A1 1 263 ? 1.604 13.87 -16.821 1.0 13.26 253 A 1 -ATOM 4440 C CA . VAL A1 1 263 ? 0.985 14.375 -15.58 1.0 13.81 253 A 1 -ATOM 4441 C C . VAL A1 1 263 ? 2.043 14.928 -14.643 1.0 13.49 253 A 1 -ATOM 4442 O O . VAL A1 1 263 ? 1.894 16.024 -14.087 1.0 13.56 253 A 1 -ATOM 4443 C CB . VAL A1 1 263 ? 0.188 13.242 -14.914 1.0 14.09 253 A 1 -ATOM 4444 C CG1 . VAL A1 1 263 ? -0.233 13.639 -13.49 1.0 14.35 253 A 1 -ATOM 4445 C CG2 . VAL A1 1 263 ? -1.034 12.875 -15.759 1.0 14.68 253 A 1 -ATOM 4446 H H . VAL A1 1 263 ? 1.475 13.033 -16.971 1.0 15.91 253 A 1 -ATOM 4447 H HA . VAL A1 1 263 ? 0.38 15.101 -15.799 1.0 16.57 253 A 1 -ATOM 4448 H HB . VAL A1 1 263 ? 0.755 12.458 -14.85 1.0 16.91 253 A 1 -ATOM 4449 H HG11 . VAL A1 1 263 ? -0.955 13.059 -13.201 1.0 17.21 253 A 1 -ATOM 4450 H HG12 . VAL A1 1 263 ? 0.528 13.541 -12.897 1.0 17.21 253 A 1 -ATOM 4451 H HG13 . VAL A1 1 263 ? -0.532 14.562 -13.495 1.0 17.21 253 A 1 -ATOM 4452 H HG21 . VAL A1 1 263 ? -1.513 12.152 -15.324 1.0 17.61 253 A 1 -ATOM 4453 H HG22 . VAL A1 1 263 ? -1.608 13.652 -15.839 1.0 17.61 253 A 1 -ATOM 4454 H HG23 . VAL A1 1 263 ? -0.736 12.592 -16.638 1.0 17.61 253 A 1 -ATOM 4455 N N . ALA A1 1 264 ? 3.128 14.189 -14.478 1.0 13.24 254 A 1 -ATOM 4456 C CA . ALA A1 1 264 ? 4.172 14.632 -13.558 1.0 13.89 254 A 1 -ATOM 4457 C C . ALA A1 1 264 ? 4.764 15.96 -14.026 1.0 14.5 254 A 1 -ATOM 4458 O O . ALA A1 1 264 ? 4.978 16.892 -13.219 1.0 14.29 254 A 1 -ATOM 4459 C CB . ALA A1 1 264 ? 5.255 13.573 -13.458 1.0 15.04 254 A 1 -ATOM 4460 H H . ALA A1 1 264 ? 3.285 13.442 -14.875 1.0 15.89 254 A 1 -ATOM 4461 H HA . ALA A1 1 264 ? 3.79 14.757 -12.675 1.0 16.67 254 A 1 -ATOM 4462 H HB1 . ALA A1 1 264 ? 5.94 13.878 -12.843 1.0 18.05 254 A 1 -ATOM 4463 H HB2 . ALA A1 1 264 ? 4.861 12.748 -13.132 1.0 18.05 254 A 1 -ATOM 4464 H HB3 . ALA A1 1 264 ? 5.639 13.431 -14.338 1.0 18.05 254 A 1 -ATOM 4465 N N . LEU A1 1 265 ? 5.112 16.062 -15.325 1.0 14.35 255 A 1 -ATOM 4466 C CA . LEU A1 1 265 ? 5.688 17.313 -15.832 1.0 14.21 255 A 1 -ATOM 4467 C C . LEU A1 1 265 ? 4.687 18.453 -15.748 1.0 14.12 255 A 1 -ATOM 4468 O O . LEU A1 1 265 ? 5.082 19.588 -15.47 1.0 15.27 255 A 1 -ATOM 4469 C CB . LEU A1 1 265 ? 6.222 17.101 -17.248 1.0 15.48 255 A 1 -ATOM 4470 C CG . LEU A1 1 265 ? 7.49 16.254 -17.29 1.0 15.3 255 A 1 -ATOM 4471 C CD1 . LEU A1 1 265 ? 7.711 15.739 -18.719 1.0 17.88 255 A 1 -ATOM 4472 C CD2 . LEU A1 1 265 ? 8.697 17.088 -16.824 1.0 16.75 255 A 1 -ATOM 4473 H H . LEU A1 1 265 ? 5.026 15.439 -15.911 1.0 17.23 255 A 1 -ATOM 4474 H HA . LEU A1 1 265 ? 6.449 17.574 -15.289 1.0 17.05 255 A 1 -ATOM 4475 H HB2 . LEU A1 1 265 ? 5.543 16.649 -17.774 1.0 18.57 255 A 1 -ATOM 4476 H HB3 . LEU A1 1 265 ? 6.425 17.964 -17.64 1.0 18.57 255 A 1 -ATOM 4477 H HG . LEU A1 1 265 ? 7.403 15.494 -16.694 1.0 18.36 255 A 1 -ATOM 4478 H HD11 . LEU A1 1 265 ? 8.523 15.209 -18.741 1.0 21.45 255 A 1 -ATOM 4479 H HD12 . LEU A1 1 265 ? 6.952 15.194 -18.978 1.0 21.45 255 A 1 -ATOM 4480 H HD13 . LEU A1 1 265 ? 7.793 16.497 -19.318 1.0 21.45 255 A 1 -ATOM 4481 H HD21 . LEU A1 1 265 ? 9.503 16.558 -16.921 1.0 20.1 255 A 1 -ATOM 4482 H HD22 . LEU A1 1 265 ? 8.758 17.887 -17.37 1.0 20.1 255 A 1 -ATOM 4483 H HD23 . LEU A1 1 265 ? 8.572 17.332 -15.893 1.0 20.1 255 A 1 -ATOM 4484 N N . THR A1 1 266 ? 3.412 18.175 -15.922 1.0 14.04 256 A 1 -ATOM 4485 C CA . THR A1 1 266 ? 2.374 19.211 -15.77 1.0 13.62 256 A 1 -ATOM 4486 C C . THR A1 1 266 ? 2.366 19.751 -14.346 1.0 14.93 256 A 1 -ATOM 4487 O O . THR A1 1 266 ? 2.328 20.959 -14.133 1.0 14.95 256 A 1 -ATOM 4488 C CB . THR A1 1 266 ? 0.998 18.698 -16.168 1.0 13.62 256 A 1 -ATOM 4489 O OG1 . THR A1 1 266 ? 1.018 18.419 -17.578 1.0 14.42 256 A 1 -ATOM 4490 C CG2 . THR A1 1 266 ? -0.05 19.773 -15.984 1.0 15.92 256 A 1 -ATOM 4491 H H . THR A1 1 266 ? 3.105 17.398 -16.128 1.0 16.85 256 A 1 -ATOM 4492 H HA . THR A1 1 266 ? 2.58 19.936 -16.38 1.0 16.34 256 A 1 -ATOM 4493 H HB . THR A1 1 266 ? 0.781 17.921 -15.629 1.0 16.34 256 A 1 -ATOM 4494 H HG1 . THR A1 1 266 ? 1.557 17.796 -17.74 1.0 17.31 256 A 1 -ATOM 4495 H HG21 . THR A1 1 266 ? -0.883 19.499 -16.4 1.0 19.11 256 A 1 -ATOM 4496 H HG22 . THR A1 1 266 ? -0.206 19.927 -15.039 1.0 19.11 256 A 1 -ATOM 4497 H HG23 . THR A1 1 266 ? 0.248 20.601 -16.393 1.0 19.11 256 A 1 -ATOM 4498 N N . ARG A1 1 267 ? 2.428 18.855 -13.343 1.0 13.97 257 A 1 -ATOM 4499 C CA . ARG A1 1 267 ? 2.498 19.321 -11.961 1.0 13.87 257 A 1 -ATOM 4500 C C . ARG A1 1 267 ? 3.753 20.138 -11.734 1.0 14.8 257 A 1 -ATOM 4501 O O . ARG A1 1 267 ? 3.712 21.161 -11.035 1.0 15.04 257 A 1 -ATOM 4502 C CB . ARG A1 1 267 ? 2.489 18.12 -11.028 1.0 14.28 257 A 1 -ATOM 4503 C CG . ARG A1 1 267 ? 2.825 18.442 -9.536 1.0 15.31 257 A 1 -ATOM 4504 C CD . ARG A1 1 267 ? 1.832 19.429 -8.87 1.0 14.48 257 A 1 -ATOM 4505 N NE . ARG A1 1 267 ? 0.525 18.827 -8.778 1.0 13.76 257 A 1 -ATOM 4506 C CZ . ARG A1 1 267 ? -0.638 19.473 -8.787 1.0 13.65 257 A 1 -ATOM 4507 N NH1 . ARG A1 1 267 ? -0.639 20.806 -8.699 1.0 14.84 257 A 1 -ATOM 4508 N NH2 . ARG A1 1 267 ? -1.791 18.808 -8.821 1.0 13.98 257 A 1 -ATOM 4509 H H . ARG A1 1 267 ? 2.431 18.0 -13.44 1.0 16.77 257 A 1 -ATOM 4510 H HA . ARG A1 1 267 ? 1.726 19.876 -11.767 1.0 16.64 257 A 1 -ATOM 4511 H HB2 . ARG A1 1 267 ? 1.604 17.723 -11.048 1.0 17.14 257 A 1 -ATOM 4512 H HB3 . ARG A1 1 267 ? 3.147 17.481 -11.343 1.0 17.14 257 A 1 -ATOM 4513 H HG2 . ARG A1 1 267 ? 2.807 17.617 -9.027 1.0 18.37 257 A 1 -ATOM 4514 H HG3 . ARG A1 1 267 ? 3.709 18.84 -9.494 1.0 18.37 257 A 1 -ATOM 4515 H HD2 . ARG A1 1 267 ? 2.138 19.647 -7.976 1.0 17.38 257 A 1 -ATOM 4516 H HD3 . ARG A1 1 267 ? 1.766 20.236 -9.404 1.0 17.38 257 A 1 -ATOM 4517 H HE . ARG A1 1 267 ? 0.494 17.97 -8.711 1.0 16.51 257 A 1 -ATOM 4518 H HH11 . ARG A1 1 267 ? 0.105 21.234 -8.638 1.0 17.81 257 A 1 -ATOM 4519 H HH12 . ARG A1 1 267 ? -1.383 21.237 -8.704 1.0 17.81 257 A 1 -ATOM 4520 H HH21 . ARG A1 1 267 ? -1.792 17.948 -8.838 1.0 16.78 257 A 1 -ATOM 4521 H HH22 . ARG A1 1 267 ? -2.536 19.239 -8.826 1.0 16.78 257 A 1 -ATOM 4522 N N . ILE A1 1 268 ? 4.902 19.687 -12.232 1.0 15.13 258 A 1 -ATOM 4523 C CA . ILE A1 1 268 ? 6.131 20.463 -12.053 1.0 16.24 258 A 1 -ATOM 4524 C C . ILE A1 1 268 ? 5.997 21.854 -12.673 1.0 17.21 258 A 1 -ATOM 4525 O O . ILE A1 1 268 ? 6.405 22.869 -12.077 1.0 17.81 258 A 1 -ATOM 4526 C CB . ILE A1 1 268 ? 7.312 19.658 -12.636 1.0 16.03 258 A 1 -ATOM 4527 C CG1 . ILE A1 1 268 ? 7.561 18.431 -11.768 1.0 17.52 258 A 1 -ATOM 4528 C CG2 . ILE A1 1 268 ? 8.602 20.509 -12.711 1.0 18.79 258 A 1 -ATOM 4529 C CD1 . ILE A1 1 268 ? 8.348 17.322 -12.435 1.0 18.43 258 A 1 -ATOM 4530 H H . ILE A1 1 268 ? 4.998 18.952 -12.667 1.0 18.15 258 A 1 -ATOM 4531 H HA . ILE A1 1 268 ? 6.294 20.605 -11.108 1.0 19.49 258 A 1 -ATOM 4532 H HB . ILE A1 1 268 ? 7.076 19.391 -13.538 1.0 19.24 258 A 1 -ATOM 4533 H HG12 . ILE A1 1 268 ? 8.057 18.707 -10.982 1.0 21.02 258 A 1 -ATOM 4534 H HG13 . ILE A1 1 268 ? 6.703 18.061 -11.506 1.0 21.02 258 A 1 -ATOM 4535 H HG21 . ILE A1 1 268 ? 9.355 19.926 -12.892 1.0 22.54 258 A 1 -ATOM 4536 H HG22 . ILE A1 1 268 ? 8.509 21.161 -13.424 1.0 22.54 258 A 1 -ATOM 4537 H HG23 . ILE A1 1 268 ? 8.731 20.963 -11.864 1.0 22.54 258 A 1 -ATOM 4538 H HD11 . ILE A1 1 268 ? 8.408 16.568 -11.827 1.0 22.12 258 A 1 -ATOM 4539 H HD12 . ILE A1 1 268 ? 7.892 17.056 -13.248 1.0 22.12 258 A 1 -ATOM 4540 H HD13 . ILE A1 1 268 ? 9.237 17.648 -12.646 1.0 22.12 258 A 1 -ATOM 4541 N N . LEU A1 1 269 ? 5.433 21.932 -13.886 1.0 16.05 259 A 1 -ATOM 4542 C CA . LEU A1 1 269 ? 5.29 23.21 -14.589 1.0 16.32 259 A 1 -ATOM 4543 C C . LEU A1 1 269 ? 4.254 24.122 -13.943 1.0 17.65 259 A 1 -ATOM 4544 O O . LEU A1 1 269 ? 4.425 25.359 -13.955 1.0 18.64 259 A 1 -ATOM 4545 C CB . LEU A1 1 269 ? 4.925 22.948 -16.04 1.0 17.71 259 A 1 -ATOM 4546 C CG . LEU A1 1 269 ? 6.033 22.365 -16.923 1.0 17.72 259 A 1 -ATOM 4547 C CD1 . LEU A1 1 269 ? 5.445 21.846 -18.221 1.0 21.07 259 A 1 -ATOM 4548 C CD2 . LEU A1 1 269 ? 7.041 23.408 -17.207 1.0 22.51 259 A 1 -ATOM 4549 H H . LEU A1 1 269 ? 5.126 21.258 -14.323 1.0 19.26 259 A 1 -ATOM 4550 H HA . LEU A1 1 269 ? 6.14 23.676 -14.557 1.0 19.58 259 A 1 -ATOM 4551 H HB2 . LEU A1 1 269 ? 4.186 22.32 -16.057 1.0 21.25 259 A 1 -ATOM 4552 H HB3 . LEU A1 1 269 ? 4.654 23.789 -16.44 1.0 21.25 259 A 1 -ATOM 4553 H HG . LEU A1 1 269 ? 6.464 21.627 -16.464 1.0 21.27 259 A 1 -ATOM 4554 H HD11 . LEU A1 1 269 ? 6.16 21.493 -18.773 1.0 25.28 259 A 1 -ATOM 4555 H HD12 . LEU A1 1 269 ? 4.806 21.145 -18.02 1.0 25.28 259 A 1 -ATOM 4556 H HD13 . LEU A1 1 269 ? 5.002 22.576 -18.681 1.0 25.28 259 A 1 -ATOM 4557 H HD21 . LEU A1 1 269 ? 7.708 23.047 -17.812 1.0 27.02 259 A 1 -ATOM 4558 H HD22 . LEU A1 1 269 ? 6.601 24.17 -17.616 1.0 27.02 259 A 1 -ATOM 4559 H HD23 . LEU A1 1 269 ? 7.46 23.677 -16.374 1.0 27.02 259 A 1 -ATOM 4560 N N . LEU A1 1 270 ? 3.195 23.54 -13.377 1.0 16.52 260 A 1 -ATOM 4561 C CA . LEU A1 1 270 ? 2.019 24.28 -12.871 1.0 17.56 260 A 1 -ATOM 4562 C C . LEU A1 1 270 ? 1.754 23.779 -11.456 1.0 15.42 260 A 1 -ATOM 4563 O O . LEU A1 1 270 ? 0.823 23.03 -11.205 1.0 15.49 260 A 1 -ATOM 4564 C CB . LEU A1 1 270 ? 0.792 24.032 -13.77 1.0 15.52 260 A 1 -ATOM 4565 C CG . LEU A1 1 270 ? 0.903 24.625 -15.181 1.0 17.5 260 A 1 -ATOM 4566 C CD1 . LEU A1 1 270 ? -0.326 24.214 -15.98 1.0 20.15 260 A 1 -ATOM 4567 C CD2 . LEU A1 1 270 ? 1.095 26.14 -15.168 1.0 20.99 260 A 1 -ATOM 4568 H H . LEU A1 1 270 ? 3.125 22.69 -13.267 1.0 19.82 260 A 1 -ATOM 4569 H HA . LEU A1 1 270 ? 2.203 25.233 -12.851 1.0 21.07 260 A 1 -ATOM 4570 H HB2 . LEU A1 1 270 ? 0.667 23.075 -13.863 1.0 18.62 260 A 1 -ATOM 4571 H HB3 . LEU A1 1 270 ? 0.015 24.428 -13.346 1.0 18.62 260 A 1 -ATOM 4572 H HG . LEU A1 1 270 ? 1.697 24.275 -15.615 1.0 21.0 260 A 1 -ATOM 4573 H HD11 . LEU A1 1 270 ? -0.261 24.586 -16.873 1.0 24.18 260 A 1 -ATOM 4574 H HD12 . LEU A1 1 270 ? -0.363 23.246 -16.027 1.0 24.18 260 A 1 -ATOM 4575 H HD13 . LEU A1 1 270 ? -1.119 24.554 -15.537 1.0 24.18 260 A 1 -ATOM 4576 H HD21 . LEU A1 1 270 ? 1.0 26.478 -16.072 1.0 25.19 260 A 1 -ATOM 4577 H HD22 . LEU A1 1 270 ? 0.423 26.539 -14.594 1.0 25.19 260 A 1 -ATOM 4578 H HD23 . LEU A1 1 270 ? 1.981 26.344 -14.83 1.0 25.19 260 A 1 -ATOM 4579 N N . PRO A1 1 271 ? 2.549 24.241 -10.494 1.0 15.88 261 A 1 -ATOM 4580 C CA . PRO A1 1 271 ? 2.541 23.61 -9.162 1.0 16.75 261 A 1 -ATOM 4581 C C . PRO A1 1 271 ? 1.273 23.665 -8.382 1.0 15.59 261 A 1 -ATOM 4582 O O . PRO A1 1 271 ? 1.025 22.774 -7.554 1.0 16.71 261 A 1 -ATOM 4583 C CB . PRO A1 1 271 ? 3.66 24.344 -8.405 1.0 16.95 261 A 1 -ATOM 4584 C CG . PRO A1 1 271 ? 4.611 24.736 -9.481 1.0 19.49 261 A 1 -ATOM 4585 C CD . PRO A1 1 271 ? 3.702 25.144 -10.626 1.0 18.06 261 A 1 -ATOM 4586 H HA . PRO A1 1 271 ? 2.761 22.676 -9.305 1.0 20.1 261 A 1 -ATOM 4587 H HB2 . PRO A1 1 271 ? 3.302 25.123 -7.95 1.0 20.34 261 A 1 -ATOM 4588 H HB3 . PRO A1 1 271 ? 4.078 23.748 -7.764 1.0 20.34 261 A 1 -ATOM 4589 H HG2 . PRO A1 1 271 ? 5.163 25.477 -9.188 1.0 23.39 261 A 1 -ATOM 4590 H HG3 . PRO A1 1 271 ? 5.17 23.982 -9.727 1.0 23.39 261 A 1 -ATOM 4591 H HD2 . PRO A1 1 271 ? 3.427 26.069 -10.532 1.0 21.67 261 A 1 -ATOM 4592 H HD3 . PRO A1 1 271 ? 4.145 25.014 -11.479 1.0 21.67 261 A 1 -ATOM 4593 N N . ASP A1 1 272 ? 0.449 24.68 -8.574 1.0 17.36 262 A 1 -ATOM 4594 C CA . ASP A1 1 272 ? -0.782 24.784 -7.796 1.0 17.2 262 A 1 -ATOM 4595 C C . ASP A1 1 272 ? -2.019 24.507 -8.639 1.0 18.55 262 A 1 -ATOM 4596 O O . ASP A1 1 272 ? -3.138 24.774 -8.223 1.0 16.96 262 A 1 -ATOM 4597 C CB . ASP A1 1 272 ? -0.827 26.066 -6.951 1.0 19.97 262 A 1 -ATOM 4598 C CG . ASP A1 1 272 ? -0.625 27.299 -7.75 1.0 21.56 262 A 1 -ATOM 4599 O OD1 . ASP A1 1 272 ? -0.97 27.272 -8.956 1.0 20.83 262 A 1 -ATOM 4600 O OD2 . ASP A1 1 272 ? -0.14 28.268 -7.168 1.0 21.98 262 A 1 -ATOM 4601 H H . ASP A1 1 272 ? 0.576 25.314 -9.141 1.0 20.83 262 A 1 -ATOM 4602 H HA . ASP A1 1 272 ? -0.792 24.091 -7.117 1.0 20.64 262 A 1 -ATOM 4603 H HB2 . ASP A1 1 272 ? -1.694 26.129 -6.52 1.0 23.97 262 A 1 -ATOM 4604 H HB3 . ASP A1 1 272 ? -0.126 26.027 -6.281 1.0 23.97 262 A 1 -ATOM 4605 N N . SER A1 1 273 ? -1.862 23.908 -9.817 1.0 15.44 263 A 1 -ATOM 4606 C CA . SER A1 1 273 ? -3.03 23.541 -10.638 1.0 15.24 263 A 1 -ATOM 4607 C C . SER A1 1 273 ? -3.768 22.331 -10.08 1.0 14.61 263 A 1 -ATOM 4608 O O . SER A1 1 273 ? -3.241 21.541 -9.285 1.0 15.13 263 A 1 -ATOM 4609 C CB . SER A1 1 273 ? -2.596 23.224 -12.068 1.0 15.9 263 A 1 -ATOM 4610 O OG . SER A1 1 273 ? -1.669 22.113 -12.132 1.0 18.77 263 A 1 -ATOM 4611 H H . SER A1 1 273 ? -1.103 23.704 -10.166 1.0 18.52 263 A 1 -ATOM 4612 H HA . SER A1 1 273 ? -3.642 24.294 -10.639 1.0 18.29 263 A 1 -ATOM 4613 H HB2 . SER A1 1 273 ? -3.384 22.999 -12.587 1.0 19.08 263 A 1 -ATOM 4614 H HB3 . SER A1 1 273 ? -2.165 24.009 -12.442 1.0 19.08 263 A 1 -ATOM 4615 H HG . SER A1 1 273 ? -0.968 22.3 -11.708 1.0 22.53 263 A 1 -ATOM 4616 N N . ASN A1 1 274 ? -5.001 22.185 -10.493 1.0 13.48 264 A 1 -ATOM 4617 C CA . ASN A1 1 274 ? -5.797 21.014 -10.194 1.0 13.35 264 A 1 -ATOM 4618 C C . ASN A1 1 274 ? -5.662 20.005 -11.318 1.0 13.33 264 A 1 -ATOM 4619 O O . ASN A1 1 274 ? -5.957 20.312 -12.478 1.0 14.59 264 A 1 -ATOM 4620 C CB . ASN A1 1 274 ? -7.253 21.39 -9.955 1.0 13.83 264 A 1 -ATOM 4621 C CG . ASN A1 1 274 ? -7.478 21.941 -8.583 1.0 14.04 264 A 1 -ATOM 4622 O OD1 . ASN A1 1 274 ? -6.833 21.52 -7.615 1.0 15.23 264 A 1 -ATOM 4623 N ND2 . ASN A1 1 274 ? -8.408 22.881 -8.473 1.0 16.21 264 A 1 -ATOM 4624 H H . ASN A1 1 274 ? -5.419 22.769 -10.966 1.0 16.18 264 A 1 -ATOM 4625 H HA . ASN A1 1 274 ? -5.464 20.599 -9.383 1.0 16.02 264 A 1 -ATOM 4626 H HB2 . ASN A1 1 274 ? -7.517 22.065 -10.599 1.0 16.59 264 A 1 -ATOM 4627 H HB3 . ASN A1 1 274 ? -7.807 20.6 -10.057 1.0 16.59 264 A 1 -ATOM 4628 H HD21 . ASN A1 1 274 ? -8.576 23.232 -7.705 1.0 19.46 264 A 1 -ATOM 4629 H HD22 . ASN A1 1 274 ? -8.842 23.14 -9.168 1.0 19.46 264 A 1 -ATOM 4630 N N . ILE A1 1 275 ? -5.185 18.819 -11.03 1.0 12.42 265 A 1 -ATOM 4631 C CA . ILE A1 1 275 ? -4.823 17.802 -12.017 1.0 12.2 265 A 1 -ATOM 4632 C C . ILE A1 1 275 ? -5.546 16.51 -11.678 1.0 12.56 265 A 1 -ATOM 4633 O O . ILE A1 1 275 ? -5.169 15.833 -10.706 1.0 13.06 265 A 1 -ATOM 4634 C CB . ILE A1 1 275 ? -3.33 17.593 -12.048 1.0 12.96 265 A 1 -ATOM 4635 C CG1 . ILE A1 1 275 ? -2.592 18.86 -12.41 1.0 14.75 265 A 1 -ATOM 4636 C CG2 . ILE A1 1 275 ? -2.972 16.505 -13.067 1.0 15.01 265 A 1 -ATOM 4637 C CD1 . ILE A1 1 275 ? -1.072 18.794 -12.379 1.0 15.24 265 A 1 -ATOM 4638 H H . ILE A1 1 275 ? -5.048 18.552 -10.225 1.0 14.91 265 A 1 -ATOM 4639 H HA . ILE A1 1 275 ? -5.115 18.092 -12.895 1.0 14.64 265 A 1 -ATOM 4640 H HB . ILE A1 1 275 ? -3.062 17.324 -11.156 1.0 15.55 265 A 1 -ATOM 4641 H HG12 . ILE A1 1 275 ? -2.848 19.11 -13.312 1.0 17.7 265 A 1 -ATOM 4642 H HG13 . ILE A1 1 275 ? -2.859 19.553 -11.786 1.0 17.7 265 A 1 -ATOM 4643 H HG21 . ILE A1 1 275 ? -2.006 16.449 -13.143 1.0 18.01 265 A 1 -ATOM 4644 H HG22 . ILE A1 1 275 ? -3.329 15.657 -12.762 1.0 18.01 265 A 1 -ATOM 4645 H HG23 . ILE A1 1 275 ? -3.359 16.737 -13.926 1.0 18.01 265 A 1 -ATOM 4646 H HD11 . ILE A1 1 275 ? -0.715 19.696 -12.406 1.0 18.28 265 A 1 -ATOM 4647 H HD12 . ILE A1 1 275 ? -0.791 18.352 -11.563 1.0 18.28 265 A 1 -ATOM 4648 H HD13 . ILE A1 1 275 ? -0.762 18.293 -13.15 1.0 18.28 265 A 1 -ATOM 4649 N N . PRO A1 1 276 ? -6.57 16.092 -12.409 1.0 12.3 266 A 1 -ATOM 4650 C CA . PRO A1 1 276 ? -7.219 14.814 -12.132 1.0 13.02 266 A 1 -ATOM 4651 C C . PRO A1 1 276 ? -6.368 13.626 -12.5 1.0 13.21 266 A 1 -ATOM 4652 O O . PRO A1 1 276 ? -5.577 13.651 -13.441 1.0 13.49 266 A 1 -ATOM 4653 C CB . PRO A1 1 276 ? -8.5 14.838 -12.954 1.0 14.14 266 A 1 -ATOM 4654 C CG . PRO A1 1 276 ? -8.188 15.795 -14.025 1.0 16.17 266 A 1 -ATOM 4655 C CD . PRO A1 1 276 ? -7.327 16.894 -13.375 1.0 13.75 266 A 1 -ATOM 4656 H HA . PRO A1 1 276 ? -7.44 14.774 -11.188 1.0 15.62 266 A 1 -ATOM 4657 H HB2 . PRO A1 1 276 ? -8.689 13.956 -13.311 1.0 16.96 266 A 1 -ATOM 4658 H HB3 . PRO A1 1 276 ? -9.244 15.143 -12.411 1.0 16.96 266 A 1 -ATOM 4659 H HG2 . PRO A1 1 276 ? -7.696 15.347 -14.73 1.0 19.41 266 A 1 -ATOM 4660 H HG3 . PRO A1 1 276 ? -9.01 16.168 -14.379 1.0 19.41 266 A 1 -ATOM 4661 H HD2 . PRO A1 1 276 ? -6.742 17.319 -14.022 1.0 16.5 266 A 1 -ATOM 4662 H HD3 . PRO A1 1 276 ? -7.874 17.562 -12.933 1.0 16.5 266 A 1 -ATOM 4663 N N . ALA A1 1 277 ? -6.585 12.539 -11.795 1.0 12.69 267 A 1 -ATOM 4664 C CA . ALA A1 1 277 ? -6.215 11.204 -12.226 1.0 11.97 267 A 1 -ATOM 4665 C C . ALA A1 1 277 ? -7.419 10.72 -13.015 1.0 12.43 267 A 1 -ATOM 4666 O O . ALA A1 1 277 ? -8.467 10.375 -12.44 1.0 13.7 267 A 1 -ATOM 4667 C CB . ALA A1 1 277 ? -5.963 10.325 -10.998 1.0 13.65 267 A 1 -ATOM 4668 H H . ALA A1 1 277 ? -6.964 12.544 -11.023 1.0 15.23 267 A 1 -ATOM 4669 H HA . ALA A1 1 277 ? -5.415 11.192 -12.774 1.0 14.37 267 A 1 -ATOM 4670 H HB1 . ALA A1 1 277 ? -5.711 9.436 -11.292 1.0 16.38 267 A 1 -ATOM 4671 H HB2 . ALA A1 1 277 ? -5.247 10.715 -10.472 1.0 16.38 267 A 1 -ATOM 4672 H HB3 . ALA A1 1 277 ? -6.775 10.281 -10.469 1.0 16.38 267 A 1 -ATOM 4673 N N . THR A1 1 278 ? -7.32 10.784 -14.353 1.0 12.91 268 A 1 -ATOM 4674 C CA . THR A1 1 278 ? -8.499 10.678 -15.205 1.0 12.95 268 A 1 -ATOM 4675 C C . THR A1 1 278 ? -9.029 9.252 -15.281 1.0 13.14 268 A 1 -ATOM 4676 O O . THR A1 1 278 ? -8.33 8.261 -15.088 1.0 13.18 268 A 1 -ATOM 4677 C CB . THR A1 1 278 ? -8.23 11.27 -16.591 1.0 13.72 268 A 1 -ATOM 4678 O OG1 . THR A1 1 278 ? -7.208 10.503 -17.195 1.0 14.72 268 A 1 -ATOM 4679 C CG2 A THR A1 1 278 ? -7.936 12.732 -16.527 1.0 14.33 268 A 1 -ATOM 4680 H H . THR A1 1 278 ? -6.582 10.888 -14.783 1.0 15.49 268 A 1 -ATOM 4681 H HA . THR A1 1 278 ? -9.214 11.202 -14.812 1.0 15.54 268 A 1 -ATOM 4682 H HB A THR A1 1 278 ? -9.017 11.224 -17.157 1.0 16.47 268 A 1 -ATOM 4683 H HG1 . THR A1 1 278 ? -6.983 10.85 -17.926 1.0 17.66 268 A 1 -ATOM 4684 H HG21 A THR A1 1 278 ? -8.334 13.184 -17.286 1.0 17.19 268 A 1 -ATOM 4685 H HG22 A THR A1 1 278 ? -8.3 13.108 -15.71 1.0 17.19 268 A 1 -ATOM 4686 H HG23 A THR A1 1 278 ? -6.977 12.878 -16.54 1.0 17.19 268 A 1 -ATOM 4687 N N . THR A1 1 279 ? -10.306 9.189 -15.712 1.0 13.77 269 A 1 -ATOM 4688 C CA . THR A1 1 279 ? -10.97 7.892 -15.956 1.0 14.71 269 A 1 -ATOM 4689 C C . THR A1 1 279 ? -10.146 7.031 -16.892 1.0 15.36 269 A 1 -ATOM 4690 O O . THR A1 1 279 ? -10.026 5.835 -16.695 1.0 15.99 269 A 1 -ATOM 4691 C CB . THR A1 1 279 ? -12.325 8.141 -16.621 1.0 16.27 269 A 1 -ATOM 4692 O OG1 . THR A1 1 279 ? -12.985 9.243 -16.025 1.0 16.63 269 A 1 -ATOM 4693 C CG2 . THR A1 1 279 ? -13.195 6.909 -16.56 1.0 18.38 269 A 1 -ATOM 4694 H H . THR A1 1 279 ? -10.803 9.874 -15.868 1.0 16.53 269 A 1 -ATOM 4695 H HA . THR A1 1 279 ? -11.088 7.436 -15.108 1.0 17.65 269 A 1 -ATOM 4696 H HB . THR A1 1 279 ? -12.176 8.351 -17.557 1.0 19.53 269 A 1 -ATOM 4697 H HG1 . THR A1 1 279 ? -13.782 9.278 -16.29 1.0 19.95 269 A 1 -ATOM 4698 H HG21 . THR A1 1 279 ? -14.063 7.095 -16.952 1.0 22.05 269 A 1 -ATOM 4699 H HG22 . THR A1 1 279 ? -12.778 6.183 -17.05 1.0 22.05 269 A 1 -ATOM 4700 H HG23 . THR A1 1 279 ? -13.319 6.635 -15.638 1.0 22.05 269 A 1 -ATOM 4701 N N . ALA A1 1 280 ? -9.55 7.633 -17.928 1.0 14.55 270 A 1 -ATOM 4702 C CA . ALA A1 1 280 ? -8.787 6.849 -18.891 1.0 15.65 270 A 1 -ATOM 4703 C C . ALA A1 1 280 ? -7.552 6.229 -18.275 1.0 16.81 270 A 1 -ATOM 4704 O O . ALA A1 1 280 ? -7.164 5.137 -18.647 1.0 16.53 270 A 1 -ATOM 4705 C CB . ALA A1 1 280 ? -8.468 7.765 -20.079 1.0 15.62 270 A 1 -ATOM 4706 H H . ALA A1 1 280 ? -9.574 8.477 -18.089 1.0 17.47 270 A 1 -ATOM 4707 H HA . ALA A1 1 280 ? -9.306 6.097 -19.217 1.0 18.78 270 A 1 -ATOM 4708 H HB1 . ALA A1 1 280 ? -7.966 7.262 -20.74 1.0 18.74 270 A 1 -ATOM 4709 H HB2 . ALA A1 1 280 ? -9.299 8.082 -20.466 1.0 18.74 270 A 1 -ATOM 4710 H HB3 . ALA A1 1 280 ? -7.941 8.517 -19.766 1.0 18.74 270 A 1 -ATOM 4711 N N . MET A1 1 281 ? -6.944 6.887 -17.29 1.0 15.76 271 A 1 -ATOM 4712 C CA . MET A1 1 281 ? -5.834 6.261 -16.569 1.0 15.39 271 A 1 -ATOM 4713 C C . MET A1 1 281 ? -6.272 5.049 -15.769 1.0 15.97 271 A 1 -ATOM 4714 O O . MET A1 1 281 ? -5.547 4.048 -15.692 1.0 18.64 271 A 1 -ATOM 4715 C CB . MET A1 1 281 ? -5.153 7.28 -15.638 1.0 15.63 271 A 1 -ATOM 4716 C CG . MET A1 1 281 ? -4.448 8.412 -16.331 1.0 17.55 271 A 1 -ATOM 4717 S SD . MET A1 1 281 ? -3.069 7.807 -17.359 1.0 16.67 271 A 1 -ATOM 4718 C CE . MET A1 1 281 ? -1.645 8.216 -16.337 1.0 16.3 271 A 1 -ATOM 4719 H H . MET A1 1 281 ? -7.149 7.679 -17.024 1.0 18.91 271 A 1 -ATOM 4720 H HA . MET A1 1 281 ? -5.189 5.974 -17.234 1.0 18.47 271 A 1 -ATOM 4721 H HB2 . MET A1 1 281 ? -5.831 7.67 -15.063 1.0 18.75 271 A 1 -ATOM 4722 H HB3 . MET A1 1 281 ? -4.493 6.813 -15.103 1.0 18.75 271 A 1 -ATOM 4723 H HG2 . MET A1 1 281 ? -5.076 8.878 -16.905 1.0 21.07 271 A 1 -ATOM 4724 H HG3 . MET A1 1 281 ? -4.09 9.022 -15.667 1.0 21.07 271 A 1 -ATOM 4725 H HE1 . MET A1 1 281 ? -0.838 7.918 -16.785 1.0 19.56 271 A 1 -ATOM 4726 H HE2 . MET A1 1 281 ? -1.616 9.176 -16.206 1.0 19.56 271 A 1 -ATOM 4727 H HE3 . MET A1 1 281 ? -1.733 7.768 -15.48 1.0 19.56 271 A 1 -ATOM 4728 N N . GLY A1 1 282 ? -7.483 5.109 -15.224 1.0 16.45 272 A 1 -ATOM 4729 C CA . GLY A1 1 282 ? -8.024 3.945 -14.527 1.0 17.01 272 A 1 -ATOM 4730 C C . GLY A1 1 282 ? -8.476 2.835 -15.436 1.0 18.4 272 A 1 -ATOM 4731 O O . GLY A1 1 282 ? -8.555 1.675 -15.03 1.0 20.56 272 A 1 -ATOM 4732 H H . GLY A1 1 282 ? -8.001 5.795 -15.242 1.0 19.75 272 A 1 -ATOM 4733 H HA2 . GLY A1 1 282 ? -7.342 3.588 -13.937 1.0 20.41 272 A 1 -ATOM 4734 H HA3 . GLY A1 1 282 ? -8.787 4.224 -13.996 1.0 20.41 272 A 1 -ATOM 4735 N N . THR A1 1 283 ? -8.795 3.183 -16.676 1.0 17.17 273 A 1 -ATOM 4736 C CA . THR A1 1 283 ? -9.219 2.19 -17.66 1.0 16.82 273 A 1 -ATOM 4737 C C . THR A1 1 283 ? -8.025 1.422 -18.183 1.0 19.02 273 A 1 -ATOM 4738 O O . THR A1 1 283 ? -8.078 0.201 -18.341 1.0 21.4 273 A 1 -ATOM 4739 C CB . THR A1 1 283 ? -9.925 2.91 -18.803 1.0 16.62 273 A 1 -ATOM 4740 O OG1 . THR A1 1 283 ? -11.087 3.569 -18.318 1.0 18.85 273 A 1 -ATOM 4741 C CG2 . THR A1 1 283 ? -10.329 1.963 -19.891 1.0 18.97 273 A 1 -ATOM 4742 H H . THR A1 1 283 ? -8.776 3.989 -16.976 1.0 20.61 273 A 1 -ATOM 4743 H HA . THR A1 1 283 ? -9.837 1.558 -17.26 1.0 20.19 273 A 1 -ATOM 4744 H HB . THR A1 1 283 ? -9.308 3.557 -19.179 1.0 19.94 273 A 1 -ATOM 4745 H HG1 . THR A1 1 283 ? -10.872 4.148 -17.75 1.0 22.62 273 A 1 -ATOM 4746 H HG21 . THR A1 1 283 ? -10.953 2.397 -20.494 1.0 22.76 273 A 1 -ATOM 4747 H HG22 . THR A1 1 283 ? -9.549 1.683 -20.394 1.0 22.76 273 A 1 -ATOM 4748 H HG23 . THR A1 1 283 ? -10.754 1.18 -19.508 1.0 22.76 273 A 1 -ATOM 4749 N N . ILE A1 1 284 ? -6.925 2.108 -18.44 1.0 18.39 274 A 1 -ATOM 4750 C CA . ILE A1 1 284 ? -5.809 1.475 -19.127 1.0 19.59 274 A 1 -ATOM 4751 C C . ILE A1 1 284 ? -5.02 0.531 -18.257 1.0 18.37 274 A 1 -ATOM 4752 O O . ILE A1 1 284 ? -4.469 -0.461 -18.754 1.0 21.77 274 A 1 -ATOM 4753 C CB . ILE A1 1 284 ? -4.92 2.544 -19.81 1.0 19.92 274 A 1 -ATOM 4754 C CG1 . ILE A1 1 284 ? -3.993 1.922 -20.824 1.0 21.16 274 A 1 -ATOM 4755 C CG2 . ILE A1 1 284 ? -4.126 3.351 -18.818 1.0 19.22 274 A 1 -ATOM 4756 C CD1 . ILE A1 1 284 ? -3.238 2.961 -21.651 1.0 24.07 274 A 1 -ATOM 4757 H H . ILE A1 1 284 ? -6.797 2.932 -18.23 1.0 22.06 274 A 1 -ATOM 4758 H HA . ILE A1 1 284 ? -6.186 0.914 -19.822 1.0 23.51 274 A 1 -ATOM 4759 H HB . ILE A1 1 284 ? -5.528 3.146 -20.266 1.0 23.91 274 A 1 -ATOM 4760 H HG12 . ILE A1 1 284 ? -3.339 1.375 -20.36 1.0 25.4 274 A 1 -ATOM 4761 H HG13 . ILE A1 1 284 ? -4.512 1.374 -21.432 1.0 25.4 274 A 1 -ATOM 4762 H HG21 . ILE A1 1 284 ? -3.789 4.147 -19.257 1.0 23.06 274 A 1 -ATOM 4763 H HG22 . ILE A1 1 284 ? -4.703 3.599 -18.079 1.0 23.06 274 A 1 -ATOM 4764 H HG23 . ILE A1 1 284 ? -3.386 2.814 -18.494 1.0 23.06 274 A 1 -ATOM 4765 H HD11 . ILE A1 1 284 ? -2.759 2.511 -22.365 1.0 28.88 274 A 1 -ATOM 4766 H HD12 . ILE A1 1 284 ? -3.874 3.59 -22.026 1.0 28.88 274 A 1 -ATOM 4767 H HD13 . ILE A1 1 284 ? -2.611 3.428 -21.076 1.0 28.88 274 A 1 -ATOM 4768 N N . VAL A1 1 285 ? -4.88 0.779 -16.956 1.0 17.22 275 A 1 -ATOM 4769 C CA . VAL A1 1 285 ? -4.087 -0.03 -16.051 1.0 17.72 275 A 1 -ATOM 4770 C C . VAL A1 1 285 ? -4.913 -0.22 -14.789 1.0 17.65 275 A 1 -ATOM 4771 O O . VAL A1 1 285 ? -5.488 0.773 -14.277 1.0 17.53 275 A 1 -ATOM 4772 C CB . VAL A1 1 285 ? -2.771 0.685 -15.701 1.0 18.41 275 A 1 -ATOM 4773 C CG1 . VAL A1 1 285 ? -2.102 0.093 -14.477 1.0 25.1 275 A 1 -ATOM 4774 C CG2 . VAL A1 1 285 ? -1.83 0.615 -16.913 1.0 22.38 275 A 1 -ATOM 4775 H H . VAL A1 1 285 ? -5.255 1.444 -16.561 1.0 20.66 275 A 1 -ATOM 4776 H HA . VAL A1 1 285 ? -3.886 -0.888 -16.457 1.0 21.26 275 A 1 -ATOM 4777 H HB . VAL A1 1 285 ? -2.969 1.61 -15.485 1.0 22.09 275 A 1 -ATOM 4778 H HG11 . VAL A1 1 285 ? -1.174 0.374 -14.458 1.0 30.12 275 A 1 -ATOM 4779 H HG12 . VAL A1 1 285 ? -2.56 0.409 -13.682 1.0 30.12 275 A 1 -ATOM 4780 H HG13 . VAL A1 1 285 ? -2.153 -0.874 -14.526 1.0 30.12 275 A 1 -ATOM 4781 H HG21 . VAL A1 1 285 ? -1.016 1.101 -16.71 1.0 26.86 275 A 1 -ATOM 4782 H HG22 . VAL A1 1 285 ? -1.622 -0.314 -17.099 1.0 26.86 275 A 1 -ATOM 4783 H HG23 . VAL A1 1 285 ? -2.271 1.014 -17.679 1.0 26.86 275 A 1 -ATOM 4784 N N . PRO A1 1 286 ? -4.981 -1.429 -14.225 1.0 16.97 276 A 1 -ATOM 4785 C CA . PRO A1 1 286 ? -5.651 -1.585 -12.928 1.0 18.17 276 A 1 -ATOM 4786 C C . PRO A1 1 286 ? -4.927 -0.816 -11.844 1.0 19.02 276 A 1 -ATOM 4787 O O . PRO A1 1 286 ? -3.734 -0.981 -11.665 1.0 23.02 276 A 1 -ATOM 4788 C CB . PRO A1 1 286 ? -5.608 -3.107 -12.683 1.0 21.38 276 A 1 -ATOM 4789 C CG . PRO A1 1 286 ? -5.284 -3.711 -13.989 1.0 24.09 276 A 1 -ATOM 4790 C CD . PRO A1 1 286 ? -4.459 -2.724 -14.731 1.0 18.15 276 A 1 -ATOM 4791 H HA . PRO A1 1 286 ? -6.573 -1.29 -12.98 1.0 21.8 276 A 1 -ATOM 4792 H HB2 . PRO A1 1 286 ? -4.923 -3.314 -12.028 1.0 25.66 276 A 1 -ATOM 4793 H HB3 . PRO A1 1 286 ? -6.472 -3.412 -12.366 1.0 25.66 276 A 1 -ATOM 4794 H HG2 . PRO A1 1 286 ? -4.788 -4.533 -13.85 1.0 28.91 276 A 1 -ATOM 4795 H HG3 . PRO A1 1 286 ? -6.105 -3.897 -14.471 1.0 28.91 276 A 1 -ATOM 4796 H HD2 . PRO A1 1 286 ? -3.518 -2.827 -14.519 1.0 21.78 276 A 1 -ATOM 4797 H HD3 . PRO A1 1 286 ? -4.595 -2.805 -15.688 1.0 21.78 276 A 1 -ATOM 4798 N N . GLY A1 1 287 ? -5.652 0.048 -11.162 1.0 17.95 277 A 1 -ATOM 4799 C CA . GLY A1 1 287 ? -5.012 0.923 -10.206 1.0 18.93 277 A 1 -ATOM 4800 C C . GLY A1 1 287 ? -4.386 2.16 -10.8 1.0 15.41 277 A 1 -ATOM 4801 O O . GLY A1 1 287 ? -3.592 2.852 -10.158 1.0 17.62 277 A 1 -ATOM 4802 H H . GLY A1 1 287 ? -6.504 0.145 -11.233 1.0 21.54 277 A 1 -ATOM 4803 H HA2 . GLY A1 1 287 ? -5.673 1.209 -9.556 1.0 22.72 277 A 1 -ATOM 4804 H HA3 . GLY A1 1 287 ? -4.314 0.428 -9.751 1.0 22.72 277 A 1 -ATOM 4805 N N . GLY A1 1 288 ? -4.659 2.458 -12.065 1.0 15.63 278 A 1 -ATOM 4806 C CA . GLY A1 1 288 ? -4.02 3.559 -12.74 1.0 16.22 278 A 1 -ATOM 4807 C C . GLY A1 1 288 ? -4.262 4.906 -12.096 1.0 14.21 278 A 1 -ATOM 4808 O O . GLY A1 1 288 ? -3.377 5.749 -12.11 1.0 13.68 278 A 1 -ATOM 4809 H H . GLY A1 1 288 ? -5.219 2.029 -12.556 1.0 18.76 278 A 1 -ATOM 4810 H HA2 . GLY A1 1 288 ? -3.062 3.405 -12.756 1.0 19.46 278 A 1 -ATOM 4811 H HA3 . GLY A1 1 288 ? -4.348 3.602 -13.652 1.0 19.46 278 A 1 -ATOM 4812 N N . ARG A1 1 289 ? -5.482 5.131 -11.585 1.0 14.48 279 A 1 -ATOM 4813 C CA A ARG A1 1 289 ? -5.746 6.421 -10.943 0.57 14.11 279 A 1 -ATOM 4814 C CA B ARG A1 1 289 ? -5.74 6.42 -10.944 0.43 14.27 279 A 1 -ATOM 4815 C C . ARG A1 1 289 ? -4.972 6.562 -9.641 1.0 14.43 279 A 1 -ATOM 4816 O O . ARG A1 1 289 ? -4.432 7.636 -9.374 1.0 15.23 279 A 1 -ATOM 4817 C CB A ARG A1 1 289 ? -7.232 6.643 -10.706 0.57 14.24 279 A 1 -ATOM 4818 C CB B ARG A1 1 289 ? -7.223 6.63 -10.715 0.43 14.34 279 A 1 -ATOM 4819 C CG A ARG A1 1 289 ? -8.029 6.699 -12.008 0.57 16.03 279 A 1 -ATOM 4820 C CG B ARG A1 1 289 ? -7.964 6.825 -12.021 0.43 16.28 279 A 1 -ATOM 4821 C CD A ARG A1 1 289 ? -9.373 7.418 -11.878 0.57 23.42 279 A 1 -ATOM 4822 C CD B ARG A1 1 289 ? -9.471 6.736 -11.847 0.43 15.1 279 A 1 -ATOM 4823 N NE A ARG A1 1 289 ? -10.31 6.602 -11.128 0.57 23.58 279 A 1 -ATOM 4824 N NE B ARG A1 1 289 ? -9.882 5.459 -11.288 0.43 18.37 279 A 1 -ATOM 4825 C CZ A ARG A1 1 289 ? -11.62 6.844 -11.048 0.57 44.84 279 A 1 -ATOM 4826 C CZ B ARG A1 1 289 ? -11.122 5.174 -10.918 0.43 45.85 279 A 1 -ATOM 4827 N NH1 A ARG A1 1 289 ? -12.198 7.892 -11.688 0.57 20.62 279 A 1 -ATOM 4828 N NH1 B ARG A1 1 289 ? -12.067 6.097 -11.035 0.43 43.16 279 A 1 -ATOM 4829 N NH2 A ARG A1 1 289 ? -12.345 6.003 -10.326 0.57 26.12 279 A 1 -ATOM 4830 N NH2 B ARG A1 1 289 ? -11.403 3.974 -10.421 0.43 44.27 279 A 1 -ATOM 4831 H H A ARG A1 1 289 ? -6.141 4.579 -11.598 0.57 17.38 279 A 1 -ATOM 4832 H H B ARG A1 1 289 ? -6.142 4.58 -11.597 0.43 17.38 279 A 1 -ATOM 4833 H HA A ARG A1 1 289 ? -5.454 7.115 -11.554 0.57 16.93 279 A 1 -ATOM 4834 H HA B ARG A1 1 289 ? -5.44 7.117 -11.548 0.43 17.12 279 A 1 -ATOM 4835 H HB2 A ARG A1 1 289 ? -7.58 5.912 -10.171 0.57 17.09 279 A 1 -ATOM 4836 H HB2 B ARG A1 1 289 ? -7.591 5.853 -10.268 0.43 17.21 279 A 1 -ATOM 4837 H HB3 A ARG A1 1 289 ? -7.357 7.484 -10.24 0.57 17.09 279 A 1 -ATOM 4838 H HB3 B ARG A1 1 289 ? -7.354 7.421 -10.169 0.43 17.21 279 A 1 -ATOM 4839 H HG2 A ARG A1 1 289 ? -7.506 7.17 -12.675 0.57 19.23 279 A 1 -ATOM 4840 H HG2 B ARG A1 1 289 ? -7.754 7.702 -12.379 0.43 19.54 279 A 1 -ATOM 4841 H HG3 A ARG A1 1 289 ? -8.207 5.793 -12.305 0.57 19.23 279 A 1 -ATOM 4842 H HG3 B ARG A1 1 289 ? -7.692 6.137 -12.648 0.43 19.54 279 A 1 -ATOM 4843 H HD2 A ARG A1 1 289 ? -9.249 8.258 -11.409 0.57 28.1 279 A 1 -ATOM 4844 H HD2 B ARG A1 1 289 ? -9.764 7.438 -11.245 0.43 18.12 279 A 1 -ATOM 4845 H HD3 A ARG A1 1 289 ? -9.741 7.582 -12.76 0.57 28.1 279 A 1 -ATOM 4846 H HD3 B ARG A1 1 289 ? -9.898 6.84 -12.711 0.43 18.12 279 A 1 -ATOM 4847 H HE A ARG A1 1 289 ? -10.001 5.917 -10.708 0.57 28.3 279 A 1 -ATOM 4848 H HE B ARG A1 1 289 ? -9.283 4.85 -11.193 0.43 22.05 279 A 1 -ATOM 4849 H HH11 A ARG A1 1 289 ? -11.718 8.423 -12.163 0.57 24.74 279 A 1 -ATOM 4850 H HH11 B ARG A1 1 289 ? -11.874 6.873 -11.35 0.43 51.79 279 A 1 -ATOM 4851 H HH12 A ARG A1 1 289 ? -13.045 8.024 -11.618 0.57 24.74 279 A 1 -ATOM 4852 H HH12 B ARG A1 1 289 ? -12.874 5.918 -10.796 0.43 51.79 279 A 1 -ATOM 4853 H HH21 A ARG A1 1 289 ? -11.967 5.337 -9.935 0.57 31.34 279 A 1 -ATOM 4854 H HH21 B ARG A1 1 289 ? -10.782 3.384 -10.342 0.43 53.12 279 A 1 -ATOM 4855 H HH22 A ARG A1 1 289 ? -13.193 6.123 -10.248 0.57 31.34 279 A 1 -ATOM 4856 H HH22 B ARG A1 1 289 ? -12.207 3.786 -10.18 0.43 53.12 279 A 1 -ATOM 4857 N N . GLU A1 1 290 ? -4.871 5.486 -8.856 1.0 14.78 280 A 1 -ATOM 4858 C CA . GLU A1 1 290 ? -4.111 5.522 -7.613 1.0 14.08 280 A 1 -ATOM 4859 C C . GLU A1 1 290 ? -2.667 5.828 -7.892 1.0 15.54 280 A 1 -ATOM 4860 O O . GLU A1 1 290 ? -2.045 6.616 -7.184 1.0 16.11 280 A 1 -ATOM 4861 C CB . GLU A1 1 290 ? -4.247 4.158 -6.967 1.0 16.99 280 A 1 -ATOM 4862 C CG . GLU A1 1 290 ? -5.625 3.863 -6.447 1.0 20.6 280 A 1 -ATOM 4863 C CD . GLU A1 1 290 ? -6.556 3.107 -7.415 1.0 31.79 280 A 1 -ATOM 4864 O OE1 . GLU A1 1 290 ? -6.497 3.265 -8.668 1.0 21.47 280 A 1 -ATOM 4865 O OE2 . GLU A1 1 290 ? -7.387 2.336 -6.898 1.0 25.41 280 A 1 -ATOM 4866 H H . GLU A1 1 290 ? -5.234 4.724 -9.023 1.0 17.74 280 A 1 -ATOM 4867 H HA . GLU A1 1 290 ? -4.448 6.206 -7.014 1.0 16.89 280 A 1 -ATOM 4868 H HB2 . GLU A1 1 290 ? -4.029 3.479 -7.625 1.0 20.39 280 A 1 -ATOM 4869 H HB3 . GLU A1 1 290 ? -3.632 4.105 -6.22 1.0 20.39 280 A 1 -ATOM 4870 H HG2 . GLU A1 1 290 ? -5.539 3.321 -5.647 1.0 24.72 280 A 1 -ATOM 4871 H HG3 . GLU A1 1 290 ? -6.056 4.705 -6.232 1.0 24.72 280 A 1 -ATOM 4872 N N . ILE A1 1 291 ? -2.093 5.211 -8.931 1.0 15.11 281 A 1 -ATOM 4873 C CA . ILE A1 1 291 ? -0.709 5.482 -9.299 1.0 15.53 281 A 1 -ATOM 4874 C C . ILE A1 1 291 ? -0.566 6.951 -9.68 1.0 15.29 281 A 1 -ATOM 4875 O O . ILE A1 1 291 ? 0.371 7.64 -9.284 1.0 15.04 281 A 1 -ATOM 4876 C CB . ILE A1 1 291 ? -0.285 4.547 -10.457 1.0 15.51 281 A 1 -ATOM 4877 C CG1 . ILE A1 1 291 ? -0.239 3.087 -10.016 1.0 17.95 281 A 1 -ATOM 4878 C CG2 . ILE A1 1 291 ? 1.082 4.937 -10.971 1.0 17.98 281 A 1 -ATOM 4879 C CD1 . ILE A1 1 291 ? -0.096 2.099 -11.199 1.0 21.35 281 A 1 -ATOM 4880 H H . ILE A1 1 291 ? -2.486 4.634 -9.434 1.0 18.14 281 A 1 -ATOM 4881 H HA . ILE A1 1 291 ? -0.128 5.306 -8.542 1.0 18.64 281 A 1 -ATOM 4882 H HB . ILE A1 1 291 ? -0.951 4.644 -11.155 1.0 18.61 281 A 1 -ATOM 4883 H HG12 . ILE A1 1 291 ? 0.521 2.96 -9.427 1.0 21.54 281 A 1 -ATOM 4884 H HG13 . ILE A1 1 291 ? -1.061 2.874 -9.548 1.0 21.54 281 A 1 -ATOM 4885 H HG21 . ILE A1 1 291 ? 1.393 4.256 -11.588 1.0 21.57 281 A 1 -ATOM 4886 H HG22 . ILE A1 1 291 ? 1.017 5.791 -11.426 1.0 21.57 281 A 1 -ATOM 4887 H HG23 . ILE A1 1 291 ? 1.694 5.007 -10.221 1.0 21.57 281 A 1 -ATOM 4888 H HD11 . ILE A1 1 291 ? -0.294 1.202 -10.887 1.0 25.63 281 A 1 -ATOM 4889 H HD12 . ILE A1 1 291 ? -0.719 2.351 -11.898 1.0 25.63 281 A 1 -ATOM 4890 H HD13 . ILE A1 1 291 ? 0.813 2.139 -11.536 1.0 25.63 281 A 1 -ATOM 4891 N N . THR A1 1 292 ? -1.505 7.456 -10.483 1.0 13.87 282 A 1 -ATOM 4892 C CA . THR A1 1 292 ? -1.405 8.824 -10.976 1.0 14.02 282 A 1 -ATOM 4893 C C . THR A1 1 292 ? -1.496 9.821 -9.828 1.0 13.45 282 A 1 -ATOM 4894 O O . THR A1 1 292 ? -0.802 10.85 -9.833 1.0 14.58 282 A 1 -ATOM 4895 C CB . THR A1 1 292 ? -2.516 9.076 -12.0 1.0 12.56 282 A 1 -ATOM 4896 O OG1 . THR A1 1 292 ? -2.394 8.11 -13.079 1.0 13.87 282 A 1 -ATOM 4897 C CG2 . THR A1 1 292 ? -2.366 10.401 -12.662 1.0 13.54 282 A 1 -ATOM 4898 H H . THR A1 1 292 ? -2.201 7.03 -10.753 1.0 16.65 282 A 1 -ATOM 4899 H HA . THR A1 1 292 ? -0.553 8.954 -11.421 1.0 16.82 282 A 1 -ATOM 4900 H HB . THR A1 1 292 ? -3.364 9.023 -11.532 1.0 15.07 282 A 1 -ATOM 4901 H HG1 . THR A1 1 292 ? -2.497 7.331 -12.78 1.0 16.64 282 A 1 -ATOM 4902 H HG21 . THR A1 1 292 ? -3.024 10.495 -13.369 1.0 16.25 282 A 1 -ATOM 4903 H HG22 . THR A1 1 292 ? -2.494 11.112 -12.015 1.0 16.25 282 A 1 -ATOM 4904 H HG23 . THR A1 1 292 ? -1.478 10.481 -13.046 1.0 16.25 282 A 1 -ATOM 4905 N N . LEU A1 1 293 ? -2.291 9.51 -8.797 1.0 13.85 283 A 1 -ATOM 4906 C CA . LEU A1 1 293 ? -2.374 10.374 -7.605 1.0 13.32 283 A 1 -ATOM 4907 C C . LEU A1 1 293 ? -1.068 10.396 -6.82 1.0 14.7 283 A 1 -ATOM 4908 O O . LEU A1 1 293 ? -0.886 11.301 -6.004 1.0 14.77 283 A 1 -ATOM 4909 C CB . LEU A1 1 293 ? -3.53 9.902 -6.729 1.0 14.68 283 A 1 -ATOM 4910 C CG . LEU A1 1 293 ? -4.913 10.237 -7.259 1.0 14.0 283 A 1 -ATOM 4911 C CD1 . LEU A1 1 293 ? -5.984 9.473 -6.494 1.0 16.11 283 A 1 -ATOM 4912 C CD2 . LEU A1 1 293 ? -5.183 11.727 -7.197 1.0 15.45 283 A 1 -ATOM 4913 H H . LEU A1 1 293 ? -2.791 8.812 -8.76 1.0 16.62 283 A 1 -ATOM 4914 H HA . LEU A1 1 293 ? -2.556 11.289 -7.873 1.0 15.99 283 A 1 -ATOM 4915 H HB2 . LEU A1 1 293 ? -3.476 8.937 -6.645 1.0 17.62 283 A 1 -ATOM 4916 H HB3 . LEU A1 1 293 ? -3.443 10.317 -5.857 1.0 17.62 283 A 1 -ATOM 4917 H HG . LEU A1 1 293 ? -4.953 9.97 -8.19 1.0 16.81 283 A 1 -ATOM 4918 H HD11 . LEU A1 1 293 ? -6.855 9.704 -6.854 1.0 19.34 283 A 1 -ATOM 4919 H HD12 . LEU A1 1 293 ? -5.826 8.521 -6.597 1.0 19.34 283 A 1 -ATOM 4920 H HD13 . LEU A1 1 293 ? -5.938 9.717 -5.557 1.0 19.34 283 A 1 -ATOM 4921 H HD21 . LEU A1 1 293 ? -6.116 11.888 -7.41 1.0 18.54 283 A 1 -ATOM 4922 H HD22 . LEU A1 1 293 ? -4.989 12.046 -6.301 1.0 18.54 283 A 1 -ATOM 4923 H HD23 . LEU A1 1 293 ? -4.614 12.178 -7.839 1.0 18.54 283 A 1 -ATOM 4924 N N . ARG A1 1 294 ? -0.166 9.476 -7.048 1.0 15.13 284 A 1 -ATOM 4925 C CA . ARG A1 1 294 ? 1.154 9.482 -6.425 1.0 15.84 284 A 1 -ATOM 4926 C C . ARG A1 1 294 ? 2.211 10.103 -7.322 1.0 16.52 284 A 1 -ATOM 4927 O O . ARG A1 1 294 ? 3.374 10.2 -6.929 1.0 17.84 284 A 1 -ATOM 4928 C CB . ARG A1 1 294 ? 1.574 8.049 -6.068 1.0 17.48 284 A 1 -ATOM 4929 C CG . ARG A1 1 294 ? 0.662 7.414 -4.986 1.0 19.14 284 A 1 -ATOM 4930 C CD . ARG A1 1 294 ? 1.307 6.078 -4.463 1.0 30.02 284 A 1 -ATOM 4931 N NE . ARG A1 1 294 ? 2.318 6.354 -3.438 1.0 73.18 284 A 1 -ATOM 4932 C CZ . ARG A1 1 294 ? 3.384 5.599 -3.175 1.0 89.92 284 A 1 -ATOM 4933 N NH1 . ARG A1 1 294 ? 3.628 4.485 -3.855 1.0 51.61 284 A 1 -ATOM 4934 N NH2 . ARG A1 1 294 ? 4.225 5.971 -2.219 1.0 100.72 284 A 1 -ATOM 4935 H H . ARG A1 1 294 ? -0.289 8.81 -7.578 1.0 18.15 284 A 1 -ATOM 4936 H HA . ARG A1 1 294 ? 1.11 9.995 -5.603 1.0 19.0 284 A 1 -ATOM 4937 H HB2 . ARG A1 1 294 ? 1.526 7.498 -6.865 1.0 20.98 284 A 1 -ATOM 4938 H HB3 . ARG A1 1 294 ? 2.482 8.062 -5.728 1.0 20.98 284 A 1 -ATOM 4939 H HG2 . ARG A1 1 294 ? 0.564 8.026 -4.24 1.0 22.97 284 A 1 -ATOM 4940 H HG3 . ARG A1 1 294 ? -0.207 7.213 -5.367 1.0 22.97 284 A 1 -ATOM 4941 H HD2 . ARG A1 1 294 ? 0.619 5.517 -4.073 1.0 36.02 284 A 1 -ATOM 4942 H HD3 . ARG A1 1 294 ? 1.735 5.614 -5.2 1.0 36.02 284 A 1 -ATOM 4943 H HE . ARG A1 1 294 ? 2.214 7.066 -2.966 1.0 87.81 284 A 1 -ATOM 4944 H HH11 . ARG A1 1 294 ? 3.093 4.238 -4.481 1.0 61.93 284 A 1 -ATOM 4945 H HH12 . ARG A1 1 294 ? 4.321 4.011 -3.67 1.0 61.93 284 A 1 -ATOM 4946 H HH21 . ARG A1 1 294 ? 4.081 6.694 -1.776 1.0 120.86 284 A 1 -ATOM 4947 H HH22 . ARG A1 1 294 ? 4.916 5.489 -2.042 1.0 120.86 284 A 1 -ATOM 4948 N N . CYS A1 1 295 ? 1.828 10.621 -8.483 1.0 15.32 285 A 1 -ATOM 4949 C CA . CYS A1 1 295 ? 2.774 11.147 -9.477 1.0 16.0 285 A 1 -ATOM 4950 C C . CYS A1 1 295 ? 2.398 12.565 -9.853 1.0 15.85 285 A 1 -ATOM 4951 O O . CYS A1 1 295 ? 2.79 13.06 -10.916 1.0 16.11 285 A 1 -ATOM 4952 C CB . CYS A1 1 295 ? 2.801 10.294 -10.732 1.0 16.46 285 A 1 -ATOM 4953 S SG . CYS A1 1 295 ? 3.377 8.621 -10.485 1.0 18.77 285 A 1 -ATOM 4954 H H . CYS A1 1 295 ? 1.007 10.685 -8.73 1.0 18.39 285 A 1 -ATOM 4955 H HA . CYS A1 1 295 ? 3.666 11.13 -9.095 1.0 19.2 285 A 1 -ATOM 4956 H HB2 . CYS A1 1 295 ? 1.901 10.244 -11.09 1.0 19.75 285 A 1 -ATOM 4957 H HB3 . CYS A1 1 295 ? 3.391 10.715 -11.377 1.0 19.75 285 A 1 -ATOM 4958 H HG . CYS A1 1 295 ? 3.561 8.109 -11.554 1.0 22.52 285 A 1 -ATOM 4959 N N . GLY A1 1 296 ? 1.626 13.246 -9.021 1.0 15.1 286 A 1 -ATOM 4960 C CA . GLY A1 1 296 ? 1.323 14.655 -9.189 1.0 15.63 286 A 1 -ATOM 4961 C C . GLY A1 1 296 ? -0.133 15.012 -9.244 1.0 14.19 286 A 1 -ATOM 4962 O O . GLY A1 1 296 ? -0.457 16.189 -9.111 1.0 14.12 286 A 1 -ATOM 4963 H H . GLY A1 1 296 ? 1.254 12.9 -8.327 1.0 18.12 286 A 1 -ATOM 4964 H HA2 . GLY A1 1 296 ? 1.714 15.142 -8.447 1.0 18.76 286 A 1 -ATOM 4965 H HA3 . GLY A1 1 296 ? 1.729 14.959 -10.016 1.0 18.76 286 A 1 -ATOM 4966 N N . ALA A1 1 297 ? -1.062 14.073 -9.445 1.0 13.32 287 A 1 -ATOM 4967 C CA . ALA A1 1 297 ? -2.472 14.42 -9.489 1.0 13.4 287 A 1 -ATOM 4968 C C . ALA A1 1 297 ? -3.037 14.62 -8.084 1.0 13.87 287 A 1 -ATOM 4969 O O . ALA A1 1 297 ? -2.491 14.12 -7.09 1.0 14.37 287 A 1 -ATOM 4970 C CB . ALA A1 1 297 ? -3.264 13.333 -10.202 1.0 13.44 287 A 1 -ATOM 4971 H H . ALA A1 1 297 ? -0.897 13.237 -9.557 1.0 15.98 287 A 1 -ATOM 4972 H HA . ALA A1 1 297 ? -2.573 15.253 -9.977 1.0 16.08 287 A 1 -ATOM 4973 H HB1 . ALA A1 1 297 ? -4.204 13.572 -10.197 1.0 16.12 287 A 1 -ATOM 4974 H HB2 . ALA A1 1 297 ? -2.946 13.258 -11.116 1.0 16.12 287 A 1 -ATOM 4975 H HB3 . ALA A1 1 297 ? -3.134 12.491 -9.737 1.0 16.12 287 A 1 -ATOM 4976 N N . ASN A1 1 298 ? -4.139 15.383 -8.017 1.0 12.67 288 A 1 -ATOM 4977 C CA . ASN A1 1 298 ? -4.753 15.739 -6.733 1.0 13.15 288 A 1 -ATOM 4978 C C . ASN A1 1 298 ? -6.263 15.775 -6.81 1.0 13.06 288 A 1 -ATOM 4979 O O . ASN A1 1 298 ? -6.9 16.275 -5.851 1.0 14.08 288 A 1 -ATOM 4980 C CB . ASN A1 1 298 ? -4.226 17.094 -6.213 1.0 13.47 288 A 1 -ATOM 4981 C CG . ASN A1 1 298 ? -4.728 18.271 -7.012 1.0 13.36 288 A 1 -ATOM 4982 O OD1 . ASN A1 1 298 ? -4.674 18.228 -8.265 1.0 13.42 288 A 1 -ATOM 4983 N ND2 . ASN A1 1 298 ? -5.238 19.314 -6.39 1.0 14.77 288 A 1 -ATOM 4984 H H . ASN A1 1 298 ? -4.548 15.706 -8.701 1.0 15.2 288 A 1 -ATOM 4985 H HA . ASN A1 1 298 ? -4.503 15.067 -6.08 1.0 15.78 288 A 1 -ATOM 4986 H HB2 . ASN A1 1 298 ? -4.514 17.213 -5.294 1.0 16.16 288 A 1 -ATOM 4987 H HB3 . ASN A1 1 298 ? -3.257 17.094 -6.259 1.0 16.16 288 A 1 -ATOM 4988 H HD21 . ASN A1 1 298 ? -5.525 19.987 -6.842 1.0 17.73 288 A 1 -ATOM 4989 H HD22 . ASN A1 1 298 ? -5.283 19.322 -5.531 1.0 17.73 288 A 1 -ATOM 4990 N N . VAL A1 1 299 ? -6.871 15.274 -7.876 1.0 12.86 289 A 1 -ATOM 4991 C CA . VAL A1 1 299 ? -8.31 15.317 -8.095 1.0 13.08 289 A 1 -ATOM 4992 C C . VAL A1 1 299 ? -8.74 13.965 -8.621 1.0 13.06 289 A 1 -ATOM 4993 O O . VAL A1 1 299 ? -7.991 13.3 -9.349 1.0 13.05 289 A 1 -ATOM 4994 C CB . VAL A1 1 299 ? -8.661 16.443 -9.112 1.0 13.88 289 A 1 -ATOM 4995 C CG1 . VAL A1 1 299 ? -10.117 16.369 -9.581 1.0 15.36 289 A 1 -ATOM 4996 C CG2 . VAL A1 1 299 ? -8.3 17.794 -8.545 1.0 16.01 289 A 1 -ATOM 4997 H H . VAL A1 1 299 ? -6.452 14.885 -8.518 1.0 15.44 289 A 1 -ATOM 4998 H HA . VAL A1 1 299 ? -8.784 15.482 -7.264 1.0 15.7 289 A 1 -ATOM 4999 H HB . VAL A1 1 299 ? -8.128 16.312 -9.912 1.0 16.65 289 A 1 -ATOM 5000 H HG11 . VAL A1 1 299 ? -10.338 17.187 -10.053 1.0 18.43 289 A 1 -ATOM 5001 H HG12 . VAL A1 1 299 ? -10.221 15.607 -10.172 1.0 18.43 289 A 1 -ATOM 5002 H HG13 . VAL A1 1 299 ? -10.693 16.268 -8.807 1.0 18.43 289 A 1 -ATOM 5003 H HG21 . VAL A1 1 299 ? -8.548 18.481 -9.183 1.0 19.21 289 A 1 -ATOM 5004 H HG22 . VAL A1 1 299 ? -8.782 17.926 -7.713 1.0 19.21 289 A 1 -ATOM 5005 H HG23 . VAL A1 1 299 ? -7.345 17.823 -8.382 1.0 19.21 289 A 1 -ATOM 5006 N N . ILE A1 1 300 ? -9.931 13.535 -8.267 1.0 12.89 290 A 1 -ATOM 5007 C CA . ILE A1 1 300 ? -10.54 12.318 -8.827 1.0 14.42 290 A 1 -ATOM 5008 C C . ILE A1 1 300 ? -11.982 12.641 -9.162 1.0 13.75 290 A 1 -ATOM 5009 O O . ILE A1 1 300 ? -12.645 13.441 -8.492 1.0 14.5 290 A 1 -ATOM 5010 C CB . ILE A1 1 300 ? -10.38 11.118 -7.871 1.0 16.13 290 A 1 -ATOM 5011 C CG1 . ILE A1 1 300 ? -10.709 9.835 -8.632 1.0 21.15 290 A 1 -ATOM 5012 C CG2 . ILE A1 1 300 ? -11.193 11.294 -6.621 1.0 17.59 290 A 1 -ATOM 5013 C CD1 . ILE A1 1 300 ? -9.943 8.656 -8.217 1.0 27.33 290 A 1 -ATOM 5014 H H . ILE A1 1 300 ? -10.43 13.932 -7.69 1.0 15.47 290 A 1 -ATOM 5015 H HA . ILE A1 1 300 ? -10.108 12.061 -9.656 1.0 17.3 290 A 1 -ATOM 5016 H HB . ILE A1 1 300 ? -9.46 11.06 -7.569 1.0 19.36 290 A 1 -ATOM 5017 H HG12 . ILE A1 1 300 ? -11.649 9.632 -8.501 1.0 25.38 290 A 1 -ATOM 5018 H HG13 . ILE A1 1 300 ? -10.53 9.982 -9.574 1.0 25.38 290 A 1 -ATOM 5019 H HG21 . ILE A1 1 300 ? -10.957 10.595 -5.99 1.0 21.1 290 A 1 -ATOM 5020 H HG22 . ILE A1 1 300 ? -10.999 12.164 -6.239 1.0 21.1 290 A 1 -ATOM 5021 H HG23 . ILE A1 1 300 ? -12.134 11.233 -6.846 1.0 21.1 290 A 1 -ATOM 5022 H HD11 . ILE A1 1 300 ? -10.082 7.946 -8.863 1.0 32.79 290 A 1 -ATOM 5023 H HD12 . ILE A1 1 300 ? -9.002 8.889 -8.179 1.0 32.79 290 A 1 -ATOM 5024 H HD13 . ILE A1 1 300 ? -10.25 8.372 -7.342 1.0 32.79 290 A 1 -ATOM 5025 N N . MET A1 1 301 ? -12.454 12.078 -10.267 1.0 13.34 291 A 1 -ATOM 5026 C CA A MET A1 1 301 ? -13.744 12.428 -10.854 0.79 14.28 291 A 1 -ATOM 5027 C CA B MET A1 1 301 ? -13.761 12.428 -10.81 0.21 16.11 291 A 1 -ATOM 5028 C C . MET A1 1 301 ? -14.576 11.17 -11.0 1.0 14.17 291 A 1 -ATOM 5029 O O . MET A1 1 301 ? -14.69 10.632 -12.128 1.0 17.03 291 A 1 -ATOM 5030 C CB A MET A1 1 301 ? -13.575 13.266 -12.141 0.79 13.76 291 A 1 -ATOM 5031 C CB B MET A1 1 301 ? -13.637 13.174 -12.132 0.21 15.72 291 A 1 -ATOM 5032 C CG A MET A1 1 301 ? -12.496 14.398 -12.056 0.79 12.48 291 A 1 -ATOM 5033 C CG B MET A1 1 301 ? -12.942 14.508 -12.074 0.21 28.52 291 A 1 -ATOM 5034 S SD A MET A1 1 301 ? -12.217 15.406 -13.589 0.79 16.62 291 A 1 -ATOM 5035 S SD B MET A1 1 301 ? -13.546 15.49 -13.424 0.21 16.35 291 A 1 -ATOM 5036 C CE A MET A1 1 301 ? -13.684 16.485 -13.493 0.79 20.22 291 A 1 -ATOM 5037 C CE B MET A1 1 301 ? -12.146 16.559 -13.809 0.21 26.81 291 A 1 -ATOM 5038 H H A MET A1 1 301 ? -12.032 11.473 -10.709 0.79 16.01 291 A 1 -ATOM 5039 H H B MET A1 1 301 ? -12.031 11.485 -10.725 0.21 16.01 291 A 1 -ATOM 5040 H HA A MET A1 1 301 ? -14.242 12.996 -10.246 0.79 17.13 291 A 1 -ATOM 5041 H HA B MET A1 1 301 ? -14.203 13.001 -10.164 0.21 19.33 291 A 1 -ATOM 5042 H HB2 A MET A1 1 301 ? -13.317 12.672 -12.863 0.79 16.52 291 A 1 -ATOM 5043 H HB2 B MET A1 1 301 ? -13.136 12.617 -12.749 0.21 18.86 291 A 1 -ATOM 5044 H HB3 A MET A1 1 301 ? -14.424 13.688 -12.345 0.79 16.52 291 A 1 -ATOM 5045 H HB3 B MET A1 1 301 ? -14.53 13.331 -12.477 0.21 18.86 291 A 1 -ATOM 5046 H HG2 A MET A1 1 301 ? -12.763 15.016 -11.357 0.79 14.97 291 A 1 -ATOM 5047 H HG2 B MET A1 1 301 ? -13.143 14.955 -11.236 0.21 34.23 291 A 1 -ATOM 5048 H HG3 A MET A1 1 301 ? -11.647 13.988 -11.83 0.79 14.97 291 A 1 -ATOM 5049 H HG3 B MET A1 1 301 ? -11.983 14.391 -12.165 0.21 34.23 291 A 1 -ATOM 5050 H HE1 A MET A1 1 301 ? -13.599 17.192 -14.152 0.79 24.27 291 A 1 -ATOM 5051 H HE1 B MET A1 1 301 ? -12.322 17.022 -14.643 0.21 32.17 291 A 1 -ATOM 5052 H HE2 A MET A1 1 301 ? -14.477 15.957 -13.674 0.79 24.27 291 A 1 -ATOM 5053 H HE2 B MET A1 1 301 ? -12.032 17.201 -13.091 0.21 32.17 291 A 1 -ATOM 5054 H HE3 A MET A1 1 301 ? -13.737 16.867 -12.603 0.79 24.27 291 A 1 -ATOM 5055 H HE3 B MET A1 1 301 ? -11.347 16.015 -13.895 0.21 32.17 291 A 1 -ATOM 5056 N N . PRO A1 1 302 ? -15.185 10.667 -9.944 1.0 15.01 292 A 1 -ATOM 5057 C CA . PRO A1 1 302 ? -15.982 9.456 -10.073 1.0 15.86 292 A 1 -ATOM 5058 C C . PRO A1 1 302 ? -17.159 9.667 -11.004 1.0 14.73 292 A 1 -ATOM 5059 O O . PRO A1 1 302 ? -17.784 10.729 -11.032 1.0 16.22 292 A 1 -ATOM 5060 C CB . PRO A1 1 302 ? -16.44 9.184 -8.646 1.0 18.01 292 A 1 -ATOM 5061 C CG . PRO A1 1 302 ? -16.474 10.512 -7.996 1.0 15.66 292 A 1 -ATOM 5062 C CD . PRO A1 1 302 ? -15.295 11.231 -8.58 1.0 14.11 292 A 1 -ATOM 5063 H HA . PRO A1 1 302 ? -15.44 8.717 -10.391 1.0 19.04 292 A 1 -ATOM 5064 H HB2 . PRO A1 1 302 ? -17.321 8.778 -8.653 1.0 21.61 292 A 1 -ATOM 5065 H HB3 . PRO A1 1 302 ? -15.808 8.596 -8.203 1.0 21.61 292 A 1 -ATOM 5066 H HG2 . PRO A1 1 302 ? -17.303 10.967 -8.209 1.0 18.79 292 A 1 -ATOM 5067 H HG3 . PRO A1 1 302 ? -16.385 10.416 -7.035 1.0 18.79 292 A 1 -ATOM 5068 H HD2 . PRO A1 1 302 ? -15.457 12.186 -8.614 1.0 16.93 292 A 1 -ATOM 5069 H HD3 . PRO A1 1 302 ? -14.492 11.049 -8.067 1.0 16.93 292 A 1 -ATOM 5070 N N A ASN A1 1 303 ? -17.502 8.602 -11.731 0.56 16.61 293 A 1 -ATOM 5071 N N B ASN A1 1 303 ? -17.426 8.629 -11.778 0.44 13.76 293 A 1 -ATOM 5072 C CA A ASN A1 1 303 ? -18.61 8.647 -12.684 0.56 14.88 293 A 1 -ATOM 5073 C CA B ASN A1 1 303 ? -18.596 8.635 -12.625 0.44 13.56 293 A 1 -ATOM 5074 C C A ASN A1 1 303 ? -19.93 8.386 -11.967 0.56 13.98 293 A 1 -ATOM 5075 C C B ASN A1 1 303 ? -19.851 8.484 -11.779 0.44 13.59 293 A 1 -ATOM 5076 O O A ASN A1 1 303 ? -20.182 7.278 -11.461 0.56 14.74 293 A 1 -ATOM 5077 O O B ASN A1 1 303 ? -19.958 7.566 -10.962 0.44 14.63 293 A 1 -ATOM 5078 C CB A ASN A1 1 303 ? -18.372 7.607 -13.776 0.56 14.3 293 A 1 -ATOM 5079 C CB B ASN A1 1 303 ? -18.508 7.482 -13.616 0.44 20.63 293 A 1 -ATOM 5080 C CG A ASN A1 1 303 ? -19.485 7.557 -14.805 0.56 30.06 293 A 1 -ATOM 5081 C CG B ASN A1 1 303 ? -19.538 7.596 -14.689 0.44 13.54 293 A 1 -ATOM 5082 O OD1 A ASN A1 1 303 ? -20.399 8.396 -14.799 0.56 16.49 293 A 1 -ATOM 5083 O OD1 B ASN A1 1 303 ? -20.67 7.361 -14.457 0.44 14.55 293 A 1 -ATOM 5084 N ND2 A ASN A1 1 303 ? -19.394 6.572 -15.725 0.56 17.46 293 A 1 -ATOM 5085 N ND2 B ASN A1 1 303 ? -19.123 8.029 -15.851 0.44 23.14 293 A 1 -ATOM 5086 H H A ASN A1 1 303 ? -17.106 7.84 -11.69 0.56 19.93 293 A 1 -ATOM 5087 H H B ASN A1 1 303 ? -16.948 7.916 -11.828 0.44 16.51 293 A 1 -ATOM 5088 H HA A ASN A1 1 303 ? -18.661 9.532 -13.078 0.56 17.86 293 A 1 -ATOM 5089 H HA B ASN A1 1 303 ? -18.648 9.472 -13.112 0.44 16.27 293 A 1 -ATOM 5090 H HB2 A ASN A1 1 303 ? -17.547 7.821 -14.239 0.56 17.16 293 A 1 -ATOM 5091 H HB2 B ASN A1 1 303 ? -17.632 7.485 -14.033 0.44 24.76 293 A 1 -ATOM 5092 H HB3 A ASN A1 1 303 ? -18.305 6.731 -13.366 0.56 17.16 293 A 1 -ATOM 5093 H HB3 B ASN A1 1 303 ? -18.648 6.645 -13.147 0.44 24.76 293 A 1 -ATOM 5094 H HD21 A ASN A1 1 303 ? -19.996 6.494 -16.333 0.56 20.96 293 A 1 -ATOM 5095 H HD21 B ASN A1 1 303 ? -19.678 8.113 -16.502 0.44 27.77 293 A 1 -ATOM 5096 H HD22 A ASN A1 1 303 ? -18.733 6.022 -15.702 0.56 20.96 293 A 1 -ATOM 5097 H HD22 B ASN A1 1 303 ? -18.294 8.23 -15.963 0.44 27.77 293 A 1 -ATOM 5098 N N . TRP A1 1 304 ? -20.783 9.394 -11.958 1.0 14.13 294 A 1 -ATOM 5099 C CA . TRP A1 1 304 ? -22.063 9.365 -11.289 1.0 14.25 294 A 1 -ATOM 5100 C C . TRP A1 1 304 ? -23.214 9.284 -12.274 1.0 15.21 294 A 1 -ATOM 5101 O O . TRP A1 1 304 ? -24.363 9.541 -11.928 1.0 18.27 294 A 1 -ATOM 5102 C CB . TRP A1 1 304 ? -22.13 10.597 -10.354 1.0 14.6 294 A 1 -ATOM 5103 C CG . TRP A1 1 304 ? -23.199 10.535 -9.304 1.0 15.25 294 A 1 -ATOM 5104 C CD1 . TRP A1 1 304 ? -24.3 11.274 -9.209 1.0 15.45 294 A 1 -ATOM 5105 C CD2 . TRP A1 1 304 ? -23.216 9.624 -8.195 1.0 15.55 294 A 1 -ATOM 5106 N NE1 . TRP A1 1 304 ? -25.027 10.897 -8.077 1.0 17.37 294 A 1 -ATOM 5107 C CE2 . TRP A1 1 304 ? -24.352 9.906 -7.431 1.0 17.12 294 A 1 -ATOM 5108 C CE3 . TRP A1 1 304 ? -22.337 8.633 -7.764 1.0 15.77 294 A 1 -ATOM 5109 C CZ2 . TRP A1 1 304 ? -24.627 9.227 -6.252 1.0 18.83 294 A 1 -ATOM 5110 C CZ3 . TRP A1 1 304 ? -22.636 7.956 -6.586 1.0 18.62 294 A 1 -ATOM 5111 C CH2 . TRP A1 1 304 ? -23.747 8.279 -5.848 1.0 18.31 294 A 1 -ATOM 5112 H H A TRP A1 1 304 ? -20.633 10.142 -12.354 0.56 16.95 294 A 1 -ATOM 5113 H H B TRP A1 1 304 ? -20.695 10.067 -12.486 0.44 16.95 294 A 1 -ATOM 5114 H HA . TRP A1 1 304 ? -22.162 8.574 -10.735 1.0 17.1 294 A 1 -ATOM 5115 H HB2 . TRP A1 1 304 ? -21.278 10.684 -9.897 1.0 17.52 294 A 1 -ATOM 5116 H HB3 . TRP A1 1 304 ? -22.298 11.385 -10.895 1.0 17.52 294 A 1 -ATOM 5117 H HD1 . TRP A1 1 304 ? -24.549 11.941 -9.806 1.0 18.54 294 A 1 -ATOM 5118 H HE1 . TRP A1 1 304 ? -25.778 11.236 -7.829 1.0 20.85 294 A 1 -ATOM 5119 H HE3 . TRP A1 1 304 ? -21.57 8.431 -8.25 1.0 18.93 294 A 1 -ATOM 5120 H HZ2 . TRP A1 1 304 ? -25.391 9.417 -5.756 1.0 22.6 294 A 1 -ATOM 5121 H HZ3 . TRP A1 1 304 ? -22.075 7.273 -6.295 1.0 22.34 294 A 1 -ATOM 5122 H HH2 . TRP A1 1 304 ? -23.9 7.834 -5.046 1.0 21.97 294 A 1 -ATOM 5123 N N . THR A1 1 305 ? -22.96 8.942 -13.511 1.0 14.82 295 A 1 -ATOM 5124 C CA . THR A1 1 305 ? -24.058 8.792 -14.462 1.0 14.69 295 A 1 -ATOM 5125 C C . THR A1 1 305 ? -24.893 7.553 -14.085 1.0 15.2 295 A 1 -ATOM 5126 O O . THR A1 1 305 ? -24.325 6.484 -13.817 1.0 15.53 295 A 1 -ATOM 5127 C CB . THR A1 1 305 ? -23.483 8.584 -15.862 1.0 14.54 295 A 1 -ATOM 5128 O OG1 . THR A1 1 305 ? -22.582 9.663 -16.143 1.0 14.23 295 A 1 -ATOM 5129 C CG2 . THR A1 1 305 ? -24.555 8.544 -16.912 1.0 15.29 295 A 1 -ATOM 5130 H H . THR A1 1 305 ? -22.177 8.791 -13.833 1.0 17.78 295 A 1 -ATOM 5131 H HA . THR A1 1 305 ? -24.621 9.582 -14.449 1.0 17.63 295 A 1 -ATOM 5132 H HB . THR A1 1 305 ? -23.022 7.731 -15.896 1.0 17.45 295 A 1 -ATOM 5133 H HG1 . THR A1 1 305 ? -21.926 9.633 -15.62 1.0 17.08 295 A 1 -ATOM 5134 H HG21 . THR A1 1 305 ? -24.153 8.503 -17.794 1.0 18.35 295 A 1 -ATOM 5135 H HG22 . THR A1 1 305 ? -25.115 7.763 -16.785 1.0 18.35 295 A 1 -ATOM 5136 H HG23 . THR A1 1 305 ? -25.106 9.34 -16.854 1.0 18.35 295 A 1 -ATOM 5137 N N . PRO A1 1 306 ? -26.197 7.649 -14.022 1.0 15.67 296 A 1 -ATOM 5138 C CA . PRO A1 1 306 ? -26.985 6.502 -13.567 1.0 16.3 296 A 1 -ATOM 5139 C C . PRO A1 1 306 ? -27.216 5.476 -14.674 1.0 16.68 296 A 1 -ATOM 5140 O O . PRO A1 1 306 ? -27.173 5.79 -15.898 1.0 16.87 296 A 1 -ATOM 5141 C CB . PRO A1 1 306 ? -28.307 7.143 -13.109 1.0 18.73 296 A 1 -ATOM 5142 C CG . PRO A1 1 306 ? -28.434 8.37 -14.04 1.0 18.72 296 A 1 -ATOM 5143 C CD . PRO A1 1 306 ? -27.01 8.859 -14.196 1.0 15.94 296 A 1 -ATOM 5144 H HA . PRO A1 1 306 ? -26.554 6.065 -12.815 1.0 19.56 296 A 1 -ATOM 5145 H HB2 . PRO A1 1 306 ? -29.044 6.524 -13.234 1.0 22.47 296 A 1 -ATOM 5146 H HB3 . PRO A1 1 306 ? -28.251 7.408 -12.178 1.0 22.47 296 A 1 -ATOM 5147 H HG2 . PRO A1 1 306 ? -28.809 8.104 -14.895 1.0 22.46 296 A 1 -ATOM 5148 H HG3 . PRO A1 1 306 ? -28.994 9.046 -13.628 1.0 22.46 296 A 1 -ATOM 5149 H HD2 . PRO A1 1 306 ? -26.873 9.24 -15.077 1.0 19.12 296 A 1 -ATOM 5150 H HD3 . PRO A1 1 306 ? -26.797 9.515 -13.514 1.0 19.12 296 A 1 -ATOM 5151 N N . SER A1 1 307 ? -27.491 4.242 -14.263 1.0 17.22 297 A 1 -ATOM 5152 C CA . SER A1 1 307 ? -28.104 3.269 -15.135 1.0 17.84 297 A 1 -ATOM 5153 C C . SER A1 1 307 ? -29.438 3.83 -15.586 1.0 18.48 297 A 1 -ATOM 5154 O O . SER A1 1 307 ? -30.138 4.481 -14.798 1.0 20.74 297 A 1 -ATOM 5155 C CB . SER A1 1 307 ? -28.398 1.987 -14.352 1.0 21.77 297 A 1 -ATOM 5156 O OG . SER A1 1 307 ? -27.22 1.477 -13.82 1.0 26.42 297 A 1 -ATOM 5157 H H . SER A1 1 307 ? -27.328 3.946 -13.473 1.0 20.66 297 A 1 -ATOM 5158 H HA . SER A1 1 307 ? -27.526 3.072 -15.888 1.0 21.41 297 A 1 -ATOM 5159 H HB2 . SER A1 1 307 ? -29.014 2.187 -13.63 1.0 26.12 297 A 1 -ATOM 5160 H HB3 . SER A1 1 307 ? -28.789 1.33 -14.949 1.0 26.12 297 A 1 -ATOM 5161 H HG . SER A1 1 307 ? -26.669 1.326 -14.435 1.0 31.7 297 A 1 -ATOM 5162 N N . PRO A1 1 308 ? -29.875 3.548 -16.803 1.0 18.81 298 A 1 -ATOM 5163 C CA . PRO A1 1 308 ? -29.287 2.691 -17.843 1.0 19.51 298 A 1 -ATOM 5164 C C . PRO A1 1 308 ? -28.384 3.456 -18.794 1.0 19.19 298 A 1 -ATOM 5165 O O . PRO A1 1 308 ? -27.996 2.926 -19.874 1.0 21.47 298 A 1 -ATOM 5166 C CB . PRO A1 1 308 ? -30.524 2.185 -18.561 1.0 22.74 298 A 1 -ATOM 5167 C CG . PRO A1 1 308 ? -31.385 3.414 -18.625 1.0 21.38 298 A 1 -ATOM 5168 C CD . PRO A1 1 308 ? -31.225 4.003 -17.202 1.0 20.72 298 A 1 -ATOM 5169 H HA . PRO A1 1 308 ? -28.787 1.953 -17.461 1.0 23.41 298 A 1 -ATOM 5170 H HB2 . PRO A1 1 308 ? -30.296 1.863 -19.447 1.0 27.28 298 A 1 -ATOM 5171 H HB3 . PRO A1 1 308 ? -30.949 1.479 -18.05 1.0 27.28 298 A 1 -ATOM 5172 H HG2 . PRO A1 1 308 ? -31.057 4.025 -19.303 1.0 25.65 298 A 1 -ATOM 5173 H HG3 . PRO A1 1 308 ? -32.307 3.176 -18.81 1.0 25.65 298 A 1 -ATOM 5174 H HD2 . PRO A1 1 308 ? -31.272 4.972 -17.221 1.0 24.86 298 A 1 -ATOM 5175 H HD3 . PRO A1 1 308 ? -31.901 3.65 -16.603 1.0 24.86 298 A 1 -ATOM 5176 N N . TYR A1 1 309 ? -28.048 4.695 -18.476 1.0 17.4 299 A 1 -ATOM 5177 C CA . TYR A1 1 309 ? -27.313 5.569 -19.376 1.0 17.41 299 A 1 -ATOM 5178 C C . TYR A1 1 309 ? -25.84 5.37 -19.284 1.0 17.3 299 A 1 -ATOM 5179 O O . TYR A1 1 309 ? -25.127 5.583 -20.297 1.0 17.71 299 A 1 -ATOM 5180 C CB . TYR A1 1 309 ? -27.624 7.062 -19.091 1.0 16.55 299 A 1 -ATOM 5181 C CG . TYR A1 1 309 ? -29.097 7.333 -18.949 1.0 17.95 299 A 1 -ATOM 5182 C CD1 . TYR A1 1 309 ? -29.976 7.055 -19.948 1.0 19.37 299 A 1 -ATOM 5183 C CD2 . TYR A1 1 309 ? -29.591 7.86 -17.755 1.0 19.64 299 A 1 -ATOM 5184 C CE1 . TYR A1 1 309 ? -31.362 7.307 -19.788 1.0 20.15 299 A 1 -ATOM 5185 C CE2 . TYR A1 1 309 ? -30.955 8.118 -17.6 1.0 20.31 299 A 1 -ATOM 5186 C CZ . TYR A1 1 309 ? -31.798 7.858 -18.612 1.0 20.09 299 A 1 -ATOM 5187 O OH . TYR A1 1 309 ? -33.136 8.094 -18.468 1.0 25.16 299 A 1 -ATOM 5188 H H . TYR A1 1 309 ? -28.237 5.066 -17.723 1.0 20.88 299 A 1 -ATOM 5189 H HA . TYR A1 1 309 ? -27.608 5.362 -20.277 1.0 20.89 299 A 1 -ATOM 5190 H HB2 . TYR A1 1 309 ? -27.189 7.322 -18.264 1.0 19.86 299 A 1 -ATOM 5191 H HB3 . TYR A1 1 309 ? -27.289 7.6 -19.826 1.0 19.86 299 A 1 -ATOM 5192 H HD1 . TYR A1 1 309 ? -29.664 6.695 -20.747 1.0 23.24 299 A 1 -ATOM 5193 H HD2 . TYR A1 1 309 ? -29.005 8.042 -17.056 1.0 23.56 299 A 1 -ATOM 5194 H HE1 . TYR A1 1 309 ? -31.963 7.102 -20.467 1.0 24.18 299 A 1 -ATOM 5195 H HE2 . TYR A1 1 309 ? -31.277 8.468 -16.8 1.0 24.37 299 A 1 -ATOM 5196 H HH . TYR A1 1 309 ? -33.288 8.436 -17.716 1.0 30.2 299 A 1 -ATOM 5197 N N . ARG A1 1 310 ? -25.307 5.006 -18.114 1.0 16.47 300 A 1 -ATOM 5198 C CA . ARG A1 1 310 ? -23.862 5.016 -17.918 1.0 17.46 300 A 1 -ATOM 5199 C C . ARG A1 1 310 ? -23.14 4.226 -18.985 1.0 16.92 300 A 1 -ATOM 5200 O O . ARG A1 1 310 ? -22.094 4.662 -19.47 1.0 17.43 300 A 1 -ATOM 5201 C CB . ARG A1 1 310 ? -23.461 4.58 -16.489 1.0 18.08 300 A 1 -ATOM 5202 C CG . ARG A1 1 310 ? -23.861 3.226 -16.118 1.0 19.9 300 A 1 -ATOM 5203 C CD . ARG A1 1 310 ? -23.384 2.855 -14.689 1.0 22.89 300 A 1 -ATOM 5204 N NE . ARG A1 1 310 ? -23.852 1.494 -14.415 1.0 26.31 300 A 1 -ATOM 5205 C CZ . ARG A1 1 310 ? -23.528 0.76 -13.349 1.0 69.15 300 A 1 -ATOM 5206 N NH1 . ARG A1 1 310 ? -22.671 1.216 -12.48 1.0 30.14 300 A 1 -ATOM 5207 N NH2 . ARG A1 1 310 ? -24.04 -0.446 -13.169 1.0 34.75 300 A 1 -ATOM 5208 H H . ARG A1 1 310 ? -25.757 4.751 -17.427 1.0 19.77 300 A 1 -ATOM 5209 H HA . ARG A1 1 310 ? -23.569 5.937 -17.998 1.0 20.95 300 A 1 -ATOM 5210 H HB2 . ARG A1 1 310 ? -22.495 4.627 -16.415 1.0 21.7 300 A 1 -ATOM 5211 H HB3 . ARG A1 1 310 ? -23.873 5.188 -15.856 1.0 21.7 300 A 1 -ATOM 5212 H HG2 . ARG A1 1 310 ? -24.829 3.161 -16.142 1.0 23.88 300 A 1 -ATOM 5213 H HG3 . ARG A1 1 310 ? -23.471 2.594 -16.742 1.0 23.88 300 A 1 -ATOM 5214 H HD2 . ARG A1 1 310 ? -22.415 2.879 -14.641 1.0 27.47 300 A 1 -ATOM 5215 H HD3 . ARG A1 1 310 ? -23.764 3.465 -14.038 1.0 27.47 300 A 1 -ATOM 5216 H HE . ARG A1 1 310 ? -24.381 1.137 -14.991 1.0 31.58 300 A 1 -ATOM 5217 H HH11 . ARG A1 1 310 ? -22.314 1.99 -12.593 1.0 36.17 300 A 1 -ATOM 5218 H HH12 . ARG A1 1 310 ? -22.462 0.744 -11.792 1.0 36.17 300 A 1 -ATOM 5219 H HH21 . ARG A1 1 310 ? -24.591 -0.768 -13.745 1.0 41.69 300 A 1 -ATOM 5220 H HH22 . ARG A1 1 310 ? -23.822 -0.907 -12.477 1.0 41.69 300 A 1 -ATOM 5221 N N . GLN A1 1 311 ? -23.622 3.035 -19.295 1.0 17.02 301 A 1 -ATOM 5222 C CA . GLN A1 1 311 ? -22.952 2.165 -20.232 1.0 18.4 301 A 1 -ATOM 5223 C C . GLN A1 1 311 ? -22.954 2.708 -21.637 1.0 18.92 301 A 1 -ATOM 5224 O O . GLN A1 1 311 ? -22.175 2.216 -22.48 1.0 20.56 301 A 1 -ATOM 5225 C CB . GLN A1 1 311 ? -23.554 0.763 -20.219 1.0 20.57 301 A 1 -ATOM 5226 C CG . GLN A1 1 311 ? -24.981 0.661 -20.525 1.0 24.2 301 A 1 -ATOM 5227 C CD . GLN A1 1 311 ? -25.849 0.582 -19.299 1.0 63.45 301 A 1 -ATOM 5228 O OE1 . GLN A1 1 311 ? -25.677 1.347 -18.358 1.0 25.71 301 A 1 -ATOM 5229 N NE2 . GLN A1 1 311 ? -26.802 -0.349 -19.31 1.0 33.54 301 A 1 -ATOM 5230 H H . GLN A1 1 311 ? -24.347 2.705 -18.97 1.0 20.42 301 A 1 -ATOM 5231 H HA . GLN A1 1 311 ? -22.03 2.084 -19.942 1.0 22.08 301 A 1 -ATOM 5232 H HB2 . GLN A1 1 311 ? -23.083 0.227 -20.877 1.0 24.69 301 A 1 -ATOM 5233 H HB3 . GLN A1 1 311 ? -23.426 0.388 -19.334 1.0 24.69 301 A 1 -ATOM 5234 H HG2 . GLN A1 1 311 ? -25.25 1.445 -21.03 1.0 29.04 301 A 1 -ATOM 5235 H HG3 . GLN A1 1 311 ? -25.134 -0.14 -21.05 1.0 29.04 301 A 1 -ATOM 5236 H HE21 . GLN A1 1 311 ? -26.894 -0.863 -19.993 1.0 40.24 301 A 1 -ATOM 5237 H HE22 . GLN A1 1 311 ? -27.326 -0.435 -18.633 1.0 40.24 301 A 1 -ATOM 5238 N N . LEU A1 1 312 ? -23.787 3.697 -21.933 1.0 16.42 302 A 1 -ATOM 5239 C CA . LEU A1 1 312 ? -23.895 4.255 -23.284 1.0 16.46 302 A 1 -ATOM 5240 C C . LEU A1 1 312 ? -22.96 5.443 -23.5 1.0 15.77 302 A 1 -ATOM 5241 O O . LEU A1 1 312 ? -22.83 5.89 -24.672 1.0 15.8 302 A 1 -ATOM 5242 C CB . LEU A1 1 312 ? -25.346 4.678 -23.576 1.0 16.9 302 A 1 -ATOM 5243 C CG . LEU A1 1 312 ? -26.331 3.569 -23.443 1.0 17.68 302 A 1 -ATOM 5244 C CD1 . LEU A1 1 312 ? -27.744 4.09 -23.676 1.0 19.23 302 A 1 -ATOM 5245 C CD2 . LEU A1 1 312 ? -26.021 2.488 -24.407 1.0 20.07 302 A 1 -ATOM 5246 H H . LEU A1 1 312 ? -24.311 4.072 -21.363 1.0 19.7 302 A 1 -ATOM 5247 H HA . LEU A1 1 312 ? -23.662 3.567 -23.927 1.0 19.75 302 A 1 -ATOM 5248 H HB2 . LEU A1 1 312 ? -25.599 5.376 -22.951 1.0 20.28 302 A 1 -ATOM 5249 H HB3 . LEU A1 1 312 ? -25.396 5.013 -24.485 1.0 20.28 302 A 1 -ATOM 5250 H HG . LEU A1 1 312 ? -26.28 3.204 -22.546 1.0 21.22 302 A 1 -ATOM 5251 H HD11 . LEU A1 1 312 ? -28.371 3.356 -23.578 1.0 23.07 302 A 1 -ATOM 5252 H HD12 . LEU A1 1 312 ? -27.939 4.78 -23.023 1.0 23.07 302 A 1 -ATOM 5253 H HD13 . LEU A1 1 312 ? -27.802 4.457 -24.572 1.0 23.07 302 A 1 -ATOM 5254 H HD21 . LEU A1 1 312 ? -26.784 1.892 -24.469 1.0 24.08 302 A 1 -ATOM 5255 H HD22 . LEU A1 1 312 ? -25.836 2.881 -25.274 1.0 24.08 302 A 1 -ATOM 5256 H HD23 . LEU A1 1 312 ? -25.244 1.998 -24.093 1.0 24.08 302 A 1 -ATOM 5257 N N . TYR A1 1 313 ? -22.289 5.956 -22.488 1.0 15.68 303 A 1 -ATOM 5258 C CA . TYR A1 1 313 ? -21.38 7.093 -22.681 1.0 14.66 303 A 1 -ATOM 5259 C C . TYR A1 1 313 ? -20.004 6.561 -23.031 1.0 14.47 303 A 1 -ATOM 5260 O O . TYR A1 1 313 ? -19.031 6.683 -22.3 1.0 15.1 303 A 1 -ATOM 5261 C CB . TYR A1 1 313 ? -21.397 8.018 -21.48 1.0 15.6 303 A 1 -ATOM 5262 C CG . TYR A1 1 313 ? -20.821 9.362 -21.745 1.0 13.97 303 A 1 -ATOM 5263 C CD1 . TYR A1 1 313 ? -21.552 10.386 -22.332 1.0 13.97 303 A 1 -ATOM 5264 C CD2 . TYR A1 1 313 ? -19.541 9.635 -21.317 1.0 15.45 303 A 1 -ATOM 5265 C CE1 . TYR A1 1 313 ? -21.018 11.64 -22.503 1.0 13.67 303 A 1 -ATOM 5266 C CE2 . TYR A1 1 313 ? -19.02 10.894 -21.476 1.0 16.97 303 A 1 -ATOM 5267 C CZ . TYR A1 1 313 ? -19.748 11.872 -22.017 1.0 16.39 303 A 1 -ATOM 5268 O OH . TYR A1 1 313 ? -19.292 13.169 -22.168 1.0 19.86 303 A 1 -ATOM 5269 H H . TYR A1 1 313 ? -22.337 5.672 -21.678 1.0 18.82 303 A 1 -ATOM 5270 H HA . TYR A1 1 313 ? -21.682 7.629 -23.431 1.0 17.6 303 A 1 -ATOM 5271 H HB2 . TYR A1 1 313 ? -22.316 8.142 -21.196 1.0 18.72 303 A 1 -ATOM 5272 H HB3 . TYR A1 1 313 ? -20.881 7.611 -20.766 1.0 18.72 303 A 1 -ATOM 5273 H HD1 . TYR A1 1 313 ? -22.422 10.219 -22.615 1.0 16.76 303 A 1 -ATOM 5274 H HD2 . TYR A1 1 313 ? -19.03 8.966 -20.922 1.0 18.54 303 A 1 -ATOM 5275 H HE1 . TYR A1 1 313 ? -21.498 12.311 -22.932 1.0 16.4 303 A 1 -ATOM 5276 H HE2 . TYR A1 1 313 ? -18.149 11.068 -21.202 1.0 20.36 303 A 1 -ATOM 5277 H HH . TYR A1 1 313 ? -18.545 13.256 -21.794 1.0 23.84 303 A 1 -ATOM 5278 N N . GLN A1 1 314 ? -19.969 5.96 -24.216 1.0 14.85 304 A 1 -ATOM 5279 C CA . GLN A1 1 314 ? -18.878 5.075 -24.626 1.0 17.33 304 A 1 -ATOM 5280 C C . GLN A1 1 314 ? -17.781 5.827 -25.386 1.0 15.71 304 A 1 -ATOM 5281 O O . GLN A1 1 314 ? -17.565 5.592 -26.577 1.0 16.47 304 A 1 -ATOM 5282 C CB A GLN A1 1 314 ? -19.4 3.855 -25.415 0.79 17.21 304 A 1 -ATOM 5283 C CG A GLN A1 1 314 ? -20.194 2.877 -24.616 0.79 24.87 304 A 1 -ATOM 5284 C CD A GLN A1 1 314 ? -20.661 1.688 -25.458 0.79 73.53 304 A 1 -ATOM 5285 O OE1 A GLN A1 1 314 ? -20.007 1.285 -26.416 0.79 32.47 304 A 1 -ATOM 5286 N NE2 A GLN A1 1 314 ? -21.806 1.131 -25.1 0.79 31.79 304 A 1 -ATOM 5287 H H . GLN A1 1 314 ? -20.579 6.05 -24.816 1.0 17.81 304 A 1 -ATOM 5288 H HA . GLN A1 1 314 ? -18.475 4.736 -23.812 1.0 20.79 304 A 1 -ATOM 5289 H HB2 A GLN A1 1 314 ? -19.97 4.174 -26.132 0.79 20.65 304 A 1 -ATOM 5290 H HB3 A GLN A1 1 314 ? -18.639 3.379 -25.782 0.79 20.65 304 A 1 -ATOM 5291 H HG2 A GLN A1 1 314 ? -19.646 2.538 -23.891 0.79 29.84 304 A 1 -ATOM 5292 H HG3 A GLN A1 1 314 ? -20.979 3.321 -24.258 0.79 29.84 304 A 1 -ATOM 5293 H HE21 A GLN A1 1 314 ? -22.243 1.441 -24.427 0.79 38.15 304 A 1 -ATOM 5294 H HE22 A GLN A1 1 314 ? -22.113 0.46 -25.54 0.79 38.15 304 A 1 -ATOM 5295 N N . LEU A1 1 315 ? -17.1 6.765 -24.716 1.0 15.71 305 A 1 -ATOM 5296 C CA . LEU A1 1 315 ? -16.03 7.542 -25.374 1.0 15.41 305 A 1 -ATOM 5297 C C . LEU A1 1 315 ? -14.989 6.586 -25.921 1.0 16.25 305 A 1 -ATOM 5298 O O . LEU A1 1 315 ? -14.458 6.787 -27.031 1.0 15.31 305 A 1 -ATOM 5299 C CB . LEU A1 1 315 ? -15.346 8.461 -24.376 1.0 15.3 305 A 1 -ATOM 5300 C CG . LEU A1 1 315 ? -16.209 9.51 -23.675 1.0 15.67 305 A 1 -ATOM 5301 C CD1 . LEU A1 1 315 ? -15.35 10.234 -22.596 1.0 16.07 305 A 1 -ATOM 5302 C CD2 . LEU A1 1 315 ? -16.79 10.509 -24.636 1.0 16.96 305 A 1 -ATOM 5303 H H . LEU A1 1 315 ? -17.232 6.972 -23.892 1.0 18.86 305 A 1 -ATOM 5304 H HA . LEU A1 1 315 ? -16.42 8.083 -26.078 1.0 18.49 305 A 1 -ATOM 5305 H HB2 . LEU A1 1 315 ? -14.958 7.907 -23.681 1.0 18.36 305 A 1 -ATOM 5306 H HB3 . LEU A1 1 315 ? -14.647 8.941 -24.847 1.0 18.36 305 A 1 -ATOM 5307 H HG . LEU A1 1 315 ? -16.961 9.063 -23.256 1.0 18.8 305 A 1 -ATOM 5308 H HD11 . LEU A1 1 315 ? -15.9 10.894 -22.145 1.0 19.28 305 A 1 -ATOM 5309 H HD12 . LEU A1 1 315 ? -15.028 9.579 -21.957 1.0 19.28 305 A 1 -ATOM 5310 H HD13 . LEU A1 1 315 ? -14.599 10.669 -23.03 1.0 19.28 305 A 1 -ATOM 5311 H HD21 . LEU A1 1 315 ? -17.342 11.136 -24.144 1.0 20.35 305 A 1 -ATOM 5312 H HD22 . LEU A1 1 315 ? -16.066 10.982 -25.076 1.0 20.35 305 A 1 -ATOM 5313 H HD23 . LEU A1 1 315 ? -17.327 10.04 -25.293 1.0 20.35 305 A 1 -ATOM 5314 N N . TYR A1 1 316 ? -14.673 5.548 -25.152 1.0 14.82 306 A 1 -ATOM 5315 C CA . TYR A1 1 316 ? -13.669 4.543 -25.473 1.0 16.82 306 A 1 -ATOM 5316 C C . TYR A1 1 316 ? -14.016 3.255 -24.754 1.0 15.9 306 A 1 -ATOM 5317 O O . TYR A1 1 316 ? -14.711 3.276 -23.721 1.0 17.33 306 A 1 -ATOM 5318 C CB . TYR A1 1 316 ? -12.248 5.01 -25.07 1.0 16.15 306 A 1 -ATOM 5319 C CG . TYR A1 1 316 ? -12.156 5.626 -23.698 1.0 14.71 306 A 1 -ATOM 5320 C CD1 . TYR A1 1 316 ? -12.046 4.836 -22.566 1.0 16.48 306 A 1 -ATOM 5321 C CD2 . TYR A1 1 316 ? -12.173 6.982 -23.535 1.0 14.18 306 A 1 -ATOM 5322 C CE1 . TYR A1 1 316 ? -11.97 5.433 -21.302 1.0 15.72 306 A 1 -ATOM 5323 C CE2 . TYR A1 1 316 ? -12.12 7.56 -22.279 1.0 15.35 306 A 1 -ATOM 5324 C CZ . TYR A1 1 316 ? -12.041 6.764 -21.184 1.0 13.22 306 A 1 -ATOM 5325 O OH . TYR A1 1 316 ? -11.957 7.319 -19.915 1.0 16.85 306 A 1 -ATOM 5326 H H . TYR A1 1 316 ? -15.05 5.395 -24.394 1.0 17.78 306 A 1 -ATOM 5327 H HA . TYR A1 1 316 ? -13.683 4.374 -26.428 1.0 20.18 306 A 1 -ATOM 5328 H HB2 . TYR A1 1 316 ? -11.655 4.242 -25.086 1.0 19.38 306 A 1 -ATOM 5329 H HB3 . TYR A1 1 316 ? -11.948 5.675 -25.71 1.0 19.38 306 A 1 -ATOM 5330 H HD1 . TYR A1 1 316 ? -12.022 3.909 -22.646 1.0 19.77 306 A 1 -ATOM 5331 H HD2 . TYR A1 1 316 ? -12.223 7.529 -24.286 1.0 17.01 306 A 1 -ATOM 5332 H HE1 . TYR A1 1 316 ? -11.87 4.904 -20.543 1.0 18.87 306 A 1 -ATOM 5333 H HE2 . TYR A1 1 316 ? -12.138 8.485 -22.187 1.0 18.42 306 A 1 -ATOM 5334 H HH . TYR A1 1 316 ? -12.029 8.154 -19.961 1.0 20.21 306 A 1 -ATOM 5335 N N . PRO A1 1 317 ? -13.536 2.128 -25.241 1.0 17.12 307 A 1 -ATOM 5336 C CA . PRO A1 1 317 ? -13.842 0.847 -24.607 1.0 18.02 307 A 1 -ATOM 5337 C C . PRO A1 1 317 ? -13.255 0.758 -23.21 1.0 18.07 307 A 1 -ATOM 5338 O O . PRO A1 1 317 ? -12.182 1.317 -22.92 1.0 19.39 307 A 1 -ATOM 5339 C CB . PRO A1 1 317 ? -13.237 -0.198 -25.558 1.0 20.8 307 A 1 -ATOM 5340 C CG . PRO A1 1 317 ? -12.238 0.542 -26.322 1.0 23.69 307 A 1 -ATOM 5341 C CD . PRO A1 1 317 ? -12.718 1.944 -26.454 1.0 18.49 307 A 1 -ATOM 5342 H HA . PRO A1 1 317 ? -14.801 0.708 -24.563 1.0 21.62 307 A 1 -ATOM 5343 H HB2 . PRO A1 1 317 ? -12.827 -0.914 -25.048 1.0 24.96 307 A 1 -ATOM 5344 H HB3 . PRO A1 1 317 ? -13.926 -0.558 -26.139 1.0 24.96 307 A 1 -ATOM 5345 H HG2 . PRO A1 1 317 ? -11.392 0.519 -25.848 1.0 28.42 307 A 1 -ATOM 5346 H HG3 . PRO A1 1 317 ? -12.139 0.135 -27.197 1.0 28.42 307 A 1 -ATOM 5347 H HD2 . PRO A1 1 317 ? -11.974 2.566 -26.468 1.0 22.19 307 A 1 -ATOM 5348 H HD3 . PRO A1 1 317 ? -13.256 2.052 -27.254 1.0 22.19 307 A 1 -ATOM 5349 N N . GLY A1 1 318 ? -13.971 0.031 -22.367 1.0 19.52 308 A 1 -ATOM 5350 C CA . GLY A1 1 318 ? -13.543 -0.183 -20.986 1.0 19.47 308 A 1 -ATOM 5351 C C . GLY A1 1 318 ? -13.8 0.961 -20.06 1.0 19.42 308 A 1 -ATOM 5352 O O . GLY A1 1 318 ? -13.447 0.854 -18.878 1.0 19.58 308 A 1 -ATOM 5353 H H . GLY A1 1 318 ? -14.714 -0.353 -22.567 1.0 23.43 308 A 1 -ATOM 5354 H HA2 . GLY A1 1 318 ? -14.007 -0.958 -20.634 1.0 23.37 308 A 1 -ATOM 5355 H HA3 . GLY A1 1 318 ? -12.589 -0.358 -20.981 1.0 23.37 308 A 1 -ATOM 5356 N N . LYS A1 1 319 ? -14.383 2.061 -20.539 1.0 20.14 309 A 1 -ATOM 5357 C CA . LYS A1 1 319 ? -14.572 3.242 -19.69 1.0 18.89 309 A 1 -ATOM 5358 C C . LYS A1 1 319 ? -15.468 2.964 -18.5 1.0 21.67 309 A 1 -ATOM 5359 O O . LYS A1 1 319 ? -15.23 3.451 -17.389 1.0 20.12 309 A 1 -ATOM 5360 C CB . LYS A1 1 319 ? -15.172 4.345 -20.494 1.0 17.63 309 A 1 -ATOM 5361 C CG . LYS A1 1 319 ? -15.379 5.642 -19.676 1.0 18.42 309 A 1 -ATOM 5362 C CD . LYS A1 1 319 ? -15.923 6.751 -20.479 1.0 20.1 309 A 1 -ATOM 5363 C CE . LYS A1 1 319 ? -16.266 7.969 -19.631 1.0 19.54 309 A 1 -ATOM 5364 N NZ . LYS A1 1 319 ? -17.229 7.634 -18.517 1.0 22.39 309 A 1 -ATOM 5365 H H . LYS A1 1 319 ? -14.676 2.151 -21.343 1.0 24.17 309 A 1 -ATOM 5366 H HA . LYS A1 1 319 ? -13.701 3.508 -19.358 1.0 22.67 309 A 1 -ATOM 5367 H HB2 . LYS A1 1 319 ? -14.583 4.55 -21.237 1.0 21.16 309 A 1 -ATOM 5368 H HB3 . LYS A1 1 319 ? -16.037 4.059 -20.826 1.0 21.16 309 A 1 -ATOM 5369 H HG2 . LYS A1 1 319 ? -16.001 5.464 -18.954 1.0 22.1 309 A 1 -ATOM 5370 H HG3 . LYS A1 1 319 ? -14.525 5.927 -19.315 1.0 22.1 309 A 1 -ATOM 5371 H HD2 . LYS A1 1 319 ? -15.264 7.02 -21.139 1.0 24.12 309 A 1 -ATOM 5372 H HD3 . LYS A1 1 319 ? -16.734 6.455 -20.922 1.0 24.12 309 A 1 -ATOM 5373 H HE2 . LYS A1 1 319 ? -15.453 8.319 -19.233 1.0 23.45 309 A 1 -ATOM 5374 H HE3 . LYS A1 1 319 ? -16.677 8.644 -20.194 1.0 23.45 309 A 1 -ATOM 5375 H HZ1 . LYS A1 1 319 ? -17.493 8.379 -18.109 1.0 26.86 309 A 1 -ATOM 5376 H HZ2 . LYS A1 1 319 ? -17.942 7.217 -18.847 1.0 26.86 309 A 1 -ATOM 5377 H HZ3 . LYS A1 1 319 ? -16.833 7.103 -17.922 1.0 26.86 309 A 1 -ATOM 5378 N N . ILE A1 1 320 ? -16.517 2.178 -18.712 1.0 24.59 310 A 1 -ATOM 5379 C CA . ILE A1 1 320 ? -17.585 1.995 -17.76 1.0 22.85 310 A 1 -ATOM 5380 C C . ILE A1 1 320 ? -17.492 0.581 -17.212 1.0 24.84 310 A 1 -ATOM 5381 O O . ILE A1 1 320 ? -17.293 -0.355 -17.989 1.0 29.21 310 A 1 -ATOM 5382 C CB . ILE A1 1 320 ? -18.937 2.218 -18.478 1.0 24.18 310 A 1 -ATOM 5383 C CG1 . ILE A1 1 320 ? -18.993 3.639 -19.055 1.0 32.19 310 A 1 -ATOM 5384 C CG2 . ILE A1 1 320 ? -20.087 2.001 -17.498 1.0 26.48 310 A 1 -ATOM 5385 C CD1 . ILE A1 1 320 ? -19.09 3.684 -20.578 1.0 31.92 310 A 1 -ATOM 5386 H H . ILE A1 1 320 ? -16.629 1.723 -19.434 1.0 29.51 310 A 1 -ATOM 5387 H HA . ILE A1 1 320 ? -17.497 2.609 -17.014 1.0 27.42 310 A 1 -ATOM 5388 H HB . ILE A1 1 320 ? -19.018 1.581 -19.205 1.0 29.02 310 A 1 -ATOM 5389 H HG12 . ILE A1 1 320 ? -19.772 4.091 -18.696 1.0 38.62 310 A 1 -ATOM 5390 H HG13 . ILE A1 1 320 ? -18.186 4.112 -18.797 1.0 38.62 310 A 1 -ATOM 5391 H HG21 . ILE A1 1 320 ? -20.915 2.29 -17.914 1.0 31.77 310 A 1 -ATOM 5392 H HG22 . ILE A1 1 320 ? -20.14 1.058 -17.277 1.0 31.77 310 A 1 -ATOM 5393 H HG23 . ILE A1 1 320 ? -19.921 2.52 -16.696 1.0 31.77 310 A 1 -ATOM 5394 H HD11 . ILE A1 1 320 ? -19.127 4.61 -20.865 1.0 38.3 310 A 1 -ATOM 5395 H HD12 . ILE A1 1 320 ? -18.31 3.251 -20.958 1.0 38.3 310 A 1 -ATOM 5396 H HD13 . ILE A1 1 320 ? -19.895 3.219 -20.857 1.0 38.3 310 A 1 -ATOM 5397 N N . SER A1 1 321 ? -17.602 0.404 -15.902 1.0 22.11 311 A 1 -ATOM 5398 C CA . SER A1 1 321 ? -17.868 -0.902 -15.328 1.0 26.14 311 A 1 -ATOM 5399 C C . SER A1 1 321 ? -19.333 -0.976 -14.938 1.0 20.64 311 A 1 -ATOM 5400 O O . SER A1 1 321 ? -19.854 -0.039 -14.314 1.0 27.49 311 A 1 -ATOM 5401 C CB . SER A1 1 321 ? -17.051 -1.185 -14.068 1.0 24.66 311 A 1 -ATOM 5402 O OG . SER A1 1 321 ? -17.387 -2.461 -13.589 1.0 26.64 311 A 1 -ATOM 5403 H H . SER A1 1 321 ? -17.524 1.033 -15.321 1.0 26.53 311 A 1 -ATOM 5404 H HA . SER A1 1 321 ? -17.636 -1.569 -15.993 1.0 31.37 311 A 1 -ATOM 5405 H HB2 . SER A1 1 321 ? -16.105 -1.157 -14.282 1.0 29.59 311 A 1 -ATOM 5406 H HB3 . SER A1 1 321 ? -17.257 -0.52 -13.392 1.0 29.59 311 A 1 -ATOM 5407 H HG . SER A1 1 321 ? -16.962 -2.624 -12.883 1.0 31.97 311 A 1 -ATOM 5408 N N . VAL A1 1 322 ? -19.937 -2.097 -15.243 1.0 23.31 312 A 1 -ATOM 5409 C CA . VAL A1 1 322 ? -21.317 -2.34 -14.845 1.0 24.23 312 A 1 -ATOM 5410 C C . VAL A1 1 322 ? -21.434 -3.435 -13.791 1.0 22.2 312 A 1 -ATOM 5411 O O . VAL A1 1 322 ? -22.501 -3.895 -13.508 1.0 23.1 312 A 1 -ATOM 5412 C CB . VAL A1 1 322 ? -22.224 -2.624 -16.05 1.0 40.4 312 A 1 -ATOM 5413 C CG1 . VAL A1 1 322 ? -22.41 -1.349 -16.863 1.0 38.25 312 A 1 -ATOM 5414 C CG2 . VAL A1 1 322 ? -21.653 -3.767 -16.876 1.0 27.49 312 A 1 -ATOM 5415 H H . VAL A1 1 322 ? -19.574 -2.741 -15.682 1.0 27.98 312 A 1 -ATOM 5416 H HA . VAL A1 1 322 ? -21.632 -1.522 -14.43 1.0 29.07 312 A 1 -ATOM 5417 H HB . VAL A1 1 322 ? -23.103 -2.905 -15.753 1.0 48.47 312 A 1 -ATOM 5418 H HG11 . VAL A1 1 322 ? -22.988 -1.537 -17.618 1.0 45.91 312 A 1 -ATOM 5419 H HG12 . VAL A1 1 322 ? -22.814 -0.671 -16.299 1.0 45.91 312 A 1 -ATOM 5420 H HG13 . VAL A1 1 322 ? -21.544 -1.045 -17.176 1.0 45.91 312 A 1 -ATOM 5421 H HG21 . VAL A1 1 322 ? -22.284 -3.995 -17.577 1.0 32.99 312 A 1 -ATOM 5422 H HG22 . VAL A1 1 322 ? -20.811 -3.485 -17.266 1.0 32.99 312 A 1 -ATOM 5423 H HG23 . VAL A1 1 322 ? -21.51 -4.533 -16.298 1.0 32.99 312 A 1 -ATOM 5424 N N . PHE A1 1 323 ? -20.31 -3.785 -13.16 1.0 23.98 313 A 1 -ATOM 5425 C CA . PHE A1 1 323 ? -20.31 -4.833 -12.176 1.0 25.04 313 A 1 -ATOM 5426 C C . PHE A1 1 323 ? -20.889 -4.409 -10.834 1.0 25.55 313 A 1 -ATOM 5427 O O . PHE A1 1 323 ? -21.292 -5.278 -10.057 1.0 31.7 313 A 1 -ATOM 5428 C CB . PHE A1 1 323 ? -18.858 -5.33 -11.995 1.0 31.16 313 A 1 -ATOM 5429 C CG . PHE A1 1 323 ? -18.69 -6.807 -12.186 1.0 29.22 313 A 1 -ATOM 5430 C CD1 . PHE A1 1 323 ? -19.032 -7.409 -13.373 1.0 33.8 313 A 1 -ATOM 5431 C CD2 . PHE A1 1 323 ? -18.142 -7.577 -11.188 1.0 32.48 313 A 1 -ATOM 5432 C CE1 . PHE A1 1 323 ? -18.87 -8.785 -13.528 1.0 36.76 313 A 1 -ATOM 5433 C CE2 . PHE A1 1 323 ? -17.981 -8.924 -11.345 1.0 40.01 313 A 1 -ATOM 5434 C CZ . PHE A1 1 323 ? -18.351 -9.517 -12.532 1.0 43.86 313 A 1 -ATOM 5435 H H . PHE A1 1 323 ? -19.542 -3.422 -13.294 1.0 28.78 313 A 1 -ATOM 5436 H HA . PHE A1 1 323 ? -20.861 -5.567 -12.489 1.0 30.04 313 A 1 -ATOM 5437 H HB2 . PHE A1 1 323 ? -18.293 -4.883 -12.644 1.0 37.39 313 A 1 -ATOM 5438 H HB3 . PHE A1 1 323 ? -18.565 -5.114 -11.096 1.0 37.39 313 A 1 -ATOM 5439 H HD1 . PHE A1 1 323 ? -19.372 -6.899 -14.073 1.0 40.56 313 A 1 -ATOM 5440 H HD2 . PHE A1 1 323 ? -17.877 -7.175 -10.393 1.0 38.97 313 A 1 -ATOM 5441 H HE1 . PHE A1 1 323 ? -19.121 -9.195 -14.323 1.0 44.11 313 A 1 -ATOM 5442 H HE2 . PHE A1 1 323 ? -17.624 -9.437 -10.656 1.0 48.01 313 A 1 -ATOM 5443 H HZ . PHE A1 1 323 ? -18.241 -10.434 -12.643 1.0 52.63 313 A 1 -ATOM 5444 N N . GLU A1 1 324 ? -20.959 -3.11 -10.558 1.0 24.69 314 A 1 -ATOM 5445 C CA . GLU A1 1 324 ? -21.51 -2.624 -9.29 1.0 24.5 314 A 1 -ATOM 5446 C C . GLU A1 1 324 ? -22.658 -1.64 -9.554 1.0 25.68 314 A 1 -ATOM 5447 O O . GLU A1 1 324 ? -22.822 -1.103 -10.658 1.0 24.92 314 A 1 -ATOM 5448 C CB . GLU A1 1 324 ? -20.437 -1.928 -8.438 1.0 27.86 314 A 1 -ATOM 5449 C CG . GLU A1 1 324 ? -19.16 -2.751 -8.139 1.0 52.87 314 A 1 -ATOM 5450 C CD . GLU A1 1 324 ? -19.422 -3.945 -7.245 1.0 83.51 314 A 1 -ATOM 5451 O OE1 . GLU A1 1 324 ? -20.33 -3.856 -6.393 1.0 102.39 314 A 1 -ATOM 5452 O OE2 . GLU A1 1 324 ? -18.723 -4.974 -7.392 1.0 83.86 314 A 1 -ATOM 5453 H H . GLU A1 1 324 ? -20.694 -2.487 -11.088 1.0 29.63 314 A 1 -ATOM 5454 H HA . GLU A1 1 324 ? -21.859 -3.381 -8.793 1.0 29.4 314 A 1 -ATOM 5455 H HB2 . GLU A1 1 324 ? -20.156 -1.124 -8.903 1.0 33.43 314 A 1 -ATOM 5456 H HB3 . GLU A1 1 324 ? -20.833 -1.695 -7.584 1.0 33.43 314 A 1 -ATOM 5457 H HG2 . GLU A1 1 324 ? -18.794 -3.079 -8.975 1.0 63.44 314 A 1 -ATOM 5458 H HG3 . GLU A1 1 324 ? -18.514 -2.18 -7.695 1.0 63.44 314 A 1 -ATOM 5459 N N . LYS A1 1 325 ? -23.476 -1.436 -8.531 1.0 25.65 315 A 1 -ATOM 5460 C CA . LYS A1 1 325 ? -24.557 -0.449 -8.595 1.0 25.72 315 A 1 -ATOM 5461 C C . LYS A1 1 325 ? -24.026 0.953 -8.89 1.0 21.53 315 A 1 -ATOM 5462 O O . LYS A1 1 325 ? -22.887 1.295 -8.589 1.0 21.86 315 A 1 -ATOM 5463 C CB . LYS A1 1 325 ? -25.325 -0.44 -7.254 1.0 31.43 315 A 1 -ATOM 5464 C CG . LYS A1 1 325 ? -24.549 0.06 -6.041 1.0 73.12 315 A 1 -ATOM 5465 C CD . LYS A1 1 325 ? -25.355 -0.162 -4.756 1.0 65.48 315 A 1 -ATOM 5466 H H . LYS A1 1 325 ? -23.431 -1.855 -7.781 1.0 30.78 315 A 1 -ATOM 5467 H HA . LYS A1 1 325 ? -25.163 -0.689 -9.313 1.0 30.86 315 A 1 -ATOM 5468 H HB2 . LYS A1 1 325 ? -26.101 0.132 -7.353 1.0 37.72 315 A 1 -ATOM 5469 H HB3 . LYS A1 1 325 ? -25.605 -1.349 -7.059 1.0 37.72 315 A 1 -ATOM 5470 H HG2 . LYS A1 1 325 ? -23.712 -0.424 -5.969 1.0 87.74 315 A 1 -ATOM 5471 H HG3 . LYS A1 1 325 ? -24.376 1.01 -6.137 1.0 87.74 315 A 1 -ATOM 5472 N N . ASP A1 1 326 ? -24.868 1.794 -9.538 1.0 19.92 316 A 1 -ATOM 5473 C CA . ASP A1 1 326 ? -24.454 3.09 -10.013 1.0 18.3 316 A 1 -ATOM 5474 C C . ASP A1 1 326 ? -24.228 4.137 -8.931 1.0 19.27 316 A 1 -ATOM 5475 O O . ASP A1 1 326 ? -23.816 5.241 -9.24 1.0 20.65 316 A 1 -ATOM 5476 C CB . ASP A1 1 326 ? -25.371 3.597 -11.129 1.0 17.69 316 A 1 -ATOM 5477 C CG . ASP A1 1 326 ? -26.736 3.983 -10.663 1.0 18.65 316 A 1 -ATOM 5478 O OD1 . ASP A1 1 326 ? -26.908 4.285 -9.447 1.0 21.16 316 A 1 -ATOM 5479 O OD2 . ASP A1 1 326 ? -27.682 4.022 -11.449 1.0 19.7 316 A 1 -ATOM 5480 H H . ASP A1 1 326 ? -25.692 1.615 -9.707 1.0 23.91 316 A 1 -ATOM 5481 H HA . ASP A1 1 326 ? -23.583 2.973 -10.423 1.0 21.96 316 A 1 -ATOM 5482 H HB2 . ASP A1 1 326 ? -24.966 4.379 -11.535 1.0 21.23 316 A 1 -ATOM 5483 H HB3 . ASP A1 1 326 ? -25.473 2.895 -11.791 1.0 21.23 316 A 1 -ATOM 5484 N N . THR A1 1 327 ? -24.415 3.789 -7.668 1.0 20.47 317 A 1 -ATOM 5485 C CA . THR A1 1 327 ? -24.059 4.685 -6.564 1.0 21.89 317 A 1 -ATOM 5486 C C . THR A1 1 327 ? -22.764 4.293 -5.893 1.0 24.01 317 A 1 -ATOM 5487 O O . THR A1 1 327 ? -22.422 4.87 -4.856 1.0 23.85 317 A 1 -ATOM 5488 C CB . THR A1 1 327 ? -25.153 4.702 -5.506 1.0 24.67 317 A 1 -ATOM 5489 O OG1 . THR A1 1 327 ? -25.482 3.363 -5.172 1.0 27.53 317 A 1 -ATOM 5490 C CG2 . THR A1 1 327 ? -26.396 5.4 -6.009 1.0 25.25 317 A 1 -ATOM 5491 H H . THR A1 1 327 ? -24.749 3.036 -7.417 1.0 24.57 317 A 1 -ATOM 5492 H HA . THR A1 1 327 ? -23.971 5.576 -6.935 1.0 26.27 317 A 1 -ATOM 5493 H HB . THR A1 1 327 ? -24.837 5.183 -4.726 1.0 29.61 317 A 1 -ATOM 5494 H HG1 . THR A1 1 327 ? -26.102 3.352 -4.605 1.0 33.03 317 A 1 -ATOM 5495 H HG21 . THR A1 1 327 ? -27.08 5.395 -5.322 1.0 30.3 317 A 1 -ATOM 5496 H HG22 . THR A1 1 327 ? -26.19 6.319 -6.241 1.0 30.3 317 A 1 -ATOM 5497 H HG23 . THR A1 1 327 ? -26.737 4.945 -6.796 1.0 30.3 317 A 1 -ATOM 5498 N N . ALA A1 1 328 ? -22.009 3.37 -6.455 1.0 18.76 318 A 1 -ATOM 5499 C CA . ALA A1 1 328 ? -20.843 2.86 -5.758 1.0 19.62 318 A 1 -ATOM 5500 C C . ALA A1 1 328 ? -19.644 3.769 -5.899 1.0 18.27 318 A 1 -ATOM 5501 O O . ALA A1 1 328 ? -18.714 3.686 -5.088 1.0 19.65 318 A 1 -ATOM 5502 C CB . ALA A1 1 328 ? -20.469 1.477 -6.311 1.0 26.21 318 A 1 -ATOM 5503 H H . ALA A1 1 328 ? -22.148 3.024 -7.23 1.0 22.51 318 A 1 -ATOM 5504 H HA . ALA A1 1 328 ? -21.059 2.774 -4.817 1.0 23.55 318 A 1 -ATOM 5505 H HB1 . ALA A1 1 328 ? -19.69 1.147 -5.836 1.0 31.46 318 A 1 -ATOM 5506 H HB2 . ALA A1 1 328 ? -21.216 0.872 -6.182 1.0 31.46 318 A 1 -ATOM 5507 H HB3 . ALA A1 1 328 ? -20.269 1.558 -7.257 1.0 31.46 318 A 1 -ATOM 5508 N N . SER A1 1 329 ? -19.561 4.622 -6.929 1.0 18.3 319 A 1 -ATOM 5509 C CA . SER A1 1 329 ? -18.293 5.27 -7.242 1.0 17.23 319 A 1 -ATOM 5510 C C . SER A1 1 329 ? -17.842 6.284 -6.188 1.0 17.17 319 A 1 -ATOM 5511 O O . SER A1 1 329 ? -16.639 6.365 -5.917 1.0 17.99 319 A 1 -ATOM 5512 C CB . SER A1 1 329 ? -18.312 5.978 -8.581 1.0 16.69 319 A 1 -ATOM 5513 O OG . SER A1 1 329 ? -19.32 6.988 -8.53 1.0 19.34 319 A 1 -ATOM 5514 H H . SER A1 1 329 ? -20.214 4.836 -7.447 1.0 21.96 319 A 1 -ATOM 5515 H HA . SER A1 1 329 ? -17.657 4.539 -7.279 1.0 20.67 319 A 1 -ATOM 5516 H HB2 . SER A1 1 329 ? -17.448 6.387 -8.747 1.0 20.03 319 A 1 -ATOM 5517 H HB3 . SER A1 1 329 ? -18.519 5.344 -9.284 1.0 20.03 319 A 1 -ATOM 5518 H HG . SER A1 1 329 ? -19.361 7.39 -9.267 1.0 23.2 319 A 1 -ATOM 5519 N N . ILE A1 1 330 ? -18.751 7.058 -5.601 1.0 17.95 320 A 1 -ATOM 5520 C CA . ILE A1 1 330 ? -18.299 8.056 -4.626 1.0 16.79 320 A 1 -ATOM 5521 C C . ILE A1 1 330 ? -17.751 7.36 -3.392 1.0 18.68 320 A 1 -ATOM 5522 O O . ILE A1 1 330 ? -16.625 7.67 -2.977 1.0 17.76 320 A 1 -ATOM 5523 C CB . ILE A1 1 330 ? -19.393 9.109 -4.365 1.0 17.5 320 A 1 -ATOM 5524 C CG1 . ILE A1 1 330 ? -19.606 9.965 -5.622 1.0 17.26 320 A 1 -ATOM 5525 C CG2 . ILE A1 1 330 ? -18.974 10.004 -3.216 1.0 19.47 320 A 1 -ATOM 5526 C CD1 . ILE A1 1 330 ? -20.823 10.857 -5.525 1.0 18.92 320 A 1 -ATOM 5527 H H . ILE A1 1 330 ? -19.599 7.028 -5.743 1.0 21.54 320 A 1 -ATOM 5528 H HA . ILE A1 1 330 ? -17.541 8.549 -4.978 1.0 20.15 320 A 1 -ATOM 5529 H HB . ILE A1 1 330 ? -20.219 8.653 -4.142 1.0 21.0 320 A 1 -ATOM 5530 H HG12 . ILE A1 1 330 ? -18.829 10.531 -5.754 1.0 20.71 320 A 1 -ATOM 5531 H HG13 . ILE A1 1 330 ? -19.723 9.38 -6.386 1.0 20.71 320 A 1 -ATOM 5532 H HG21 . ILE A1 1 330 ? -19.58 10.759 -3.166 1.0 23.37 320 A 1 -ATOM 5533 H HG22 . ILE A1 1 330 ? -19.011 9.496 -2.39 1.0 23.37 320 A 1 -ATOM 5534 H HG23 . ILE A1 1 330 ? -18.069 10.316 -3.372 1.0 23.37 320 A 1 -ATOM 5535 H HD11 . ILE A1 1 330 ? -21.021 11.218 -6.404 1.0 22.71 320 A 1 -ATOM 5536 H HD12 . ILE A1 1 330 ? -21.575 10.333 -5.206 1.0 22.71 320 A 1 -ATOM 5537 H HD13 . ILE A1 1 330 ? -20.637 11.58 -4.905 1.0 22.71 320 A 1 -ATOM 5538 N N . PRO A1 1 331 ? -18.468 6.397 -2.778 1.0 18.49 321 A 1 -ATOM 5539 C CA . PRO A1 1 331 ? -17.845 5.67 -1.65 1.0 18.55 321 A 1 -ATOM 5540 C C . PRO A1 1 331 ? -16.558 4.984 -2.046 1.0 20.0 321 A 1 -ATOM 5541 O O . PRO A1 1 331 ? -15.611 4.912 -1.243 1.0 21.27 321 A 1 -ATOM 5542 C CB . PRO A1 1 331 ? -18.927 4.668 -1.24 1.0 23.13 321 A 1 -ATOM 5543 C CG . PRO A1 1 331 ? -20.183 5.237 -1.751 1.0 24.74 321 A 1 -ATOM 5544 C CD . PRO A1 1 331 ? -19.89 6.048 -2.958 1.0 18.85 321 A 1 -ATOM 5545 H HA . PRO A1 1 331 ? -17.679 6.27 -0.906 1.0 22.26 321 A 1 -ATOM 5546 H HB2 . PRO A1 1 331 ? -18.747 3.805 -1.643 1.0 27.76 321 A 1 -ATOM 5547 H HB3 . PRO A1 1 331 ? -18.951 4.585 -0.274 1.0 27.76 321 A 1 -ATOM 5548 H HG2 . PRO A1 1 331 ? -20.787 4.512 -1.977 1.0 29.69 321 A 1 -ATOM 5549 H HG3 . PRO A1 1 331 ? -20.578 5.796 -1.063 1.0 29.69 321 A 1 -ATOM 5550 H HD2 . PRO A1 1 331 ? -20.02 5.527 -3.766 1.0 22.62 321 A 1 -ATOM 5551 H HD3 . PRO A1 1 331 ? -20.443 6.845 -2.984 1.0 22.62 321 A 1 -ATOM 5552 N N A SER A1 1 332 ? -16.507 4.448 -3.256 0.56 19.79 322 A 1 -ATOM 5553 N N B SER A1 1 332 ? -16.441 4.496 -3.281 0.44 20.37 322 A 1 -ATOM 5554 C CA A SER A1 1 332 ? -15.303 3.768 -3.692 0.56 20.98 322 A 1 -ATOM 5555 C CA B SER A1 1 332 ? -15.237 3.759 -3.674 0.44 19.27 322 A 1 -ATOM 5556 C C A SER A1 1 332 ? -14.123 4.718 -3.647 0.56 23.17 322 A 1 -ATOM 5557 C C B SER A1 1 332 ? -14.028 4.68 -3.83 0.44 16.26 322 A 1 -ATOM 5558 O O A SER A1 1 332 ? -13.097 4.395 -3.022 0.56 20.9 322 A 1 -ATOM 5559 O O B SER A1 1 332 ? -12.874 4.295 -3.549 0.44 15.88 322 A 1 -ATOM 5560 C CB A SER A1 1 332 ? -15.463 3.204 -5.099 0.56 24.07 322 A 1 -ATOM 5561 C CB B SER A1 1 332 ? -15.483 3.03 -4.989 0.44 21.2 322 A 1 -ATOM 5562 O OG A SER A1 1 332 ? -14.279 2.531 -5.479 0.56 23.29 322 A 1 -ATOM 5563 O OG B SER A1 1 332 ? -16.397 1.978 -4.789 0.44 28.67 322 A 1 -ATOM 5564 H H A SER A1 1 332 ? -17.146 4.463 -3.832 0.56 23.75 322 A 1 -ATOM 5565 H H B SER A1 1 332 ? -17.033 4.574 -3.9 0.44 24.44 322 A 1 -ATOM 5566 H HA A SER A1 1 332 ? -15.144 3.02 -3.096 0.56 25.17 322 A 1 -ATOM 5567 H HA B SER A1 1 332 ? -15.041 3.113 -2.977 0.44 23.12 322 A 1 -ATOM 5568 H HB2 A SER A1 1 332 ? -16.205 2.58 -5.112 0.56 28.88 322 A 1 -ATOM 5569 H HB2 B SER A1 1 332 ? -15.85 3.653 -5.636 0.44 25.44 322 A 1 -ATOM 5570 H HB3 A SER A1 1 332 ? -15.631 3.932 -5.719 0.56 28.88 322 A 1 -ATOM 5571 H HB3 B SER A1 1 332 ? -14.645 2.667 -5.315 0.44 25.44 322 A 1 -ATOM 5572 H HG A SER A1 1 332 ? -14.361 2.221 -6.255 0.56 27.94 322 A 1 -ATOM 5573 H HG B SER A1 1 332 ? -17.134 2.283 -4.525 0.44 34.4 322 A 1 -ATOM 5574 N N . VAL A1 1 333 ? -14.249 5.892 -4.303 1.0 18.49 323 A 1 -ATOM 5575 C CA . VAL A1 1 333 ? -13.124 6.833 -4.349 1.0 18.01 323 A 1 -ATOM 5576 C C . VAL A1 1 333 ? -12.791 7.329 -2.952 1.0 18.58 323 A 1 -ATOM 5577 O O . VAL A1 1 333 ? -11.62 7.585 -2.675 1.0 18.77 323 A 1 -ATOM 5578 C CB . VAL A1 1 333 ? -13.245 7.971 -5.382 1.0 17.37 323 A 1 -ATOM 5579 C CG1 . VAL A1 1 333 ? -13.41 7.427 -6.784 1.0 19.45 323 A 1 -ATOM 5580 C CG2 . VAL A1 1 333 ? -14.297 8.915 -5.053 1.0 19.52 323 A 1 -ATOM 5581 H H A VAL A1 1 333 ? -14.957 6.154 -4.715 0.56 22.18 323 A 1 -ATOM 5582 H H B VAL A1 1 333 ? -15.002 6.19 -4.592 0.44 22.18 323 A 1 -ATOM 5583 H HA . VAL A1 1 333 ? -12.375 6.32 -4.692 1.0 21.61 323 A 1 -ATOM 5584 H HB . VAL A1 1 333 ? -12.413 8.469 -5.354 1.0 20.84 323 A 1 -ATOM 5585 H HG11 . VAL A1 1 333 ? -13.461 8.169 -7.407 1.0 23.34 323 A 1 -ATOM 5586 H HG12 . VAL A1 1 333 ? -12.647 6.868 -6.998 1.0 23.34 323 A 1 -ATOM 5587 H HG13 . VAL A1 1 333 ? -14.226 6.904 -6.826 1.0 23.34 323 A 1 -ATOM 5588 H HG21 . VAL A1 1 333 ? -14.403 9.539 -5.788 1.0 23.42 323 A 1 -ATOM 5589 H HG22 . VAL A1 1 333 ? -15.124 8.429 -4.909 1.0 23.42 323 A 1 -ATOM 5590 H HG23 . VAL A1 1 333 ? -14.05 9.394 -4.246 1.0 23.42 323 A 1 -ATOM 5591 N N . MET A1 1 334 ? -13.763 7.47 -2.07 1.0 18.53 324 A 1 -ATOM 5592 C CA A MET A1 1 334 ? -13.414 7.85 -0.705 0.69 21.48 324 A 1 -ATOM 5593 C CA B MET A1 1 334 ? -13.446 7.833 -0.687 0.31 14.97 324 A 1 -ATOM 5594 C C . MET A1 1 334 ? -12.542 6.794 -0.038 1.0 20.99 324 A 1 -ATOM 5595 O O . MET A1 1 334 ? -11.567 7.134 0.663 1.0 20.29 324 A 1 -ATOM 5596 C CB A MET A1 1 334 ? -14.684 8.131 0.089 0.69 25.64 324 A 1 -ATOM 5597 C CB B MET A1 1 334 ? -14.738 7.951 0.121 0.31 15.87 324 A 1 -ATOM 5598 C CG A MET A1 1 334 ? -15.387 9.377 -0.412 0.69 20.52 324 A 1 -ATOM 5599 C CG B MET A1 1 334 ? -15.628 9.09 -0.286 0.31 23.18 324 A 1 -ATOM 5600 S SD A MET A1 1 334 ? -16.93 9.689 0.457 0.69 25.19 324 A 1 -ATOM 5601 S SD B MET A1 1 334 ? -15.039 10.637 0.414 0.31 29.02 324 A 1 -ATOM 5602 C CE A MET A1 1 334 ? -17.375 11.339 -0.101 0.69 27.29 324 A 1 -ATOM 5603 C CE B MET A1 1 334 ? -16.506 11.662 0.169 0.31 28.71 324 A 1 -ATOM 5604 H H A MET A1 1 334 ? -14.602 7.358 -2.224 0.69 22.23 324 A 1 -ATOM 5605 H H B MET A1 1 334 ? -14.601 7.366 -2.234 0.31 22.23 324 A 1 -ATOM 5606 H HA A MET A1 1 334 ? -12.903 8.675 -0.724 0.69 25.78 324 A 1 -ATOM 5607 H HA B MET A1 1 334 ? -12.996 8.693 -0.693 0.31 17.97 324 A 1 -ATOM 5608 H HB2 A MET A1 1 334 ? -15.291 7.38 -0.001 0.69 30.77 324 A 1 -ATOM 5609 H HB2 B MET A1 1 334 ? -15.244 7.131 0.014 0.31 19.05 324 A 1 -ATOM 5610 H HB3 A MET A1 1 334 ? -14.456 8.262 1.023 0.69 30.77 324 A 1 -ATOM 5611 H HB3 B MET A1 1 334 ? -14.507 8.08 1.054 0.31 19.05 324 A 1 -ATOM 5612 H HG2 A MET A1 1 334 ? -14.807 10.143 -0.28 0.69 24.62 324 A 1 -ATOM 5613 H HG2 B MET A1 1 334 ? -15.631 9.17 -1.253 0.31 27.81 324 A 1 -ATOM 5614 H HG3 A MET A1 1 334 ? -15.587 9.271 -1.355 0.69 24.62 324 A 1 -ATOM 5615 H HG3 B MET A1 1 334 ? -16.528 8.929 0.036 0.31 27.81 324 A 1 -ATOM 5616 H HE1 A MET A1 1 334 ? -18.197 11.61 0.339 0.69 32.75 324 A 1 -ATOM 5617 H HE1 B MET A1 1 334 ? -16.331 12.551 0.514 0.31 34.45 324 A 1 -ATOM 5618 H HE2 A MET A1 1 334 ? -16.66 11.953 0.128 0.69 32.75 324 A 1 -ATOM 5619 H HE2 B MET A1 1 334 ? -16.705 11.708 -0.779 0.31 34.45 324 A 1 -ATOM 5620 H HE3 A MET A1 1 334 ? -17.504 11.324 -1.062 0.69 32.75 324 A 1 -ATOM 5621 H HE3 B MET A1 1 334 ? -17.252 11.264 0.645 0.31 34.45 324 A 1 -ATOM 5622 N N . LYS A1 1 335 ? -12.847 5.511 -0.254 1.0 20.22 325 A 1 -ATOM 5623 C CA . LYS A1 1 335 ? -12.03 4.446 0.314 1.0 22.9 325 A 1 -ATOM 5624 C C . LYS A1 1 335 ? -10.635 4.482 -0.285 1.0 22.31 325 A 1 -ATOM 5625 O O . LYS A1 1 335 ? -9.636 4.319 0.438 1.0 22.09 325 A 1 -ATOM 5626 C CB . LYS A1 1 335 ? -12.7 3.096 0.034 1.0 25.33 325 A 1 -ATOM 5627 C CG . LYS A1 1 335 ? -11.947 1.889 0.528 1.0 32.77 325 A 1 -ATOM 5628 H H . LYS A1 1 335 ? -13.515 5.236 -0.721 1.0 24.27 325 A 1 -ATOM 5629 H HA . LYS A1 1 335 ? -11.956 4.558 1.275 1.0 27.48 325 A 1 -ATOM 5630 H HB2 . LYS A1 1 335 ? -13.57 3.091 0.464 1.0 30.39 325 A 1 -ATOM 5631 H HB3 . LYS A1 1 335 ? -12.804 3.0 -0.926 1.0 30.39 325 A 1 -ATOM 5632 N N . MET A1 1 336 ? -10.546 4.692 -1.601 1.0 20.03 326 A 1 -ATOM 5633 C CA A MET A1 1 336 ? -9.263 4.79 -2.283 0.62 20.74 326 A 1 -ATOM 5634 C CA B MET A1 1 336 ? -9.25 4.753 -2.241 0.38 20.43 326 A 1 -ATOM 5635 C C . MET A1 1 336 ? -8.407 5.883 -1.669 1.0 20.03 326 A 1 -ATOM 5636 O O . MET A1 1 336 ? -7.208 5.697 -1.41 1.0 19.47 326 A 1 -ATOM 5637 C CB A MET A1 1 336 ? -9.502 5.092 -3.768 0.62 25.45 326 A 1 -ATOM 5638 C CB B MET A1 1 336 ? -9.451 4.905 -3.737 0.38 18.49 326 A 1 -ATOM 5639 C CG A MET A1 1 336 ? -8.246 5.553 -4.552 0.62 19.96 326 A 1 -ATOM 5640 C CG B MET A1 1 336 ? -8.176 4.822 -4.524 0.38 20.42 326 A 1 -ATOM 5641 S SD A MET A1 1 336 ? -8.43 6.191 -6.23 0.62 21.73 326 A 1 -ATOM 5642 S SD B MET A1 1 336 ? -7.444 6.436 -4.523 0.38 23.72 326 A 1 -ATOM 5643 C CE A MET A1 1 336 ? -9.641 5.062 -6.936 0.62 20.91 326 A 1 -ATOM 5644 C CE B MET A1 1 336 ? -8.37 7.271 -5.805 0.38 37.75 326 A 1 -ATOM 5645 H H A MET A1 1 336 ? -11.223 4.782 -2.124 0.62 24.03 326 A 1 -ATOM 5646 H H B MET A1 1 336 ? -11.215 4.8 -2.13 0.38 24.03 326 A 1 -ATOM 5647 H HA A MET A1 1 336 ? -8.801 3.941 -2.206 0.62 24.89 326 A 1 -ATOM 5648 H HA B MET A1 1 336 ? -8.768 3.925 -2.089 0.38 24.51 326 A 1 -ATOM 5649 H HB2 A MET A1 1 336 ? -9.833 4.287 -4.196 0.62 30.53 326 A 1 -ATOM 5650 H HB2 B MET A1 1 336 ? -10.038 4.198 -4.047 0.38 22.19 326 A 1 -ATOM 5651 H HB3 A MET A1 1 336 ? -10.163 5.8 -3.835 0.62 30.53 326 A 1 -ATOM 5652 H HB3 B MET A1 1 336 ? -9.852 5.77 -3.912 0.38 22.19 326 A 1 -ATOM 5653 H HG2 A MET A1 1 336 ? -7.827 6.261 -4.037 0.62 23.95 326 A 1 -ATOM 5654 H HG2 B MET A1 1 336 ? -7.566 4.191 -4.11 0.38 24.5 326 A 1 -ATOM 5655 H HG3 A MET A1 1 336 ? -7.649 4.791 -4.615 0.62 23.95 326 A 1 -ATOM 5656 H HG3 B MET A1 1 336 ? -8.362 4.553 -5.437 0.38 24.5 326 A 1 -ATOM 5657 H HE1 A MET A1 1 336 ? -9.786 5.295 -7.866 0.62 25.09 326 A 1 -ATOM 5658 H HE1 B MET A1 1 336 ? -8.287 8.23 -5.682 0.38 45.3 326 A 1 -ATOM 5659 H HE2 A MET A1 1 336 ? -9.303 4.155 -6.872 0.62 25.09 326 A 1 -ATOM 5660 H HE2 B MET A1 1 336 ? -8.012 7.017 -6.67 0.38 45.3 326 A 1 -ATOM 5661 H HE3 A MET A1 1 336 ? -10.472 5.14 -6.442 0.62 25.09 326 A 1 -ATOM 5662 H HE3 B MET A1 1 336 ? -9.302 7.009 -5.743 0.38 45.3 326 A 1 -ATOM 5663 N N . ILE A1 1 337 ? -9.008 7.045 -1.456 1.0 19.3 327 A 1 -ATOM 5664 C CA . ILE A1 1 337 ? -8.285 8.185 -0.919 1.0 18.29 327 A 1 -ATOM 5665 C C . ILE A1 1 337 ? -7.766 7.862 0.474 1.0 19.67 327 A 1 -ATOM 5666 O O . ILE A1 1 337 ? -6.63 8.168 0.795 1.0 18.65 327 A 1 -ATOM 5667 C CB . ILE A1 1 337 ? -9.208 9.411 -0.94 1.0 17.99 327 A 1 -ATOM 5668 C CG1 . ILE A1 1 337 ? -9.442 9.865 -2.396 1.0 17.99 327 A 1 -ATOM 5669 C CG2 . ILE A1 1 337 ? -8.632 10.553 -0.081 1.0 19.21 327 A 1 -ATOM 5670 C CD1 . ILE A1 1 337 ? -10.619 10.882 -2.515 1.0 20.05 327 A 1 -ATOM 5671 H H . ILE A1 1 337 ? -9.839 7.201 -1.615 1.0 23.17 327 A 1 -ATOM 5672 H HA . ILE A1 1 337 ? -7.511 8.381 -1.47 1.0 21.95 327 A 1 -ATOM 5673 H HB . ILE A1 1 337 ? -10.063 9.163 -0.555 1.0 21.58 327 A 1 -ATOM 5674 H HG12 . ILE A1 1 337 ? -8.638 10.293 -2.729 1.0 21.59 327 A 1 -ATOM 5675 H HG13 . ILE A1 1 337 ? -9.656 9.091 -2.94 1.0 21.59 327 A 1 -ATOM 5676 H HG21 . ILE A1 1 337 ? -9.14 11.362 -0.248 1.0 23.05 327 A 1 -ATOM 5677 H HG22 . ILE A1 1 337 ? -8.699 10.308 0.856 1.0 23.05 327 A 1 -ATOM 5678 H HG23 . ILE A1 1 337 ? -7.702 10.691 -0.321 1.0 23.05 327 A 1 -ATOM 5679 H HD11 . ILE A1 1 337 ? -10.795 11.052 -3.453 1.0 24.05 327 A 1 -ATOM 5680 H HD12 . ILE A1 1 337 ? -11.407 10.504 -2.094 1.0 24.05 327 A 1 -ATOM 5681 H HD13 . ILE A1 1 337 ? -10.369 11.707 -2.07 1.0 24.05 327 A 1 -ATOM 5682 N N . GLU A1 1 338 ? -8.599 7.222 1.29 1.0 18.09 328 A 1 -ATOM 5683 C CA A GLU A1 1 338 ? -8.161 6.822 2.623 0.49 18.56 328 A 1 -ATOM 5684 C CA B GLU A1 1 338 ? -8.173 6.811 2.624 0.51 21.87 328 A 1 -ATOM 5685 C C . GLU A1 1 338 ? -7.008 5.837 2.553 1.0 20.24 328 A 1 -ATOM 5686 O O . GLU A1 1 338 ? -6.016 5.979 3.281 1.0 22.46 328 A 1 -ATOM 5687 C CB A GLU A1 1 338 ? -9.353 6.201 3.355 0.49 22.8 328 A 1 -ATOM 5688 C CB B GLU A1 1 338 ? -9.38 6.172 3.317 0.51 19.89 328 A 1 -ATOM 5689 C CG A GLU A1 1 338 ? -9.003 5.668 4.756 0.49 25.23 328 A 1 -ATOM 5690 C CG B GLU A1 1 338 ? -9.169 5.913 4.809 0.51 49.54 328 A 1 -ATOM 5691 C CD A GLU A1 1 338 ? -8.568 6.758 5.711 0.49 58.17 328 A 1 -ATOM 5692 C CD B GLU A1 1 338 ? -10.416 5.351 5.486 0.51 43.61 328 A 1 -ATOM 5693 O OE1 A GLU A1 1 338 ? -9.03 7.909 5.557 0.49 48.71 328 A 1 -ATOM 5694 O OE1 B GLU A1 1 338 ? -10.936 4.302 5.047 0.51 38.63 328 A 1 -ATOM 5695 O OE2 A GLU A1 1 338 ? -7.769 6.464 6.628 0.49 62.69 328 A 1 -ATOM 5696 O OE2 B GLU A1 1 338 ? -10.891 5.979 6.445 0.51 47.8 328 A 1 -ATOM 5697 H H A GLU A1 1 338 ? -9.411 7.011 1.101 0.49 21.7 328 A 1 -ATOM 5698 H H B GLU A1 1 338 ? -9.411 7.015 1.098 0.51 21.7 328 A 1 -ATOM 5699 H HA A GLU A1 1 338 ? -7.85 7.598 3.114 0.49 22.27 328 A 1 -ATOM 5700 H HA B GLU A1 1 338 ? -7.872 7.578 3.136 0.51 26.24 328 A 1 -ATOM 5701 H HB2 A GLU A1 1 338 ? -10.042 6.876 3.458 0.49 27.36 328 A 1 -ATOM 5702 H HB2 B GLU A1 1 338 ? -10.142 6.764 3.224 0.51 23.87 328 A 1 -ATOM 5703 H HB3 A GLU A1 1 338 ? -9.69 5.459 2.83 0.49 27.36 328 A 1 -ATOM 5704 H HB3 B GLU A1 1 338 ? -9.567 5.32 2.892 0.51 23.87 328 A 1 -ATOM 5705 H HG2 A GLU A1 1 338 ? -9.784 5.234 5.132 0.49 30.27 328 A 1 -ATOM 5706 H HG2 B GLU A1 1 338 ? -8.45 5.271 4.922 0.51 59.45 328 A 1 -ATOM 5707 H HG3 A GLU A1 1 338 ? -8.275 5.031 4.678 0.49 30.27 328 A 1 -ATOM 5708 H HG3 B GLU A1 1 338 ? -8.939 6.748 5.247 0.51 59.45 328 A 1 -ATOM 5709 N N . LEU A1 1 339 ? -7.1 4.842 1.668 1.0 22.68 329 A 1 -ATOM 5710 C CA . LEU A1 1 339 ? -6.038 3.845 1.535 1.0 24.7 329 A 1 -ATOM 5711 C C . LEU A1 1 339 ? -4.731 4.46 1.075 1.0 24.0 329 A 1 -ATOM 5712 O O . LEU A1 1 339 ? -3.659 3.939 1.408 1.0 25.64 329 A 1 -ATOM 5713 C CB . LEU A1 1 339 ? -6.485 2.778 0.533 1.0 32.43 329 A 1 -ATOM 5714 C CG . LEU A1 1 339 ? -7.118 1.491 1.054 1.0 44.48 329 A 1 -ATOM 5715 C CD1 . LEU A1 1 339 ? -8.08 1.722 2.179 1.0 74.73 329 A 1 -ATOM 5716 C CD2 . LEU A1 1 339 ? -7.807 0.758 -0.095 1.0 66.42 329 A 1 -ATOM 5717 H H . LEU A1 1 339 ? -7.765 4.721 1.135 1.0 27.22 329 A 1 -ATOM 5718 H HA . LEU A1 1 339 ? -5.882 3.434 2.399 1.0 29.64 329 A 1 -ATOM 5719 H HB2 . LEU A1 1 339 ? -7.141 3.187 -0.054 1.0 38.92 329 A 1 -ATOM 5720 H HB3 . LEU A1 1 339 ? -5.704 2.512 0.024 1.0 38.92 329 A 1 -ATOM 5721 H HG . LEU A1 1 339 ? -6.409 0.937 1.418 1.0 53.37 329 A 1 -ATOM 5722 H HD11 . LEU A1 1 339 ? -8.542 0.893 2.375 1.0 89.68 329 A 1 -ATOM 5723 H HD12 . LEU A1 1 339 ? -7.586 2.018 2.96 1.0 89.68 329 A 1 -ATOM 5724 H HD13 . LEU A1 1 339 ? -8.718 2.403 1.913 1.0 89.68 329 A 1 -ATOM 5725 H HD21 . LEU A1 1 339 ? -8.174 -0.076 0.237 1.0 79.7 329 A 1 -ATOM 5726 H HD22 . LEU A1 1 339 ? -8.518 1.317 -0.444 1.0 79.7 329 A 1 -ATOM 5727 H HD23 . LEU A1 1 339 ? -7.155 0.579 -0.791 1.0 79.7 329 A 1 -ATOM 5728 N N . LEU A1 1 340 ? -4.766 5.52 0.275 1.0 20.26 330 A 1 -ATOM 5729 C CA . LEU A1 1 340 ? -3.58 6.235 -0.118 1.0 20.09 330 A 1 -ATOM 5730 C C . LEU A1 1 340 ? -2.964 7.045 0.997 1.0 23.93 330 A 1 -ATOM 5731 O O . LEU A1 1 340 ? -1.873 7.597 0.806 1.0 25.33 330 A 1 -ATOM 5732 C CB . LEU A1 1 340 ? -3.881 7.178 -1.287 1.0 21.81 330 A 1 -ATOM 5733 C CG . LEU A1 1 340 ? -4.106 6.543 -2.65 1.0 23.45 330 A 1 -ATOM 5734 C CD1 . LEU A1 1 340 ? -4.53 7.631 -3.6 1.0 26.12 330 A 1 -ATOM 5735 C CD2 . LEU A1 1 340 ? -2.864 5.84 -3.148 1.0 33.15 330 A 1 -ATOM 5736 H H . LEU A1 1 340 ? -5.488 5.847 -0.058 1.0 24.31 330 A 1 -ATOM 5737 H HA . LEU A1 1 340 ? -2.934 5.573 -0.409 1.0 24.11 330 A 1 -ATOM 5738 H HB2 . LEU A1 1 340 ? -4.686 7.675 -1.07 1.0 26.18 330 A 1 -ATOM 5739 H HB3 . LEU A1 1 340 ? -3.131 7.787 -1.379 1.0 26.18 330 A 1 -ATOM 5740 H HG . LEU A1 1 340 ? -4.796 5.864 -2.594 1.0 28.14 330 A 1 -ATOM 5741 H HD11 . LEU A1 1 340 ? -4.661 7.247 -4.481 1.0 31.35 330 A 1 -ATOM 5742 H HD12 . LEU A1 1 340 ? -5.359 8.023 -3.283 1.0 31.35 330 A 1 -ATOM 5743 H HD13 . LEU A1 1 340 ? -3.836 8.308 -3.634 1.0 31.35 330 A 1 -ATOM 5744 H HD21 . LEU A1 1 340 ? -3.001 5.571 -4.07 1.0 39.78 330 A 1 -ATOM 5745 H HD22 . LEU A1 1 340 ? -2.111 6.449 -3.09 1.0 39.78 330 A 1 -ATOM 5746 H HD23 . LEU A1 1 340 ? -2.7 5.059 -2.597 1.0 39.78 330 A 1 -ATOM 5747 N N . GLY A1 1 341 ? -3.664 7.173 2.104 1.0 20.69 331 A 1 -ATOM 5748 C CA . GLY A1 1 341 ? -3.216 8.058 3.153 1.0 24.01 331 A 1 -ATOM 5749 C C . GLY A1 1 341 ? -3.469 9.524 2.886 1.0 24.24 331 A 1 -ATOM 5750 O O . GLY A1 1 341 ? -2.822 10.375 3.503 1.0 24.99 331 A 1 -ATOM 5751 H H . GLY A1 1 341 ? -4.4 6.761 2.271 1.0 24.83 331 A 1 -ATOM 5752 H HA2 . GLY A1 1 341 ? -3.673 7.822 3.976 1.0 28.81 331 A 1 -ATOM 5753 H HA3 . GLY A1 1 341 ? -2.262 7.938 3.276 1.0 28.81 331 A 1 -ATOM 5754 N N . ARG A1 1 342 ? -4.407 9.849 1.986 1.0 18.06 332 A 1 -ATOM 5755 C CA . ARG A1 1 342 ? -4.792 11.208 1.636 1.0 17.23 332 A 1 -ATOM 5756 C C . ARG A1 1 342 ? -6.087 11.56 2.356 1.0 18.87 332 A 1 -ATOM 5757 O O . ARG A1 1 342 ? -6.624 10.763 3.128 1.0 19.51 332 A 1 -ATOM 5758 C CB . ARG A1 1 342 ? -4.869 11.271 0.104 1.0 17.03 332 A 1 -ATOM 5759 C CG . ARG A1 1 342 ? -3.544 10.963 -0.586 1.0 17.71 332 A 1 -ATOM 5760 C CD . ARG A1 1 342 ? -2.668 12.154 -0.711 1.0 16.95 332 A 1 -ATOM 5761 N NE . ARG A1 1 342 ? -2.902 12.984 -1.895 1.0 16.64 332 A 1 -ATOM 5762 C CZ . ARG A1 1 342 ? -2.532 12.64 -3.12 1.0 17.28 332 A 1 -ATOM 5763 N NH1 . ARG A1 1 342 ? -1.889 11.534 -3.32 1.0 17.22 332 A 1 -ATOM 5764 N NH2 . ARG A1 1 342 ? -2.798 13.506 -4.118 1.0 17.44 332 A 1 -ATOM 5765 H H . ARG A1 1 342 ? -4.856 9.262 1.546 1.0 21.68 332 A 1 -ATOM 5766 H HA . ARG A1 1 342 ? -4.149 11.874 1.927 1.0 20.67 332 A 1 -ATOM 5767 H HB2 . ARG A1 1 342 ? -5.522 10.622 -0.203 1.0 20.43 332 A 1 -ATOM 5768 H HB3 . ARG A1 1 342 ? -5.14 12.164 -0.159 1.0 20.43 332 A 1 -ATOM 5769 H HG2 . ARG A1 1 342 ? -3.068 10.293 -0.071 1.0 21.25 332 A 1 -ATOM 5770 H HG3 . ARG A1 1 342 ? -3.723 10.628 -1.479 1.0 21.25 332 A 1 -ATOM 5771 H HD2 . ARG A1 1 342 ? -2.804 12.716 0.068 1.0 20.34 332 A 1 -ATOM 5772 H HD3 . ARG A1 1 342 ? -1.747 11.853 -0.747 1.0 20.34 332 A 1 -ATOM 5773 H HE . ARG A1 1 342 ? -3.302 13.738 -1.788 1.0 19.97 332 A 1 -ATOM 5774 H HH11 . ARG A1 1 342 ? -1.7 11.02 -2.656 1.0 20.67 332 A 1 -ATOM 5775 H HH12 . ARG A1 1 342 ? -1.65 11.312 -4.116 1.0 20.67 332 A 1 -ATOM 5776 H HH21 . ARG A1 1 342 ? -3.193 14.25 -3.947 1.0 20.93 332 A 1 -ATOM 5777 H HH22 . ARG A1 1 342 ? -2.572 13.314 -4.925 1.0 20.93 332 A 1 -ATOM 5778 N N . LYS A1 1 343 ? -6.618 12.73 2.101 1.0 18.8 333 A 1 -ATOM 5779 C CA . LYS A1 1 343 ? -7.861 13.173 2.701 1.0 23.52 333 A 1 -ATOM 5780 C C . LYS A1 1 343 ? -8.813 13.649 1.629 1.0 22.82 333 A 1 -ATOM 5781 O O . LYS A1 1 343 ? -8.36 14.161 0.663 1.0 19.37 333 A 1 -ATOM 5782 C CB . LYS A1 1 343 ? -7.581 14.386 3.606 1.0 26.21 333 A 1 -ATOM 5783 C CG . LYS A1 1 343 ? -6.142 14.74 3.737 1.0 64.7 333 A 1 -ATOM 5784 H H . LYS A1 1 343 ? -6.27 13.307 1.567 1.0 22.56 333 A 1 -ATOM 5785 H HA . LYS A1 1 343 ? -8.266 12.444 3.196 1.0 28.23 333 A 1 -ATOM 5786 H HB2 . LYS A1 1 343 ? -8.04 15.158 3.239 1.0 31.45 333 A 1 -ATOM 5787 H HB3 . LYS A1 1 343 ? -7.917 14.193 4.495 1.0 31.45 333 A 1 -ATOM 5788 N N . PRO A1 1 344 ? -10.135 13.519 1.759 1.0 28.23 334 A 1 -ATOM 5789 C CA . PRO A1 1 344 ? -11.027 14.184 0.805 1.0 24.36 334 A 1 -ATOM 5790 C C . PRO A1 1 344 ? -11.001 15.696 1.042 1.0 26.79 334 A 1 -ATOM 5791 O O . PRO A1 1 344 ? -10.615 16.187 2.095 1.0 24.35 334 A 1 -ATOM 5792 C CB B PRO A1 1 344 ? -12.4 13.599 1.168 1.0 42.97 334 A 1 -ATOM 5793 C CG . PRO A1 1 344 ? -12.278 13.385 2.68 1.0 35.51 334 A 1 -ATOM 5794 C CD . PRO A1 1 344 ? -10.863 12.861 2.855 1.0 34.1 334 A 1 -ATOM 5795 H HA . PRO A1 1 344 ? -10.81 13.975 -0.117 1.0 29.23 334 A 1 -ATOM 5796 H HB2 B PRO A1 1 344 ? -13.106 14.229 0.954 1.0 51.57 334 A 1 -ATOM 5797 H HB3 B PRO A1 1 344 ? -12.548 12.762 0.701 1.0 51.57 334 A 1 -ATOM 5798 H HG2 B PRO A1 1 344 ? -12.403 14.224 3.15 1.0 42.61 334 A 1 -ATOM 5799 H HG3 B PRO A1 1 344 ? -12.933 12.735 2.982 1.0 42.61 334 A 1 -ATOM 5800 H HD2 . PRO A1 1 344 ? -10.501 13.119 3.717 1.0 40.92 334 A 1 -ATOM 5801 H HD3 . PRO A1 1 344 ? -10.835 11.896 2.759 1.0 40.92 334 A 1 -ATOM 5802 N N . GLY A1 1 345 ? -11.355 16.429 -0.002 1.0 25.83 335 A 1 -ATOM 5803 C CA . GLY A1 1 345 ? -11.361 17.874 0.091 1.0 22.33 335 A 1 -ATOM 5804 C C . GLY A1 1 345 ? -12.356 18.368 1.123 1.0 23.94 335 A 1 -ATOM 5805 O O . GLY A1 1 345 ? -13.428 17.792 1.302 1.0 30.08 335 A 1 -ATOM 5806 H H . GLY A1 1 345 ? -11.593 16.116 -0.767 1.0 30.99 335 A 1 -ATOM 5807 H HA2 . GLY A1 1 345 ? -10.478 18.187 0.341 1.0 26.8 335 A 1 -ATOM 5808 H HA3 . GLY A1 1 345 ? -11.598 18.253 -0.77 1.0 26.8 335 A 1 -ATOM 5809 N N . ARG A1 1 346 ? -11.985 19.446 1.794 1.0 22.35 336 A 1 -ATOM 5810 C CA . ARG A1 1 346 ? -12.792 20.042 2.854 1.0 27.0 336 A 1 -ATOM 5811 C C . ARG A1 1 346 ? -13.672 21.17 2.368 1.0 26.75 336 A 1 -ATOM 5812 O O . ARG A1 1 346 ? -14.623 21.56 3.054 1.0 33.91 336 A 1 -ATOM 5813 C CB . ARG A1 1 346 ? -11.872 20.603 3.949 1.0 31.48 336 A 1 -ATOM 5814 C CG . ARG A1 1 346 ? -11.069 19.514 4.696 1.0 39.58 336 A 1 -ATOM 5815 H H . ARG A1 1 346 ? -11.248 19.866 1.654 1.0 26.82 336 A 1 -ATOM 5816 H HA . ARG A1 1 346 ? -13.359 19.352 3.232 1.0 32.41 336 A 1 -ATOM 5817 H HB2 . ARG A1 1 346 ? -11.237 21.214 3.542 1.0 37.78 336 A 1 -ATOM 5818 H HB3 . ARG A1 1 346 ? -12.413 21.074 4.602 1.0 37.78 336 A 1 -ATOM 5819 N N . ASP A1 1 347 ? -13.339 21.757 1.233 1.0 20.8 337 A 1 -ATOM 5820 C CA . ASP A1 1 347 ? -14.09 22.841 0.627 1.0 19.86 337 A 1 -ATOM 5821 C C . ASP A1 1 347 ? -14.278 22.465 -0.841 1.0 18.72 337 A 1 -ATOM 5822 O O . ASP A1 1 347 ? -14.22 21.294 -1.214 1.0 18.03 337 A 1 -ATOM 5823 C CB . ASP A1 1 347 ? -13.302 24.131 0.89 1.0 21.04 337 A 1 -ATOM 5824 C CG . ASP A1 1 347 ? -11.913 24.146 0.241 1.0 27.38 337 A 1 -ATOM 5825 O OD1 . ASP A1 1 347 ? -11.564 23.243 -0.536 1.0 21.1 337 A 1 -ATOM 5826 O OD2 . ASP A1 1 347 ? -11.105 25.056 0.549 1.0 28.42 337 A 1 -ATOM 5827 H H . ASP A1 1 347 ? -12.649 21.535 0.771 1.0 24.96 337 A 1 -ATOM 5828 H HA . ASP A1 1 347 ? -14.979 22.949 1.0 1.0 23.84 337 A 1 -ATOM 5829 H HB2 . ASP A1 1 347 ? -13.803 24.882 0.535 1.0 25.25 337 A 1 -ATOM 5830 H HB3 . ASP A1 1 347 ? -13.182 24.234 1.847 1.0 25.25 337 A 1 -ATOM 5831 N N . TRP A1 1 348 ? -14.547 23.446 -1.699 1.0 17.5 338 A 1 -ATOM 5832 C CA . TRP A1 1 348 ? -14.799 23.144 -3.108 1.0 16.26 338 A 1 -ATOM 5833 C C . TRP A1 1 348 ? -13.532 22.82 -3.88 1.0 16.8 338 A 1 -ATOM 5834 O O . TRP A1 1 348 ? -13.627 22.4 -5.046 1.0 15.66 338 A 1 -ATOM 5835 C CB . TRP A1 1 348 ? -15.488 24.324 -3.826 1.0 18.19 338 A 1 -ATOM 5836 C CG . TRP A1 1 348 ? -16.865 24.647 -3.332 1.0 18.02 338 A 1 -ATOM 5837 C CD1 . TRP A1 1 348 ? -17.564 23.979 -2.41 1.0 20.13 338 A 1 -ATOM 5838 C CD2 . TRP A1 1 348 ? -17.706 25.719 -3.789 1.0 17.71 338 A 1 -ATOM 5839 N NE1 . TRP A1 1 348 ? -18.828 24.574 -2.258 1.0 20.22 338 A 1 -ATOM 5840 C CE2 . TRP A1 1 348 ? -18.912 25.648 -3.093 1.0 19.06 338 A 1 -ATOM 5841 C CE3 . TRP A1 1 348 ? -17.534 26.736 -4.723 1.0 19.69 338 A 1 -ATOM 5842 C CZ2 . TRP A1 1 348 ? -19.957 26.568 -3.292 1.0 20.5 338 A 1 -ATOM 5843 C CZ3 . TRP A1 1 348 ? -18.577 27.605 -4.958 1.0 22.66 338 A 1 -ATOM 5844 C CH2 . TRP A1 1 348 ? -19.758 27.532 -4.235 1.0 21.76 338 A 1 -ATOM 5845 H H . TRP A1 1 348 ? -14.589 24.281 -1.495 1.0 21.0 338 A 1 -ATOM 5846 H HA . TRP A1 1 348 ? -15.399 22.382 -3.13 1.0 19.51 338 A 1 -ATOM 5847 H HB2 . TRP A1 1 348 ? -14.943 25.118 -3.706 1.0 21.83 338 A 1 -ATOM 5848 H HB3 . TRP A1 1 348 ? -15.56 24.111 -4.769 1.0 21.83 338 A 1 -ATOM 5849 H HD1 . TRP A1 1 348 ? -17.26 23.236 -1.941 1.0 24.16 338 A 1 -ATOM 5850 H HE1 . TRP A1 1 348 ? -19.447 24.304 -1.725 1.0 24.27 338 A 1 -ATOM 5851 H HE3 . TRP A1 1 348 ? -16.729 26.827 -5.181 1.0 23.62 338 A 1 -ATOM 5852 H HZ2 . TRP A1 1 348 ? -20.747 26.522 -2.803 1.0 24.59 338 A 1 -ATOM 5853 H HZ3 . TRP A1 1 348 ? -18.486 28.256 -5.617 1.0 27.19 338 A 1 -ATOM 5854 H HH2 . TRP A1 1 348 ? -20.429 28.154 -4.397 1.0 26.11 338 A 1 -ATOM 5855 N N . GLY A1 1 349 ? -12.349 23.01 -3.324 1.0 16.33 339 A 1 -ATOM 5856 C CA . GLY A1 1 349 ? -11.125 22.661 -4.016 1.0 16.3 339 A 1 -ATOM 5857 C C . GLY A1 1 349 ? -10.878 23.538 -5.228 1.0 15.57 339 A 1 -ATOM 5858 O O . GLY A1 1 349 ? -10.31 23.049 -6.207 1.0 16.35 339 A 1 -ATOM 5859 H H . GLY A1 1 349 ? -12.227 23.342 -2.541 1.0 19.6 339 A 1 -ATOM 5860 H HA2 . GLY A1 1 349 ? -10.375 22.758 -3.409 1.0 19.56 339 A 1 -ATOM 5861 H HA3 . GLY A1 1 349 ? -11.175 21.738 -4.31 1.0 19.56 339 A 1 -ATOM 5862 N N . GLY A1 1 350 ? -11.224 24.811 -5.19 1.0 16.17 340 A 1 -ATOM 5863 C CA . GLY A1 1 350 ? -10.895 25.701 -6.288 1.0 16.6 340 A 1 -ATOM 5864 C C . GLY A1 1 350 ? -9.412 25.94 -6.386 1.0 17.37 340 A 1 -ATOM 5865 O O . GLY A1 1 350 ? -8.683 25.847 -5.407 1.0 18.4 340 A 1 -ATOM 5866 H H . GLY A1 1 350 ? -11.649 25.186 -4.543 1.0 19.41 340 A 1 -ATOM 5867 H HA2 . GLY A1 1 350 ? -11.201 25.312 -7.122 1.0 19.92 340 A 1 -ATOM 5868 H HA3 . GLY A1 1 350 ? -11.337 26.554 -6.156 1.0 19.92 340 A 1 -ATOM 5869 N N . ARG A1 1 351 ? -8.916 26.219 -7.59 1.0 16.61 341 A 1 -ATOM 5870 C CA . ARG A1 1 351 ? -7.501 26.471 -7.749 1.0 15.79 341 A 1 -ATOM 5871 C C . ARG A1 1 351 ? -7.104 27.719 -6.988 1.0 18.81 341 A 1 -ATOM 5872 O O . ARG A1 1 351 ? -7.771 28.758 -7.064 1.0 19.38 341 A 1 -ATOM 5873 C CB . ARG A1 1 351 ? -7.194 26.651 -9.239 1.0 17.79 341 A 1 -ATOM 5874 C CG . ARG A1 1 351 ? -5.725 26.815 -9.597 1.0 17.39 341 A 1 -ATOM 5875 C CD . ARG A1 1 351 ? -5.36 28.264 -9.656 1.0 19.51 341 A 1 -ATOM 5876 N NE . ARG A1 1 351 ? -3.928 28.494 -9.888 1.0 21.36 341 A 1 -ATOM 5877 C CZ . ARG A1 1 351 ? -3.368 28.79 -11.053 1.0 21.27 341 A 1 -ATOM 5878 N NH1 . ARG A1 1 351 ? -4.1 28.912 -12.16 1.0 18.97 341 A 1 -ATOM 5879 N NH2 . ARG A1 1 351 ? -2.065 28.998 -11.098 1.0 21.39 341 A 1 -ATOM 5880 H H . ARG A1 1 351 ? -9.376 26.265 -8.315 1.0 19.93 341 A 1 -ATOM 5881 H HA . ARG A1 1 351 ? -6.986 25.725 -7.404 1.0 18.95 341 A 1 -ATOM 5882 H HB2 . ARG A1 1 351 ? -7.52 25.869 -9.713 1.0 21.35 341 A 1 -ATOM 5883 H HB3 . ARG A1 1 351 ? -7.657 27.444 -9.551 1.0 21.35 341 A 1 -ATOM 5884 H HG2 . ARG A1 1 351 ? -5.176 26.385 -8.923 1.0 20.87 341 A 1 -ATOM 5885 H HG3 . ARG A1 1 351 ? -5.555 26.418 -10.465 1.0 20.87 341 A 1 -ATOM 5886 H HD2 . ARG A1 1 351 ? -5.849 28.682 -10.382 1.0 23.41 341 A 1 -ATOM 5887 H HD3 . ARG A1 1 351 ? -5.596 28.682 -8.814 1.0 23.41 341 A 1 -ATOM 5888 H HE . ARG A1 1 351 ? -3.406 28.432 -9.207 1.0 25.63 341 A 1 -ATOM 5889 H HH11 . ARG A1 1 351 ? -4.952 28.798 -12.127 1.0 22.76 341 A 1 -ATOM 5890 H HH12 . ARG A1 1 351 ? -3.72 29.105 -12.907 1.0 22.76 341 A 1 -ATOM 5891 H HH21 . ARG A1 1 351 ? -1.595 28.94 -10.38 1.0 25.67 341 A 1 -ATOM 5892 H HH22 . ARG A1 1 351 ? -1.686 29.191 -11.845 1.0 25.67 341 A 1 -ATOM 5893 N N . LYS A1 1 352 ? -5.991 27.612 -6.266 1.0 18.03 342 A 1 -ATOM 5894 C CA . LYS A1 1 352 ? -5.428 28.727 -5.512 1.0 19.05 342 A 1 -ATOM 5895 C C . LYS A1 1 352 ? -4.082 29.117 -6.111 1.0 20.75 342 A 1 -ATOM 5896 O O . LYS A1 1 352 ? -3.468 28.375 -6.882 1.0 19.79 342 A 1 -ATOM 5897 C CB . LYS A1 1 352 ? -5.279 28.338 -4.033 1.0 20.36 342 A 1 -ATOM 5898 C CG . LYS A1 1 352 ? -6.576 28.007 -3.371 1.0 23.77 342 A 1 -ATOM 5899 C CD . LYS A1 1 352 ? -7.514 29.222 -3.359 1.0 38.16 342 A 1 -ATOM 5900 C CE . LYS A1 1 352 ? -8.722 29.056 -2.425 1.0 57.78 342 A 1 -ATOM 5901 N NZ . LYS A1 1 352 ? -9.727 28.09 -2.937 1.0 77.35 342 A 1 -ATOM 5902 H H . LYS A1 1 352 ? -5.534 26.887 -6.197 1.0 21.63 342 A 1 -ATOM 5903 H HA . LYS A1 1 352 ? -6.008 29.503 -5.559 1.0 22.86 342 A 1 -ATOM 5904 H HB2 . LYS A1 1 352 ? -4.706 27.558 -3.971 1.0 24.43 342 A 1 -ATOM 5905 H HB3 . LYS A1 1 352 ? -4.881 29.081 -3.553 1.0 24.43 342 A 1 -ATOM 5906 H HG2 . LYS A1 1 352 ? -7.011 27.288 -3.855 1.0 28.53 342 A 1 -ATOM 5907 H HG3 . LYS A1 1 352 ? -6.411 27.738 -2.454 1.0 28.53 342 A 1 -ATOM 5908 H HD2 . LYS A1 1 352 ? -7.016 30.0 -3.063 1.0 45.79 342 A 1 -ATOM 5909 H HD3 . LYS A1 1 352 ? -7.851 29.366 -4.257 1.0 45.79 342 A 1 -ATOM 5910 H HE2 . LYS A1 1 352 ? -8.413 28.736 -1.564 1.0 69.34 342 A 1 -ATOM 5911 H HE3 . LYS A1 1 352 ? -9.161 29.915 -2.322 1.0 69.34 342 A 1 -ATOM 5912 H HZ1 . LYS A1 1 352 ? -9.355 27.287 -3.034 1.0 92.82 342 A 1 -ATOM 5913 H HZ2 . LYS A1 1 352 ? -10.407 28.027 -2.367 1.0 92.82 342 A 1 -ATOM 5914 H HZ3 . LYS A1 1 352 ? -10.036 28.362 -3.727 1.0 92.82 342 A 1 -ATOM 5915 N N . ARG A1 1 353 ? -3.6 30.298 -5.738 1.0 23.02 343 A 1 -ATOM 5916 C CA . ARG A1 1 353 ? -2.322 30.8 -6.211 1.0 26.32 343 A 1 -ATOM 5917 C C . ARG A1 1 353 ? -1.39 30.885 -5.019 1.0 25.14 343 A 1 -ATOM 5918 O O . ARG A1 1 353 ? -1.378 31.886 -4.297 1.0 30.35 343 A 1 -ATOM 5919 C CB . ARG A1 1 353 ? -2.527 32.122 -6.889 1.0 26.82 343 A 1 -ATOM 5920 C CG . ARG A1 1 353 ? -3.344 31.953 -8.156 1.0 27.3 343 A 1 -ATOM 5921 C CD . ARG A1 1 353 ? -3.506 33.258 -8.883 1.0 32.49 343 A 1 -ATOM 5922 N NE . ARG A1 1 353 ? -4.397 33.042 -10.009 1.0 35.42 343 A 1 -ATOM 5923 C CZ . ARG A1 1 353 ? -3.98 32.604 -11.185 1.0 32.18 343 A 1 -ATOM 5924 N NH1 . ARG A1 1 353 ? -2.689 32.361 -11.378 1.0 32.28 343 A 1 -ATOM 5925 N NH2 . ARG A1 1 353 ? -4.855 32.419 -12.152 1.0 31.11 343 A 1 -ATOM 5926 H H . ARG A1 1 353 ? -4.006 30.833 -5.201 1.0 27.62 343 A 1 -ATOM 5927 H HA . ARG A1 1 353 ? -1.921 30.184 -6.844 1.0 31.58 343 A 1 -ATOM 5928 H HB2 . ARG A1 1 353 ? -3.002 32.722 -6.292 1.0 32.19 343 A 1 -ATOM 5929 H HB3 . ARG A1 1 353 ? -1.666 32.502 -7.124 1.0 32.19 343 A 1 -ATOM 5930 H HG2 . ARG A1 1 353 ? -2.895 31.328 -8.746 1.0 32.76 343 A 1 -ATOM 5931 H HG3 . ARG A1 1 353 ? -4.225 31.62 -7.927 1.0 32.76 343 A 1 -ATOM 5932 H HD2 . ARG A1 1 353 ? -3.893 33.923 -8.293 1.0 38.99 343 A 1 -ATOM 5933 H HD3 . ARG A1 1 353 ? -2.646 33.566 -9.211 1.0 38.99 343 A 1 -ATOM 5934 H HE . ARG A1 1 353 ? -5.235 33.205 -9.906 1.0 42.5 343 A 1 -ATOM 5935 H HH11 . ARG A1 1 353 ? -2.128 32.488 -10.739 1.0 38.74 343 A 1 -ATOM 5936 H HH12 . ARG A1 1 353 ? -2.415 32.077 -12.142 1.0 38.74 343 A 1 -ATOM 5937 H HH21 . ARG A1 1 353 ? -5.689 32.581 -12.015 1.0 37.33 343 A 1 -ATOM 5938 H HH22 . ARG A1 1 353 ? -4.593 32.135 -12.92 1.0 37.33 343 A 1 -ATOM 5939 N N . VAL A1 1 354 ? -0.654 29.81 -4.768 1.0 25.61 344 A 1 -ATOM 5940 C CA . VAL A1 1 354 ? 0.275 29.726 -3.65 1.0 23.4 344 A 1 -ATOM 5941 C C . VAL A1 1 354 ? 1.711 29.529 -4.085 1.0 24.89 344 A 1 -ATOM 5942 O O . VAL A1 1 354 ? 2.629 29.652 -3.223 1.0 28.28 344 A 1 -ATOM 5943 C CB . VAL A1 1 354 ? -0.108 28.655 -2.609 1.0 30.78 344 A 1 -ATOM 5944 C CG1 . VAL A1 1 354 ? -1.375 29.054 -1.881 1.0 29.3 344 A 1 -ATOM 5945 C CG2 . VAL A1 1 354 ? -0.254 27.279 -3.262 1.0 26.59 344 A 1 -ATOM 5946 H H . VAL A1 1 354 ? -0.676 29.094 -5.245 1.0 30.73 344 A 1 -ATOM 5947 H HA . VAL A1 1 354 ? 0.222 30.577 -3.187 1.0 28.08 344 A 1 -ATOM 5948 H HB . VAL A1 1 354 ? 0.605 28.588 -1.955 1.0 36.94 344 A 1 -ATOM 5949 H HG11 . VAL A1 1 354 ? -1.596 28.368 -1.232 1.0 35.16 344 A 1 -ATOM 5950 H HG12 . VAL A1 1 354 ? -1.227 29.9 -1.43 1.0 35.16 344 A 1 -ATOM 5951 H HG13 . VAL A1 1 354 ? -2.095 29.144 -2.525 1.0 35.16 344 A 1 -ATOM 5952 H HG21 . VAL A1 1 354 ? -0.497 26.631 -2.582 1.0 31.91 344 A 1 -ATOM 5953 H HG22 . VAL A1 1 354 ? -0.948 27.323 -3.939 1.0 31.91 344 A 1 -ATOM 5954 H HG23 . VAL A1 1 354 ? 0.59 27.031 -3.669 1.0 31.91 344 A 1 -ATOM 5955 N N . PHE A1 1 355 ? 1.948 29.279 -5.377 1.0 24.53 345 A 1 -ATOM 5956 C CA . PHE A1 1 355 ? 3.293 29.144 -5.916 1.0 26.25 345 A 1 -ATOM 5957 C C . PHE A1 1 355 ? 3.764 30.49 -6.468 1.0 41.98 345 A 1 -ATOM 5958 O O . PHE A1 1 355 ? 3.087 31.103 -7.307 1.0 34.57 345 A 1 -ATOM 5959 C CB . PHE A1 1 355 ? 3.341 28.113 -7.037 1.0 24.84 345 A 1 -ATOM 5960 C CG . PHE A1 1 355 ? 4.725 27.856 -7.53 1.0 27.27 345 A 1 -ATOM 5961 C CD1 . PHE A1 1 355 ? 5.574 27.017 -6.837 1.0 24.6 345 A 1 -ATOM 5962 C CD2 . PHE A1 1 355 ? 5.183 28.44 -8.693 1.0 31.65 345 A 1 -ATOM 5963 C CE1 . PHE A1 1 355 ? 6.874 26.821 -7.251 1.0 31.19 345 A 1 -ATOM 5964 C CE2 . PHE A1 1 355 ? 6.479 28.23 -9.106 1.0 31.65 345 A 1 -ATOM 5965 C CZ . PHE A1 1 355 ? 7.318 27.419 -8.403 1.0 28.6 345 A 1 -ATOM 5966 H H . PHE A1 1 355 ? 1.331 29.181 -5.968 1.0 29.43 345 A 1 -ATOM 5967 H HA . PHE A1 1 355 ? 3.883 28.858 -5.202 1.0 31.5 345 A 1 -ATOM 5968 H HB2 . PHE A1 1 355 ? 2.979 27.275 -6.71 1.0 29.8 345 A 1 -ATOM 5969 H HB3 . PHE A1 1 355 ? 2.812 28.434 -7.784 1.0 29.8 345 A 1 -ATOM 5970 H HD1 . PHE A1 1 355 ? 5.265 26.577 -6.079 1.0 29.52 345 A 1 -ATOM 5971 H HD2 . PHE A1 1 355 ? 4.615 28.976 -9.199 1.0 37.98 345 A 1 -ATOM 5972 H HE1 . PHE A1 1 355 ? 7.447 26.286 -6.751 1.0 37.43 345 A 1 -ATOM 5973 H HE2 . PHE A1 1 355 ? 6.787 28.648 -9.877 1.0 37.98 345 A 1 -ATOM 5974 H HZ . PHE A1 1 355 ? 8.187 27.273 -8.701 1.0 34.33 345 A 1 -ATOM 5975 N N . THR A1 1 356 ? 4.951 30.904 -6.041 1.0 36.21 346 A 1 -ATOM 5976 C CA . THR A1 1 356 ? 5.494 32.241 -6.349 1.0 95.29 346 A 1 -ATOM 5977 C C . THR A1 1 356 ? 4.423 33.337 -6.326 1.0 77.1 346 A 1 -ATOM 5978 O O . THR A1 1 356 ? 3.764 33.562 -5.308 1.0 69.13 346 A 1 -ATOM 5979 C CB . THR A1 1 356 ? 6.216 32.271 -7.723 1.0 45.92 346 A 1 -ATOM 5980 H H . THR A1 1 356 ? 5.48 30.426 -5.56 1.0 43.45 346 A 1 -ATOM 5981 H HA . THR A1 1 356 ? 6.139 32.46 -5.658 1.0 114.34 346 A 1 -HETATM 5982 N N . CYS B2 2 357 ? -13.62 11.653 -17.753 1.0 15.5 401 A 1 -HETATM 5983 C CA . CYS B2 2 357 ? -13.258 11.104 -19.086 1.0 14.53 401 A 1 -HETATM 5984 C C . CYS B2 2 357 ? -11.777 10.907 -18.976 1.0 19.5 401 A 1 -HETATM 5985 O O . CYS B2 2 357 ? -11.206 9.988 -19.577 1.0 21.3 401 A 1 -HETATM 5986 C CB . CYS B2 2 357 ? -13.549 12.161 -20.146 1.0 15.72 401 A 1 -HETATM 5987 S SG . CYS B2 2 357 ? -12.837 13.793 -19.661 1.0 14.51 401 A 1 -HETATM 5988 O OXT . CYS B2 2 357 ? -11.137 11.77 -18.293 1.0 18.79 401 A 1 -HETATM 5989 H HA . CYS B2 2 357 ? -13.734 10.298 -19.339 1.0 17.44 401 A 1 -HETATM 5990 H HB2 . CYS B2 2 357 ? -13.154 11.89 -20.989 1.0 18.87 401 A 1 -HETATM 5991 H HB3 . CYS B2 2 357 ? -14.509 12.261 -20.246 1.0 18.87 401 A 1 -HETATM 5992 FE FE . FE2 C3 3 358 ? -12.387 13.254 -17.469 1.0 14.79 402 A 1 -HETATM 5993 C C C CMO D4 4 359 ? -13.654 14.394 -16.878 0.93 15.47 403 A 1 -HETATM 5994 O O C CMO D4 4 359 ? -14.462 15.123 -16.5 0.93 17.1 403 A 1 -HETATM 5995 C C C CMO E4 5 360 ? -11.117 14.498 -17.376 0.96 14.1 404 A 1 -HETATM 5996 O O C CMO E4 5 360 ? -10.282 15.318 -17.308 0.96 15.65 404 A 1 -HETATM 5997 C C . CYN F5 6 361 ? -11.936 12.582 -15.952 1.0 16.12 405 A 1 -HETATM 5998 N N . CYN F5 6 361 ? -11.615 12.105 -14.879 1.0 14.92 405 A 1 -HETATM 5999 C C . PYR G6 7 362 ? -6.947 7.429 -40.8 1.0 56.9 406 A 1 -HETATM 6000 O O . PYR G6 7 362 ? -6.283 6.301 -40.895 1.0 57.5 406 A 1 -HETATM 6001 O OXT . PYR G6 7 362 ? -8.258 7.366 -40.833 1.0 56.71 406 A 1 -HETATM 6002 C CA . PYR G6 7 362 ? -6.295 8.664 -40.657 1.0 57.62 406 A 1 -HETATM 6003 O O3 . PYR G6 7 362 ? -6.927 9.794 -40.892 1.0 60.52 406 A 1 -HETATM 6004 C CB . PYR G6 7 362 ? -4.859 8.74 -40.223 1.0 55.28 406 A 1 -HETATM 6005 H HB1 . PYR G6 7 362 ? -4.21 8.649 -41.094 1.0 66.34 406 A 1 -HETATM 6006 H HB2 . PYR G6 7 362 ? -4.677 9.697 -39.734 1.0 66.34 406 A 1 -HETATM 6007 H HB3 . PYR G6 7 362 ? -4.647 7.93 -39.526 1.0 66.34 406 A 1 -HETATM 6008 C C1 A GOL H7 8 363 ? -13.852 26.587 -1.22 0.82 40.6 407 A 1 -HETATM 6009 O O1 A GOL H7 8 363 ? -13.272 27.014 -2.397 0.82 38.97 407 A 1 -HETATM 6010 C C2 A GOL H7 8 363 ? -14.767 27.657 -0.692 0.82 38.62 407 A 1 -HETATM 6011 O O2 A GOL H7 8 363 ? -15.368 27.265 0.544 0.82 44.83 407 A 1 -HETATM 6012 C C3 A GOL H7 8 363 ? -15.845 27.845 -1.778 0.82 42.1 407 A 1 -HETATM 6013 O O3 A GOL H7 8 363 ? -16.99 28.225 -1.083 0.82 46.84 407 A 1 -HETATM 6014 H H11 A GOL H7 8 363 ? -13.19 26.384 -0.541 0.82 48.72 407 A 1 -HETATM 6015 H H12 A GOL H7 8 363 ? -14.366 25.774 -1.342 0.82 48.72 407 A 1 -HETATM 6016 H H2 A GOL H7 8 363 ? -14.269 28.474 -0.533 0.82 46.35 407 A 1 -HETATM 6017 H HO2 A GOL H7 8 363 ? -16.146 27.605 0.57 0.82 53.8 407 A 1 -HETATM 6018 H H31 A GOL H7 8 363 ? -15.946 27.021 -2.28 0.82 50.52 407 A 1 -HETATM 6019 H H32 A GOL H7 8 363 ? -15.542 28.503 -2.423 0.82 50.52 407 A 1 -HETATM 6020 N N . SAH I8 9 364 ? -17.865 17.003 -26.042 1.0 15.52 408 A 1 -HETATM 6021 C CA . SAH I8 9 364 ? -17.075 17.569 -24.928 1.0 13.98 408 A 1 -HETATM 6022 C CB . SAH I8 9 364 ? -17.07 16.718 -23.687 1.0 16.79 408 A 1 -HETATM 6023 C CG . SAH I8 9 364 ? -17.189 15.242 -23.847 1.0 18.34 408 A 1 -HETATM 6024 S SD . SAH I8 9 364 ? -15.779 14.412 -24.57 1.0 19.12 408 A 1 -HETATM 6025 C C . SAH I8 9 364 ? -15.673 17.89 -25.432 1.0 15.58 408 A 1 -HETATM 6026 O O . SAH I8 9 364 ? -14.983 18.683 -24.861 1.0 15.41 408 A 1 -HETATM 6027 O OXT . SAH I8 9 364 ? -15.354 17.308 -26.538 1.0 16.89 408 A 1 -HETATM 6028 C "C5'" . SAH I8 9 364 ? -14.672 14.417 -23.123 1.0 19.7 408 A 1 -HETATM 6029 C "C4'" . SAH I8 9 364 ? -13.223 14.058 -23.438 1.0 16.19 408 A 1 -HETATM 6030 O "O4'" . SAH I8 9 364 ? -13.1 12.691 -23.698 1.0 17.08 408 A 1 -HETATM 6031 C "C3'" . SAH I8 9 364 ? -12.552 14.719 -24.616 1.0 14.58 408 A 1 -HETATM 6032 O "O3'" . SAH I8 9 364 ? -12.114 16.019 -24.243 1.0 16.83 408 A 1 -HETATM 6033 C "C2'" . SAH I8 9 364 ? -11.375 13.766 -24.892 1.0 14.5 408 A 1 -HETATM 6034 O "O2'" . SAH I8 9 364 ? -10.169 14.207 -24.323 1.0 16.84 408 A 1 -HETATM 6035 C "C1'" . SAH I8 9 364 ? -11.815 12.456 -24.215 1.0 14.78 408 A 1 -HETATM 6036 N N9 . SAH I8 9 364 ? -11.906 11.313 -25.151 1.0 13.49 408 A 1 -HETATM 6037 C C8 . SAH I8 9 364 ? -12.756 11.213 -26.252 1.0 15.31 408 A 1 -HETATM 6038 N N7 . SAH I8 9 364 ? -12.456 10.119 -26.909 1.0 14.76 408 A 1 -HETATM 6039 C C5 . SAH I8 9 364 ? -11.389 9.515 -26.298 1.0 14.68 408 A 1 -HETATM 6040 C C6 . SAH I8 9 364 ? -10.636 8.377 -26.563 1.0 14.06 408 A 1 -HETATM 6041 N N6 . SAH I8 9 364 ? -10.879 7.568 -27.608 1.0 14.29 408 A 1 -HETATM 6042 N N1 . SAH I8 9 364 ? -9.616 8.087 -25.732 1.0 14.25 408 A 1 -HETATM 6043 C C2 . SAH I8 9 364 ? -9.355 8.843 -24.658 1.0 14.58 408 A 1 -HETATM 6044 N N3 . SAH I8 9 364 ? -10.058 9.951 -24.351 1.0 14.39 408 A 1 -HETATM 6045 C C4 . SAH I8 9 364 ? -11.056 10.289 -25.186 1.0 13.52 408 A 1 -HETATM 6046 H H2 . SAH I8 9 364 ? -8.536 8.548 -24.001 1.0 17.5 408 A 1 -HETATM 6047 H HN1 . SAH I8 9 364 ? -18.702 16.964 -25.862 1.0 18.63 408 A 1 -HETATM 6048 H HN2 . SAH I8 9 364 ? -17.937 17.52 -26.725 1.0 18.63 408 A 1 -HETATM 6049 H HA . SAH I8 9 364 ? -17.499 18.396 -24.617 1.0 16.78 408 A 1 -HETATM 6050 H HB1 . SAH I8 9 364 ? -17.894 17.054 -23.058 1.0 20.14 408 A 1 -HETATM 6051 H HB2 . SAH I8 9 364 ? -16.139 16.922 -23.156 1.0 20.14 408 A 1 -HETATM 6052 H HG1 . SAH I8 9 364 ? -18.06 15.038 -24.47 1.0 22.01 408 A 1 -HETATM 6053 H HG2 . SAH I8 9 364 ? -17.371 14.808 -22.864 1.0 22.01 408 A 1 -HETATM 6054 H "H5'1" . SAH I8 9 364 ? -15.055 13.708 -22.39 1.0 23.64 408 A 1 -HETATM 6055 H "H5'2" . SAH I8 9 364 ? -14.694 15.41 -22.673 1.0 23.64 408 A 1 -HETATM 6056 H "H4'" . SAH I8 9 364 ? -12.727 14.413 -22.535 1.0 19.42 408 A 1 -HETATM 6057 H "H3'" . SAH I8 9 364 ? -13.187 14.869 -25.489 1.0 17.5 408 A 1 -HETATM 6058 H "HO3'" . SAH I8 9 364 ? -11.135 16.058 -24.286 1.0 20.2 408 A 1 -HETATM 6059 H "H2'" . SAH I8 9 364 ? -11.171 13.682 -25.96 1.0 17.4 408 A 1 -HETATM 6060 H "HO2'" . SAH I8 9 364 ? -9.811 13.509 -23.735 1.0 20.21 408 A 1 -HETATM 6061 H "H1'" . SAH I8 9 364 ? -11.067 12.204 -23.464 1.0 17.74 408 A 1 -HETATM 6062 H H8 . SAH I8 9 364 ? -13.537 11.924 -26.52 1.0 18.37 408 A 1 -HETATM 6063 H HN61 . SAH I8 9 364 ? -11.64 7.777 -28.246 1.0 17.15 408 A 1 -HETATM 6064 H HN62 . SAH I8 9 364 ? -10.3 6.747 -27.76 1.0 17.15 408 A 1 -HETATM 6065 P P . PO4 J9 10 365 ? 8.003 28.971 -13.083 1.0 78.39 409 A 1 -HETATM 6066 O O1 . PO4 J9 10 365 ? 8.416 28.801 -14.525 1.0 78.44 409 A 1 -HETATM 6067 O O2 . PO4 J9 10 365 ? 6.834 28.065 -12.775 1.0 77.58 409 A 1 -HETATM 6068 O O3 . PO4 J9 10 365 ? 7.594 30.403 -12.845 1.0 80.67 409 A 1 -HETATM 6069 O O4 . PO4 J9 10 365 ? 9.166 28.635 -12.171 1.0 79.12 409 A 1 -HETATM 6070 P P . PO4 K9 11 366 ? -15.521 5.422 -12.462 0.96 29.98 410 A 1 -HETATM 6071 O O1 . PO4 K9 11 366 ? -15.041 6.241 -13.574 0.96 34.04 410 A 1 -HETATM 6072 O O2 . PO4 K9 11 366 ? -14.487 4.409 -12.015 0.96 34.36 410 A 1 -HETATM 6073 O O3 . PO4 K9 11 366 ? -16.639 4.543 -13.013 0.96 40.68 410 A 1 -HETATM 6074 O O4 . PO4 K9 11 366 ? -16.024 6.091 -11.297 0.96 30.35 410 A 1 -HETATM 6075 P P A PO4 L9 12 367 ? 4.639 4.645 -8.181 0.46 42.84 411 A 1 -HETATM 6076 P P B PO4 L9 12 367 ? 6.483 6.365 -6.973 0.54 48.42 411 A 1 -HETATM 6077 O O1 A PO4 L9 12 367 ? 5.005 3.882 -9.445 0.46 41.03 411 A 1 -HETATM 6078 O O1 B PO4 L9 12 367 ? 6.594 4.861 -7.019 0.54 49.69 411 A 1 -HETATM 6079 O O2 A PO4 L9 12 367 ? 3.153 4.486 -7.791 0.46 36.41 411 A 1 -HETATM 6080 O O2 B PO4 L9 12 367 ? 5.039 6.73 -7.266 0.54 44.99 411 A 1 -HETATM 6081 O O3 A PO4 L9 12 367 ? 5.458 4.2 -7.004 0.46 41.84 411 A 1 -HETATM 6082 O O3 B PO4 L9 12 367 ? 6.801 6.865 -5.574 0.54 41.11 411 A 1 -HETATM 6083 O O4 A PO4 L9 12 367 ? 4.939 6.108 -8.399 0.46 43.47 411 A 1 -HETATM 6084 O O4 B PO4 L9 12 367 ? 7.424 6.948 -7.999 0.54 50.62 411 A 1 -HETATM 6085 P P . PO4 M9 13 368 ? -16.748 -1.865 -23.51 0.66 49.03 412 A 1 -HETATM 6086 O O1 . PO4 M9 13 368 ? -15.705 -1.77 -24.582 0.66 50.1 412 A 1 -HETATM 6087 O O2 . PO4 M9 13 368 ? -17.149 -3.323 -23.348 0.66 51.67 412 A 1 -HETATM 6088 O O3 . PO4 M9 13 368 ? -17.957 -1.021 -23.834 0.66 43.93 412 A 1 -HETATM 6089 O O4 . PO4 M9 13 368 ? -16.196 -1.448 -22.192 0.66 45.55 412 A 1 -HETATM 6090 P P . PO4 N9 14 369 ? 12.855 26.598 -26.938 0.64 42.51 413 A 1 -HETATM 6091 O O1 . PO4 N9 14 369 ? 11.669 26.549 -27.867 0.64 41.15 413 A 1 -HETATM 6092 O O2 . PO4 N9 14 369 ? 14.012 25.826 -27.549 0.64 41.85 413 A 1 -HETATM 6093 O O3 . PO4 N9 14 369 ? 12.564 26.065 -25.53 0.64 40.27 413 A 1 -HETATM 6094 O O4 . PO4 N9 14 369 ? 13.258 28.03 -26.75 0.64 41.72 413 A 1 -HETATM 6095 CL CL . CL O10 15 370 ? -13.656 20.424 -11.485 1.0 18.89 414 A 1 -HETATM 6096 FE FE1 . SF4 P11 16 371 ? -16.704 13.168 -28.652 1.0 14.51 415 A 1 -HETATM 6097 FE FE2 . SF4 P11 16 371 ? -18.415 15.035 -29.544 1.0 14.51 415 A 1 -HETATM 6098 FE FE3 . SF4 P11 16 371 ? -15.796 15.239 -30.166 1.0 14.69 415 A 1 -HETATM 6099 FE FE4 . SF4 P11 16 371 ? -16.618 15.773 -27.438 1.0 16.4 415 A 1 -HETATM 6100 S S1 . SF4 P11 16 371 ? -17.092 16.926 -29.468 1.0 15.42 415 A 1 -HETATM 6101 S S2 . SF4 P11 16 371 ? -14.845 14.451 -28.213 1.0 14.86 415 A 1 -HETATM 6102 S S3 . SF4 P11 16 371 ? -18.333 14.121 -27.454 1.0 14.72 415 A 1 -HETATM 6103 S S4 . SF4 P11 16 371 ? -17.281 13.593 -30.861 1.0 14.95 415 A 1 -HETATM 6104 O O . HOH Q12 17 372 ? -19.612 -2.124 -23.261 1.0 49.98 501 A 1 -HETATM 6105 O O . HOH Q12 17 373 ? -19.483 2.481 -28.077 1.0 42.55 502 A 1 -HETATM 6106 O O . HOH Q12 17 374 ? -3.58 12.739 4.824 1.0 33.48 503 A 1 -HETATM 6107 O O . HOH Q12 17 375 ? 9.623 16.996 -34.751 1.0 58.83 504 A 1 -HETATM 6108 O O . HOH Q12 17 376 ? -0.212 11.671 3.131 1.0 43.13 505 A 1 -HETATM 6109 O O . HOH Q12 17 377 ? -17.845 2.97 -14.13 1.0 50.92 506 A 1 -HETATM 6110 O O . HOH Q12 17 378 ? -9.806 24.224 -10.622 1.0 21.54 507 A 1 -HETATM 6111 O O . HOH Q12 17 379 ? -3.109 18.95 3.117 1.0 34.26 508 A 1 -HETATM 6112 O O . HOH Q12 17 380 ? 28.212 14.334 -26.678 1.0 43.38 509 A 1 -HETATM 6113 O O . HOH Q12 17 381 ? 15.689 14.1 -26.332 1.0 34.64 510 A 1 -HETATM 6114 O O . HOH Q12 17 382 ? -16.465 -1.949 -19.827 1.0 53.36 511 A 1 -HETATM 6115 O O . HOH Q12 17 383 ? -23.392 12.083 -32.002 0.4 13.83 512 A 1 -HETATM 6116 O O . HOH Q12 17 384 ? 10.315 15.426 -0.555 1.0 40.07 513 A 1 -HETATM 6117 O O . HOH Q12 17 385 ? 31.507 8.327 -31.33 1.0 60.62 514 A 1 -HETATM 6118 O O . HOH Q12 17 386 ? 10.588 19.241 -28.95 1.0 50.03 515 A 1 -HETATM 6119 O O . HOH Q12 17 387 ? -14.021 2.041 -11.512 1.0 43.52 516 A 1 -HETATM 6120 O O . HOH Q12 17 388 ? 6.188 2.144 -5.839 1.0 56.79 517 A 1 -HETATM 6121 O O . HOH Q12 17 389 ? -11.118 16.128 4.522 1.0 58.42 518 A 1 -HETATM 6122 O O . HOH Q12 17 390 ? -38.708 14.79 -9.112 1.0 50.04 519 A 1 -HETATM 6123 O O . HOH Q12 17 391 ? -31.457 32.688 -23.397 1.0 52.45 520 A 1 -HETATM 6124 O O . HOH Q12 17 392 ? -20.175 6.486 -18.436 1.0 31.42 521 A 1 -HETATM 6125 O O . HOH Q12 17 393 ? -14.726 8.734 -13.977 1.0 22.71 522 A 1 -HETATM 6126 O O . HOH Q12 17 394 ? 31.785 16.068 -31.64 1.0 31.0 523 A 1 -HETATM 6127 O O . HOH Q12 17 395 ? 25.322 3.519 -18.036 1.0 52.13 524 A 1 -HETATM 6128 O O . HOH Q12 17 396 ? 0.189 33.909 -24.603 1.0 58.6 525 A 1 -HETATM 6129 O O . HOH Q12 17 397 ? -13.917 30.075 -8.921 1.0 50.11 526 A 1 -HETATM 6130 O O . HOH Q12 17 398 ? -19.447 20.271 -38.644 1.0 48.16 527 A 1 -HETATM 6131 O O . HOH Q12 17 399 ? -10.654 32.843 -15.288 1.0 42.06 528 A 1 -HETATM 6132 O O . HOH Q12 17 400 ? 31.954 12.64 -36.06 1.0 52.7 529 A 1 -HETATM 6133 O O . HOH Q12 17 401 ? -1.366 29.858 -27.073 1.0 47.88 530 A 1 -HETATM 6134 O O . HOH Q12 17 402 ? 5.458 9.082 -5.49 1.0 41.01 531 A 1 -HETATM 6135 O O . HOH Q12 17 403 ? -20.468 1.896 -30.399 1.0 26.77 532 A 1 -HETATM 6136 O O . HOH Q12 17 404 ? -0.226 9.577 1.206 1.0 37.49 533 A 1 -HETATM 6137 O O . HOH Q12 17 405 ? -36.118 19.555 -21.132 1.0 39.3 534 A 1 -HETATM 6138 O O . HOH Q12 17 406 ? -19.441 11.13 -42.836 1.0 38.58 535 A 1 -HETATM 6139 O O . HOH Q12 17 407 ? 6.778 3.634 -21.949 1.0 35.27 536 A 1 -HETATM 6140 O O . HOH Q12 17 408 ? -0.34 15.133 -24.996 1.0 20.48 537 A 1 -HETATM 6141 O O . HOH Q12 17 409 ? 2.721 20.302 -31.818 1.0 18.51 538 A 1 -HETATM 6142 O O . HOH Q12 17 410 ? -8.531 29.134 -20.631 1.0 43.03 539 A 1 -HETATM 6143 O O . HOH Q12 17 411 ? -25.693 6.323 -32.73 1.0 23.27 540 A 1 -HETATM 6144 O O . HOH Q12 17 412 ? -25.982 0.363 -15.925 1.0 29.45 541 A 1 -HETATM 6145 O O . HOH Q12 17 413 ? -11.256 26.782 2.544 1.0 53.51 542 A 1 -HETATM 6146 O O . HOH Q12 17 414 ? -21.51 12.913 -40.833 1.0 37.73 543 A 1 -HETATM 6147 O O . HOH Q12 17 415 ? 11.126 28.822 -14.667 1.0 48.6 544 A 1 -HETATM 6148 O O . HOH Q12 17 416 ? -17.772 -2.993 -33.537 1.0 62.34 545 A 1 -HETATM 6149 O O . HOH Q12 17 417 ? 2.113 3.162 -5.742 1.0 51.65 546 A 1 -HETATM 6150 O O . HOH Q12 17 418 ? 0.693 12.372 0.245 1.0 35.31 547 A 1 -HETATM 6151 O O . HOH Q12 17 419 ? -18.51 1.467 -3.267 1.0 30.52 548 A 1 -HETATM 6152 O O . HOH Q12 17 420 ? -17.018 8.559 -40.349 1.0 28.83 549 A 1 -HETATM 6153 O O . HOH Q12 17 421 ? -0.182 17.076 -29.242 1.0 16.38 550 A 1 -HETATM 6154 O O . HOH Q12 17 422 ? 6.877 20.656 -32.458 1.0 39.93 551 A 1 -HETATM 6155 O O . HOH Q12 17 423 ? 3.03 15.199 -35.539 1.0 29.99 552 A 1 -HETATM 6156 O O . HOH Q12 17 424 ? -28.86 1.206 -21.715 1.0 26.9 553 A 1 -HETATM 6157 O O . HOH Q12 17 425 ? -9.241 9.834 3.728 1.0 25.41 554 A 1 -HETATM 6158 O O . HOH Q12 17 426 ? 13.514 18.197 -31.714 1.0 54.28 555 A 1 -HETATM 6159 O O . HOH Q12 17 427 ? -22.724 -2.7 -6.157 1.0 52.79 556 A 1 -HETATM 6160 O O . HOH Q12 17 428 ? -12.712 30.897 -33.308 1.0 34.61 557 A 1 -HETATM 6161 O O . HOH Q12 17 429 ? -6.255 -0.469 -31.81 1.0 21.66 558 A 1 -HETATM 6162 O O . HOH Q12 17 430 ? -11.128 10.607 -12.365 1.0 15.66 559 A 1 -HETATM 6163 O O . HOH Q12 17 431 ? -12.335 28.638 -4.301 1.0 56.55 560 A 1 -HETATM 6164 O O . HOH Q12 17 432 ? -29.615 30.734 -20.548 1.0 27.89 561 A 1 -HETATM 6165 O O . HOH Q12 17 433 ? -17.301 0.829 -21.328 1.0 39.78 562 A 1 -HETATM 6166 O O . HOH Q12 17 434 ? -12.795 16.926 -28.272 1.0 20.96 563 A 1 -HETATM 6167 O O . HOH Q12 17 435 ? -9.845 14.156 -41.102 1.0 28.62 564 A 1 -HETATM 6168 O O . HOH Q12 17 436 ? 0.752 1.438 -26.803 1.0 33.71 565 A 1 -HETATM 6169 O O . HOH Q12 17 437 ? 1.141 13.216 -6.111 1.0 16.78 566 A 1 -HETATM 6170 O O . HOH Q12 17 438 ? -16.987 24.327 -32.882 1.0 19.77 567 A 1 -HETATM 6171 O O . HOH Q12 17 439 ? -30.31 4.488 -11.682 1.0 36.66 568 A 1 -HETATM 6172 O O . HOH Q12 17 440 ? -26.742 37.552 -24.904 1.0 50.63 569 A 1 -HETATM 6173 O O . HOH Q12 17 441 ? -2.417 6.043 -31.888 1.0 18.29 570 A 1 -HETATM 6174 O O . HOH Q12 17 442 ? -23.553 17.835 -37.216 1.0 40.95 571 A 1 -HETATM 6175 O O . HOH Q12 17 443 ? -8.686 0.039 -27.591 1.0 24.52 572 A 1 -HETATM 6176 O O . HOH Q12 17 444 ? -7.797 3.391 -11.015 1.0 19.69 573 A 1 -HETATM 6177 O O . HOH Q12 17 445 ? 10.253 26.996 -22.16 1.0 54.81 574 A 1 -HETATM 6178 O O . HOH Q12 17 446 ? -21.472 17.411 -0.642 1.0 21.96 575 A 1 -HETATM 6179 O O . HOH Q12 17 447 ? -11.962 1.768 -3.357 1.0 41.6 576 A 1 -HETATM 6180 O O . HOH Q12 17 448 ? -24.868 -4.658 -14.546 1.0 44.85 577 A 1 -HETATM 6181 O O . HOH Q12 17 449 ? 26.05 19.386 -14.204 1.0 51.92 578 A 1 -HETATM 6182 O O . HOH Q12 17 450 ? -34.361 10.487 -20.191 1.0 21.21 579 A 1 -HETATM 6183 O O . HOH Q12 17 451 ? -16.476 11.722 -18.34 1.0 17.96 580 A 1 -HETATM 6184 O O . HOH Q12 17 452 ? -26.814 30.465 -9.422 1.0 26.1 581 A 1 -HETATM 6185 O O . HOH Q12 17 453 ? 0.067 26.345 -11.271 1.0 20.13 582 A 1 -HETATM 6186 O O . HOH Q12 17 454 ? 12.712 11.654 -28.585 1.0 40.25 583 A 1 -HETATM 6187 O O . HOH Q12 17 455 ? -9.223 25.826 -1.229 1.0 41.55 584 A 1 -HETATM 6188 O O . HOH Q12 17 456 ? -15.663 33.121 -27.991 1.0 48.41 585 A 1 -HETATM 6189 O O . HOH Q12 17 457 ? -7.832 31.258 -11.54 1.0 43.88 586 A 1 -HETATM 6190 O O . HOH Q12 17 458 ? -21.152 4.792 -9.353 1.0 36.32 587 A 1 -HETATM 6191 O O . HOH Q12 17 459 ? -29.187 10.623 0.352 1.0 31.03 588 A 1 -HETATM 6192 O O . HOH Q12 17 460 ? -1.003 3.755 -34.636 1.0 26.3 589 A 1 -HETATM 6193 O O . HOH Q12 17 461 ? -22.139 5.673 -12.441 1.0 31.43 590 A 1 -HETATM 6194 O O . HOH Q12 17 462 ? -13.384 19.307 -2.852 1.0 16.77 591 A 1 -HETATM 6195 O O . HOH Q12 17 463 ? -27.292 26.14 -30.276 1.0 38.7 592 A 1 -HETATM 6196 O O . HOH Q12 17 464 ? -15.977 19.745 -28.188 1.0 18.33 593 A 1 -HETATM 6197 O O . HOH Q12 17 465 ? 19.736 10.036 -22.273 1.0 65.24 594 A 1 -HETATM 6198 O O . HOH Q12 17 466 ? 26.343 12.134 -30.096 1.0 57.68 595 A 1 -HETATM 6199 O O . HOH Q12 17 467 ? -22.053 6.331 -40.313 1.0 36.31 596 A 1 -HETATM 6200 O O . HOH Q12 17 468 ? -0.839 25.488 -31.136 1.0 30.64 597 A 1 -HETATM 6201 O O . HOH Q12 17 469 ? -14.636 17.588 -34.81 1.0 19.3 598 A 1 -HETATM 6202 O O . HOH Q12 17 470 ? -32.304 6.511 -25.025 1.0 29.85 599 A 1 -HETATM 6203 O O . HOH Q12 17 471 ? -4.58 25.139 -5.949 1.0 17.49 600 A 1 -HETATM 6204 O O . HOH Q12 17 472 ? -15.146 30.748 -11.198 1.0 26.87 601 A 1 -HETATM 6205 O O . HOH Q12 17 473 ? -1.538 33.659 -15.155 1.0 58.65 602 A 1 -HETATM 6206 O O . HOH Q12 17 474 ? -17.973 -2.923 -18.582 1.0 69.52 603 A 1 -HETATM 6207 O O . HOH Q12 17 475 ? -32.419 8.709 -14.195 1.0 46.94 604 A 1 -HETATM 6208 O O . HOH Q12 17 476 ? -28.792 29.221 -8.03 1.0 24.15 605 A 1 -HETATM 6209 O O . HOH Q12 17 477 ? -3.21 25.173 -3.46 1.0 23.18 606 A 1 -HETATM 6210 O O . HOH Q12 17 478 ? -7.604 31.165 -15.243 1.0 54.73 607 A 1 -HETATM 6211 O O . HOH Q12 17 479 ? 7.045 16.165 -34.574 1.0 35.82 608 A 1 -HETATM 6212 O O . HOH Q12 17 480 ? -20.241 30.578 -9.228 1.0 37.21 609 A 1 -HETATM 6213 O O . HOH Q12 17 481 ? -20.442 31.912 -11.92 1.0 25.05 610 A 1 -HETATM 6214 O O . HOH Q12 17 482 ? -6.46 23.379 -36.316 1.0 17.84 611 A 1 -HETATM 6215 O O . HOH Q12 17 483 ? 1.342 8.83 -30.807 1.0 23.32 612 A 1 -HETATM 6216 O O . HOH Q12 17 484 ? -3.633 15.85 -2.853 1.0 17.86 613 A 1 -HETATM 6217 O O . HOH Q12 17 485 ? -3.689 33.216 -21.746 1.0 44.06 614 A 1 -HETATM 6218 O O . HOH Q12 17 486 ? 14.805 3.627 -24.971 1.0 53.15 615 A 1 -HETATM 6219 O O . HOH Q12 17 487 ? -31.949 12.507 -2.458 1.0 31.25 616 A 1 -HETATM 6220 O O . HOH Q12 17 488 ? -5.378 19.266 -3.422 1.0 17.1 617 A 1 -HETATM 6221 O O . HOH Q12 17 489 ? -8.136 24.302 -3.206 1.0 24.99 618 A 1 -HETATM 6222 O O . HOH Q12 17 490 ? -4.919 19.956 0.309 1.0 22.53 619 A 1 -HETATM 6223 O O . HOH Q12 17 491 ? -1.748 26.645 -13.316 1.0 23.41 620 A 1 -HETATM 6224 O O . HOH Q12 17 492 ? 0.903 21.902 1.34 1.0 28.97 621 A 1 -HETATM 6225 O O . HOH Q12 17 493 ? 5.606 18.376 -34.061 1.0 31.05 622 A 1 -HETATM 6226 O O . HOH Q12 17 494 ? -6.979 28.918 -16.427 1.0 41.11 623 A 1 -HETATM 6227 O O . HOH Q12 17 495 ? -18.365 36.907 -16.324 1.0 44.64 624 A 1 -HETATM 6228 O O . HOH Q12 17 496 ? -18.195 -1.15 -29.755 1.0 40.07 625 A 1 -HETATM 6229 O O . HOH Q12 17 497 ? -17.176 2.107 -23.368 1.0 34.92 626 A 1 -HETATM 6230 O O . HOH Q12 17 498 ? -8.252 0.935 -12.397 1.0 22.03 627 A 1 -HETATM 6231 O O . HOH Q12 17 499 ? -8.503 35.168 -21.734 1.0 25.55 628 A 1 -HETATM 6232 O O . HOH Q12 17 500 ? -2.242 12.676 -42.388 1.0 52.46 629 A 1 -HETATM 6233 O O . HOH Q12 17 501 ? -9.902 -0.228 -22.822 1.0 22.17 630 A 1 -HETATM 6234 O O . HOH Q12 17 502 ? -29.247 3.527 -8.201 1.0 31.81 631 A 1 -HETATM 6235 O O . HOH Q12 17 503 ? -32.086 22.862 -6.282 1.0 27.72 632 A 1 -HETATM 6236 O O . HOH Q12 17 504 ? -32.091 12.932 -5.277 1.0 29.53 633 A 1 -HETATM 6237 O O . HOH Q12 17 505 ? -17.133 16.883 -40.054 1.0 22.38 634 A 1 -HETATM 6238 O O . HOH Q12 17 506 ? -32.26 11.25 -11.032 1.0 26.68 635 A 1 -HETATM 6239 O O . HOH Q12 17 507 ? 15.019 6.819 -8.788 1.0 35.56 636 A 1 -HETATM 6240 O O . HOH Q12 17 508 ? -10.544 -0.933 -31.663 1.0 28.29 637 A 1 -HETATM 6241 O O . HOH Q12 17 509 ? -7.685 1.76 -4.21 1.0 45.41 638 A 1 -HETATM 6242 O O . HOH Q12 17 510 ? -13.602 3.326 -8.04 1.0 50.79 639 A 1 -HETATM 6243 O O . HOH Q12 17 511 ? -4.828 15.152 -15.64 1.0 14.27 640 A 1 -HETATM 6244 O O . HOH Q12 17 512 ? -28.05 33.039 -17.27 1.0 32.39 641 A 1 -HETATM 6245 O O . HOH Q12 17 513 ? -8.864 22.7 -0.28 1.0 40.91 642 A 1 -HETATM 6246 O O . HOH Q12 17 514 ? -5.71 9.248 5.254 1.0 38.34 643 A 1 -HETATM 6247 O O . HOH Q12 17 515 ? 9.687 24.796 -3.342 1.0 53.73 644 A 1 -HETATM 6248 O O . HOH Q12 17 516 ? -35.243 23.488 -18.137 1.0 44.9 645 A 1 -HETATM 6249 O O . HOH Q12 17 517 ? 2.192 10.063 -2.942 1.0 24.78 646 A 1 -HETATM 6250 O O . HOH Q12 17 518 ? 1.145 7.531 -34.973 1.0 37.64 647 A 1 -HETATM 6251 O O . HOH Q12 17 519 ? 0.496 1.527 -21.655 1.0 36.85 648 A 1 -HETATM 6252 O O . HOH Q12 17 520 ? -17.804 6.144 -36.523 1.0 20.08 649 A 1 -HETATM 6253 O O . HOH Q12 17 521 ? -16.357 9.074 -16.311 1.0 30.66 650 A 1 -HETATM 6254 O O . HOH Q12 17 522 ? -23.168 26.702 -4.626 1.0 21.69 651 A 1 -HETATM 6255 O O . HOH Q12 17 523 ? 13.345 13.218 -7.443 1.0 35.81 652 A 1 -HETATM 6256 O O . HOH Q12 17 524 ? -14.018 26.975 -7.123 1.0 26.23 653 A 1 -HETATM 6257 O O . HOH Q12 17 525 ? -6.34 23.173 -5.437 1.0 21.76 654 A 1 -HETATM 6258 O O . HOH Q12 17 526 ? 14.632 1.002 -16.969 1.0 28.18 655 A 1 -HETATM 6259 O O . HOH Q12 17 527 ? -13.254 -2.191 -35.389 1.0 37.62 656 A 1 -HETATM 6260 O O . HOH Q12 17 528 ? 1.036 19.486 -29.691 1.0 16.72 657 A 1 -HETATM 6261 O O . HOH Q12 17 529 ? -20.599 1.92 -10.056 1.0 40.11 658 A 1 -HETATM 6262 O O . HOH Q12 17 530 ? -9.17 1.404 -8.831 1.0 53.84 659 A 1 -HETATM 6263 O O . HOH Q12 17 531 ? -10.468 29.153 -6.468 1.0 30.38 660 A 1 -HETATM 6264 O O . HOH Q12 17 532 ? 4.266 6.633 0.492 1.0 61.51 661 A 1 -HETATM 6265 O O . HOH Q12 17 533 ? -9.545 10.755 -21.713 1.0 26.42 662 A 1 -HETATM 6266 O O . HOH Q12 17 534 ? -9.873 17.192 -41.315 1.0 27.72 663 A 1 -HETATM 6267 O O . HOH Q12 17 535 ? -11.505 9.538 2.085 1.0 26.38 664 A 1 -HETATM 6268 O O . HOH Q12 17 536 ? 0.74 30.266 -8.913 1.0 33.42 665 A 1 -HETATM 6269 O O . HOH Q12 17 537 ? -7.011 32.906 -9.025 1.0 56.44 666 A 1 -HETATM 6270 O O . HOH Q12 17 538 ? -15.99 20.424 -22.917 1.0 15.54 667 A 1 -HETATM 6271 O O . HOH Q12 17 539 ? 25.734 17.226 -20.381 1.0 60.23 668 A 1 -HETATM 6272 O O . HOH Q12 17 540 ? 0.911 5.162 -28.498 1.0 36.69 669 A 1 -HETATM 6273 O O . HOH Q12 17 541 ? -23.484 -0.343 -26.798 1.0 58.56 670 A 1 -HETATM 6274 O O . HOH Q12 17 542 ? 3.134 2.065 -20.374 1.0 21.34 671 A 1 -HETATM 6275 O O . HOH Q12 17 543 ? -10.789 5.844 -31.455 1.0 16.41 672 A 1 -HETATM 6276 O O . HOH Q12 17 544 ? -13.052 18.224 -22.779 1.0 15.54 673 A 1 -HETATM 6277 O O . HOH Q12 17 545 ? -14.773 18.967 -5.213 1.0 15.99 674 A 1 -HETATM 6278 O O . HOH Q12 17 546 ? -18.701 33.421 -29.805 1.0 36.43 675 A 1 -HETATM 6279 O O . HOH Q12 17 547 ? 5.884 25.231 -28.131 1.0 47.66 676 A 1 -HETATM 6280 O O . HOH Q12 17 548 ? -15.871 28.936 -7.432 1.0 29.6 677 A 1 -HETATM 6281 O O . HOH Q12 17 549 ? -16.338 5.019 1.47 1.0 37.39 678 A 1 -HETATM 6282 O O . HOH Q12 17 550 ? -0.612 6.078 -37.417 1.0 49.99 679 A 1 -HETATM 6283 O O . HOH Q12 17 551 ? -34.747 22.701 -25.676 1.0 37.99 680 A 1 -HETATM 6284 O O . HOH Q12 17 552 ? -7.814 2.49 -37.55 1.0 26.85 681 A 1 -HETATM 6285 O O . HOH Q12 17 553 ? 5.368 28.02 -22.349 1.0 29.29 682 A 1 -HETATM 6286 O O . HOH Q12 17 554 ? -30.178 7.866 -8.675 1.0 26.35 683 A 1 -HETATM 6287 O O . HOH Q12 17 555 ? -5.06 31.275 -14.721 1.0 39.37 684 A 1 -HETATM 6288 O O . HOH Q12 17 556 ? 0.775 17.058 1.601 1.0 34.29 685 A 1 -HETATM 6289 O O . HOH Q12 17 557 ? -25.509 9.939 -34.44 1.0 30.14 686 A 1 -HETATM 6290 O O . HOH Q12 17 558 ? -31.898 24.591 -26.855 1.0 28.58 687 A 1 -HETATM 6291 O O . HOH Q12 17 559 ? 18.506 23.044 -22.294 1.0 49.45 688 A 1 -HETATM 6292 O O . HOH Q12 17 560 ? -32.53 5.962 -14.513 1.0 35.63 689 A 1 -HETATM 6293 O O . HOH Q12 17 561 ? -20.143 8.587 0.362 1.0 39.53 690 A 1 -HETATM 6294 O O . HOH Q12 17 562 ? 25.284 6.462 -12.432 1.0 50.85 691 A 1 -HETATM 6295 O O . HOH Q12 17 563 ? 1.938 1.226 -24.754 1.0 50.75 692 A 1 -HETATM 6296 O O . HOH Q12 17 564 ? -1.141 32.938 -18.717 1.0 42.62 693 A 1 -HETATM 6297 O O . HOH Q12 17 565 ? -19.795 -0.664 -11.393 1.0 48.2 694 A 1 -HETATM 6298 O O . HOH Q12 17 566 ? 24.414 12.678 -25.466 1.0 43.99 695 A 1 -HETATM 6299 O O . HOH Q12 17 567 ? -21.596 -8.099 -10.207 1.0 42.07 696 A 1 -HETATM 6300 O O . HOH Q12 17 568 ? -19.904 21.542 -34.874 1.0 26.79 697 A 1 -HETATM 6301 O O . HOH Q12 17 569 ? -20.143 0.344 -21.809 1.0 29.31 698 A 1 -HETATM 6302 O O . HOH Q12 17 570 ? 2.966 25.149 -27.523 1.0 28.52 699 A 1 -HETATM 6303 O O . HOH Q12 17 571 ? -1.013 15.665 -38.748 1.0 53.53 700 A 1 -HETATM 6304 O O B HOH Q12 17 572 ? -12.068 26.462 -3.019 1.0 26.67 701 A 1 -HETATM 6305 O O . HOH Q12 17 573 ? 7.672 12.617 -3.223 1.0 26.42 702 A 1 -HETATM 6306 O O . HOH Q12 17 574 ? -9.627 20.239 -43.323 1.0 42.32 703 A 1 -HETATM 6307 O O . HOH Q12 17 575 ? 10.638 22.14 -9.993 1.0 31.74 704 A 1 -HETATM 6308 O O . HOH Q12 17 576 ? -5.343 32.149 -4.426 1.0 46.74 705 A 1 -HETATM 6309 O O . HOH Q12 17 577 ? 4.302 8.834 -2.263 1.0 52.75 706 A 1 -HETATM 6310 O O . HOH Q12 17 578 ? -29.736 24.583 -30.018 1.0 37.65 707 A 1 -HETATM 6311 O O . HOH Q12 17 579 ? -22.072 34.809 -28.756 1.0 28.03 708 A 1 -HETATM 6312 O O . HOH Q12 17 580 ? -14.858 10.348 -40.557 1.0 28.45 709 A 1 -HETATM 6313 O O . HOH Q12 17 581 ? -36.551 22.234 -24.06 1.0 52.21 710 A 1 -HETATM 6314 O O . HOH Q12 17 582 ? -7.352 0.018 -22.114 1.0 25.32 711 A 1 -HETATM 6315 O O . HOH Q12 17 583 ? -4.642 11.652 -15.306 1.0 13.41 712 A 1 -HETATM 6316 O O . HOH Q12 17 584 ? -0.36 9.713 -1.704 1.0 25.43 713 A 1 -HETATM 6317 O O . HOH Q12 17 585 ? -0.269 32.452 -9.823 1.0 48.54 714 A 1 -HETATM 6318 O O . HOH Q12 17 586 ? 28.466 7.388 -27.828 1.0 46.89 715 A 1 -HETATM 6319 O O B HOH Q12 17 587 ? -14.398 26.31 -1.395 0.6 20.49 716 A 1 -HETATM 6320 O O . HOH Q12 17 588 ? 22.433 10.661 -23.068 1.0 47.35 717 A 1 -HETATM 6321 O O . HOH Q12 17 589 ? -31.178 27.866 -28.289 1.0 46.68 718 A 1 -HETATM 6322 O O . HOH Q12 17 590 ? 15.642 23.879 -26.165 1.0 36.5 719 A 1 -HETATM 6323 O O . HOH Q12 17 591 ? -35.829 8.124 -14.759 1.0 47.12 720 A 1 -HETATM 6324 O O . HOH Q12 17 592 ? -25.519 0.822 -27.765 1.0 29.38 721 A 1 -HETATM 6325 O O . HOH Q12 17 593 ? -30.003 5.827 -30.667 1.0 31.31 722 A 1 -HETATM 6326 O O . HOH Q12 17 594 ? -16.55 5.782 -16.288 1.0 21.93 723 A 1 -HETATM 6327 O O . HOH Q12 17 595 ? -1.954 -0.542 -29.046 1.0 27.84 724 A 1 -HETATM 6328 O O . HOH Q12 17 596 ? -19.328 4.495 -11.932 1.0 56.59 725 A 1 -HETATM 6329 O O . HOH Q12 17 597 ? 16.408 5.965 -22.586 1.0 30.76 726 A 1 -HETATM 6330 O O . HOH Q12 17 598 ? -27.081 0.612 -11.051 1.0 27.59 727 A 1 -HETATM 6331 O O . HOH Q12 17 599 ? -13.814 16.643 -2.356 1.0 22.88 728 A 1 -HETATM 6332 O O . HOH Q12 17 600 ? -7.258 27.603 -37.934 1.0 30.23 729 A 1 -HETATM 6333 O O . HOH Q12 17 601 ? -6.887 22.102 -1.669 1.0 43.84 730 A 1 -HETATM 6334 O O . HOH Q12 17 602 ? -29.266 -1.051 -17.918 1.0 28.59 731 A 1 -HETATM 6335 O O . HOH Q12 17 603 ? -19.944 21.837 -0.611 1.0 31.92 732 A 1 -HETATM 6336 O O . HOH Q12 17 604 ? -12.553 18.551 -42.22 1.0 37.19 733 A 1 -HETATM 6337 O O . HOH Q12 17 605 ? -21.84 3.151 -37.694 1.0 31.83 734 A 1 -HETATM 6338 O O . HOH Q12 17 606 ? -33.586 26.757 -12.382 1.0 34.68 735 A 1 -HETATM 6339 O O . HOH Q12 17 607 ? -6.125 26.117 -35.9 1.0 20.37 736 A 1 -HETATM 6340 O O . HOH Q12 17 608 ? 24.541 5.329 -21.294 1.0 38.72 737 A 1 -HETATM 6341 O O . HOH Q12 17 609 ? -11.297 39.238 -17.751 1.0 52.71 738 A 1 -HETATM 6342 O O . HOH Q12 17 610 ? -17.114 28.14 -30.833 1.0 38.4 739 A 1 -HETATM 6343 O O . HOH Q12 17 611 ? -12.111 32.325 -11.202 1.0 53.93 740 A 1 -HETATM 6344 O O . HOH Q12 17 612 ? 7.141 1.924 -16.591 1.0 36.16 741 A 1 -HETATM 6345 O O . HOH Q12 17 613 ? -4.745 19.673 -41.065 1.0 24.2 742 A 1 -HETATM 6346 O O . HOH Q12 17 614 ? -20.896 30.256 -6.034 1.0 29.16 743 A 1 -HETATM 6347 O O . HOH Q12 17 615 ? -23.132 3.181 -2.552 1.0 47.02 744 A 1 -HETATM 6348 O O . HOH Q12 17 616 ? 1.803 6.783 -26.46 1.0 21.95 745 A 1 -HETATM 6349 O O . HOH Q12 17 617 ? -16.562 30.805 -27.879 1.0 39.08 746 A 1 -HETATM 6350 O O . HOH Q12 17 618 ? 9.469 3.865 -12.653 1.0 32.45 747 A 1 -HETATM 6351 O O . HOH Q12 17 619 ? 3.498 27.591 -25.876 1.0 37.66 748 A 1 -HETATM 6352 O O . HOH Q12 17 620 ? -32.191 26.488 -24.797 1.0 32.65 749 A 1 -HETATM 6353 O O . HOH Q12 17 621 ? -8.568 33.914 -33.661 1.0 50.92 750 A 1 -HETATM 6354 O O . HOH Q12 17 622 ? 3.362 9.156 -34.154 1.0 51.36 751 A 1 -HETATM 6355 O O . HOH Q12 17 623 ? 8.232 10.79 -31.156 1.0 34.75 752 A 1 -HETATM 6356 O O . HOH Q12 17 624 ? -16.54 14.36 -40.701 1.0 21.37 753 A 1 -HETATM 6357 O O . HOH Q12 17 625 ? -14.842 1.053 -37.385 1.0 48.31 754 A 1 -HETATM 6358 O O . HOH Q12 17 626 ? 2.395 11.104 3.379 1.0 35.26 755 A 1 -HETATM 6359 O O . HOH Q12 17 627 ? -29.836 30.194 -28.736 1.0 50.7 756 A 1 -HETATM 6360 O O . HOH Q12 17 628 ? 2.36 17.1 -37.476 1.0 38.4 757 A 1 -HETATM 6361 O O . HOH Q12 17 629 ? 16.141 16.724 -26.109 1.0 31.49 758 A 1 -HETATM 6362 O O . HOH Q12 17 630 ? -16.429 0.173 -7.169 1.0 55.3 759 A 1 -HETATM 6363 O O . HOH Q12 17 631 ? -34.169 5.82 -16.821 1.0 56.98 760 A 1 -HETATM 6364 O O . HOH Q12 17 632 ? -16.484 24.722 -35.544 1.0 40.79 761 A 1 -HETATM 6365 O O . HOH Q12 17 633 ? 9.732 5.816 -20.112 1.0 42.57 762 A 1 -HETATM 6366 O O . HOH Q12 17 634 ? -7.438 10.582 -22.143 1.0 24.6 763 A 1 -HETATM 6367 O O . HOH Q12 17 635 ? -19.074 36.279 -13.295 1.0 42.16 764 A 1 -HETATM 6368 O O . HOH Q12 17 636 ? 8.917 3.686 -15.427 1.0 30.05 765 A 1 -HETATM 6369 O O . HOH Q12 17 637 ? -15.076 -2.736 -27.357 1.0 43.42 766 A 1 -HETATM 6370 O O . HOH Q12 17 638 ? 9.471 13.967 -31.689 1.0 27.79 767 A 1 -HETATM 6371 O O . HOH Q12 17 639 ? -18.846 26.043 -31.775 1.0 47.28 768 A 1 -HETATM 6372 O O . HOH Q12 17 640 ? -23.468 34.307 -11.183 1.0 51.35 769 A 1 -HETATM 6373 O O . HOH Q12 17 641 ? -15.363 34.28 -11.231 1.0 59.62 770 A 1 -HETATM 6374 O O A HOH Q12 17 642 ? 8.484 25.589 -27.922 0.52 41.93 771 A 1 -HETATM 6375 O O B HOH Q12 17 642 ? 8.526 20.471 -29.446 0.48 21.2 771 A 1 -HETATM 6376 O O . HOH Q12 17 643 ? -11.408 34.62 -27.299 1.0 64.24 772 A 1 -HETATM 6377 O O . HOH Q12 17 644 ? -0.849 9.681 5.724 1.0 56.55 773 A 1 -HETATM 6378 O O . HOH Q12 17 645 ? -32.992 9.039 -23.74 1.0 22.71 774 A 1 -HETATM 6379 O O . HOH Q12 17 646 ? 21.938 20.103 -14.807 1.0 45.39 775 A 1 -HETATM 6380 O O . HOH Q12 17 647 ? -24.989 36.295 -22.935 1.0 43.64 776 A 1 -HETATM 6381 O O . HOH Q12 17 648 ? -17.497 31.807 -10.15 1.0 42.58 777 A 1 -HETATM 6382 O O . HOH Q12 17 649 ? -6.039 33.991 -21.055 1.0 51.79 778 A 1 -HETATM 6383 O O . HOH Q12 17 650 ? -5.722 3.353 -2.72 1.0 31.55 779 A 1 -HETATM 6384 O O . HOH Q12 17 651 ? -20.602 3.353 -13.238 1.0 49.37 780 A 1 -HETATM 6385 O O . HOH Q12 17 652 ? 30.795 10.225 -34.368 1.0 50.36 781 A 1 -HETATM 6386 O O . HOH Q12 17 653 ? -4.095 16.048 6.473 1.0 46.34 782 A 1 -HETATM 6387 O O . HOH Q12 17 654 ? -10.643 19.894 -11.024 1.0 29.1 783 A 1 -HETATM 6388 O O . HOH Q12 17 655 ? -20.098 17.061 1.818 1.0 45.9 784 A 1 -HETATM 6389 O O . HOH Q12 17 656 ? -22.399 26.672 -31.71 1.0 40.21 785 A 1 -HETATM 6390 O O . HOH Q12 17 657 ? -12.292 1.451 -38.498 1.0 58.52 786 A 1 -HETATM 6391 O O . HOH Q12 17 658 ? -15.241 26.503 -37.757 1.0 67.68 787 A 1 -HETATM 6392 O O . HOH Q12 17 659 ? 11.624 22.377 -7.447 1.0 52.63 788 A 1 -HETATM 6393 O O . HOH Q12 17 660 ? -14.908 15.483 -0.198 1.0 48.52 789 A 1 -HETATM 6394 O O . HOH Q12 17 661 ? 2.648 8.886 1.622 1.0 46.3 790 A 1 -HETATM 6395 O O . HOH Q12 17 662 ? -35.723 18.44 -10.041 1.0 49.75 791 A 1 -HETATM 6396 O O . HOH Q12 17 663 ? -25.079 11.193 3.911 1.0 53.09 792 A 1 -HETATM 6397 O O . HOH Q12 17 664 ? -21.119 20.047 -36.478 1.0 52.6 793 A 1 -HETATM 6398 O O . HOH Q12 17 665 ? -21.435 36.339 -17.224 1.0 55.11 794 A 1 -HETATM 6399 O O . HOH Q12 17 666 ? -19.866 2.36 -36.36 1.0 53.59 795 A 1 -HETATM 6400 O O . HOH Q12 17 667 ? 4.301 1.232 -6.716 1.0 49.92 796 A 1 -HETATM 6401 O O . HOH Q12 17 668 ? -8.848 -1.103 -25.169 1.0 27.86 797 A 1 -HETATM 6402 O O . HOH Q12 17 669 ? -15.414 4.231 -38.292 1.0 31.0 798 A 1 -HETATM 6403 O O . HOH Q12 17 670 ? -31.933 31.636 -25.88 1.0 54.68 799 A 1 -HETATM 6404 O O . HOH Q12 17 671 ? -30.505 36.42 -25.28 1.0 51.92 800 A 1 -HETATM 6405 O O . HOH Q12 17 672 ? 16.456 16.46 -4.947 1.0 55.81 801 A 1 -HETATM 6406 O O . HOH Q12 17 673 ? 14.058 8.305 -6.897 1.0 47.2 802 A 1 -HETATM 6407 O O . HOH Q12 17 674 ? -18.658 4.93 -38.731 1.0 53.99 803 A 1 -HETATM 6408 O O . HOH Q12 17 675 ? -1.803 22.962 0.366 1.0 39.78 804 A 1 -HETATM 6409 O O . HOH Q12 17 676 ? -3.219 9.682 6.721 1.0 43.41 805 A 1 -HETATM 6410 O O . HOH Q12 17 677 ? 19.131 17.233 -8.494 1.0 50.21 806 A 1 -HETATM 6411 O O . HOH Q12 17 678 ? -34.006 8.014 -21.692 1.0 48.75 807 A 1 -HETATM 6412 O O . HOH Q12 17 679 ? -25.537 11.937 -32.44 1.0 31.55 808 A 1 -HETATM 6413 O O A HOH Q12 17 680 ? -22.717 0.234 -29.247 0.57 33.94 809 A 1 -HETATM 6414 O O . HOH Q12 17 681 ? -16.47 1.316 -1.46 1.0 38.28 810 A 1 -HETATM 6415 O O . HOH Q12 17 682 ? 19.952 17.855 -6.85 1.0 52.31 811 A 1 -HETATM 6416 O O . HOH Q12 17 683 ? -16.056 38.993 -16.776 1.0 60.38 812 A 1 -HETATM 6417 O O . HOH Q12 17 684 ? -26.578 -2.141 -11.565 1.0 49.99 813 A 1 -HETATM 6418 O O . HOH Q12 17 685 ? -31.202 10.34 -8.68 1.0 31.49 814 A 1 -HETATM 6419 O O . HOH Q12 17 686 ? -16.272 -0.431 -27.783 1.0 37.22 815 A 1 -HETATM 6420 O O . HOH Q12 17 687 ? -17.925 2.161 -8.841 1.0 45.77 816 A 1 -HETATM 6421 O O . HOH Q12 17 688 ? -25.948 36.669 -20.286 1.0 54.16 817 A 1 -HETATM 6422 O O . HOH Q12 17 689 ? 7.411 2.005 -20.182 1.0 62.22 818 A 1 -HETATM 6423 O O . HOH Q12 17 690 ? -24.54 13.44 -40.024 1.0 49.41 819 A 1 -HETATM 6424 O O . HOH Q12 17 691 ? 19.011 2.307 -19.71 1.0 72.26 820 A 1 -HETATM 6425 O O . HOH Q12 17 692 ? -8.438 36.408 -19.361 1.0 44.71 821 A 1 -HETATM 6426 O O . HOH Q12 17 693 ? 2.756 9.244 -28.131 1.0 41.72 822 A 1 -HETATM 6427 O O . HOH Q12 17 694 ? 7.877 6.549 -21.305 1.0 55.18 823 A 1 -HETATM 6428 O O . HOH Q12 17 695 ? -21.812 36.651 -14.681 1.0 54.51 824 A 1 -HETATM 6429 O O . HOH Q12 17 696 ? -35.13 20.333 -12.863 1.0 55.14 825 A 1 -HETATM 6430 O O . HOH Q12 17 697 ? 7.932 14.244 -1.045 1.0 28.61 826 A 1 -HETATM 6431 O O . HOH Q12 17 698 ? -10.33 -1.791 -29.122 1.0 32.9 827 A 1 -HETATM 6432 O O . HOH Q12 17 699 ? -24.95 27.485 -31.687 1.0 47.37 828 A 1 -HETATM 6433 O O . HOH Q12 17 700 ? -27.741 29.565 -5.431 1.0 36.51 829 A 1 -HETATM 6434 O O . HOH Q12 17 701 ? -30.309 -0.897 -20.418 1.0 32.22 830 A 1 -HETATM 6435 O O . HOH Q12 17 702 ? 15.366 13.07 -32.134 1.0 68.45 831 A 1 -HETATM 6436 O O . HOH Q12 17 703 ? -4.177 30.082 -35.841 1.0 52.9 832 A 1 -HETATM 6437 O O . HOH Q12 17 704 ? -0.527 18.623 3.659 1.0 29.16 833 A 1 -HETATM 6438 O O . HOH Q12 17 705 ? 15.538 22.388 -28.423 1.0 32.17 834 A 1 -HETATM 6439 O O . HOH Q12 17 706 ? -25.057 30.021 -5.334 1.0 47.27 835 A 1 -HETATM 6440 O O . HOH Q12 17 707 ? 16.691 16.851 -30.577 1.0 51.64 836 A 1 -HETATM 6441 O O . HOH Q12 17 708 ? 2.184 0.953 -6.819 1.0 57.87 837 A 1 -HETATM 6442 O O . HOH Q12 17 709 ? -27.675 35.633 -18.166 1.0 51.21 838 A 1 -HETATM 6443 O O . HOH Q12 17 710 ? -34.071 22.607 -14.072 1.0 41.83 839 A 1 -HETATM 6444 O O . HOH Q12 17 711 ? 17.937 24.75 -24.737 1.0 54.26 840 A 1 -HETATM 6445 O O . HOH Q12 17 712 ? -32.856 31.238 -18.108 1.0 58.67 841 A 1 -HETATM 6446 O O . HOH Q12 17 713 ? 1.89 28.301 -11.363 1.0 48.85 842 A 1 -HETATM 6447 O O . HOH Q12 17 714 ? 1.084 33.123 -17.006 1.0 55.94 843 A 1 -HETATM 6448 O O . HOH Q12 17 715 ? -18.263 22.818 1.164 1.0 44.17 844 A 1 -HETATM 6449 O O . HOH Q12 17 716 ? 18.347 4.056 -21.334 1.0 50.61 845 A 1 -HETATM 6450 O O . HOH Q12 17 717 ? 14.028 20.031 -28.61 1.0 36.93 846 A 1 -HETATM 6451 O O . HOH Q12 17 718 ? -4.021 27.53 -34.93 1.0 28.71 847 A 1 -HETATM 6452 O O . HOH Q12 17 719 ? 5.258 30.349 -20.742 1.0 53.33 848 A 1 -HETATM 6453 O O . HOH Q12 17 720 ? 12.749 14.782 -5.299 1.0 51.05 849 A 1 -HETATM 6454 O O . HOH Q12 17 721 ? -32.682 10.538 -6.315 1.0 43.62 850 A 1 -HETATM 6455 O O . HOH Q12 17 722 ? -2.997 32.947 -27.01 1.0 49.82 851 A 1 -HETATM 6456 O O . HOH Q12 17 723 ? -8.608 36.821 -23.965 1.0 49.52 852 A 1 -HETATM 6457 O O . HOH Q12 17 724 ? -31.275 9.384 -12.3 1.0 36.9 853 A 1 -HETATM 6458 O O . HOH Q12 17 725 ? -9.224 24.878 -40.14 1.0 49.04 854 A 1 -HETATM 6459 O O . HOH Q12 17 726 ? -29.556 0.808 -9.907 1.0 45.18 855 A 1 -HETATM 6460 O O . HOH Q12 17 727 ? -2.859 11.429 -40.795 1.0 63.98 856 A 1 -HETATM 6461 O O . HOH Q12 17 728 ? 5.396 28.834 -25.135 1.0 50.13 857 A 1 -HETATM 6462 O O . HOH Q12 17 729 ? -30.014 32.803 -19.098 1.0 42.39 858 A 1 -HETATM 6463 O O . HOH Q12 17 730 ? -14.526 12.801 -41.362 1.0 40.05 859 A 1 -HETATM 6464 O O . HOH Q12 17 731 ? 1.665 6.031 -30.943 1.0 28.39 860 A 1 -HETATM 6465 O O . HOH Q12 17 732 ? 28.197 3.694 -17.794 1.0 51.65 861 A 1 -HETATM 6466 O O . HOH Q12 17 733 ? -0.043 5.768 -33.161 1.0 26.93 862 A 1 -HETATM 6467 O O . HOH Q12 17 734 ? -18.829 29.555 2.369 1.0 71.75 863 A 1 -HETATM 6468 O O . HOH Q12 17 735 ? -11.318 -3.082 -33.279 1.0 44.13 864 A 1 -HETATM 6469 O O . HOH Q12 17 736 ? 26.081 2.239 -15.771 1.0 53.81 865 A 1 -HETATM 6470 O O . HOH Q12 17 737 ? 18.362 6.197 -20.09 1.0 51.22 866 A 1 -HETATM 6471 O O . HOH Q12 17 738 ? -27.299 7.886 -34.247 1.0 49.84 867 A 1 -HETATM 6472 O O . HOH Q12 17 739 ? -30.613 6.014 -6.798 1.0 46.31 868 A 1 -HETATM 6473 O O . HOH Q12 17 740 ? -31.168 2.349 -22.542 1.0 46.5 869 A 1 -HETATM 6474 O O . HOH Q12 17 741 ? -14.08 4.4 -40.735 1.0 57.2 870 A 1 -HETATM 6475 O O . HOH Q12 17 742 ? 15.425 12.844 -28.873 1.0 54.6 871 A 1 -HETATM 6476 O O . HOH Q12 17 743 ? -7.058 23.981 -39.157 1.0 24.7 872 A 1 -HETATM 6477 O O B HOH Q12 17 744 ? -17.781 28.426 -0.941 0.54 49.47 873 A 1 -HETATM 6478 O O . HOH Q12 17 745 ? 11.141 11.962 -30.834 1.0 46.58 874 A 1 -HETATM 6479 O O . HOH Q12 17 746 ? -31.399 6.727 -10.907 1.0 37.13 875 A 1 -HETATM 6480 O O . HOH Q12 17 747 ? -30.732 -0.502 -15.819 1.0 41.52 876 A 1 -HETATM 6481 O O . HOH Q12 17 748 ? -3.534 21.81 2.159 1.0 40.49 877 A 1 -HETATM 6482 O O . HOH Q12 17 749 ? -5.223 22.449 -40.989 1.0 33.98 878 A 1 -HETATM 6483 O O . HOH Q12 17 750 ? 4.872 8.516 -28.777 1.0 48.26 879 A 1 -HETATM 6484 O O . HOH Q12 17 751 ? -22.87 28.752 -2.969 1.0 45.24 880 A 1 -HETATM 6485 O O . HOH Q12 17 752 ? -6.573 -0.82 -28.902 1.0 35.96 881 A 1 -HETATM 6486 O O . HOH Q12 17 753 ? 23.582 2.792 -20.112 1.0 44.6 882 A 1 -HETATM 6487 O O . HOH Q12 17 754 ? -1.666 25.768 0.527 1.0 32.72 883 A 1 -HETATM 6488 O O . HOH Q12 17 755 ? -31.082 30.833 -8.497 1.0 42.34 884 A 1 -HETATM 6489 O O . HOH Q12 17 756 ? -30.972 8.78 -0.181 1.0 40.67 885 A 1 -HETATM 6490 O O . HOH Q12 17 757 ? -34.655 25.537 -24.223 1.0 47.63 886 A 1 -HETATM 6491 O O . HOH Q12 17 758 ? -24.579 30.814 -7.997 1.0 35.22 887 A 1 -HETATM 6492 O O . HOH Q12 17 759 ? -0.313 2.819 -2.717 1.0 49.36 888 A 1 -HETATM 6493 O O . HOH Q12 17 760 ? -36.546 22.245 -20.361 1.0 50.02 889 A 1 -HETATM 6494 O O . HOH Q12 17 761 ? -32.6 9.726 -1.926 1.0 51.63 890 A 1 -HETATM 6495 O O . HOH Q12 17 762 ? 11.646 12.473 -2.84 1.0 57.13 891 A 1 -HETATM 6496 O O . HOH Q12 17 763 ? -21.176 1.393 -2.172 1.0 52.97 892 A 1 -HETATM 6497 O O . HOH Q12 17 764 ? -13.414 9.661 3.866 1.0 42.8 893 A 1 -HETATM 6498 O O . HOH Q12 17 765 ? 17.617 14.615 -7.543 1.0 54.26 894 A 1 -HETATM 6499 O O . HOH Q12 17 766 ? -12.31 9.325 -41.2 1.0 38.7 895 A 1 -HETATM 6500 O O . HOH Q12 17 767 ? -20.916 -1.964 -20.156 1.0 45.22 896 A 1 -HETATM 6501 O O . HOH Q12 17 768 ? -3.859 26.451 -1.109 1.0 31.48 897 A 1 -HETATM 6502 O O . HOH Q12 17 769 ? -20.234 -9.522 -8.763 1.0 55.88 898 A 1 -HETATM 6503 O O . HOH Q12 17 770 ? 27.184 4.947 -21.047 1.0 57.56 899 A 1 -HETATM 6504 O O . HOH Q12 17 771 ? -24.919 3.378 -0.626 1.0 67.49 900 A 1 -HETATM 6505 O O . HOH Q12 17 772 ? -18.554 6.822 1.79 1.0 54.22 901 A 1 -HETATM 6506 O O . HOH Q12 17 773 ? 5.632 18.333 -36.858 1.0 32.87 902 A 1 -HETATM 6507 O O . HOH Q12 17 774 ? 0.616 26.23 -28.68 1.0 36.78 903 A 1 -HETATM 6508 O O . HOH Q12 17 775 ? -24.363 28.417 -1.086 1.0 49.21 904 A 1 -HETATM 6509 O O . HOH Q12 17 776 ? -28.739 5.849 -3.053 1.0 53.43 905 A 1 -HETATM 6510 O O . HOH Q12 17 777 ? 16.37 18.206 -28.365 1.0 32.48 906 A 1 -HETATM 6511 O O . HOH Q12 17 778 ? 3.745 3.978 -27.489 1.0 53.14 907 A 1 -HETATM 6512 O O . HOH Q12 17 779 ? 5.597 14.978 -37.098 1.0 44.7 908 A 1 -HETATM 6513 O O A HOH Q12 17 780 ? -10.66 18.363 -12.968 0.86 32.08 909 A 1 -HETATM 6514 O O . HOH Q12 17 781 ? -4.864 31.064 -1.226 1.0 52.02 910 A 1 -HETATM 6515 O O . HOH Q12 17 782 ? -15.942 35.27 -29.896 1.0 52.51 911 A 1 -HETATM 6516 O O . HOH Q12 17 783 ? -25.337 8.073 1.7 1.0 55.07 912 A 1 -HETATM 6517 O O . HOH Q12 17 784 ? -27.466 -0.463 -26.185 1.0 45.25 913 A 1 -HETATM 6518 O O . HOH Q12 17 785 ? -21.658 29.154 -0.629 1.0 78.1 914 A 1 -HETATM 6519 O O . HOH Q12 17 786 ? -1.818 27.126 -33.21 1.0 41.78 915 A 1 -HETATM 6520 O O . HOH Q12 17 787 ? -12.125 13.194 -42.014 1.0 39.55 916 A 1 -HETATM 6521 O O . HOH Q12 17 788 ? -16.856 -3.918 -30.732 1.0 55.34 917 A 1 -HETATM 6522 O O . HOH Q12 17 789 ? -11.71 26.012 -44.308 1.0 56.23 918 A 1 -HETATM 6523 O O . HOH Q12 17 790 ? -12.523 -3.037 -28.072 1.0 54.13 919 A 1 -HETATM 6524 O O . HOH Q12 17 791 ? -4.231 -2.521 -28.883 1.0 56.89 920 A 1 -HETATM 6525 O O . HOH Q12 17 792 ? -31.746 4.92 -22.512 1.0 47.8 921 A 1 -HETATM 6526 O O . HOH Q12 17 793 ? -30.005 35.872 -20.346 1.0 57.0 922 A 1 -HETATM 6527 O O . HOH Q12 17 794 ? -8.355 -3.836 -29.781 1.0 51.58 923 A 1 -HETATM 6528 O O . HOH Q12 17 795 ? -0.834 0.489 -6.205 1.0 54.17 924 A 1 -HETATM 6529 O O . HOH Q12 17 796 ? -4.398 28.91 -0.263 1.0 43.73 925 A 1 -HETATM 6530 O O . HOH Q12 17 797 ? -2.523 29.748 -31.82 1.0 44.4 926 A 1 -HETATM 6531 O O . HOH Q12 17 798 ? 12.068 11.646 0.601 1.0 65.71 927 A 1 -HETATM 6532 O O . HOH Q12 17 799 ? -11.446 12.037 -44.424 1.0 56.24 928 A 1 -HETATM 6533 O O . HOH Q12 17 800 ? 18.981 13.053 -6.917 1.0 54.14 929 A 1 -HETATM 6534 O O . HOH Q12 17 801 ? -32.518 8.24 -4.408 1.0 51.72 930 A 1 -HETATM 6535 O O . HOH Q12 17 802 ? -30.193 -1.93 -8.743 1.0 61.15 931 A 1 -HETATM 6536 O O . HOH Q12 17 803 ? -8.626 25.044 -47.258 1.0 55.02 932 A 1 -HETATM 6537 O O . HOH Q12 17 804 ? -5.403 25.976 -42.947 1.0 57.15 933 A 1 +ATOM 1 N N . MET A1 1 1 ? 38.148 15.945 -39.073 0.79 41.59 ? -9 A 1 +ATOM 2 C CA . MET A1 1 1 ? 36.885 15.61 -38.335 0.79 76.65 ? -9 A 1 +ATOM 3 C C . MET A1 1 1 ? 37.158 14.603 -37.223 0.79 73.14 ? -9 A 1 +ATOM 4 O O . MET A1 1 1 ? 37.995 13.711 -37.337 0.79 78.18 ? -9 A 1 +ATOM 5 C CB . MET A1 1 1 ? 35.785 15.067 -39.263 0.79 41.4 ? -9 A 1 +ATOM 6 C CG . MET A1 1 1 ? 34.44 14.758 -38.636 0.79 36.33 ? -9 A 1 +ATOM 7 S SD . MET A1 1 1 ? 33.713 16.096 -37.624 0.79 36.0 ? -9 A 1 +ATOM 8 C CE . MET A1 1 1 ? 33.668 17.43 -38.787 0.79 35.87 ? -9 A 1 +ATOM 9 H H1 . MET A1 1 1 ? 37.959 16.487 -39.754 0.79 49.91 ? -9 A 1 +ATOM 10 H H2 . MET A1 1 1 ? 38.716 16.35 -38.521 0.79 49.91 ? -9 A 1 +ATOM 11 H H3 . MET A1 1 1 ? 38.517 15.197 -39.383 0.79 49.91 ? -9 A 1 +ATOM 12 H HA . MET A1 1 1 ? 36.546 16.437 -37.957 0.79 91.98 ? -9 A 1 +ATOM 13 H HB2 . MET A1 1 1 ? 35.628 15.726 -39.957 0.79 49.68 ? -9 A 1 +ATOM 14 H HB3 . MET A1 1 1 ? 36.108 14.241 -39.657 0.79 49.68 ? -9 A 1 +ATOM 15 H HG2 . MET A1 1 1 ? 33.81 14.562 -39.348 0.79 43.6 ? -9 A 1 +ATOM 16 H HG3 . MET A1 1 1 ? 34.542 13.985 -38.061 0.79 43.6 ? -9 A 1 +ATOM 17 H HE1 . MET A1 1 1 ? 33.292 18.213 -38.354 0.79 43.05 ? -9 A 1 +ATOM 18 H HE2 . MET A1 1 1 ? 34.571 17.619 -39.086 0.79 43.05 ? -9 A 1 +ATOM 19 H HE3 . MET A1 1 1 ? 33.116 17.172 -39.542 0.79 43.05 ? -9 A 1 +ATOM 20 N N . TRP A1 1 2 ? 36.397 14.756 -36.154 1.0 51.72 ? -8 A 1 +ATOM 21 C CA . TRP A1 1 2 ? 36.576 14.031 -34.911 1.0 37.95 ? -8 A 1 +ATOM 22 C C . TRP A1 1 2 ? 35.234 13.355 -34.569 1.0 60.47 ? -8 A 1 +ATOM 23 O O . TRP A1 1 2 ? 34.2 13.59 -35.212 1.0 39.4 ? -8 A 1 +ATOM 24 C CB . TRP A1 1 2 ? 36.969 15.024 -33.802 1.0 41.92 ? -8 A 1 +ATOM 25 C CG . TRP A1 1 2 ? 35.911 16.127 -33.579 1.0 49.1 ? -8 A 1 +ATOM 26 C CD1 . TRP A1 1 2 ? 34.842 16.078 -32.737 1.0 41.65 ? -8 A 1 +ATOM 27 C CD2 . TRP A1 1 2 ? 35.847 17.403 -34.224 1.0 37.75 ? -8 A 1 +ATOM 28 N NE1 . TRP A1 1 2 ? 34.11 17.246 -32.808 1.0 42.91 ? -8 A 1 +ATOM 29 C CE2 . TRP A1 1 2 ? 34.703 18.069 -33.725 1.0 45.83 ? -8 A 1 +ATOM 30 C CE3 . TRP A1 1 2 ? 36.639 18.044 -35.193 1.0 41.88 ? -8 A 1 +ATOM 31 C CZ2 . TRP A1 1 2 ? 34.342 19.349 -34.141 1.0 44.65 ? -8 A 1 +ATOM 32 C CZ3 . TRP A1 1 2 ? 36.273 19.312 -35.607 1.0 82.58 ? -8 A 1 +ATOM 33 C CH2 . TRP A1 1 2 ? 35.132 19.948 -35.084 1.0 66.0 ? -8 A 1 +ATOM 34 H H . TRP A1 1 2 ? 35.735 15.304 -36.123 1.0 62.07 ? -8 A 1 +ATOM 35 H HA . TRP A1 1 2 ? 37.261 13.348 -34.986 1.0 45.54 ? -8 A 1 +ATOM 36 H HB2 . TRP A1 1 2 ? 37.077 14.539 -32.969 1.0 50.3 ? -8 A 1 +ATOM 37 H HB3 . TRP A1 1 2 ? 37.804 15.454 -34.046 1.0 50.3 ? -8 A 1 +ATOM 38 H HD1 . TRP A1 1 2 ? 34.633 15.356 -32.19 1.0 49.98 ? -8 A 1 +ATOM 39 H HE1 . TRP A1 1 2 ? 33.403 17.426 -32.353 1.0 51.5 ? -8 A 1 +ATOM 40 H HE3 . TRP A1 1 2 ? 37.391 17.625 -35.547 1.0 50.25 ? -8 A 1 +ATOM 41 H HZ2 . TRP A1 1 2 ? 33.594 19.778 -33.792 1.0 53.58 ? -8 A 1 +ATOM 42 H HZ3 . TRP A1 1 2 ? 36.789 19.751 -36.244 1.0 99.1 ? -8 A 1 +ATOM 43 H HH2 . TRP A1 1 2 ? 34.909 20.799 -35.386 1.0 79.2 ? -8 A 1 +ATOM 44 N N . SER A1 1 3 ? 35.238 12.526 -33.522 1.0 29.85 ? -7 A 1 +ATOM 45 C CA A SER A1 1 3 ? 34.091 11.739 -33.112 0.63 28.25 ? -7 A 1 +ATOM 46 C CA B SER A1 1 3 ? 34.095 11.738 -33.109 0.37 28.25 ? -7 A 1 +ATOM 47 C C . SER A1 1 3 ? 33.087 12.601 -32.344 1.0 27.43 ? -7 A 1 +ATOM 48 O O . SER A1 1 3 ? 33.363 13.725 -31.927 1.0 36.37 ? -7 A 1 +ATOM 49 C CB A SER A1 1 3 ? 34.537 10.559 -32.252 0.63 38.49 ? -7 A 1 +ATOM 50 C CB B SER A1 1 3 ? 34.57 10.572 -32.243 0.37 36.36 ? -7 A 1 +ATOM 51 O OG A SER A1 1 3 ? 33.445 9.699 -31.985 0.63 63.39 ? -7 A 1 +ATOM 52 O OG B SER A1 1 3 ? 35.205 11.043 -31.066 0.37 62.85 ? -7 A 1 +ATOM 53 H H . SER A1 1 3 ? 35.923 12.401 -33.017 1.0 35.82 ? -7 A 1 +ATOM 54 H HA . SER A1 1 3 ? 33.648 11.394 -33.902 1.0 33.9 ? -7 A 1 +ATOM 55 H HB2 A SER A1 1 3 ? 35.223 10.064 -32.725 0.63 46.19 ? -7 A 1 +ATOM 56 H HB2 B SER A1 1 3 ? 33.804 10.031 -31.994 0.37 43.64 ? -7 A 1 +ATOM 57 H HB3 A SER A1 1 3 ? 34.889 10.894 -31.412 0.63 46.19 ? -7 A 1 +ATOM 58 H HB3 B SER A1 1 3 ? 35.202 10.039 -32.751 0.37 43.64 ? -7 A 1 +ATOM 59 H HG A SER A1 1 3 ? 33.692 9.068 -31.488 0.63 76.07 ? -7 A 1 +ATOM 60 H HG B SER A1 1 3 ? 34.661 11.488 -30.605 0.37 75.43 ? -7 A 1 +ATOM 61 N N . HIS A1 1 4 ? 31.903 12.063 -32.172 1.0 26.34 ? -6 A 1 +ATOM 62 C CA . HIS A1 1 4 ? 30.834 12.761 -31.484 1.0 25.69 ? -6 A 1 +ATOM 63 C C . HIS A1 1 4 ? 30.056 11.791 -30.615 1.0 24.36 ? -6 A 1 +ATOM 64 O O . HIS A1 1 4 ? 28.874 11.508 -30.852 1.0 27.57 ? -6 A 1 +ATOM 65 C CB . HIS A1 1 4 ? 29.885 13.431 -32.497 1.0 31.17 ? -6 A 1 +ATOM 66 C CG . HIS A1 1 4 ? 28.911 14.393 -31.898 1.0 33.72 ? -6 A 1 +ATOM 67 N ND1 . HIS A1 1 4 ? 29.313 15.567 -31.292 1.0 32.82 ? -6 A 1 +ATOM 68 C CD2 . HIS A1 1 4 ? 27.558 14.413 -31.907 1.0 40.6 ? -6 A 1 +ATOM 69 C CE1 . HIS A1 1 4 ? 28.243 16.251 -30.931 1.0 30.94 ? -6 A 1 +ATOM 70 N NE2 . HIS A1 1 4 ? 27.162 15.556 -31.248 1.0 30.54 ? -6 A 1 +ATOM 71 H H . HIS A1 1 4 ? 31.685 11.278 -32.45 1.0 31.61 ? -6 A 1 +ATOM 72 H HA . HIS A1 1 4 ? 31.233 13.434 -30.91 1.0 30.83 ? -6 A 1 +ATOM 73 H HB2 . HIS A1 1 4 ? 30.418 13.919 -33.143 1.0 37.4 ? -6 A 1 +ATOM 74 H HB3 . HIS A1 1 4 ? 29.374 12.738 -32.945 1.0 37.4 ? -6 A 1 +ATOM 75 H HD1 . HIS A1 1 4 ? 30.128 15.812 -31.169 1.0 39.38 ? -6 A 1 +ATOM 76 H HD2 . HIS A1 1 4 ? 27.0 13.774 -32.287 1.0 48.72 ? -6 A 1 +ATOM 77 H HE1 . HIS A1 1 4 ? 28.248 17.085 -30.521 1.0 37.12 ? -6 A 1 +ATOM 78 N N . PRO A1 1 5 ? 30.646 11.321 -29.516 1.0 25.28 ? -5 A 1 +ATOM 79 C CA . PRO A1 1 5 ? 29.93 10.356 -28.687 1.0 24.96 ? -5 A 1 +ATOM 80 C C . PRO A1 1 5 ? 28.873 10.989 -27.816 1.0 24.39 ? -5 A 1 +ATOM 81 O O . PRO A1 1 5 ? 28.908 12.182 -27.52 1.0 30.77 ? -5 A 1 +ATOM 82 C CB . PRO A1 1 5 ? 31.044 9.786 -27.805 1.0 26.01 ? -5 A 1 +ATOM 83 C CG . PRO A1 1 5 ? 32.069 10.791 -27.814 1.0 27.78 ? -5 A 1 +ATOM 84 C CD . PRO A1 1 5 ? 31.989 11.621 -29.065 1.0 27.01 ? -5 A 1 +ATOM 85 H HA . PRO A1 1 5 ? 29.526 9.673 -29.245 1.0 29.95 ? -5 A 1 +ATOM 86 H HB2 . PRO A1 1 5 ? 30.711 9.636 -26.907 1.0 31.22 ? -5 A 1 +ATOM 87 H HB3 . PRO A1 1 5 ? 31.37 8.953 -28.181 1.0 31.22 ? -5 A 1 +ATOM 88 H HG2 . PRO A1 1 5 ? 31.947 11.36 -27.038 1.0 33.34 ? -5 A 1 +ATOM 89 H HG3 . PRO A1 1 5 ? 32.931 10.35 -27.771 1.0 33.34 ? -5 A 1 +ATOM 90 H HD2 . PRO A1 1 5 ? 32.094 12.565 -28.87 1.0 32.41 ? -5 A 1 +ATOM 91 H HD3 . PRO A1 1 5 ? 32.651 11.341 -29.717 1.0 32.41 ? -5 A 1 +ATOM 92 N N . GLN A1 1 6 ? 27.874 10.185 -27.464 1.0 23.78 ? -4 A 1 +ATOM 93 C CA . GLN A1 1 6 ? 26.799 10.587 -26.595 1.0 23.02 ? -4 A 1 +ATOM 94 C C . GLN A1 1 6 ? 27.211 10.457 -25.129 1.0 24.25 ? -4 A 1 +ATOM 95 O O . GLN A1 1 6 ? 28.094 9.691 -24.801 1.0 27.41 ? -4 A 1 +ATOM 96 C CB . GLN A1 1 6 ? 25.61 9.66 -26.823 1.0 24.39 ? -4 A 1 +ATOM 97 C CG . GLN A1 1 6 ? 24.956 9.818 -28.22 1.0 37.55 ? -4 A 1 +ATOM 98 H H . GLN A1 1 6 ? 27.802 9.371 -27.731 1.0 28.54 ? -4 A 1 +ATOM 99 H HA . GLN A1 1 6 ? 26.562 11.509 -26.779 1.0 27.62 ? -4 A 1 +ATOM 100 H HB2 . GLN A1 1 6 ? 25.908 8.742 -26.738 1.0 29.27 ? -4 A 1 +ATOM 101 H HB3 . GLN A1 1 6 ? 24.932 9.852 -26.155 1.0 29.27 ? -4 A 1 +ATOM 102 N N . PHE A1 1 7 ? 26.523 11.19 -24.294 1.0 24.25 ? -3 A 1 +ATOM 103 C CA . PHE A1 1 7 ? 26.769 11.152 -22.851 1.0 23.83 ? -3 A 1 +ATOM 104 C C . PHE A1 1 7 ? 26.07 9.96 -22.223 1.0 26.94 ? -3 A 1 +ATOM 105 O O . PHE A1 1 7 ? 25.039 9.48 -22.696 1.0 28.29 ? -3 A 1 +ATOM 106 C CB . PHE A1 1 7 ? 26.202 12.43 -22.239 1.0 22.45 ? -3 A 1 +ATOM 107 C CG . PHE A1 1 7 ? 26.994 13.655 -22.589 1.0 22.39 ? -3 A 1 +ATOM 108 C CD1 . PHE A1 1 7 ? 28.253 13.859 -22.148 1.0 22.48 ? -3 A 1 +ATOM 109 C CD2 . PHE A1 1 7 ? 26.445 14.634 -23.393 1.0 48.1 ? -3 A 1 +ATOM 110 C CE1 . PHE A1 1 7 ? 28.984 14.967 -22.405 1.0 23.69 ? -3 A 1 +ATOM 111 C CE2 . PHE A1 1 7 ? 27.189 15.774 -23.716 1.0 40.66 ? -3 A 1 +ATOM 112 C CZ . PHE A1 1 7 ? 28.451 15.934 -23.212 1.0 36.7 ? -3 A 1 +ATOM 113 H H . PHE A1 1 7 ? 25.896 11.73 -24.527 1.0 29.11 ? -3 A 1 +ATOM 114 H HA . PHE A1 1 7 ? 27.719 11.078 -22.668 1.0 28.6 ? -3 A 1 +ATOM 115 H HB2 . PHE A1 1 7 ? 25.297 12.558 -22.562 1.0 26.95 ? -3 A 1 +ATOM 116 H HB3 . PHE A1 1 7 ? 26.2 12.342 -21.273 1.0 26.95 ? -3 A 1 +ATOM 117 H HD1 . PHE A1 1 7 ? 28.644 13.192 -21.631 1.0 26.97 ? -3 A 1 +ATOM 118 H HD2 . PHE A1 1 7 ? 25.58 14.536 -23.72 1.0 57.71 ? -3 A 1 +ATOM 119 H HE1 . PHE A1 1 7 ? 29.834 15.069 -22.041 1.0 28.43 ? -3 A 1 +ATOM 120 H HE2 . PHE A1 1 7 ? 26.825 16.423 -24.275 1.0 48.79 ? -3 A 1 +ATOM 121 H HZ . PHE A1 1 7 ? 28.942 16.696 -23.416 1.0 44.04 ? -3 A 1 +ATOM 122 N N . GLU A1 1 8 ? 26.632 9.501 -21.115 1.0 25.59 ? -2 A 1 +ATOM 123 C CA . GLU A1 1 8 ? 26.009 8.428 -20.348 1.0 29.53 ? -2 A 1 +ATOM 124 C C . GLU A1 1 8 ? 24.61 8.778 -19.864 1.0 26.25 ? -2 A 1 +ATOM 125 O O . GLU A1 1 8 ? 24.321 9.884 -19.391 1.0 25.07 ? -2 A 1 +ATOM 126 C CB . GLU A1 1 8 ? 26.922 8.09 -19.165 1.0 29.58 ? -2 A 1 +ATOM 127 C CG . GLU A1 1 8 ? 26.626 6.753 -18.496 1.0 69.91 ? -2 A 1 +ATOM 128 C CD . GLU A1 1 8 ? 25.582 6.852 -17.405 1.0 107.8 ? -2 A 1 +ATOM 129 O OE1 . GLU A1 1 8 ? 25.557 7.881 -16.687 1.0 49.86 ? -2 A 1 +ATOM 130 O OE2 . GLU A1 1 8 ? 24.789 5.892 -17.262 1.0 36.84 ? -2 A 1 +ATOM 131 H H . GLU A1 1 8 ? 27.371 9.791 -20.785 1.0 30.7 ? -2 A 1 +ATOM 132 H HA . GLU A1 1 8 ? 25.899 7.65 -20.917 1.0 35.44 ? -2 A 1 +ATOM 133 H HB2 . GLU A1 1 8 ? 27.839 8.062 -19.48 1.0 35.5 ? -2 A 1 +ATOM 134 H HB3 . GLU A1 1 8 ? 26.824 8.781 -18.491 1.0 35.5 ? -2 A 1 +ATOM 135 H HG2 . GLU A1 1 8 ? 26.299 6.132 -19.166 1.0 83.9 ? -2 A 1 +ATOM 136 H HG3 . GLU A1 1 8 ? 27.442 6.412 -18.098 1.0 83.9 ? -2 A 1 +ATOM 137 N N . LYS A1 1 9 ? 23.739 7.751 -19.85 1.0 28.53 ? -1 A 1 +ATOM 138 C CA . LYS A1 1 9 ? 22.313 7.942 -19.606 1.0 28.31 ? -1 A 1 +ATOM 139 C C . LYS A1 1 9 ? 21.967 8.358 -18.174 1.0 23.68 ? -1 A 1 +ATOM 140 O O . LYS A1 1 9 ? 21.176 9.268 -17.966 1.0 25.84 ? -1 A 1 +ATOM 141 C CB . LYS A1 1 9 ? 21.569 6.649 -19.99 1.0 29.13 ? -1 A 1 +ATOM 142 C CG . LYS A1 1 9 ? 21.697 6.312 -21.459 1.0 40.7 ? -1 A 1 +ATOM 143 H H . LYS A1 1 9 ? 23.958 6.929 -19.982 1.0 34.23 ? -1 A 1 +ATOM 144 H HA . LYS A1 1 9 ? 22.018 8.679 -20.163 1.0 33.97 ? -1 A 1 +ATOM 145 H HB2 . LYS A1 1 9 ? 21.936 5.91 -19.48 1.0 34.96 ? -1 A 1 +ATOM 146 H HB3 . LYS A1 1 9 ? 20.626 6.755 -19.788 1.0 34.96 ? -1 A 1 +ATOM 147 N N . ALA A1 1 10 ? 22.541 7.7 -17.158 1.0 27.77 ? 0 A 1 +ATOM 148 C CA . ALA A1 1 10 ? 22.168 8.046 -15.794 1.0 32.88 ? 0 A 1 +ATOM 149 C C . ALA A1 1 10 ? 22.572 9.48 -15.477 1.0 25.14 ? 0 A 1 +ATOM 150 O O . ALA A1 1 10 ? 21.811 10.22 -14.86 1.0 26.67 ? 0 A 1 +ATOM 151 C CB . ALA A1 1 10 ? 22.841 7.093 -14.797 1.0 40.14 ? 0 A 1 +ATOM 152 H H . ALA A1 1 10 ? 23.125 7.074 -17.235 1.0 33.33 ? 0 A 1 +ATOM 153 H HA . ALA A1 1 10 ? 21.206 7.955 -15.702 1.0 39.45 ? 0 A 1 +ATOM 154 H HB1 . ALA A1 1 10 ? 22.582 7.344 -13.897 1.0 48.16 ? 0 A 1 +ATOM 155 H HB2 . ALA A1 1 10 ? 22.552 6.186 -14.984 1.0 48.16 ? 0 A 1 +ATOM 156 H HB3 . ALA A1 1 10 ? 23.803 7.161 -14.896 1.0 48.16 ? 0 A 1 +ATOM 157 N N . SER A1 1 11 ? 23.757 9.886 -15.915 1.0 29.79 ? 1 A 1 +ATOM 158 C CA . SER A1 1 11 ? 24.198 11.235 -15.579 1.0 27.03 ? 1 A 1 +ATOM 159 C C . SER A1 1 11 ? 23.384 12.274 -16.34 1.0 23.91 ? 1 A 1 +ATOM 160 O O . SER A1 1 11 ? 22.95 13.267 -15.741 1.0 24.82 ? 1 A 1 +ATOM 161 C CB . SER A1 1 11 ? 25.659 11.439 -15.899 1.0 32.94 ? 1 A 1 +ATOM 162 O OG . SER A1 1 11 ? 25.972 12.758 -15.498 1.0 30.22 ? 1 A 1 +ATOM 163 H H . SER A1 1 11 ? 24.304 9.42 -16.388 1.0 35.75 ? 1 A 1 +ATOM 164 H HA . SER A1 1 11 ? 24.08 11.349 -14.623 1.0 32.44 ? 1 A 1 +ATOM 165 H HB2 . SER A1 1 11 ? 26.201 10.803 -15.407 1.0 39.53 ? 1 A 1 +ATOM 166 H HB3 . SER A1 1 11 ? 25.81 11.336 -16.852 1.0 39.53 ? 1 A 1 +ATOM 167 H HG . SER A1 1 11 ? 26.741 12.964 -15.764 1.0 36.27 ? 1 A 1 +ATOM 168 N N . THR A1 1 12 ? 23.071 11.994 -17.619 1.0 24.48 ? 2 A 1 +ATOM 169 C CA . THR A1 1 12 ? 22.142 12.835 -18.388 1.0 22.44 ? 2 A 1 +ATOM 170 C C . THR A1 1 12 ? 20.8 12.944 -17.679 1.0 24.37 ? 2 A 1 +ATOM 171 O O . THR A1 1 12 ? 20.262 14.04 -17.484 1.0 24.1 ? 2 A 1 +ATOM 172 C CB . THR A1 1 12 ? 21.902 12.264 -19.776 1.0 23.42 ? 2 A 1 +ATOM 173 O OG1 . THR A1 1 12 ? 23.105 12.36 -20.515 1.0 28.21 ? 2 A 1 +ATOM 174 C CG2 . THR A1 1 12 ? 20.819 13.054 -20.49 1.0 27.46 ? 2 A 1 +ATOM 175 H H . THR A1 1 12 ? 23.383 11.326 -18.061 1.0 29.38 ? 2 A 1 +ATOM 176 H HA . THR A1 1 12 ? 22.55 13.711 -18.477 1.0 26.92 ? 2 A 1 +ATOM 177 H HB . THR A1 1 12 ? 21.617 11.339 -19.713 1.0 28.1 ? 2 A 1 +ATOM 178 H HG1 . THR A1 1 12 ? 23.715 11.93 -20.129 1.0 33.86 ? 2 A 1 +ATOM 179 H HG21 . THR A1 1 12 ? 20.895 12.93 -21.449 1.0 32.95 ? 2 A 1 +ATOM 180 H HG22 . THR A1 1 12 ? 19.943 12.752 -20.202 1.0 32.95 ? 2 A 1 +ATOM 181 H HG23 . THR A1 1 12 ? 20.908 13.999 -20.286 1.0 32.95 ? 2 A 1 +ATOM 182 N N . GLY A1 1 13 ? 20.284 11.818 -17.21 1.0 22.35 ? 3 A 1 +ATOM 183 C CA . GLY A1 1 13 ? 19.055 11.861 -16.42 1.0 23.55 ? 3 A 1 +ATOM 184 C C . GLY A1 1 13 ? 19.172 12.688 -15.15 1.0 22.85 ? 3 A 1 +ATOM 185 O O . GLY A1 1 13 ? 18.268 13.45 -14.787 1.0 24.72 ? 3 A 1 +ATOM 186 H H . GLY A1 1 13 ? 20.614 11.033 -17.328 1.0 26.82 ? 3 A 1 +ATOM 187 H HA2 . GLY A1 1 13 ? 18.346 12.241 -16.962 1.0 28.26 ? 3 A 1 +ATOM 188 H HA3 . GLY A1 1 13 ? 18.81 10.957 -16.168 1.0 28.26 ? 3 A 1 +ATOM 189 N N . ARG A1 1 14 ? 20.3 12.569 -14.456 1.0 23.83 ? 4 A 1 +ATOM 190 C CA . ARG A1 1 14 ? 20.472 13.36 -13.245 1.0 27.88 ? 4 A 1 +ATOM 191 C C . ARG A1 1 14 ? 20.564 14.849 -13.602 1.0 26.39 ? 4 A 1 +ATOM 192 O O . ARG A1 1 14 ? 20.095 15.71 -12.859 1.0 32.82 ? 4 A 1 +ATOM 193 C CB . ARG A1 1 14 ? 21.74 12.914 -12.471 1.0 33.78 ? 4 A 1 +ATOM 194 C CG . ARG A1 1 14 ? 21.559 11.537 -11.752 1.0 32.28 ? 4 A 1 +ATOM 195 C CD . ARG A1 1 14 ? 22.699 11.213 -10.769 1.0 30.62 ? 4 A 1 +ATOM 196 N NE . ARG A1 1 14 ? 23.986 11.187 -11.435 1.0 33.27 ? 4 A 1 +ATOM 197 C CZ . ARG A1 1 14 ? 24.548 10.094 -11.971 1.0 57.78 ? 4 A 1 +ATOM 198 N NH1 . ARG A1 1 14 ? 23.95 8.905 -11.915 1.0 37.08 ? 4 A 1 +ATOM 199 N NH2 . ARG A1 1 14 ? 25.728 10.187 -12.55 1.0 36.56 ? 4 A 1 +ATOM 200 H H . ARG A1 1 14 ? 20.959 12.055 -14.658 1.0 28.6 ? 4 A 1 +ATOM 201 H HA . ARG A1 1 14 ? 19.711 13.215 -12.66 1.0 33.46 ? 4 A 1 +ATOM 202 H HB2 . ARG A1 1 14 ? 22.478 12.832 -13.095 1.0 40.54 ? 4 A 1 +ATOM 203 H HB3 . ARG A1 1 14 ? 21.948 13.579 -11.796 1.0 40.54 ? 4 A 1 +ATOM 204 H HG2 . ARG A1 1 14 ? 20.728 11.549 -11.251 1.0 38.74 ? 4 A 1 +ATOM 205 H HG3 . ARG A1 1 14 ? 21.532 10.834 -12.42 1.0 38.74 ? 4 A 1 +ATOM 206 H HD2 . ARG A1 1 14 ? 22.728 11.892 -10.076 1.0 36.75 ? 4 A 1 +ATOM 207 H HD3 . ARG A1 1 14 ? 22.543 10.341 -10.373 1.0 36.75 ? 4 A 1 +ATOM 208 H HE . ARG A1 1 14 ? 24.422 11.926 -11.49 1.0 39.93 ? 4 A 1 +ATOM 209 H HH11 . ARG A1 1 14 ? 23.186 8.825 -11.528 1.0 44.5 ? 4 A 1 +ATOM 210 H HH12 . ARG A1 1 14 ? 24.328 8.216 -12.265 1.0 44.5 ? 4 A 1 +ATOM 211 H HH21 . ARG A1 1 14 ? 26.132 10.946 -12.582 1.0 43.87 ? 4 A 1 +ATOM 212 H HH22 . ARG A1 1 14 ? 26.094 9.49 -12.896 1.0 43.87 ? 4 A 1 +ATOM 213 N N . GLU A1 1 15 ? 21.198 15.156 -14.706 1.0 25.65 ? 5 A 1 +ATOM 214 C CA . GLU A1 1 15 ? 21.264 16.554 -15.15 1.0 30.27 ? 5 A 1 +ATOM 215 C C . GLU A1 1 15 ? 19.891 17.084 -15.572 1.0 24.14 ? 5 A 1 +ATOM 216 O O . GLU A1 1 15 ? 19.563 18.239 -15.295 1.0 27.91 ? 5 A 1 +ATOM 217 C CB . GLU A1 1 15 ? 22.283 16.719 -16.265 1.0 26.51 ? 5 A 1 +ATOM 218 C CG . GLU A1 1 15 ? 23.76 16.717 -15.647 1.0 36.46 ? 5 A 1 +ATOM 219 C CD . GLU A1 1 15 ? 24.891 17.064 -16.619 1.0 84.59 ? 5 A 1 +ATOM 220 O OE1 . GLU A1 1 15 ? 24.669 16.827 -17.823 1.0 62.11 ? 5 A 1 +ATOM 221 O OE2 . GLU A1 1 15 ? 26.002 17.557 -16.187 1.0 31.23 ? 5 A 1 +ATOM 222 H H . GLU A1 1 15 ? 21.597 14.594 -15.22 1.0 30.78 ? 5 A 1 +ATOM 223 H HA . GLU A1 1 15 ? 21.566 17.093 -14.402 1.0 36.32 ? 5 A 1 +ATOM 224 H HB2 . GLU A1 1 15 ? 22.205 15.983 -16.892 1.0 31.82 ? 5 A 1 +ATOM 225 H HB3 . GLU A1 1 15 ? 22.136 17.562 -16.722 1.0 31.82 ? 5 A 1 +ATOM 226 H HG2 . GLU A1 1 15 ? 23.79 17.368 -14.928 1.0 43.75 ? 5 A 1 +ATOM 227 H HG3 . GLU A1 1 15 ? 23.943 15.83 -15.299 1.0 43.75 ? 5 A 1 +ATOM 228 N N . ILE A1 1 16 ? 19.081 16.258 -16.22 1.0 23.23 ? 6 A 1 +ATOM 229 C CA . ILE A1 1 16 ? 17.701 16.66 -16.524 1.0 22.2 ? 6 A 1 +ATOM 230 C C . ILE A1 1 16 ? 16.905 16.926 -15.244 1.0 23.61 ? 6 A 1 +ATOM 231 O O . ILE A1 1 16 ? 16.211 17.945 -15.124 1.0 25.49 ? 6 A 1 +ATOM 232 C CB . ILE A1 1 16 ? 17.031 15.613 -17.421 1.0 22.84 ? 6 A 1 +ATOM 233 C CG1 . ILE A1 1 16 ? 17.66 15.544 -18.815 1.0 24.96 ? 6 A 1 +ATOM 234 C CG2 . ILE A1 1 16 ? 15.517 15.874 -17.557 1.0 22.82 ? 6 A 1 +ATOM 235 C CD1 . ILE A1 1 16 ? 17.553 16.818 -19.644 1.0 27.36 ? 6 A 1 +ATOM 236 H H . ILE A1 1 16 ? 19.295 15.472 -16.493 1.0 27.88 ? 6 A 1 +ATOM 237 H HA . ILE A1 1 16 ? 17.727 17.498 -17.012 1.0 26.64 ? 6 A 1 +ATOM 238 H HB . ILE A1 1 16 ? 17.175 14.761 -16.981 1.0 27.41 ? 6 A 1 +ATOM 239 H HG12 . ILE A1 1 16 ? 18.604 15.343 -18.715 1.0 29.95 ? 6 A 1 +ATOM 240 H HG13 . ILE A1 1 16 ? 17.221 14.837 -19.314 1.0 29.95 ? 6 A 1 +ATOM 241 H HG21 . ILE A1 1 16 ? 15.174 15.36 -18.306 1.0 27.39 ? 6 A 1 +ATOM 242 H HG22 . ILE A1 1 16 ? 15.074 15.601 -16.739 1.0 27.39 ? 6 A 1 +ATOM 243 H HG23 . ILE A1 1 16 ? 15.372 16.821 -17.712 1.0 27.39 ? 6 A 1 +ATOM 244 H HD11 . ILE A1 1 16 ? 17.903 16.647 -20.532 1.0 32.83 ? 6 A 1 +ATOM 245 H HD12 . ILE A1 1 16 ? 16.621 17.081 -19.701 1.0 32.83 ? 6 A 1 +ATOM 246 H HD13 . ILE A1 1 16 ? 18.069 17.518 -19.215 1.0 32.83 ? 6 A 1 +ATOM 247 N N . LEU A1 1 17 ? 17.007 16.033 -14.251 1.0 23.41 ? 7 A 1 +ATOM 248 C CA . LEU A1 1 17 ? 16.324 16.247 -12.971 1.0 24.52 ? 7 A 1 +ATOM 249 C C . LEU A1 1 17 ? 16.76 17.543 -12.311 1.0 24.47 ? 7 A 1 +ATOM 250 O O . LEU A1 1 17 ? 15.918 18.276 -11.782 1.0 28.2 ? 7 A 1 +ATOM 251 C CB . LEU A1 1 17 ? 16.555 15.062 -12.021 1.0 25.43 ? 7 A 1 +ATOM 252 C CG . LEU A1 1 17 ? 15.876 13.781 -12.48 1.0 23.71 ? 7 A 1 +ATOM 253 C CD1 . LEU A1 1 17 ? 16.474 12.537 -11.806 1.0 27.62 ? 7 A 1 +ATOM 254 C CD2 . LEU A1 1 17 ? 14.367 13.813 -12.227 1.0 28.12 ? 7 A 1 +ATOM 255 H H . LEU A1 1 17 ? 17.46 15.303 -14.293 1.0 28.09 ? 7 A 1 +ATOM 256 H HA . LEU A1 1 17 ? 15.372 16.304 -13.149 1.0 29.42 ? 7 A 1 +ATOM 257 H HB2 . LEU A1 1 17 ? 17.508 14.89 -11.962 1.0 30.51 ? 7 A 1 +ATOM 258 H HB3 . LEU A1 1 17 ? 16.204 15.289 -11.146 1.0 30.51 ? 7 A 1 +ATOM 259 H HG . LEU A1 1 17 ? 16.029 13.715 -13.435 1.0 28.45 ? 7 A 1 +ATOM 260 H HD11 . LEU A1 1 17 ? 16.022 11.747 -12.142 1.0 33.14 ? 7 A 1 +ATOM 261 H HD12 . LEU A1 1 17 ? 17.421 12.49 -12.014 1.0 33.14 ? 7 A 1 +ATOM 262 H HD13 . LEU A1 1 17 ? 16.35 12.607 -10.847 1.0 33.14 ? 7 A 1 +ATOM 263 H HD21 . LEU A1 1 17 ? 13.982 12.967 -12.503 1.0 33.75 ? 7 A 1 +ATOM 264 H HD22 . LEU A1 1 17 ? 14.208 13.955 -11.28 1.0 33.75 ? 7 A 1 +ATOM 265 H HD23 . LEU A1 1 17 ? 13.976 14.538 -12.739 1.0 33.75 ? 7 A 1 +ATOM 266 N N . GLU A1 1 18 ? 18.064 17.866 -12.362 1.0 25.93 ? 8 A 1 +ATOM 267 C CA . GLU A1 1 18 ? 18.543 19.097 -11.763 1.0 30.48 ? 8 A 1 +ATOM 268 C C . GLU A1 1 18 ? 17.961 20.312 -12.474 1.0 26.17 ? 8 A 1 +ATOM 269 O O . GLU A1 1 18 ? 17.606 21.303 -11.829 1.0 30.91 ? 8 A 1 +ATOM 270 C CB . GLU A1 1 18 ? 20.073 19.122 -11.798 1.0 31.8 ? 8 A 1 +ATOM 271 C CG . GLU A1 1 18 ? 20.671 20.503 -11.577 1.0 45.12 ? 8 A 1 +ATOM 272 C CD . GLU A1 1 18 ? 22.035 20.454 -10.928 1.0 84.93 ? 8 A 1 +ATOM 273 O OE1 . GLU A1 1 18 ? 22.991 19.98 -11.578 1.0 73.57 ? 8 A 1 +ATOM 274 O OE2 . GLU A1 1 18 ? 22.143 20.881 -9.76 1.0 100.44 ? 8 A 1 +ATOM 275 H H . GLU A1 1 18 ? 18.675 17.389 -12.734 1.0 31.12 ? 8 A 1 +ATOM 276 H HA . GLU A1 1 18 ? 18.264 19.137 -10.836 1.0 36.57 ? 8 A 1 +ATOM 277 H HB2 . GLU A1 1 18 ? 20.41 18.538 -11.1 1.0 38.16 ? 8 A 1 +ATOM 278 H HB3 . GLU A1 1 18 ? 20.37 18.806 -12.666 1.0 38.16 ? 8 A 1 +ATOM 279 H HG2 . GLU A1 1 18 ? 20.762 20.949 -12.434 1.0 54.15 ? 8 A 1 +ATOM 280 H HG3 . GLU A1 1 18 ? 20.082 21.013 -10.998 1.0 54.15 ? 8 A 1 +ATOM 281 N N . LYS A1 1 19 ? 17.866 20.252 -13.806 1.0 28.95 ? 9 A 1 +ATOM 282 C CA . LYS A1 1 19 ? 17.277 21.358 -14.557 1.0 27.62 ? 9 A 1 +ATOM 283 C C . LYS A1 1 19 ? 15.79 21.51 -14.235 1.0 23.18 ? 9 A 1 +ATOM 284 O O . LYS A1 1 19 ? 15.299 22.615 -14.069 1.0 26.16 ? 9 A 1 +ATOM 285 C CB . LYS A1 1 19 ? 17.534 21.173 -16.056 1.0 26.87 ? 9 A 1 +ATOM 286 C CG . LYS A1 1 19 ? 19.016 21.383 -16.439 1.0 30.45 ? 9 A 1 +ATOM 287 C CD . LYS A1 1 19 ? 19.242 21.46 -17.915 1.0 34.83 ? 9 A 1 +ATOM 288 C CE . LYS A1 1 19 ? 20.715 21.78 -18.239 1.0 46.24 ? 9 A 1 +ATOM 289 H H . LYS A1 1 19 ? 18.131 19.592 -14.289 1.0 34.74 ? 9 A 1 +ATOM 290 H HA . LYS A1 1 19 ? 17.707 22.189 -14.303 1.0 33.14 ? 9 A 1 +ATOM 291 H HB2 . LYS A1 1 19 ? 17.282 20.271 -16.31 1.0 32.24 ? 9 A 1 +ATOM 292 H HB3 . LYS A1 1 19 ? 17.002 21.817 -16.549 1.0 32.24 ? 9 A 1 +ATOM 293 H HG2 . LYS A1 1 19 ? 19.328 22.214 -16.047 1.0 36.53 ? 9 A 1 +ATOM 294 H HG3 . LYS A1 1 19 ? 19.537 20.639 -16.098 1.0 36.53 ? 9 A 1 +ATOM 295 H HD2 . LYS A1 1 19 ? 19.018 20.608 -18.32 1.0 41.79 ? 9 A 1 +ATOM 296 H HD3 . LYS A1 1 19 ? 18.687 22.162 -18.289 1.0 41.79 ? 9 A 1 +ATOM 297 N N . LEU A1 1 20 ? 15.082 20.398 -14.04 1.0 22.9 ? 10 A 1 +ATOM 298 C CA . LEU A1 1 20 ? 13.655 20.477 -13.678 1.0 23.21 ? 10 A 1 +ATOM 299 C C . LEU A1 1 20 ? 13.502 21.062 -12.281 1.0 23.54 ? 10 A 1 +ATOM 300 O O . LEU A1 1 20 ? 12.613 21.888 -12.046 1.0 28.3 ? 10 A 1 +ATOM 301 C CB . LEU A1 1 20 ? 13.004 19.094 -13.776 1.0 21.14 ? 10 A 1 +ATOM 302 C CG . LEU A1 1 20 ? 12.88 18.566 -15.2 1.0 21.97 ? 10 A 1 +ATOM 303 C CD1 . LEU A1 1 20 ? 12.384 17.125 -15.134 1.0 21.62 ? 10 A 1 +ATOM 304 C CD2 . LEU A1 1 20 ? 11.98 19.399 -16.042 1.0 25.63 ? 10 A 1 +ATOM 305 H H . LEU A1 1 20 ? 15.391 19.598 -14.108 1.0 27.48 ? 10 A 1 +ATOM 306 H HA . LEU A1 1 20 ? 13.191 21.053 -14.306 1.0 27.85 ? 10 A 1 +ATOM 307 H HB2 . LEU A1 1 20 ? 13.54 18.462 -13.271 1.0 25.37 ? 10 A 1 +ATOM 308 H HB3 . LEU A1 1 20 ? 12.11 19.145 -13.4 1.0 25.37 ? 10 A 1 +ATOM 309 H HG . LEU A1 1 20 ? 13.748 18.601 -15.632 1.0 26.37 ? 10 A 1 +ATOM 310 H HD11 . LEU A1 1 20 ? 12.316 16.773 -16.035 1.0 25.94 ? 10 A 1 +ATOM 311 H HD12 . LEU A1 1 20 ? 13.015 16.598 -14.619 1.0 25.94 ? 10 A 1 +ATOM 312 H HD13 . LEU A1 1 20 ? 11.514 17.11 -14.706 1.0 25.94 ? 10 A 1 +ATOM 313 H HD21 . LEU A1 1 20 ? 11.78 18.919 -16.861 1.0 30.75 ? 10 A 1 +ATOM 314 H HD22 . LEU A1 1 20 ? 11.161 19.573 -15.552 1.0 30.75 ? 10 A 1 +ATOM 315 H HD23 . LEU A1 1 20 ? 12.425 20.235 -16.249 1.0 30.75 ? 10 A 1 +ATOM 316 N N . GLU A1 1 21 ? 14.406 20.681 -11.353 1.0 26.73 ? 11 A 1 +ATOM 317 C CA . GLU A1 1 21 ? 14.338 21.168 -9.979 1.0 31.03 ? 11 A 1 +ATOM 318 C C . GLU A1 1 21 ? 14.664 22.651 -9.907 1.0 33.81 ? 11 A 1 +ATOM 319 O O . GLU A1 1 21 ? 14.092 23.367 -9.081 1.0 35.52 ? 11 A 1 +ATOM 320 C CB . GLU A1 1 21 ? 15.285 20.356 -9.099 1.0 38.79 ? 11 A 1 +ATOM 321 C CG . GLU A1 1 21 ? 14.8 20.202 -7.664 1.0 47.09 ? 11 A 1 +ATOM 322 C CD . GLU A1 1 21 ? 15.923 19.896 -6.695 1.0 113.55 ? 11 A 1 +ATOM 323 O OE1 . GLU A1 1 21 ? 16.0 20.565 -5.637 1.0 76.71 ? 11 A 1 +ATOM 324 O OE2 . GLU A1 1 21 ? 16.733 18.992 -6.999 1.0 123.52 ? 11 A 1 +ATOM 325 H H . GLU A1 1 21 ? 15.061 20.144 -11.502 1.0 32.08 ? 11 A 1 +ATOM 326 H HA . GLU A1 1 21 ? 13.439 21.046 -9.635 1.0 37.24 ? 11 A 1 +ATOM 327 H HB2 . GLU A1 1 21 ? 15.379 19.468 -9.478 1.0 46.55 ? 11 A 1 +ATOM 328 H HB3 . GLU A1 1 21 ? 16.147 20.799 -9.075 1.0 46.55 ? 11 A 1 +ATOM 329 H HG2 . GLU A1 1 21 ? 14.378 21.029 -7.382 1.0 56.51 ? 11 A 1 +ATOM 330 H HG3 . GLU A1 1 21 ? 14.161 19.473 -7.622 1.0 56.51 ? 11 A 1 +ATOM 331 N N . ARG A1 1 22 ? 15.541 23.129 -10.782 1.0 33.16 ? 12 A 1 +ATOM 332 C CA . ARG A1 1 22 ? 15.856 24.545 -10.942 1.0 36.15 ? 12 A 1 +ATOM 333 C C . ARG A1 1 22 ? 14.873 25.262 -11.858 1.0 31.75 ? 12 A 1 +ATOM 334 O O . ARG A1 1 22 ? 15.021 26.47 -12.106 1.0 35.07 ? 12 A 1 +ATOM 335 C CB . ARG A1 1 22 ? 17.29 24.717 -11.479 1.0 34.0 ? 12 A 1 +ATOM 336 C CG . ARG A1 1 22 ? 18.347 24.519 -10.402 1.0 65.65 ? 12 A 1 +ATOM 337 C CD . ARG A1 1 22 ? 19.745 24.786 -10.939 1.0 52.58 ? 12 A 1 +ATOM 338 N NE . ARG A1 1 22 ? 19.949 24.136 -12.225 1.0 47.82 ? 12 A 1 +ATOM 339 C CZ . ARG A1 1 22 ? 21.088 24.152 -12.904 1.0 90.47 ? 12 A 1 +ATOM 340 N NH1 . ARG A1 1 22 ? 22.139 24.8 -12.422 1.0 100.68 ? 12 A 1 +ATOM 341 N NH2 . ARG A1 1 22 ? 21.178 23.52 -14.067 1.0 62.28 ? 12 A 1 +ATOM 342 H H . ARG A1 1 22 ? 15.99 22.63 -11.32 1.0 39.8 ? 12 A 1 +ATOM 343 H HA . ARG A1 1 22 ? 15.82 24.971 -10.072 1.0 43.38 ? 12 A 1 +ATOM 344 H HB2 . ARG A1 1 22 ? 17.447 24.063 -12.178 1.0 40.8 ? 12 A 1 +ATOM 345 H HB3 . ARG A1 1 22 ? 17.389 25.614 -11.836 1.0 40.8 ? 12 A 1 +ATOM 346 H HG2 . ARG A1 1 22 ? 18.179 25.132 -9.67 1.0 78.78 ? 12 A 1 +ATOM 347 H HG3 . ARG A1 1 22 ? 18.313 23.603 -10.083 1.0 78.78 ? 12 A 1 +ATOM 348 H HD2 . ARG A1 1 22 ? 19.868 25.741 -11.056 1.0 63.09 ? 12 A 1 +ATOM 349 H HD3 . ARG A1 1 22 ? 20.402 24.441 -10.314 1.0 63.09 ? 12 A 1 +ATOM 350 H HE . ARG A1 1 22 ? 19.285 23.711 -12.568 1.0 57.38 ? 12 A 1 +ATOM 351 H HH11 . ARG A1 1 22 ? 22.082 25.21 -11.668 1.0 120.82 ? 12 A 1 +ATOM 352 H HH12 . ARG A1 1 22 ? 22.877 24.811 -12.863 1.0 120.82 ? 12 A 1 +ATOM 353 H HH21 . ARG A1 1 22 ? 20.497 23.099 -14.381 1.0 74.73 ? 12 A 1 +ATOM 354 H HH22 . ARG A1 1 22 ? 21.917 23.531 -14.507 1.0 74.73 ? 12 A 1 +ATOM 355 N N . ARG A1 1 23 ? 13.876 24.557 -12.364 1.0 28.77 ? 13 A 1 +ATOM 356 C CA . ARG A1 1 23 ? 12.812 25.158 -13.155 1.0 30.18 ? 13 A 1 +ATOM 357 C C . ARG A1 1 23 ? 13.321 25.773 -14.454 1.0 28.29 ? 13 A 1 +ATOM 358 O O . ARG A1 1 23 ? 12.854 26.824 -14.893 1.0 34.96 ? 13 A 1 +ATOM 359 C CB . ARG A1 1 23 ? 11.983 26.11 -12.295 1.0 29.75 ? 13 A 1 +ATOM 360 C CG . ARG A1 1 23 ? 11.456 25.385 -11.033 1.0 31.48 ? 13 A 1 +ATOM 361 C CD . ARG A1 1 23 ? 10.403 26.141 -10.278 1.0 36.0 ? 13 A 1 +ATOM 362 N NE . ARG A1 1 23 ? 9.186 26.295 -11.055 1.0 31.74 ? 13 A 1 +ATOM 363 C CZ . ARG A1 1 23 ? 8.266 25.348 -11.216 1.0 28.16 ? 13 A 1 +ATOM 364 N NH1 . ARG A1 1 23 ? 8.419 24.148 -10.689 1.0 23.79 ? 13 A 1 +ATOM 365 N NH2 . ARG A1 1 23 ? 7.189 25.656 -11.936 1.0 25.67 ? 13 A 1 +ATOM 366 H H . ARG A1 1 23 ? 13.788 23.708 -12.261 1.0 34.52 ? 13 A 1 +ATOM 367 H HA . ARG A1 1 23 ? 12.209 24.461 -13.457 1.0 36.22 ? 13 A 1 +ATOM 368 H HB2 . ARG A1 1 23 ? 12.535 26.857 -12.015 1.0 35.71 ? 13 A 1 +ATOM 369 H HB3 . ARG A1 1 23 ? 11.225 26.431 -12.807 1.0 35.71 ? 13 A 1 +ATOM 370 H HG2 . ARG A1 1 23 ? 11.071 24.536 -11.301 1.0 37.78 ? 13 A 1 +ATOM 371 H HG3 . ARG A1 1 23 ? 12.199 25.235 -10.428 1.0 37.78 ? 13 A 1 +ATOM 372 H HD2 . ARG A1 1 23 ? 10.185 25.66 -9.464 1.0 43.2 ? 13 A 1 +ATOM 373 H HD3 . ARG A1 1 23 ? 10.738 27.025 -10.061 1.0 43.2 ? 13 A 1 +ATOM 374 H HE . ARG A1 1 23 ? 9.05 27.052 -11.438 1.0 38.08 ? 13 A 1 +ATOM 375 H HH11 . ARG A1 1 23 ? 9.124 23.966 -10.232 1.0 28.54 ? 13 A 1 +ATOM 376 H HH12 . ARG A1 1 23 ? 7.814 23.548 -10.804 1.0 28.54 ? 13 A 1 +ATOM 377 H HH21 . ARG A1 1 23 ? 7.109 26.442 -12.276 1.0 30.8 ? 13 A 1 +ATOM 378 H HH22 . ARG A1 1 23 ? 6.573 25.068 -12.061 1.0 30.8 ? 13 A 1 +ATOM 379 N N . GLU A1 1 24 ? 14.301 25.103 -15.074 1.0 29.75 ? 14 A 1 +ATOM 380 C CA . GLU A1 1 24 ? 14.852 25.506 -16.372 1.0 30.25 ? 14 A 1 +ATOM 381 C C . GLU A1 1 24 ? 14.151 24.672 -17.438 1.0 37.12 ? 14 A 1 +ATOM 382 O O . GLU A1 1 24 ? 14.655 23.64 -17.883 1.0 36.14 ? 14 A 1 +ATOM 383 C CB . GLU A1 1 24 ? 16.361 25.288 -16.372 1.0 37.31 ? 14 A 1 +ATOM 384 C CG . GLU A1 1 24 ? 17.069 26.077 -15.286 1.0 55.06 ? 14 A 1 +ATOM 385 C CD . GLU A1 1 24 ? 18.576 25.898 -15.313 1.0 75.5 ? 14 A 1 +ATOM 386 O OE1 . GLU A1 1 24 ? 19.22 26.14 -14.27 1.0 59.69 ? 14 A 1 +ATOM 387 O OE2 . GLU A1 1 24 ? 19.11 25.52 -16.378 1.0 62.03 ? 14 A 1 +ATOM 388 H H . GLU A1 1 24 ? 14.671 24.395 -14.754 1.0 35.7 ? 14 A 1 +ATOM 389 H HA . GLU A1 1 24 ? 14.668 26.442 -16.55 1.0 36.3 ? 14 A 1 +ATOM 390 H HB2 . GLU A1 1 24 ? 16.543 24.347 -16.227 1.0 44.77 ? 14 A 1 +ATOM 391 H HB3 . GLU A1 1 24 ? 16.72 25.567 -17.228 1.0 44.77 ? 14 A 1 +ATOM 392 H HG2 . GLU A1 1 24 ? 16.878 27.02 -15.405 1.0 66.07 ? 14 A 1 +ATOM 393 H HG3 . GLU A1 1 24 ? 16.748 25.78 -14.42 1.0 66.07 ? 14 A 1 +ATOM 394 N N . PHE A1 1 25 ? 12.984 25.149 -17.871 1.0 29.91 ? 15 A 1 +ATOM 395 C CA . PHE A1 1 25 ? 12.045 24.338 -18.643 1.0 31.37 ? 15 A 1 +ATOM 396 C C . PHE A1 1 25 ? 12.225 24.54 -20.148 1.0 43.89 ? 15 A 1 +ATOM 397 O O . PHE A1 1 25 ? 11.305 24.878 -20.885 1.0 37.04 ? 15 A 1 +ATOM 398 C CB . PHE A1 1 25 ? 10.62 24.682 -18.23 1.0 32.95 ? 15 A 1 +ATOM 399 C CG . PHE A1 1 25 ? 10.313 24.398 -16.801 1.0 27.88 ? 15 A 1 +ATOM 400 C CD1 . PHE A1 1 25 ? 10.635 23.183 -16.237 1.0 25.35 ? 15 A 1 +ATOM 401 C CD2 . PHE A1 1 25 ? 9.696 25.361 -16.03 1.0 26.83 ? 15 A 1 +ATOM 402 C CE1 . PHE A1 1 25 ? 10.312 22.924 -14.904 1.0 24.53 ? 15 A 1 +ATOM 403 C CE2 . PHE A1 1 25 ? 9.368 25.099 -14.719 1.0 28.82 ? 15 A 1 +ATOM 404 C CZ . PHE A1 1 25 ? 9.674 23.895 -14.166 1.0 26.67 ? 15 A 1 +ATOM 405 H H . PHE A1 1 25 ? 12.709 25.951 -17.727 1.0 35.89 ? 15 A 1 +ATOM 406 H HA . PHE A1 1 25 ? 12.226 23.405 -18.449 1.0 37.64 ? 15 A 1 +ATOM 407 H HB2 . PHE A1 1 25 ? 10.474 25.629 -18.38 1.0 39.54 ? 15 A 1 +ATOM 408 H HB3 . PHE A1 1 25 ? 10.006 24.162 -18.772 1.0 39.54 ? 15 A 1 +ATOM 409 H HD1 . PHE A1 1 25 ? 11.068 22.535 -16.745 1.0 30.42 ? 15 A 1 +ATOM 410 H HD2 . PHE A1 1 25 ? 9.501 26.192 -16.399 1.0 32.19 ? 15 A 1 +ATOM 411 H HE1 . PHE A1 1 25 ? 10.526 22.105 -14.518 1.0 29.43 ? 15 A 1 +ATOM 412 H HE2 . PHE A1 1 25 ? 8.937 25.747 -14.21 1.0 34.59 ? 15 A 1 +ATOM 413 H HZ . PHE A1 1 25 ? 9.449 23.725 -13.28 1.0 32.0 ? 15 A 1 +ATOM 414 N N . THR A1 1 26 ? 13.431 24.294 -20.616 1.0 30.38 ? 16 A 1 +ATOM 415 C CA . THR A1 1 26 ? 13.648 24.448 -22.042 1.0 32.36 ? 16 A 1 +ATOM 416 C C . THR A1 1 26 ? 13.02 23.277 -22.796 1.0 33.72 ? 16 A 1 +ATOM 417 O O . THR A1 1 26 ? 12.801 22.19 -22.266 1.0 28.55 ? 16 A 1 +ATOM 418 C CB . THR A1 1 26 ? 15.145 24.465 -22.341 1.0 34.49 ? 16 A 1 +ATOM 419 O OG1 . THR A1 1 26 ? 15.694 23.186 -22.035 1.0 31.37 ? 16 A 1 +ATOM 420 C CG2 . THR A1 1 26 ? 15.864 25.552 -21.51 1.0 32.53 ? 16 A 1 +ATOM 421 H H . THR A1 1 26 ? 14.111 24.047 -20.152 1.0 36.46 ? 16 A 1 +ATOM 422 H HA . THR A1 1 26 ? 13.249 25.279 -22.343 1.0 38.83 ? 16 A 1 +ATOM 423 H HB . THR A1 1 26 ? 15.288 24.668 -23.279 1.0 41.39 ? 16 A 1 +ATOM 424 H HG1 . THR A1 1 26 ? 16.518 23.181 -22.198 1.0 37.64 ? 16 A 1 +ATOM 425 H HG21 . THR A1 1 26 ? 16.796 25.608 -21.772 1.0 39.03 ? 16 A 1 +ATOM 426 H HG22 . THR A1 1 26 ? 15.443 26.414 -21.657 1.0 39.03 ? 16 A 1 +ATOM 427 H HG23 . THR A1 1 26 ? 15.815 25.335 -20.566 1.0 39.03 ? 16 A 1 +ATOM 428 N N . ARG A1 1 27 ? 12.747 23.508 -24.068 1.0 31.58 ? 17 A 1 +ATOM 429 C CA A ARG A1 1 27 ? 12.212 22.459 -24.922 0.49 27.64 ? 17 A 1 +ATOM 430 C CA B ARG A1 1 27 ? 12.204 22.452 -24.909 0.51 29.49 ? 17 A 1 +ATOM 431 C C . ARG A1 1 27 ? 13.095 21.215 -24.903 1.0 27.78 ? 17 A 1 +ATOM 432 O O . ARG A1 1 27 ? 12.594 20.092 -24.812 1.0 26.63 ? 17 A 1 +ATOM 433 C CB A ARG A1 1 27 ? 12.067 23.001 -26.337 0.49 33.87 ? 17 A 1 +ATOM 434 C CB B ARG A1 1 27 ? 12.019 22.98 -26.32 0.51 28.14 ? 17 A 1 +ATOM 435 C CG A ARG A1 1 27 ? 11.523 22.013 -27.301 0.49 35.32 ? 17 A 1 +ATOM 436 C CG B ARG A1 1 27 ? 11.441 22.012 -27.306 0.51 33.9 ? 17 A 1 +ATOM 437 C CD A ARG A1 1 27 ? 11.298 22.615 -28.673 0.49 30.48 ? 17 A 1 +ATOM 438 C CD B ARG A1 1 27 ? 11.31 22.699 -28.66 0.51 29.86 ? 17 A 1 +ATOM 439 N NE A ARG A1 1 27 ? 10.367 21.753 -29.392 0.49 40.81 ? 17 A 1 +ATOM 440 N NE B ARG A1 1 27 ? 10.668 24.012 -28.511 0.51 40.51 ? 17 A 1 +ATOM 441 C CZ A ARG A1 1 27 ? 9.056 21.753 -29.202 0.49 27.42 ? 17 A 1 +ATOM 442 C CZ B ARG A1 1 27 ? 9.359 24.232 -28.536 0.51 37.42 ? 17 A 1 +ATOM 443 N NH1 A ARG A1 1 27 ? 8.491 22.589 -28.344 0.49 50.28 ? 17 A 1 +ATOM 444 N NH1 B ARG A1 1 27 ? 8.51 23.234 -28.701 0.51 28.71 ? 17 A 1 +ATOM 445 N NH2 A ARG A1 1 27 ? 8.291 20.919 -29.895 0.49 50.98 ? 17 A 1 +ATOM 446 N NH2 B ARG A1 1 27 ? 8.888 25.461 -28.386 0.51 51.63 ? 17 A 1 +ATOM 447 H H A ARG A1 1 27 ? 12.862 24.263 -24.464 0.49 37.9 ? 17 A 1 +ATOM 448 H H B ARG A1 1 27 ? 12.865 24.26 -24.468 0.51 37.9 ? 17 A 1 +ATOM 449 H HA A ARG A1 1 27 ? 11.336 22.193 -24.6 0.49 33.17 ? 17 A 1 +ATOM 450 H HA B ARG A1 1 27 ? 11.337 22.183 -24.566 0.51 35.38 ? 17 A 1 +ATOM 451 H HB2 A ARG A1 1 27 ? 11.465 23.761 -26.319 0.49 40.64 ? 17 A 1 +ATOM 452 H HB2 B ARG A1 1 27 ? 11.422 23.744 -26.283 0.51 33.76 ? 17 A 1 +ATOM 453 H HB3 A ARG A1 1 27 ? 12.941 23.277 -26.656 0.49 40.64 ? 17 A 1 +ATOM 454 H HB3 B ARG A1 1 27 ? 12.886 23.253 -26.659 0.51 33.76 ? 17 A 1 +ATOM 455 H HG2 A ARG A1 1 27 ? 12.151 21.279 -27.393 0.49 42.39 ? 17 A 1 +ATOM 456 H HG2 B ARG A1 1 27 ? 12.027 21.245 -27.398 0.51 40.69 ? 17 A 1 +ATOM 457 H HG3 A ARG A1 1 27 ? 10.673 21.682 -26.973 0.49 42.39 ? 17 A 1 +ATOM 458 H HG3 B ARG A1 1 27 ? 10.562 21.726 -27.012 0.51 40.69 ? 17 A 1 +ATOM 459 H HD2 A ARG A1 1 27 ? 10.914 23.502 -28.591 0.49 36.58 ? 17 A 1 +ATOM 460 H HD2 B ARG A1 1 27 ? 12.191 22.828 -29.045 0.51 35.83 ? 17 A 1 +ATOM 461 H HD3 A ARG A1 1 27 ? 12.135 22.659 -29.161 0.49 36.58 ? 17 A 1 +ATOM 462 H HD3 B ARG A1 1 27 ? 10.767 22.154 -29.25 0.51 35.83 ? 17 A 1 +ATOM 463 H HE A ARG A1 1 27 ? 10.689 21.212 -29.977 0.49 48.98 ? 17 A 1 +ATOM 464 H HE B ARG A1 1 27 ? 11.181 24.693 -28.398 0.51 48.61 ? 17 A 1 +ATOM 465 H HH11 A ARG A1 1 27 ? 8.977 23.144 -27.901 0.49 60.33 ? 17 A 1 +ATOM 466 H HH11 B ARG A1 1 27 ? 8.803 22.431 -28.793 0.51 34.45 ? 17 A 1 +ATOM 467 H HH12 A ARG A1 1 27 ? 7.639 22.578 -28.231 0.49 60.33 ? 17 A 1 +ATOM 468 H HH12 B ARG A1 1 27 ? 7.664 23.387 -28.716 0.51 34.45 ? 17 A 1 +ATOM 469 H HH21 A ARG A1 1 27 ? 8.646 20.382 -30.465 0.49 61.18 ? 17 A 1 +ATOM 470 H HH21 B ARG A1 1 27 ? 9.43 26.119 -28.272 0.51 61.96 ? 17 A 1 +ATOM 471 H HH22 A ARG A1 1 27 ? 7.439 20.916 -29.774 0.49 61.18 ? 17 A 1 +ATOM 472 H HH22 B ARG A1 1 27 ? 8.039 25.601 -28.403 0.51 61.96 ? 17 A 1 +ATOM 473 N N . GLU A1 1 28 ? 14.423 21.394 -24.97 1.0 25.58 ? 18 A 1 +ATOM 474 C CA . GLU A1 1 28 ? 15.316 20.246 -24.962 1.0 23.71 ? 18 A 1 +ATOM 475 C C . GLU A1 1 28 ? 15.21 19.458 -23.658 1.0 24.71 ? 18 A 1 +ATOM 476 O O . GLU A1 1 28 ? 15.336 18.228 -23.664 1.0 23.24 ? 18 A 1 +ATOM 477 C CB . GLU A1 1 28 ? 16.765 20.74 -25.202 1.0 31.32 ? 18 A 1 +ATOM 478 C CG . GLU A1 1 28 ? 17.836 20.084 -24.469 1.0 43.13 ? 18 A 1 +ATOM 479 C CD . GLU A1 1 28 ? 19.199 20.645 -24.833 1.0 91.85 ? 18 A 1 +ATOM 480 O OE1 . GLU A1 1 28 ? 19.575 20.56 -26.019 1.0 50.29 ? 18 A 1 +ATOM 481 O OE2 . GLU A1 1 28 ? 19.878 21.202 -23.944 1.0 38.35 ? 18 A 1 +ATOM 482 H H . GLU A1 1 28 ? 14.817 22.156 -25.02 1.0 30.69 ? 18 A 1 +ATOM 483 H HA . GLU A1 1 28 ? 15.072 19.638 -25.677 1.0 28.45 ? 18 A 1 +ATOM 484 H HB2 . GLU A1 1 28 ? 16.963 20.628 -26.145 1.0 37.58 ? 18 A 1 +ATOM 485 H HB3 . GLU A1 1 28 ? 16.8 21.68 -24.965 1.0 37.58 ? 18 A 1 +ATOM 486 H HG2 . GLU A1 1 28 ? 17.698 20.215 -23.518 1.0 51.75 ? 18 A 1 +ATOM 487 H HG3 . GLU A1 1 28 ? 17.832 19.137 -24.678 1.0 51.75 ? 18 A 1 +ATOM 488 N N . VAL A1 1 29 ? 15.029 20.147 -22.542 1.0 23.29 ? 19 A 1 +ATOM 489 C CA . VAL A1 1 29 ? 14.929 19.465 -21.259 1.0 20.86 ? 19 A 1 +ATOM 490 C C . VAL A1 1 29 ? 13.63 18.67 -21.21 1.0 21.02 ? 19 A 1 +ATOM 491 O O . VAL A1 1 29 ? 13.625 17.52 -20.758 1.0 20.8 ? 19 A 1 +ATOM 492 C CB . VAL A1 1 29 ? 14.993 20.484 -20.108 1.0 25.38 ? 19 A 1 +ATOM 493 C CG1 . VAL A1 1 29 ? 14.536 19.872 -18.786 1.0 27.16 ? 19 A 1 +ATOM 494 C CG2 . VAL A1 1 29 ? 16.42 21.008 -19.937 1.0 29.05 ? 19 A 1 +ATOM 495 H H . VAL A1 1 29 ? 14.962 21.003 -22.498 1.0 27.95 ? 19 A 1 +ATOM 496 H HA . VAL A1 1 29 ? 15.678 18.856 -21.164 1.0 25.03 ? 19 A 1 +ATOM 497 H HB . VAL A1 1 29 ? 14.397 21.215 -20.335 1.0 30.46 ? 19 A 1 +ATOM 498 H HG11 . VAL A1 1 29 ? 14.836 20.436 -18.057 1.0 32.59 ? 19 A 1 +ATOM 499 H HG12 . VAL A1 1 29 ? 13.567 19.815 -18.783 1.0 32.59 ? 19 A 1 +ATOM 500 H HG13 . VAL A1 1 29 ? 14.92 18.985 -18.699 1.0 32.59 ? 19 A 1 +ATOM 501 H HG21 . VAL A1 1 29 ? 16.417 21.724 -19.283 1.0 34.86 ? 19 A 1 +ATOM 502 H HG22 . VAL A1 1 29 ? 16.988 20.283 -19.631 1.0 34.86 ? 19 A 1 +ATOM 503 H HG23 . VAL A1 1 29 ? 16.739 21.34 -20.79 1.0 34.86 ? 19 A 1 +ATOM 504 N N . LEU A1 1 30 ? 12.518 19.275 -21.626 1.0 20.54 ? 20 A 1 +ATOM 505 C CA . LEU A1 1 30 ? 11.23 18.564 -21.591 1.0 18.48 ? 20 A 1 +ATOM 506 C C . LEU A1 1 30 ? 11.252 17.389 -22.535 1.0 20.92 ? 20 A 1 +ATOM 507 O O . LEU A1 1 30 ? 10.788 16.299 -22.191 1.0 20.51 ? 20 A 1 +ATOM 508 C CB . LEU A1 1 30 ? 10.074 19.497 -21.916 1.0 21.21 ? 20 A 1 +ATOM 509 C CG . LEU A1 1 30 ? 9.919 20.644 -20.896 1.0 22.17 ? 20 A 1 +ATOM 510 C CD1 . LEU A1 1 30 ? 8.867 21.616 -21.385 1.0 25.03 ? 20 A 1 +ATOM 511 C CD2 . LEU A1 1 30 ? 9.601 20.17 -19.521 1.0 21.75 ? 20 A 1 +ATOM 512 H H . LEU A1 1 30 ? 12.476 20.079 -21.927 1.0 24.65 ? 20 A 1 +ATOM 513 H HA . LEU A1 1 30 ? 11.081 18.239 -20.689 1.0 22.17 ? 20 A 1 +ATOM 514 H HB2 . LEU A1 1 30 ? 10.224 19.891 -22.789 1.0 25.45 ? 20 A 1 +ATOM 515 H HB3 . LEU A1 1 30 ? 9.249 18.986 -21.92 1.0 25.45 ? 20 A 1 +ATOM 516 H HG . LEU A1 1 30 ? 10.774 21.096 -20.826 1.0 26.61 ? 20 A 1 +ATOM 517 H HD11 . LEU A1 1 30 ? 8.789 22.343 -20.748 1.0 30.04 ? 20 A 1 +ATOM 518 H HD12 . LEU A1 1 30 ? 9.135 21.962 -22.251 1.0 30.04 ? 20 A 1 +ATOM 519 H HD13 . LEU A1 1 30 ? 8.019 21.152 -21.462 1.0 30.04 ? 20 A 1 +ATOM 520 H HD21 . LEU A1 1 30 ? 9.372 20.934 -18.969 1.0 26.1 ? 20 A 1 +ATOM 521 H HD22 . LEU A1 1 30 ? 8.851 19.557 -19.564 1.0 26.1 ? 20 A 1 +ATOM 522 H HD23 . LEU A1 1 30 ? 10.377 19.718 -19.156 1.0 26.1 ? 20 A 1 +ATOM 523 N N . LYS A1 1 31 ? 11.822 17.568 -23.741 1.0 20.08 ? 21 A 1 +ATOM 524 C CA . LYS A1 1 31 ? 11.891 16.469 -24.697 1.0 22.75 ? 21 A 1 +ATOM 525 C C . LYS A1 1 31 ? 12.703 15.321 -24.114 1.0 20.73 ? 21 A 1 +ATOM 526 O O . LYS A1 1 31 ? 12.33 14.153 -24.259 1.0 21.91 ? 21 A 1 +ATOM 527 C CB . LYS A1 1 31 ? 12.492 16.945 -26.007 1.0 24.5 ? 21 A 1 +ATOM 528 C CG . LYS A1 1 31 ? 12.534 15.815 -27.054 1.0 24.43 ? 21 A 1 +ATOM 529 C CD . LYS A1 1 31 ? 12.945 16.317 -28.405 1.0 29.93 ? 21 A 1 +ATOM 530 C CE . LYS A1 1 31 ? 12.823 15.211 -29.456 1.0 39.81 ? 21 A 1 +ATOM 531 N NZ . LYS A1 1 31 ? 13.085 15.723 -30.824 1.0 67.35 ? 21 A 1 +ATOM 532 H H . LYS A1 1 31 ? 12.167 18.305 -24.018 1.0 24.09 ? 21 A 1 +ATOM 533 H HA . LYS A1 1 31 ? 10.995 16.151 -24.89 1.0 27.3 ? 21 A 1 +ATOM 534 H HB2 . LYS A1 1 31 ? 11.954 17.671 -26.361 1.0 29.41 ? 21 A 1 +ATOM 535 H HB3 . LYS A1 1 31 ? 13.4 17.251 -25.85 1.0 29.41 ? 21 A 1 +ATOM 536 H HG2 . LYS A1 1 31 ? 13.175 15.143 -26.773 1.0 29.31 ? 21 A 1 +ATOM 537 H HG3 . LYS A1 1 31 ? 11.652 15.42 -27.133 1.0 29.31 ? 21 A 1 +ATOM 538 H HD2 . LYS A1 1 31 ? 12.369 17.053 -28.665 1.0 35.92 ? 21 A 1 +ATOM 539 H HD3 . LYS A1 1 31 ? 13.868 16.612 -28.374 1.0 35.92 ? 21 A 1 +ATOM 540 H HE2 . LYS A1 1 31 ? 13.47 14.513 -29.264 1.0 47.77 ? 21 A 1 +ATOM 541 H HE3 . LYS A1 1 31 ? 11.925 14.845 -29.435 1.0 47.77 ? 21 A 1 +ATOM 542 H HZ1 . LYS A1 1 31 ? 13.907 16.061 -30.87 1.0 80.82 ? 21 A 1 +ATOM 543 H HZ2 . LYS A1 1 31 ? 13.011 15.062 -31.416 1.0 80.82 ? 21 A 1 +ATOM 544 H HZ3 . LYS A1 1 31 ? 12.498 16.36 -31.028 1.0 80.82 ? 21 A 1 +ATOM 545 N N . GLU A1 1 32 ? 13.846 15.627 -23.534 1.0 22.47 ? 22 A 1 +ATOM 546 C CA . GLU A1 1 32 ? 14.656 14.555 -22.993 1.0 21.67 ? 22 A 1 +ATOM 547 C C . GLU A1 1 32 ? 13.976 13.863 -21.827 1.0 23.52 ? 22 A 1 +ATOM 548 O O . GLU A1 1 32 ? 14.02 12.625 -21.727 1.0 22.53 ? 22 A 1 +ATOM 549 C CB . GLU A1 1 32 ? 16.036 15.092 -22.632 1.0 25.44 ? 22 A 1 +ATOM 550 C CG . GLU A1 1 32 ? 17.048 14.007 -22.224 1.0 41.87 ? 22 A 1 +ATOM 551 C CD . GLU A1 1 32 ? 17.422 13.041 -23.35 1.0 55.28 ? 22 A 1 +ATOM 552 O OE1 . GLU A1 1 32 ? 17.113 13.313 -24.532 1.0 43.92 ? 22 A 1 +ATOM 553 O OE2 . GLU A1 1 32 ? 18.03 11.993 -23.047 1.0 55.49 ? 22 A 1 +ATOM 554 H H . GLU A1 1 32 ? 14.166 16.42 -23.442 1.0 26.96 ? 22 A 1 +ATOM 555 H HA . GLU A1 1 32 ? 14.782 13.872 -23.671 1.0 26.0 ? 22 A 1 +ATOM 556 H HB2 . GLU A1 1 32 ? 16.399 15.558 -23.401 1.0 30.53 ? 22 A 1 +ATOM 557 H HB3 . GLU A1 1 32 ? 15.945 15.704 -21.885 1.0 30.53 ? 22 A 1 +ATOM 558 H HG2 . GLU A1 1 32 ? 17.864 14.439 -21.926 1.0 50.25 ? 22 A 1 +ATOM 559 H HG3 . GLU A1 1 32 ? 16.668 13.483 -21.502 1.0 50.25 ? 22 A 1 +ATOM 560 N N . ALA A1 1 33 ? 13.316 14.619 -20.952 1.0 21.62 ? 23 A 1 +ATOM 561 C CA . ALA A1 1 33 ? 12.579 13.96 -19.868 1.0 20.66 ? 23 A 1 +ATOM 562 C C . ALA A1 1 33 ? 11.541 13.001 -20.415 1.0 20.32 ? 23 A 1 +ATOM 563 O O . ALA A1 1 33 ? 11.352 11.9 -19.872 1.0 20.89 ? 23 A 1 +ATOM 564 C CB . ALA A1 1 33 ? 11.913 15.015 -18.992 1.0 20.29 ? 23 A 1 +ATOM 565 H H . ALA A1 1 33 ? 13.279 15.478 -20.959 1.0 25.94 ? 23 A 1 +ATOM 566 H HA . ALA A1 1 33 ? 13.201 13.452 -19.324 1.0 24.8 ? 23 A 1 +ATOM 567 H HB1 . ALA A1 1 33 ? 11.439 14.573 -18.271 1.0 24.34 ? 23 A 1 +ATOM 568 H HB2 . ALA A1 1 33 ? 12.596 15.601 -18.629 1.0 24.34 ? 23 A 1 +ATOM 569 H HB3 . ALA A1 1 33 ? 11.291 15.528 -19.532 1.0 24.34 ? 23 A 1 +ATOM 570 N N . LEU A1 1 34 ? 10.823 13.385 -21.472 1.0 19.65 ? 24 A 1 +ATOM 571 C CA . LEU A1 1 34 ? 9.819 12.504 -22.027 1.0 19.87 ? 24 A 1 +ATOM 572 C C . LEU A1 1 34 ? 10.444 11.334 -22.764 1.0 23.35 ? 24 A 1 +ATOM 573 O O . LEU A1 1 34 ? 9.808 10.279 -22.85 1.0 30.44 ? 24 A 1 +ATOM 574 C CB . LEU A1 1 34 ? 8.904 13.267 -22.973 1.0 20.15 ? 24 A 1 +ATOM 575 C CG . LEU A1 1 34 ? 7.957 14.222 -22.258 1.0 19.98 ? 24 A 1 +ATOM 576 C CD1 . LEU A1 1 34 ? 7.296 15.094 -23.31 1.0 20.6 ? 24 A 1 +ATOM 577 C CD2 . LEU A1 1 34 ? 6.885 13.497 -21.458 1.0 20.32 ? 24 A 1 +ATOM 578 H H . LEU A1 1 34 ? 10.902 14.141 -21.874 1.0 23.58 ? 24 A 1 +ATOM 579 H HA . LEU A1 1 34 ? 9.274 12.159 -21.302 1.0 23.84 ? 24 A 1 +ATOM 580 H HB2 . LEU A1 1 34 ? 9.449 13.788 -23.583 1.0 24.18 ? 24 A 1 +ATOM 581 H HB3 . LEU A1 1 34 ? 8.366 12.63 -23.469 1.0 24.18 ? 24 A 1 +ATOM 582 H HG . LEU A1 1 34 ? 8.464 14.752 -21.624 1.0 23.98 ? 24 A 1 +ATOM 583 H HD11 . LEU A1 1 34 ? 6.679 15.702 -22.874 1.0 24.72 ? 24 A 1 +ATOM 584 H HD12 . LEU A1 1 34 ? 7.981 15.597 -23.779 1.0 24.72 ? 24 A 1 +ATOM 585 H HD13 . LEU A1 1 34 ? 6.817 14.527 -23.934 1.0 24.72 ? 24 A 1 +ATOM 586 H HD21 . LEU A1 1 34 ? 6.247 14.147 -21.123 1.0 24.38 ? 24 A 1 +ATOM 587 H HD22 . LEU A1 1 34 ? 6.437 12.859 -22.035 1.0 24.38 ? 24 A 1 +ATOM 588 H HD23 . LEU A1 1 34 ? 7.304 13.033 -20.716 1.0 24.38 ? 24 A 1 +ATOM 589 N N . SER A1 1 35 ? 11.673 11.482 -23.239 1.0 21.38 ? 25 A 1 +ATOM 590 C CA . SER A1 1 35 ? 12.267 10.472 -24.104 1.0 24.3 ? 25 A 1 +ATOM 591 C C . SER A1 1 35 ? 13.031 9.396 -23.341 1.0 26.21 ? 25 A 1 +ATOM 592 O O . SER A1 1 35 ? 13.146 8.265 -23.842 1.0 27.79 ? 25 A 1 +ATOM 593 C CB . SER A1 1 35 ? 13.242 11.171 -25.046 1.0 24.27 ? 25 A 1 +ATOM 594 O OG . SER A1 1 35 ? 12.503 12.033 -25.919 1.0 27.22 ? 25 A 1 +ATOM 595 H H . SER A1 1 35 ? 12.182 12.156 -23.076 1.0 25.65 ? 25 A 1 +ATOM 596 H HA . SER A1 1 35 ? 11.566 10.031 -24.608 1.0 29.16 ? 25 A 1 +ATOM 597 H HB2 . SER A1 1 35 ? 13.872 11.697 -24.528 1.0 29.12 ? 25 A 1 +ATOM 598 H HB3 . SER A1 1 35 ? 13.717 10.507 -25.571 1.0 29.12 ? 25 A 1 +ATOM 599 H HG . SER A1 1 35 ? 12.079 12.602 -25.47 1.0 32.66 ? 25 A 1 +ATOM 600 N N . ILE A1 1 36 ? 13.557 9.721 -22.157 1.0 23.3 ? 26 A 1 +ATOM 601 C CA . ILE A1 1 36 ? 14.34 8.76 -21.369 1.0 22.3 ? 26 A 1 +ATOM 602 C C . ILE A1 1 36 ? 13.437 7.616 -20.956 1.0 23.52 ? 26 A 1 +ATOM 603 O O . ILE A1 1 36 ? 12.35 7.834 -20.39 1.0 26.66 ? 26 A 1 +ATOM 604 C CB . ILE A1 1 36 ? 14.943 9.47 -20.155 1.0 22.82 ? 26 A 1 +ATOM 605 C CG1 . ILE A1 1 36 ? 16.013 10.435 -20.584 1.0 23.34 ? 26 A 1 +ATOM 606 C CG2 . ILE A1 1 36 ? 15.45 8.441 -19.128 1.0 26.19 ? 26 A 1 +ATOM 607 C CD1 . ILE A1 1 36 ? 16.522 11.393 -19.509 1.0 31.36 ? 26 A 1 +ATOM 608 H H . ILE A1 1 36 ? 13.476 10.492 -21.785 1.0 27.96 ? 26 A 1 +ATOM 609 H HA . ILE A1 1 36 ? 15.063 8.399 -21.906 1.0 26.76 ? 26 A 1 +ATOM 610 H HB . ILE A1 1 36 ? 14.252 9.993 -19.719 1.0 27.39 ? 26 A 1 +ATOM 611 H HG12 . ILE A1 1 36 ? 16.775 9.922 -20.895 1.0 28.01 ? 26 A 1 +ATOM 612 H HG13 . ILE A1 1 36 ? 15.66 10.977 -21.307 1.0 28.01 ? 26 A 1 +ATOM 613 H HG21 . ILE A1 1 36 ? 16.052 8.882 -18.509 1.0 31.43 ? 26 A 1 +ATOM 614 H HG22 . ILE A1 1 36 ? 14.691 8.074 -18.648 1.0 31.43 ? 26 A 1 +ATOM 615 H HG23 . ILE A1 1 36 ? 15.919 7.732 -19.597 1.0 31.43 ? 26 A 1 +ATOM 616 H HD11 . ILE A1 1 36 ? 17.164 12.001 -19.907 1.0 37.63 ? 26 A 1 +ATOM 617 H HD12 . ILE A1 1 36 ? 15.772 11.892 -19.15 1.0 37.63 ? 26 A 1 +ATOM 618 H HD13 . ILE A1 1 36 ? 16.946 10.88 -18.803 1.0 37.63 ? 26 A 1 +ATOM 619 N N A ASN A1 1 37 ? 13.88 6.367 -21.136 0.48 19.63 ? 27 A 1 +ATOM 620 N N B ASN A1 1 37 ? 13.864 6.4 -21.264 0.52 25.48 ? 27 A 1 +ATOM 621 C CA A ASN A1 1 37 ? 13.048 5.191 -20.839 0.48 28.91 ? 27 A 1 +ATOM 622 C CA B ASN A1 1 37 ? 13.17 5.184 -20.883 0.52 18.22 ? 27 A 1 +ATOM 623 C C A ASN A1 1 37 ? 13.487 4.391 -19.593 0.48 20.77 ? 27 A 1 +ATOM 624 C C B ASN A1 1 37 ? 14.046 4.453 -19.867 0.52 21.31 ? 27 A 1 +ATOM 625 O O A ASN A1 1 37 ? 13.165 3.22 -19.444 0.48 31.28 ? 27 A 1 +ATOM 626 O O B ASN A1 1 37 ? 14.678 3.445 -20.169 0.52 23.33 ? 27 A 1 +ATOM 627 C CB A ASN A1 1 37 ? 12.936 4.27 -22.058 0.48 29.13 ? 27 A 1 +ATOM 628 C CB B ASN A1 1 37 ? 12.89 4.307 -22.124 0.52 29.3 ? 27 A 1 +ATOM 629 C CG A ASN A1 1 37 ? 11.99 4.808 -23.112 0.48 33.75 ? 27 A 1 +ATOM 630 C CG B ASN A1 1 37 ? 11.789 3.263 -21.893 0.52 38.43 ? 27 A 1 +ATOM 631 O OD1 A ASN A1 1 37 ? 11.018 5.502 -22.802 0.48 67.44 ? 27 A 1 +ATOM 632 O OD1 B ASN A1 1 37 ? 11.227 3.135 -20.802 0.52 30.82 ? 27 A 1 +ATOM 633 N ND2 A ASN A1 1 37 ? 12.276 4.496 -24.369 0.48 38.3 ? 27 A 1 +ATOM 634 N ND2 B ASN A1 1 37 ? 11.466 2.521 -22.944 0.52 32.91 ? 27 A 1 +ATOM 635 H H A ASN A1 1 37 ? 14.664 6.173 -21.431 0.48 23.55 ? 27 A 1 +ATOM 636 H H B ASN A1 1 37 ? 14.582 6.25 -21.712 0.52 30.57 ? 27 A 1 +ATOM 637 H HA A ASN A1 1 37 ? 12.164 5.533 -20.633 0.48 34.69 ? 27 A 1 +ATOM 638 H HA B ASN A1 1 37 ? 12.316 5.403 -20.479 0.52 21.86 ? 27 A 1 +ATOM 639 H HB2 A ASN A1 1 37 ? 13.812 4.173 -22.462 0.48 34.95 ? 27 A 1 +ATOM 640 H HB2 B ASN A1 1 37 ? 12.609 4.879 -22.855 0.52 35.16 ? 27 A 1 +ATOM 641 H HB3 A ASN A1 1 37 ? 12.605 3.405 -21.771 0.48 34.95 ? 27 A 1 +ATOM 642 H HB3 B ASN A1 1 37 ? 13.702 3.834 -22.365 0.52 35.16 ? 27 A 1 +ATOM 643 H HD21 A ASN A1 1 37 ? 11.772 4.775 -25.007 0.48 45.96 ? 27 A 1 +ATOM 644 H HD21 B ASN A1 1 37 ? 10.855 1.919 -22.875 0.52 39.49 ? 27 A 1 +ATOM 645 H HD22 A ASN A1 1 37 ? 12.966 4.014 -24.545 0.48 45.96 ? 27 A 1 +ATOM 646 H HD22 B ASN A1 1 37 ? 11.867 2.642 -23.695 0.52 39.49 ? 27 A 1 +ATOM 647 N N . ASP A1 1 38 ? 14.155 5.037 -18.671 1.0 29.93 ? 28 A 1 +ATOM 648 C CA . ASP A1 1 38 ? 14.851 4.398 -17.548 1.0 24.65 ? 28 A 1 +ATOM 649 C C . ASP A1 1 38 ? 13.926 4.458 -16.342 1.0 21.1 ? 28 A 1 +ATOM 650 O O . ASP A1 1 38 ? 13.482 5.546 -15.971 1.0 24.99 ? 28 A 1 +ATOM 651 C CB . ASP A1 1 38 ? 16.175 5.136 -17.341 1.0 24.97 ? 28 A 1 +ATOM 652 C CG . ASP A1 1 38 ? 17.068 4.497 -16.283 1.0 25.15 ? 28 A 1 +ATOM 653 O OD1 . ASP A1 1 38 ? 16.679 4.641 -15.085 1.0 27.41 ? 28 A 1 +ATOM 654 O OD2 . ASP A1 1 38 ? 18.143 3.927 -16.61 1.0 28.08 ? 28 A 1 +ATOM 655 H H A ASP A1 1 38 ? 14.232 5.894 -18.66 0.48 35.92 ? 28 A 1 +ATOM 656 H H B ASP A1 1 38 ? 13.83 5.812 -18.483 0.52 35.92 ? 28 A 1 +ATOM 657 H HA . ASP A1 1 38 ? 15.046 3.459 -17.695 1.0 29.58 ? 28 A 1 +ATOM 658 H HB2 . ASP A1 1 38 ? 16.665 5.141 -18.178 1.0 29.96 ? 28 A 1 +ATOM 659 H HB3 . ASP A1 1 38 ? 15.987 6.045 -17.061 1.0 29.96 ? 28 A 1 +ATOM 660 N N . ARG A1 1 39 ? 13.606 3.296 -15.777 1.0 25.33 ? 29 A 1 +ATOM 661 C CA . ARG A1 1 39 ? 12.703 3.173 -14.627 1.0 29.67 ? 29 A 1 +ATOM 662 C C . ARG A1 1 39 ? 13.128 4.074 -13.466 1.0 21.98 ? 29 A 1 +ATOM 663 O O . ARG A1 1 39 ? 12.301 4.684 -12.789 1.0 21.96 ? 29 A 1 +ATOM 664 C CB . ARG A1 1 39 ? 12.705 1.697 -14.158 1.0 31.35 ? 29 A 1 +ATOM 665 C CG . ARG A1 1 39 ? 11.356 1.081 -13.919 1.0 78.29 ? 29 A 1 +ATOM 666 C CD . ARG A1 1 39 ? 11.266 -0.394 -14.382 1.0 90.52 ? 29 A 1 +ATOM 667 N NE . ARG A1 1 39 ? 12.447 -1.225 -14.099 1.0 47.15 ? 29 A 1 +ATOM 668 C CZ . ARG A1 1 39 ? 13.093 -1.963 -15.009 1.0 57.27 ? 29 A 1 +ATOM 669 N NH1 . ARG A1 1 39 ? 14.149 -2.705 -14.665 1.0 53.54 ? 29 A 1 +ATOM 670 N NH2 . ARG A1 1 39 ? 12.677 -1.996 -16.262 1.0 51.03 ? 29 A 1 +ATOM 671 H H . ARG A1 1 39 ? 13.905 2.536 -16.046 1.0 30.4 ? 29 A 1 +ATOM 672 H HA . ARG A1 1 39 ? 11.81 3.438 -14.896 1.0 35.6 ? 29 A 1 +ATOM 673 H HB2 . ARG A1 1 39 ? 13.148 1.163 -14.837 1.0 37.62 ? 29 A 1 +ATOM 674 H HB3 . ARG A1 1 39 ? 13.196 1.644 -13.323 1.0 37.62 ? 29 A 1 +ATOM 675 H HG2 . ARG A1 1 39 ? 11.162 1.107 -12.969 1.0 93.95 ? 29 A 1 +ATOM 676 H HG3 . ARG A1 1 39 ? 10.688 1.588 -14.408 1.0 93.95 ? 29 A 1 +ATOM 677 H HD2 . ARG A1 1 39 ? 10.51 -0.807 -13.936 1.0 108.63 ? 29 A 1 +ATOM 678 H HD3 . ARG A1 1 39 ? 11.131 -0.404 -15.342 1.0 108.63 ? 29 A 1 +ATOM 679 H HE . ARG A1 1 39 ? 12.743 -1.238 -13.291 1.0 56.58 ? 29 A 1 +ATOM 680 H HH11 . ARG A1 1 39 ? 14.422 -2.712 -13.849 1.0 64.25 ? 29 A 1 +ATOM 681 H HH12 . ARG A1 1 39 ? 14.556 -3.175 -15.258 1.0 64.25 ? 29 A 1 +ATOM 682 H HH21 . ARG A1 1 39 ? 11.987 -1.541 -16.498 1.0 61.24 ? 29 A 1 +ATOM 683 H HH22 . ARG A1 1 39 ? 13.097 -2.472 -16.842 1.0 61.24 ? 29 A 1 +ATOM 684 N N . GLY A1 1 40 ? 14.437 4.185 -13.226 1.0 24.21 ? 30 A 1 +ATOM 685 C CA . GLY A1 1 40 ? 14.889 5.005 -12.107 1.0 23.32 ? 30 A 1 +ATOM 686 C C . GLY A1 1 40 ? 14.827 6.495 -12.359 1.0 21.31 ? 30 A 1 +ATOM 687 O O . GLY A1 1 40 ? 14.447 7.262 -11.455 1.0 22.83 ? 30 A 1 +ATOM 688 H H . GLY A1 1 40 ? 15.061 3.809 -13.682 1.0 29.05 ? 30 A 1 +ATOM 689 H HA2 . GLY A1 1 40 ? 14.336 4.81 -11.334 1.0 27.98 ? 30 A 1 +ATOM 690 H HA3 . GLY A1 1 40 ? 15.809 4.775 -11.903 1.0 27.98 ? 30 A 1 +ATOM 691 N N . PHE A1 1 41 ? 15.061 6.948 -13.602 1.0 19.68 ? 31 A 1 +ATOM 692 C CA . PHE A1 1 41 ? 14.808 8.325 -13.925 1.0 18.52 ? 31 A 1 +ATOM 693 C C . PHE A1 1 41 ? 13.327 8.62 -13.743 1.0 20.45 ? 31 A 1 +ATOM 694 O O . PHE A1 1 41 ? 12.938 9.642 -13.173 1.0 18.84 ? 31 A 1 +ATOM 695 C CB . PHE A1 1 41 ? 15.208 8.64 -15.376 1.0 19.78 ? 31 A 1 +ATOM 696 C CG . PHE A1 1 41 ? 14.752 9.986 -15.814 1.0 19.17 ? 31 A 1 +ATOM 697 C CD1 . PHE A1 1 41 ? 15.511 11.127 -15.489 1.0 20.65 ? 31 A 1 +ATOM 698 C CD2 . PHE A1 1 41 ? 13.553 10.178 -16.488 1.0 19.94 ? 31 A 1 +ATOM 699 C CE1 . PHE A1 1 41 ? 15.062 12.356 -15.823 1.0 22.07 ? 31 A 1 +ATOM 700 C CE2 . PHE A1 1 41 ? 13.118 11.444 -16.862 1.0 19.97 ? 31 A 1 +ATOM 701 C CZ . PHE A1 1 41 ? 13.86 12.531 -16.507 1.0 21.88 ? 31 A 1 +ATOM 702 H H . PHE A1 1 41 ? 15.36 6.472 -14.253 1.0 23.62 ? 31 A 1 +ATOM 703 H HA . PHE A1 1 41 ? 15.345 8.884 -13.342 1.0 22.22 ? 31 A 1 +ATOM 704 H HB2 . PHE A1 1 41 ? 16.175 8.61 -15.451 1.0 23.73 ? 31 A 1 +ATOM 705 H HB3 . PHE A1 1 41 ? 14.81 7.98 -15.964 1.0 23.73 ? 31 A 1 +ATOM 706 H HD1 . PHE A1 1 41 ? 16.322 11.034 -15.044 1.0 24.78 ? 31 A 1 +ATOM 707 H HD2 . PHE A1 1 41 ? 13.028 9.44 -16.696 1.0 23.92 ? 31 A 1 +ATOM 708 H HE1 . PHE A1 1 41 ? 15.566 13.103 -15.592 1.0 26.49 ? 31 A 1 +ATOM 709 H HE2 . PHE A1 1 41 ? 12.332 11.548 -17.348 1.0 23.96 ? 31 A 1 +ATOM 710 H HZ . PHE A1 1 41 ? 13.565 13.387 -16.72 1.0 26.26 ? 31 A 1 +ATOM 711 N N . ASN A1 1 42 ? 12.469 7.753 -14.305 1.0 20.34 ? 32 A 1 +ATOM 712 C CA . ASN A1 1 42 ? 11.019 8.02 -14.231 1.0 17.41 ? 32 A 1 +ATOM 713 C C . ASN A1 1 42 ? 10.556 8.086 -12.782 1.0 17.79 ? 32 A 1 +ATOM 714 O O . ASN A1 1 42 ? 9.747 8.951 -12.429 1.0 18.13 ? 32 A 1 +ATOM 715 C CB . ASN A1 1 42 ? 10.252 6.925 -14.971 1.0 18.49 ? 32 A 1 +ATOM 716 C CG . ASN A1 1 42 ? 10.441 6.964 -16.47 1.0 19.2 ? 32 A 1 +ATOM 717 O OD1 . ASN A1 1 42 ? 10.93 7.922 -17.022 1.0 18.92 ? 32 A 1 +ATOM 718 N ND2 . ASN A1 1 42 ? 10.055 5.899 -17.111 1.0 19.95 ? 32 A 1 +ATOM 719 H H . ASN A1 1 42 ? 12.689 7.032 -14.719 1.0 24.41 ? 32 A 1 +ATOM 720 H HA . ASN A1 1 42 ? 10.831 8.87 -14.659 1.0 20.89 ? 32 A 1 +ATOM 721 H HB2 . ASN A1 1 42 ? 10.559 6.061 -14.656 1.0 22.19 ? 32 A 1 +ATOM 722 H HB3 . ASN A1 1 42 ? 9.305 7.028 -14.788 1.0 22.19 ? 32 A 1 +ATOM 723 H HD21 . ASN A1 1 42 ? 10.136 5.859 -17.967 1.0 23.94 ? 32 A 1 +ATOM 724 H HD22 . ASN A1 1 42 ? 9.72 5.235 -16.679 1.0 23.94 ? 32 A 1 +ATOM 725 N N . GLU A1 1 43 ? 11.053 7.18 -11.949 1.0 18.03 ? 33 A 1 +ATOM 726 C CA . GLU A1 1 43 ? 10.66 7.192 -10.54 1.0 17.08 ? 33 A 1 +ATOM 727 C C . GLU A1 1 43 ? 11.083 8.495 -9.864 1.0 20.17 ? 33 A 1 +ATOM 728 O O . GLU A1 1 43 ? 10.331 9.057 -9.082 1.0 18.96 ? 33 A 1 +ATOM 729 C CB . GLU A1 1 43 ? 11.183 5.942 -9.856 1.0 23.68 ? 33 A 1 +ATOM 730 C CG . GLU A1 1 43 ? 11.056 5.89 -8.367 1.0 55.69 ? 33 A 1 +ATOM 731 C CD . GLU A1 1 43 ? 11.293 4.482 -7.82 1.0 72.22 ? 33 A 1 +ATOM 732 O OE1 . GLU A1 1 43 ? 11.229 3.509 -8.603 1.0 50.7 ? 33 A 1 +ATOM 733 O OE2 . GLU A1 1 43 ? 11.541 4.352 -6.606 1.0 92.3 ? 33 A 1 +ATOM 734 H H . GLU A1 1 43 ? 11.606 6.558 -12.165 1.0 21.63 ? 33 A 1 +ATOM 735 H HA . GLU A1 1 43 ? 9.694 7.158 -10.454 1.0 20.5 ? 33 A 1 +ATOM 736 H HB2 . GLU A1 1 43 ? 10.698 5.18 -10.21 1.0 28.41 ? 33 A 1 +ATOM 737 H HB3 . GLU A1 1 43 ? 12.127 5.858 -10.064 1.0 28.41 ? 33 A 1 +ATOM 738 H HG2 . GLU A1 1 43 ? 11.712 6.484 -7.97 1.0 66.82 ? 33 A 1 +ATOM 739 H HG3 . GLU A1 1 43 ? 10.161 6.167 -8.114 1.0 66.82 ? 33 A 1 +ATOM 740 N N . ALA A1 1 44 ? 12.271 9.001 -10.157 1.0 19.26 ? 34 A 1 +ATOM 741 C CA . ALA A1 1 44 ? 12.705 10.289 -9.616 1.0 20.2 ? 34 A 1 +ATOM 742 C C . ALA A1 1 44 ? 11.85 11.437 -10.119 1.0 18.18 ? 34 A 1 +ATOM 743 O O . ALA A1 1 44 ? 11.529 12.359 -9.358 1.0 19.56 ? 34 A 1 +ATOM 744 C CB . ALA A1 1 44 ? 14.176 10.523 -9.982 1.0 21.17 ? 34 A 1 +ATOM 745 H H . ALA A1 1 44 ? 12.85 8.623 -10.668 1.0 23.11 ? 34 A 1 +ATOM 746 H HA . ALA A1 1 44 ? 12.618 10.265 -8.65 1.0 24.24 ? 34 A 1 +ATOM 747 H HB1 . ALA A1 1 44 ? 14.457 11.381 -9.628 1.0 25.41 ? 34 A 1 +ATOM 748 H HB2 . ALA A1 1 44 ? 14.714 9.813 -9.596 1.0 25.41 ? 34 A 1 +ATOM 749 H HB3 . ALA A1 1 44 ? 14.265 10.518 -10.948 1.0 25.41 ? 34 A 1 +ATOM 750 N N . LEU A1 1 45 ? 11.454 11.407 -11.398 1.0 16.86 ? 35 A 1 +ATOM 751 C CA . LEU A1 1 45 ? 10.543 12.41 -11.93 1.0 16.72 ? 35 A 1 +ATOM 752 C C . LEU A1 1 45 ? 9.192 12.367 -11.207 1.0 16.31 ? 35 A 1 +ATOM 753 O O . LEU A1 1 45 ? 8.649 13.413 -10.845 1.0 16.63 ? 35 A 1 +ATOM 754 C CB . LEU A1 1 45 ? 10.353 12.17 -13.43 1.0 16.41 ? 35 A 1 +ATOM 755 C CG . LEU A1 1 45 ? 9.379 13.074 -14.141 1.0 16.77 ? 35 A 1 +ATOM 756 C CD1 . LEU A1 1 45 ? 9.919 14.524 -14.192 1.0 21.67 ? 35 A 1 +ATOM 757 C CD2 . LEU A1 1 45 ? 9.043 12.585 -15.557 1.0 19.98 ? 35 A 1 +ATOM 758 H H . LEU A1 1 45 ? 11.7 10.816 -11.972 1.0 20.24 ? 35 A 1 +ATOM 759 H HA . LEU A1 1 45 ? 10.925 13.292 -11.798 1.0 20.06 ? 35 A 1 +ATOM 760 H HB2 . LEU A1 1 45 ? 11.214 12.282 -13.863 1.0 19.7 ? 35 A 1 +ATOM 761 H HB3 . LEU A1 1 45 ? 10.037 11.261 -13.551 1.0 19.7 ? 35 A 1 +ATOM 762 H HG . LEU A1 1 45 ? 8.552 13.062 -13.635 1.0 20.12 ? 35 A 1 +ATOM 763 H HD11 . LEU A1 1 45 ? 9.301 15.073 -14.698 1.0 26.01 ? 35 A 1 +ATOM 764 H HD12 . LEU A1 1 45 ? 9.999 14.863 -13.286 1.0 26.01 ? 35 A 1 +ATOM 765 H HD13 . LEU A1 1 45 ? 10.789 14.522 -14.622 1.0 26.01 ? 35 A 1 +ATOM 766 H HD21 . LEU A1 1 45 ? 8.405 13.196 -15.959 1.0 23.97 ? 35 A 1 +ATOM 767 H HD22 . LEU A1 1 45 ? 9.856 12.562 -16.085 1.0 23.97 ? 35 A 1 +ATOM 768 H HD23 . LEU A1 1 45 ? 8.659 11.696 -15.501 1.0 23.97 ? 35 A 1 +ATOM 769 N N . PHE A1 1 46 ? 8.647 11.162 -11.008 1.0 15.68 ? 36 A 1 +ATOM 770 C CA . PHE A1 1 46 ? 7.38 11.026 -10.276 1.0 15.06 ? 36 A 1 +ATOM 771 C C . PHE A1 1 46 ? 7.518 11.536 -8.849 1.0 17.02 ? 36 A 1 +ATOM 772 O O . PHE A1 1 46 ? 6.591 12.203 -8.363 1.0 17.67 ? 36 A 1 +ATOM 773 C CB . PHE A1 1 46 ? 6.913 9.573 -10.277 1.0 15.75 ? 36 A 1 +ATOM 774 C CG . PHE A1 1 46 ? 6.705 8.954 -11.645 1.0 14.46 ? 36 A 1 +ATOM 775 C CD1 . PHE A1 1 46 ? 6.279 9.729 -12.741 1.0 15.56 ? 36 A 1 +ATOM 776 C CD2 . PHE A1 1 46 ? 6.932 7.649 -11.82 1.0 16.19 ? 36 A 1 +ATOM 777 C CE1 . PHE A1 1 46 ? 6.115 9.155 -13.941 1.0 15.57 ? 36 A 1 +ATOM 778 C CE2 . PHE A1 1 46 ? 6.799 7.067 -13.088 1.0 18.27 ? 36 A 1 +ATOM 779 C CZ . PHE A1 1 46 ? 6.391 7.842 -14.155 1.0 15.99 ? 36 A 1 +ATOM 780 H H . PHE A1 1 46 ? 8.984 10.419 -11.28 1.0 18.81 ? 36 A 1 +ATOM 781 H HA . PHE A1 1 46 ? 6.704 11.554 -10.728 1.0 18.08 ? 36 A 1 +ATOM 782 H HB2 . PHE A1 1 46 ? 7.579 9.038 -9.817 1.0 18.9 ? 36 A 1 +ATOM 783 H HB3 . PHE A1 1 46 ? 6.066 9.524 -9.806 1.0 18.9 ? 36 A 1 +ATOM 784 H HD1 . PHE A1 1 46 ? 6.11 10.637 -12.632 1.0 18.67 ? 36 A 1 +ATOM 785 H HD2 . PHE A1 1 46 ? 7.181 7.123 -11.095 1.0 19.43 ? 36 A 1 +ATOM 786 H HE1 . PHE A1 1 46 ? 5.804 9.672 -14.649 1.0 18.68 ? 36 A 1 +ATOM 787 H HE2 . PHE A1 1 46 ? 6.985 6.164 -13.21 1.0 21.92 ? 36 A 1 +ATOM 788 H HZ . PHE A1 1 46 ? 6.305 7.472 -15.005 1.0 19.19 ? 36 A 1 +ATOM 789 N N . LYS A1 1 47 ? 8.628 11.248 -8.186 1.0 16.8 ? 37 A 1 +ATOM 790 C CA . LYS A1 1 47 ? 8.811 11.726 -6.81 1.0 17.75 ? 37 A 1 +ATOM 791 C C . LYS A1 1 47 ? 8.955 13.239 -6.75 1.0 20.35 ? 37 A 1 +ATOM 792 O O . LYS A1 1 47 ? 8.465 13.865 -5.808 1.0 18.67 ? 37 A 1 +ATOM 793 C CB . LYS A1 1 47 ? 9.997 11.02 -6.181 1.0 21.93 ? 37 A 1 +ATOM 794 C CG . LYS A1 1 47 ? 9.723 9.582 -5.822 1.0 25.16 ? 37 A 1 +ATOM 795 C CD . LYS A1 1 47 ? 11.0 8.941 -5.281 1.0 51.44 ? 37 A 1 +ATOM 796 C CE . LYS A1 1 47 ? 10.782 7.506 -4.876 1.0 71.22 ? 37 A 1 +ATOM 797 N NZ . LYS A1 1 47 ? 12.096 6.81 -4.728 1.0 74.43 ? 37 A 1 +ATOM 798 H H . LYS A1 1 47 ? 9.284 10.787 -8.498 1.0 20.16 ? 37 A 1 +ATOM 799 H HA . LYS A1 1 47 ? 8.024 11.503 -6.288 1.0 21.3 ? 37 A 1 +ATOM 800 H HB2 . LYS A1 1 47 ? 10.737 11.033 -6.808 1.0 26.32 ? 37 A 1 +ATOM 801 H HB3 . LYS A1 1 47 ? 10.243 11.487 -5.367 1.0 26.32 ? 37 A 1 +ATOM 802 H HG2 . LYS A1 1 47 ? 9.036 9.538 -5.138 1.0 30.19 ? 37 A 1 +ATOM 803 H HG3 . LYS A1 1 47 ? 9.437 9.094 -6.61 1.0 30.19 ? 37 A 1 +ATOM 804 H HD2 . LYS A1 1 47 ? 11.683 8.961 -5.969 1.0 61.73 ? 37 A 1 +ATOM 805 H HD3 . LYS A1 1 47 ? 11.299 9.433 -4.501 1.0 61.73 ? 37 A 1 +ATOM 806 H HE2 . LYS A1 1 47 ? 10.315 7.473 -4.027 1.0 85.46 ? 37 A 1 +ATOM 807 H HE3 . LYS A1 1 47 ? 10.264 7.049 -5.557 1.0 85.46 ? 37 A 1 +ATOM 808 H HZ1 . LYS A1 1 47 ? 12.589 7.217 -4.109 1.0 89.32 ? 37 A 1 +ATOM 809 H HZ2 . LYS A1 1 47 ? 11.967 5.964 -4.484 1.0 89.32 ? 37 A 1 +ATOM 810 H HZ3 . LYS A1 1 47 ? 12.537 6.823 -5.502 1.0 89.32 ? 37 A 1 +ATOM 811 N N . LEU A1 1 48 ? 9.6 13.86 -7.742 1.0 18.55 ? 38 A 1 +ATOM 812 C CA . LEU A1 1 48 ? 9.656 15.311 -7.805 1.0 18.75 ? 38 A 1 +ATOM 813 C C . LEU A1 1 48 ? 8.272 15.91 -7.944 1.0 17.65 ? 38 A 1 +ATOM 814 O O . LEU A1 1 48 ? 7.915 16.867 -7.235 1.0 17.53 ? 38 A 1 +ATOM 815 C CB . LEU A1 1 48 ? 10.579 15.739 -8.946 1.0 20.13 ? 38 A 1 +ATOM 816 C CG . LEU A1 1 48 ? 10.662 17.248 -9.176 1.0 19.78 ? 38 A 1 +ATOM 817 C CD1 . LEU A1 1 48 ? 11.07 18.007 -7.94 1.0 20.4 ? 38 A 1 +ATOM 818 C CD2 . LEU A1 1 48 ? 11.661 17.495 -10.33 1.0 21.02 ? 38 A 1 +ATOM 819 H H . LEU A1 1 48 ? 10.009 13.462 -8.385 1.0 22.26 ? 38 A 1 +ATOM 820 H HA . LEU A1 1 48 ? 10.031 15.655 -6.979 1.0 22.51 ? 38 A 1 +ATOM 821 H HB2 . LEU A1 1 48 ? 11.476 15.424 -8.749 1.0 24.16 ? 38 A 1 +ATOM 822 H HB3 . LEU A1 1 48 ? 10.259 15.336 -9.768 1.0 24.16 ? 38 A 1 +ATOM 823 H HG . LEU A1 1 48 ? 9.784 17.589 -9.407 1.0 23.74 ? 38 A 1 +ATOM 824 H HD11 . LEU A1 1 48 ? 11.216 18.937 -8.174 1.0 24.48 ? 38 A 1 +ATOM 825 H HD12 . LEU A1 1 48 ? 10.362 17.939 -7.28 1.0 24.48 ? 38 A 1 +ATOM 826 H HD13 . LEU A1 1 48 ? 11.888 17.622 -7.588 1.0 24.48 ? 38 A 1 +ATOM 827 H HD21 . LEU A1 1 48 ? 11.728 18.449 -10.492 1.0 25.22 ? 38 A 1 +ATOM 828 H HD22 . LEU A1 1 48 ? 12.529 17.141 -10.078 1.0 25.22 ? 38 A 1 +ATOM 829 H HD23 . LEU A1 1 48 ? 11.34 17.047 -11.128 1.0 25.22 ? 38 A 1 +ATOM 830 N N . ALA A1 1 49 ? 7.49 15.394 -8.885 1.0 16.48 ? 39 A 1 +ATOM 831 C CA . ALA A1 1 49 ? 6.141 15.878 -9.061 1.0 15.27 ? 39 A 1 +ATOM 832 C C . ALA A1 1 49 ? 5.304 15.676 -7.791 1.0 15.99 ? 39 A 1 +ATOM 833 O O . ALA A1 1 49 ? 4.569 16.59 -7.399 1.0 15.49 ? 39 A 1 +ATOM 834 C CB . ALA A1 1 49 ? 5.483 15.203 -10.251 1.0 15.62 ? 39 A 1 +ATOM 835 H H . ALA A1 1 49 ? 7.72 14.768 -9.428 1.0 19.78 ? 39 A 1 +ATOM 836 H HA . ALA A1 1 49 ? 6.18 16.83 -9.247 1.0 18.33 ? 39 A 1 +ATOM 837 H HB1 . ALA A1 1 49 ? 4.594 15.574 -10.372 1.0 18.74 ? 39 A 1 +ATOM 838 H HB2 . ALA A1 1 49 ? 6.019 15.365 -11.042 1.0 18.74 ? 39 A 1 +ATOM 839 H HB3 . ALA A1 1 49 ? 5.423 14.25 -10.08 1.0 18.74 ? 39 A 1 +ATOM 840 N N . ASP A1 1 50 ? 5.446 14.512 -7.168 1.0 15.31 ? 40 A 1 +ATOM 841 C CA . ASP A1 1 50 ? 4.734 14.285 -5.912 1.0 15.7 ? 40 A 1 +ATOM 842 C C . ASP A1 1 50 ? 5.153 15.26 -4.831 1.0 16.42 ? 40 A 1 +ATOM 843 O O . ASP A1 1 50 ? 4.271 15.735 -4.082 1.0 16.92 ? 40 A 1 +ATOM 844 C CB . ASP A1 1 50 ? 4.94 12.844 -5.5 1.0 15.92 ? 40 A 1 +ATOM 845 C CG . ASP A1 1 50 ? 4.187 12.483 -4.257 1.0 17.3 ? 40 A 1 +ATOM 846 O OD1 . ASP A1 1 50 ? 2.935 12.348 -4.322 1.0 18.21 ? 40 A 1 +ATOM 847 O OD2 . ASP A1 1 50 ? 4.83 12.307 -3.2 1.0 19.08 ? 40 A 1 +ATOM 848 H H . ASP A1 1 50 ? 5.932 13.857 -7.44 1.0 18.37 ? 40 A 1 +ATOM 849 H HA . ASP A1 1 50 ? 3.784 14.433 -6.04 1.0 18.84 ? 40 A 1 +ATOM 850 H HB2 . ASP A1 1 50 ? 4.634 12.264 -6.215 1.0 19.1 ? 40 A 1 +ATOM 851 H HB3 . ASP A1 1 50 ? 5.884 12.695 -5.333 1.0 19.1 ? 40 A 1 +ATOM 852 N N . GLU A1 1 51 ? 6.424 15.601 -4.749 1.0 16.59 ? 41 A 1 +ATOM 853 C CA . GLU A1 1 51 ? 6.87 16.557 -3.761 1.0 18.01 ? 41 A 1 +ATOM 854 C C . GLU A1 1 51 ? 6.222 17.91 -4.013 1.0 17.4 ? 41 A 1 +ATOM 855 O O . GLU A1 1 51 ? 5.769 18.582 -3.089 1.0 19.33 ? 41 A 1 +ATOM 856 C CB . GLU A1 1 51 ? 8.383 16.679 -3.854 1.0 22.96 ? 41 A 1 +ATOM 857 C CG . GLU A1 1 51 ? 8.954 17.582 -2.864 1.0 29.44 ? 41 A 1 +ATOM 858 C CD . GLU A1 1 51 ? 10.469 17.656 -3.021 1.0 67.73 ? 41 A 1 +ATOM 859 O OE1 . GLU A1 1 51 ? 10.964 18.469 -3.827 1.0 63.26 ? 41 A 1 +ATOM 860 O OE2 . GLU A1 1 51 ? 11.151 16.864 -2.364 1.0 39.0 ? 41 A 1 +ATOM 861 H H . GLU A1 1 51 ? 7.049 15.293 -5.253 1.0 19.91 ? 41 A 1 +ATOM 862 H HA . GLU A1 1 51 ? 6.628 16.257 -2.871 1.0 21.61 ? 41 A 1 +ATOM 863 H HB2 . GLU A1 1 51 ? 8.776 15.803 -3.72 1.0 27.55 ? 41 A 1 +ATOM 864 H HB3 . GLU A1 1 51 ? 8.616 17.016 -4.733 1.0 27.55 ? 41 A 1 +ATOM 865 H HG2 . GLU A1 1 51 ? 8.587 18.471 -2.985 1.0 35.32 ? 41 A 1 +ATOM 866 H HG3 . GLU A1 1 51 ? 8.751 17.257 -1.973 1.0 35.32 ? 41 A 1 +ATOM 867 N N . ILE A1 1 52 ? 6.212 18.356 -5.264 1.0 16.07 ? 42 A 1 +ATOM 868 C CA . ILE A1 1 52 ? 5.657 19.648 -5.587 1.0 16.14 ? 42 A 1 +ATOM 869 C C . ILE A1 1 52 ? 4.165 19.64 -5.278 1.0 16.02 ? 42 A 1 +ATOM 870 O O . ILE A1 1 52 ? 3.606 20.636 -4.764 1.0 16.74 ? 42 A 1 +ATOM 871 C CB . ILE A1 1 52 ? 5.96 19.997 -7.073 1.0 16.03 ? 42 A 1 +ATOM 872 C CG1 . ILE A1 1 52 ? 7.449 20.208 -7.205 1.0 20.85 ? 42 A 1 +ATOM 873 C CG2 . ILE A1 1 52 ? 5.197 21.194 -7.536 1.0 17.03 ? 42 A 1 +ATOM 874 C CD1 . ILE A1 1 52 ? 7.933 20.471 -8.628 1.0 38.42 ? 42 A 1 +ATOM 875 H H . ILE A1 1 52 ? 6.522 17.925 -5.94 1.0 19.28 ? 42 A 1 +ATOM 876 H HA . ILE A1 1 52 ? 6.072 20.336 -5.043 1.0 19.37 ? 42 A 1 +ATOM 877 H HB . ILE A1 1 52 ? 5.673 19.264 -7.639 1.0 19.23 ? 42 A 1 +ATOM 878 H HG12 . ILE A1 1 52 ? 7.701 20.973 -6.665 1.0 25.02 ? 42 A 1 +ATOM 879 H HG13 . ILE A1 1 52 ? 7.902 19.412 -6.884 1.0 25.02 ? 42 A 1 +ATOM 880 H HG21 . ILE A1 1 52 ? 5.479 21.418 -8.437 1.0 20.44 ? 42 A 1 +ATOM 881 H HG22 . ILE A1 1 52 ? 4.25 20.987 -7.527 1.0 20.44 ? 42 A 1 +ATOM 882 H HG23 . ILE A1 1 52 ? 5.38 21.936 -6.939 1.0 20.44 ? 42 A 1 +ATOM 883 H HD11 . ILE A1 1 52 ? 8.888 20.309 -8.672 1.0 46.1 ? 42 A 1 +ATOM 884 H HD12 . ILE A1 1 52 ? 7.468 19.873 -9.235 1.0 46.1 ? 42 A 1 +ATOM 885 H HD13 . ILE A1 1 52 ? 7.742 21.393 -8.861 1.0 46.1 ? 42 A 1 +ATOM 886 N N . ARG A1 1 53 ? 3.482 18.55 -5.605 1.0 15.25 ? 43 A 1 +ATOM 887 C CA . ARG A1 1 53 ? 2.067 18.413 -5.268 1.0 14.48 ? 43 A 1 +ATOM 888 C C . ARG A1 1 53 ? 1.856 18.56 -3.755 1.0 15.39 ? 43 A 1 +ATOM 889 O O . ARG A1 1 53 ? 0.986 19.356 -3.333 1.0 16.46 ? 43 A 1 +ATOM 890 C CB . ARG A1 1 53 ? 1.573 17.074 -5.793 1.0 15.04 ? 43 A 1 +ATOM 891 C CG . ARG A1 1 53 ? 0.096 16.746 -5.675 1.0 15.02 ? 43 A 1 +ATOM 892 C CD . ARG A1 1 53 ? -0.32 16.279 -4.259 1.0 15.04 ? 43 A 1 +ATOM 893 N NE . ARG A1 1 53 ? 0.339 15.055 -3.901 1.0 15.94 ? 43 A 1 +ATOM 894 C CZ . ARG A1 1 53 ? 0.364 14.512 -2.692 1.0 15.2 ? 43 A 1 +ATOM 895 N NH1 . ARG A1 1 53 ? -0.247 15.148 -1.69 1.0 17.18 ? 43 A 1 +ATOM 896 N NH2 . ARG A1 1 53 ? 0.986 13.396 -2.466 1.0 16.41 ? 43 A 1 +ATOM 897 H H . ARG A1 1 53 ? 3.811 17.874 -6.023 1.0 18.3 ? 43 A 1 +ATOM 898 H HA . ARG A1 1 53 ? 1.544 19.11 -5.694 1.0 17.37 ? 43 A 1 +ATOM 899 H HB2 . ARG A1 1 53 ? 1.79 17.032 -6.738 1.0 18.05 ? 43 A 1 +ATOM 900 H HB3 . ARG A1 1 53 ? 2.049 16.378 -5.313 1.0 18.05 ? 43 A 1 +ATOM 901 H HG2 . ARG A1 1 53 ? -0.42 17.539 -5.889 1.0 18.03 ? 43 A 1 +ATOM 902 H HG3 . ARG A1 1 53 ? -0.118 16.034 -6.298 1.0 18.03 ? 43 A 1 +ATOM 903 H HD2 . ARG A1 1 53 ? -0.078 16.959 -3.611 1.0 18.05 ? 43 A 1 +ATOM 904 H HD3 . ARG A1 1 53 ? -1.278 16.128 -4.238 1.0 18.05 ? 43 A 1 +ATOM 905 H HE . ARG A1 1 53 ? 0.755 14.637 -4.527 1.0 19.12 ? 43 A 1 +ATOM 906 H HH11 . ARG A1 1 53 ? -0.647 15.895 -1.835 1.0 20.62 ? 43 A 1 +ATOM 907 H HH12 . ARG A1 1 53 ? -0.24 14.81 -0.899 1.0 20.62 ? 43 A 1 +ATOM 908 H HH21 . ARG A1 1 53 ? 1.393 12.993 -3.108 1.0 19.69 ? 43 A 1 +ATOM 909 H HH22 . ARG A1 1 53 ? 0.991 13.059 -1.675 1.0 19.69 ? 43 A 1 +ATOM 910 N N . ARG A1 1 54 ? 2.628 17.821 -2.959 1.0 15.34 ? 44 A 1 +ATOM 911 C CA . ARG A1 1 54 ? 2.494 17.939 -1.507 1.0 16.73 ? 44 A 1 +ATOM 912 C C . ARG A1 1 54 ? 2.653 19.384 -1.063 1.0 18.65 ? 44 A 1 +ATOM 913 O O . ARG A1 1 54 ? 1.925 19.849 -0.173 1.0 20.75 ? 44 A 1 +ATOM 914 C CB . ARG A1 1 54 ? 3.568 17.082 -0.859 1.0 18.28 ? 44 A 1 +ATOM 915 C CG . ARG A1 1 54 ? 3.325 15.587 -0.936 1.0 17.16 ? 44 A 1 +ATOM 916 C CD . ARG A1 1 54 ? 4.542 14.812 -0.555 1.0 20.11 ? 44 A 1 +ATOM 917 N NE . ARG A1 1 54 ? 4.378 13.385 -0.688 1.0 22.23 ? 44 A 1 +ATOM 918 C CZ . ARG A1 1 54 ? 3.863 12.57 0.204 0.89 26.85 ? 44 A 1 +ATOM 919 N NH1 . ARG A1 1 54 ? 3.474 13.031 1.403 0.7 23.89 ? 44 A 1 +ATOM 920 N NH2 . ARG A1 1 54 ? 3.802 11.268 -0.054 0.73 26.78 ? 44 A 1 +ATOM 921 H H . ARG A1 1 54 ? 3.222 17.259 -3.227 1.0 18.4 ? 44 A 1 +ATOM 922 H HA . ARG A1 1 54 ? 1.618 17.63 -1.228 1.0 20.07 ? 44 A 1 +ATOM 923 H HB2 . ARG A1 1 54 ? 4.413 17.263 -1.3 1.0 21.93 ? 44 A 1 +ATOM 924 H HB3 . ARG A1 1 54 ? 3.626 17.32 0.08 1.0 21.93 ? 44 A 1 +ATOM 925 H HG2 . ARG A1 1 54 ? 2.608 15.346 -0.329 1.0 20.59 ? 44 A 1 +ATOM 926 H HG3 . ARG A1 1 54 ? 3.084 15.347 -1.845 1.0 20.59 ? 44 A 1 +ATOM 927 H HD2 . ARG A1 1 54 ? 5.277 15.081 -1.127 1.0 24.13 ? 44 A 1 +ATOM 928 H HD3 . ARG A1 1 54 ? 4.756 15.001 0.372 1.0 24.13 ? 44 A 1 +ATOM 929 H HE . ARG A1 1 54 ? 4.645 13.033 -1.425 1.0 26.68 ? 44 A 1 +ATOM 930 H HH11 . ARG A1 1 54 ? 3.56 13.865 1.592 0.81 28.67 ? 44 A 1 +ATOM 931 H HH12 . ARG A1 1 54 ? 3.137 12.492 1.982 0.81 28.67 ? 44 A 1 +ATOM 932 H HH21 . ARG A1 1 54 ? 4.099 10.964 -0.801 0.75 32.13 ? 44 A 1 +ATOM 933 H HH22 . ARG A1 1 54 ? 3.466 10.73 0.527 0.72 32.13 ? 44 A 1 +ATOM 934 N N . LYS A1 1 55 ? 3.641 20.093 -1.582 1.0 17.59 ? 45 A 1 +ATOM 935 C CA . LYS A1 1 55 ? 3.943 21.425 -1.109 1.0 19.63 ? 45 A 1 +ATOM 936 C C . LYS A1 1 55 ? 2.903 22.446 -1.506 1.0 17.14 ? 45 A 1 +ATOM 937 O O . LYS A1 1 55 ? 2.642 23.378 -0.746 1.0 20.76 ? 45 A 1 +ATOM 938 C CB . LYS A1 1 55 ? 5.34 21.769 -1.556 1.0 21.86 ? 45 A 1 +ATOM 939 C CG . LYS A1 1 55 ? 6.356 20.861 -0.881 1.0 22.37 ? 45 A 1 +ATOM 940 C CD . LYS A1 1 55 ? 7.779 21.328 -1.2 1.0 29.14 ? 45 A 1 +ATOM 941 C CE . LYS A1 1 55 ? 8.863 20.43 -0.5 1.0 25.72 ? 45 A 1 +ATOM 942 N NZ . LYS A1 1 55 ? 10.166 20.911 -0.707 1.0 29.81 ? 45 A 1 +ATOM 943 H H . LYS A1 1 55 ? 4.156 19.821 -2.215 1.0 21.11 ? 45 A 1 +ATOM 944 H HA . LYS A1 1 55 ? 3.926 21.45 -0.139 1.0 23.55 ? 45 A 1 +ATOM 945 H HB2 . LYS A1 1 55 ? 5.411 21.652 -2.516 1.0 26.24 ? 45 A 1 +ATOM 946 H HB3 . LYS A1 1 55 ? 5.539 22.688 -1.317 1.0 26.24 ? 45 A 1 +ATOM 947 H HG2 . LYS A1 1 55 ? 6.23 20.889 0.081 1.0 26.85 ? 45 A 1 +ATOM 948 H HG3 . LYS A1 1 55 ? 6.248 19.953 -1.204 1.0 26.85 ? 45 A 1 +ATOM 949 H HD2 . LYS A1 1 55 ? 7.922 21.284 -2.159 1.0 34.96 ? 45 A 1 +ATOM 950 H HD3 . LYS A1 1 55 ? 7.894 22.24 -0.89 1.0 34.96 ? 45 A 1 +ATOM 951 H HE2 . LYS A1 1 55 ? 8.695 20.414 0.456 1.0 30.87 ? 45 A 1 +ATOM 952 H HE3 . LYS A1 1 55 ? 8.813 19.53 -0.86 1.0 30.87 ? 45 A 1 +ATOM 953 H HZ1 . LYS A1 1 55 ? 10.754 20.381 -0.302 1.0 35.78 ? 45 A 1 +ATOM 954 H HZ2 . LYS A1 1 55 ? 10.347 20.932 -1.578 1.0 35.78 ? 45 A 1 +ATOM 955 H HZ3 . LYS A1 1 55 ? 10.242 21.734 -0.376 1.0 35.78 ? 45 A 1 +ATOM 956 N N . TYR A1 1 56 ? 2.337 22.364 -2.724 1.0 16.69 ? 46 A 1 +ATOM 957 C CA . TYR A1 1 56 ? 1.54 23.458 -3.241 1.0 18.52 ? 46 A 1 +ATOM 958 C C . TYR A1 1 56 ? 0.057 23.194 -3.351 1.0 17.69 ? 46 A 1 +ATOM 959 O O . TYR A1 1 56 ? -0.684 24.152 -3.441 1.0 20.41 ? 46 A 1 +ATOM 960 C CB . TYR A1 1 56 ? 2.123 23.965 -4.576 1.0 17.94 ? 46 A 1 +ATOM 961 C CG . TYR A1 1 56 ? 3.49 24.57 -4.276 1.0 19.38 ? 46 A 1 +ATOM 962 C CD1 . TYR A1 1 56 ? 3.622 25.792 -3.647 1.0 20.13 ? 46 A 1 +ATOM 963 C CD2 . TYR A1 1 56 ? 4.659 23.826 -4.494 1.0 20.97 ? 46 A 1 +ATOM 964 C CE1 . TYR A1 1 56 ? 4.86 26.323 -3.295 1.0 25.17 ? 46 A 1 +ATOM 965 C CE2 . TYR A1 1 56 ? 5.923 24.359 -4.105 1.0 22.79 ? 46 A 1 +ATOM 966 C CZ . TYR A1 1 56 ? 6.003 25.587 -3.528 1.0 23.08 ? 46 A 1 +ATOM 967 O OH . TYR A1 1 56 ? 7.24 26.077 -3.158 1.0 26.63 ? 46 A 1 +ATOM 968 H H . TYR A1 1 56 ? 2.408 21.689 -3.252 1.0 20.03 ? 46 A 1 +ATOM 969 H HA . TYR A1 1 56 ? 1.603 24.198 -2.617 1.0 22.23 ? 46 A 1 +ATOM 970 H HB2 . TYR A1 1 56 ? 2.225 23.229 -5.199 1.0 21.53 ? 46 A 1 +ATOM 971 H HB3 . TYR A1 1 56 ? 1.546 24.645 -4.958 1.0 21.53 ? 46 A 1 +ATOM 972 H HD1 . TYR A1 1 56 ? 2.855 26.279 -3.451 1.0 24.16 ? 46 A 1 +ATOM 973 H HD2 . TYR A1 1 56 ? 4.61 22.986 -4.892 1.0 25.16 ? 46 A 1 +ATOM 974 H HE1 . TYR A1 1 56 ? 4.916 27.166 -2.906 1.0 30.2 ? 46 A 1 +ATOM 975 H HE2 . TYR A1 1 56 ? 6.697 23.864 -4.248 1.0 27.35 ? 46 A 1 +ATOM 976 H HH . TYR A1 1 56 ? 7.154 26.83 -2.796 1.0 31.96 ? 46 A 1 +ATOM 977 N N . VAL A1 1 57 ? -0.396 21.94 -3.34 1.0 17.59 ? 47 A 1 +ATOM 978 C CA . VAL A1 1 57 ? -1.823 21.627 -3.249 1.0 16.9 ? 47 A 1 +ATOM 979 C C . VAL A1 1 57 ? -2.138 20.713 -2.077 1.0 17.01 ? 47 A 1 +ATOM 980 O O . VAL A1 1 57 ? -3.325 20.439 -1.872 1.0 17.34 ? 47 A 1 +ATOM 981 C CB . VAL A1 1 57 ? -2.417 21.084 -4.57 1.0 16.64 ? 47 A 1 +ATOM 982 C CG1 . VAL A1 1 57 ? -2.267 22.142 -5.707 1.0 16.02 ? 47 A 1 +ATOM 983 C CG2 . VAL A1 1 57 ? -1.818 19.74 -4.971 1.0 15.98 ? 47 A 1 +ATOM 984 H H . VAL A1 1 57 ? 0.109 21.246 -3.384 1.0 21.11 ? 47 A 1 +ATOM 985 H HA . VAL A1 1 57 ? -2.298 22.459 -3.096 1.0 20.28 ? 47 A 1 +ATOM 986 H HB . VAL A1 1 57 ? -3.363 20.921 -4.426 1.0 19.96 ? 47 A 1 +ATOM 987 H HG11 . VAL A1 1 57 ? -2.693 21.805 -6.511 1.0 19.22 ? 47 A 1 +ATOM 988 H HG12 . VAL A1 1 57 ? -2.692 22.968 -5.428 1.0 19.22 ? 47 A 1 +ATOM 989 H HG13 . VAL A1 1 57 ? -1.323 22.295 -5.873 1.0 19.22 ? 47 A 1 +ATOM 990 H HG21 . VAL A1 1 57 ? -2.2 19.465 -5.819 1.0 19.17 ? 47 A 1 +ATOM 991 H HG22 . VAL A1 1 57 ? -0.857 19.836 -5.057 1.0 19.17 ? 47 A 1 +ATOM 992 H HG23 . VAL A1 1 57 ? -2.025 19.085 -4.287 1.0 19.17 ? 47 A 1 +ATOM 993 N N . GLY A1 1 58 ? -1.154 20.212 -1.353 1.0 17.86 ? 48 A 1 +ATOM 994 C CA . GLY A1 1 58 ? -1.461 19.519 -0.109 1.0 19.29 ? 48 A 1 +ATOM 995 C C . GLY A1 1 58 ? -1.981 18.106 -0.333 1.0 17.95 ? 48 A 1 +ATOM 996 O O . GLY A1 1 58 ? -1.86 17.511 -1.431 1.0 18.76 ? 48 A 1 +ATOM 997 H H . GLY A1 1 58 ? -0.318 20.258 -1.551 1.0 21.43 ? 48 A 1 +ATOM 998 H HA2 . GLY A1 1 58 ? -0.659 19.464 0.434 1.0 23.15 ? 48 A 1 +ATOM 999 H HA3 . GLY A1 1 58 ? -2.137 20.017 0.376 1.0 23.15 ? 48 A 1 +ATOM 1000 N N . ASP A1 1 59 ? -2.605 17.543 0.717 1.0 18.09 ? 49 A 1 +ATOM 1001 C CA A ASP A1 1 59 ? -2.973 16.128 0.748 0.72 17.17 ? 49 A 1 +ATOM 1002 C CA B ASP A1 1 59 ? -2.954 16.13 0.692 0.28 21.98 ? 49 A 1 +ATOM 1003 C C . ASP A1 1 59 ? -4.424 15.867 0.409 1.0 18.12 ? 49 A 1 +ATOM 1004 O O . ASP A1 1 59 ? -4.808 14.714 0.266 1.0 20.81 ? 49 A 1 +ATOM 1005 C CB A ASP A1 1 59 ? -2.655 15.487 2.111 0.72 21.63 ? 49 A 1 +ATOM 1006 C CB B ASP A1 1 59 ? -2.46 15.398 1.927 0.28 40.47 ? 49 A 1 +ATOM 1007 C CG A ASP A1 1 59 ? -1.465 14.458 2.003 0.72 24.72 ? 49 A 1 +ATOM 1008 C CG B ASP A1 1 59 ? -3.345 15.585 3.078 0.28 32.72 ? 49 A 1 +ATOM 1009 O OD1 A ASP A1 1 59 ? -0.483 14.576 1.139 0.72 21.91 ? 49 A 1 +ATOM 1010 O OD1 B ASP A1 1 59 ? -3.906 16.69 3.224 0.28 36.53 ? 49 A 1 +ATOM 1011 O OD2 A ASP A1 1 59 ? -1.47 13.523 2.807 0.72 31.5 ? 49 A 1 +ATOM 1012 O OD2 B ASP A1 1 59 ? -3.517 14.605 3.82 0.28 29.57 ? 49 A 1 +ATOM 1013 H H . ASP A1 1 59 ? -2.825 17.973 1.429 1.0 21.71 ? 49 A 1 +ATOM 1014 H HA . ASP A1 1 59 ? -2.426 15.68 0.085 1.0 26.38 ? 49 A 1 +ATOM 1015 H HB2 A ASP A1 1 59 ? -2.403 16.181 2.741 0.72 25.96 ? 49 A 1 +ATOM 1016 H HB2 B ASP A1 1 59 ? -2.412 14.448 1.735 0.28 48.56 ? 49 A 1 +ATOM 1017 H HB3 A ASP A1 1 59 ? -3.438 15.015 2.435 0.72 25.96 ? 49 A 1 +ATOM 1018 H HB3 B ASP A1 1 59 ? -1.581 15.733 2.165 0.28 48.56 ? 49 A 1 +ATOM 1019 N N . GLU A1 1 60 ? -5.258 16.914 0.246 1.0 16.54 ? 50 A 1 +ATOM 1020 C CA . GLU A1 1 60 ? -6.657 16.7 -0.102 1.0 17.67 ? 50 A 1 +ATOM 1021 C C . GLU A1 1 60 ? -6.762 16.232 -1.546 1.0 17.52 ? 50 A 1 +ATOM 1022 O O . GLU A1 1 60 ? -6.157 16.822 -2.452 1.0 16.7 ? 50 A 1 +ATOM 1023 C CB . GLU A1 1 60 ? -7.465 18.003 0.094 1.0 18.44 ? 50 A 1 +ATOM 1024 C CG . GLU A1 1 60 ? -7.639 18.332 1.568 1.0 21.81 ? 50 A 1 +ATOM 1025 C CD . GLU A1 1 60 ? -8.324 19.639 1.93 1.0 38.42 ? 50 A 1 +ATOM 1026 O OE1 . GLU A1 1 60 ? -9.206 20.129 1.232 1.0 26.81 ? 50 A 1 +ATOM 1027 O OE2 . GLU A1 1 60 ? -7.977 20.177 3.003 1.0 47.03 ? 50 A 1 +ATOM 1028 H H . GLU A1 1 60 ? -5.033 17.739 0.332 1.0 19.85 ? 50 A 1 +ATOM 1029 H HA . GLU A1 1 60 ? -7.035 16.02 0.477 1.0 21.2 ? 50 A 1 +ATOM 1030 H HB2 . GLU A1 1 60 ? -6.996 18.739 -0.33 1.0 22.13 ? 50 A 1 +ATOM 1031 H HB3 . GLU A1 1 60 ? -8.344 17.898 -0.302 1.0 22.13 ? 50 A 1 +ATOM 1032 H HG2 . GLU A1 1 60 ? -8.165 17.622 1.969 1.0 26.17 ? 50 A 1 +ATOM 1033 H HG3 . GLU A1 1 60 ? -6.757 18.359 1.971 1.0 26.17 ? 50 A 1 +ATOM 1034 N N . VAL A1 1 61 ? -7.552 15.188 -1.769 1.0 16.05 ? 51 A 1 +ATOM 1035 C CA . VAL A1 1 61 ? -7.91 14.736 -3.122 1.0 15.57 ? 51 A 1 +ATOM 1036 C C . VAL A1 1 61 ? -9.352 15.161 -3.33 1.0 15.54 ? 51 A 1 +ATOM 1037 O O . VAL A1 1 61 ? -10.256 14.697 -2.636 1.0 16.9 ? 51 A 1 +ATOM 1038 C CB . VAL A1 1 61 ? -7.746 13.233 -3.285 1.0 15.31 ? 51 A 1 +ATOM 1039 C CG1 . VAL A1 1 61 ? -8.214 12.773 -4.652 1.0 15.4 ? 51 A 1 +ATOM 1040 C CG2 . VAL A1 1 61 ? -6.288 12.856 -3.117 1.0 16.48 ? 51 A 1 +ATOM 1041 H H . VAL A1 1 61 ? -7.903 14.712 -1.145 1.0 19.27 ? 51 A 1 +ATOM 1042 H HA . VAL A1 1 61 ? -7.344 15.166 -3.782 1.0 18.68 ? 51 A 1 +ATOM 1043 H HB . VAL A1 1 61 ? -8.285 12.794 -2.608 1.0 18.37 ? 51 A 1 +ATOM 1044 H HG11 . VAL A1 1 61 ? -7.971 11.842 -4.773 1.0 18.49 ? 51 A 1 +ATOM 1045 H HG12 . VAL A1 1 61 ? -9.178 12.873 -4.706 1.0 18.49 ? 51 A 1 +ATOM 1046 H HG13 . VAL A1 1 61 ? -7.787 13.318 -5.332 1.0 18.49 ? 51 A 1 +ATOM 1047 H HG21 . VAL A1 1 61 ? -6.193 11.899 -3.239 1.0 19.78 ? 51 A 1 +ATOM 1048 H HG22 . VAL A1 1 61 ? -5.761 13.328 -3.781 1.0 19.78 ? 51 A 1 +ATOM 1049 H HG23 . VAL A1 1 61 ? -5.997 13.106 -2.226 1.0 19.78 ? 51 A 1 +ATOM 1050 N N . HIS A1 1 62 ? -9.57 16.114 -4.23 1.0 15.21 ? 52 A 1 +ATOM 1051 C CA . HIS A1 1 62 ? -10.896 16.673 -4.453 1.0 15.01 ? 52 A 1 +ATOM 1052 C C . HIS A1 1 62 ? -11.749 15.764 -5.302 1.0 14.07 ? 52 A 1 +ATOM 1053 O O . HIS A1 1 62 ? -11.274 15.264 -6.337 1.0 15.69 ? 52 A 1 +ATOM 1054 C CB . HIS A1 1 62 ? -10.797 18.072 -5.051 1.0 14.57 ? 52 A 1 +ATOM 1055 C CG . HIS A1 1 62 ? -10.071 18.999 -4.143 1.0 15.99 ? 52 A 1 +ATOM 1056 N ND1 . HIS A1 1 62 ? -10.636 19.419 -2.972 1.0 17.59 ? 52 A 1 +ATOM 1057 C CD2 . HIS A1 1 62 ? -8.804 19.463 -4.162 1.0 18.68 ? 52 A 1 +ATOM 1058 C CE1 . HIS A1 1 62 ? -9.75 20.153 -2.314 1.0 18.36 ? 52 A 1 +ATOM 1059 N NE2 . HIS A1 1 62 ? -8.634 20.193 -3.007 1.0 18.23 ? 52 A 1 +ATOM 1060 H H . HIS A1 1 62 ? -8.96 16.457 -4.729 1.0 18.25 ? 52 A 1 +ATOM 1061 H HA . HIS A1 1 62 ? -11.347 16.749 -3.598 1.0 18.02 ? 52 A 1 +ATOM 1062 H HB2 . HIS A1 1 62 ? -10.316 18.029 -5.892 1.0 17.49 ? 52 A 1 +ATOM 1063 H HB3 . HIS A1 1 62 ? -11.689 18.423 -5.196 1.0 17.49 ? 52 A 1 +ATOM 1064 H HD1 . HIS A1 1 62 ? -11.434 19.238 -2.707 1.0 21.1 ? 52 A 1 +ATOM 1065 H HD2 . HIS A1 1 62 ? -8.169 19.319 -4.826 1.0 22.41 ? 52 A 1 +ATOM 1066 H HE1 . HIS A1 1 62 ? -9.895 20.571 -1.496 1.0 22.03 ? 52 A 1 +ATOM 1067 N N . ILE A1 1 63 ? -12.971 15.558 -4.915 1.0 14.57 ? 53 A 1 +ATOM 1068 C CA . ILE A1 1 63 ? -13.892 14.681 -5.599 1.0 15.62 ? 53 A 1 +ATOM 1069 C C . ILE A1 1 63 ? -14.814 15.516 -6.456 1.0 14.65 ? 53 A 1 +ATOM 1070 O O . ILE A1 1 63 ? -15.549 16.372 -5.956 1.0 15.42 ? 53 A 1 +ATOM 1071 C CB . ILE A1 1 63 ? -14.677 13.834 -4.59 1.0 16.65 ? 53 A 1 +ATOM 1072 C CG1 . ILE A1 1 63 ? -13.721 12.902 -3.859 1.0 18.43 ? 53 A 1 +ATOM 1073 C CG2 . ILE A1 1 63 ? -15.783 13.06 -5.306 1.0 18.74 ? 53 A 1 +ATOM 1074 C CD1 . ILE A1 1 63 ? -14.348 12.183 -2.66 1.0 23.7 ? 53 A 1 +ATOM 1075 H H . ILE A1 1 63 ? -13.317 15.932 -4.223 1.0 17.49 ? 53 A 1 +ATOM 1076 H HA . ILE A1 1 63 ? -13.401 14.09 -6.192 1.0 18.75 ? 53 A 1 +ATOM 1077 H HB . ILE A1 1 63 ? -15.097 14.412 -3.934 1.0 19.98 ? 53 A 1 +ATOM 1078 H HG12 . ILE A1 1 63 ? -13.411 12.224 -4.48 1.0 22.12 ? 53 A 1 +ATOM 1079 H HG13 . ILE A1 1 63 ? -12.969 13.42 -3.532 1.0 22.12 ? 53 A 1 +ATOM 1080 H HG21 . ILE A1 1 63 ? -16.112 12.362 -4.718 1.0 22.49 ? 53 A 1 +ATOM 1081 H HG22 . ILE A1 1 63 ? -16.503 13.671 -5.529 1.0 22.49 ? 53 A 1 +ATOM 1082 H HG23 . ILE A1 1 63 ? -15.421 12.667 -6.116 1.0 22.49 ? 53 A 1 +ATOM 1083 H HD11 . ILE A1 1 63 ? -13.647 11.741 -2.156 1.0 28.45 ? 53 A 1 +ATOM 1084 H HD12 . ILE A1 1 63 ? -14.797 12.835 -2.101 1.0 28.45 ? 53 A 1 +ATOM 1085 H HD13 . ILE A1 1 63 ? -14.987 11.528 -2.983 1.0 28.45 ? 53 A 1 +ATOM 1086 N N . ARG A1 1 64 ? -14.864 15.233 -7.759 1.0 13.74 ? 54 A 1 +ATOM 1087 C CA . ARG A1 1 64 ? -15.715 15.929 -8.706 1.0 14.06 ? 54 A 1 +ATOM 1088 C C . ARG A1 1 64 ? -16.631 14.865 -9.303 1.0 15.32 ? 54 A 1 +ATOM 1089 O O . ARG A1 1 64 ? -16.172 14.059 -10.111 1.0 16.05 ? 54 A 1 +ATOM 1090 C CB . ARG A1 1 64 ? -14.91 16.621 -9.811 1.0 14.22 ? 54 A 1 +ATOM 1091 C CG . ARG A1 1 64 ? -13.536 17.177 -9.427 1.0 14.19 ? 54 A 1 +ATOM 1092 C CD . ARG A1 1 64 ? -13.563 18.305 -8.535 1.0 15.96 ? 54 A 1 +ATOM 1093 N NE . ARG A1 1 64 ? -12.312 19.099 -8.562 1.0 14.64 ? 54 A 1 +ATOM 1094 C CZ . ARG A1 1 64 ? -12.036 20.079 -7.743 1.0 15.52 ? 54 A 1 +ATOM 1095 N NH1 . ARG A1 1 64 ? -12.756 20.306 -6.682 1.0 16.26 ? 54 A 1 +ATOM 1096 N NH2 . ARG A1 1 64 ? -10.973 20.848 -7.994 1.0 17.69 ? 54 A 1 +ATOM 1097 H H . ARG A1 1 64 ? -14.392 14.615 -8.127 1.0 16.49 ? 54 A 1 +ATOM 1098 H HA . ARG A1 1 64 ? -16.228 16.615 -8.25 1.0 16.87 ? 54 A 1 +ATOM 1099 H HB2 . ARG A1 1 64 ? -14.765 15.978 -10.522 1.0 17.06 ? 54 A 1 +ATOM 1100 H HB3 . ARG A1 1 64 ? -15.434 17.368 -10.14 1.0 17.06 ? 54 A 1 +ATOM 1101 H HG2 . ARG A1 1 64 ? -13.03 16.474 -8.99 1.0 17.03 ? 54 A 1 +ATOM 1102 H HG3 . ARG A1 1 64 ? -13.081 17.458 -10.236 1.0 17.03 ? 54 A 1 +ATOM 1103 H HD2 . ARG A1 1 64 ? -14.293 18.89 -8.791 1.0 19.15 ? 54 A 1 +ATOM 1104 H HD3 . ARG A1 1 64 ? -13.694 17.986 -7.629 1.0 19.15 ? 54 A 1 +ATOM 1105 H HE . ARG A1 1 64 ? -11.726 18.9 -9.159 1.0 17.57 ? 54 A 1 +ATOM 1106 H HH11 . ARG A1 1 64 ? -13.432 19.804 -6.505 1.0 19.52 ? 54 A 1 +ATOM 1107 H HH12 . ARG A1 1 64 ? -12.556 20.957 -6.157 1.0 19.52 ? 54 A 1 +ATOM 1108 H HH21 . ARG A1 1 64 ? -10.483 20.693 -8.684 1.0 21.23 ? 54 A 1 +ATOM 1109 H HH22 . ARG A1 1 64 ? -10.777 21.497 -7.465 1.0 21.23 ? 54 A 1 +ATOM 1110 N N . ALA A1 1 65 ? -17.913 14.844 -8.946 1.0 13.32 ? 55 A 1 +ATOM 1111 C CA . ALA A1 1 65 ? -18.782 13.797 -9.436 1.0 12.77 ? 55 A 1 +ATOM 1112 C C . ALA A1 1 65 ? -19.308 14.164 -10.816 1.0 13.03 ? 55 A 1 +ATOM 1113 O O . ALA A1 1 65 ? -19.921 15.212 -10.995 1.0 14.51 ? 55 A 1 +ATOM 1114 C CB . ALA A1 1 65 ? -19.985 13.614 -8.513 1.0 14.49 ? 55 A 1 +ATOM 1115 H H . ALA A1 1 65 ? -18.29 15.418 -8.429 1.0 15.98 ? 55 A 1 +ATOM 1116 H HA . ALA A1 1 65 ? -18.275 12.972 -9.477 1.0 15.32 ? 55 A 1 +ATOM 1117 H HB1 . ALA A1 1 65 ? -20.553 12.912 -8.868 1.0 17.39 ? 55 A 1 +ATOM 1118 H HB2 . ALA A1 1 65 ? -19.671 13.369 -7.629 1.0 17.39 ? 55 A 1 +ATOM 1119 H HB3 . ALA A1 1 65 ? -20.479 14.448 -8.469 1.0 17.39 ? 55 A 1 +ATOM 1120 N N . ILE A1 1 66 ? -19.101 13.267 -11.784 1.0 12.92 ? 56 A 1 +ATOM 1121 C CA . ILE A1 1 66 ? -19.465 13.543 -13.181 1.0 13.41 ? 56 A 1 +ATOM 1122 C C . ILE A1 1 66 ? -20.821 12.951 -13.497 1.0 13.42 ? 56 A 1 +ATOM 1123 O O . ILE A1 1 66 ? -21.05 11.755 -13.264 1.0 15.24 ? 56 A 1 +ATOM 1124 C CB . ILE A1 1 66 ? -18.462 12.963 -14.178 1.0 12.74 ? 56 A 1 +ATOM 1125 C CG1 . ILE A1 1 66 ? -17.015 13.342 -13.906 1.0 15.18 ? 56 A 1 +ATOM 1126 C CG2 . ILE A1 1 66 ? -18.776 13.479 -15.609 1.0 15.31 ? 56 A 1 +ATOM 1127 C CD1 A ILE A1 1 66 ? -16.062 12.47 -14.761 0.85 15.32 ? 56 A 1 +ATOM 1128 H H . ILE A1 1 66 ? -18.751 12.491 -11.657 1.0 15.5 ? 56 A 1 +ATOM 1129 H HA . ILE A1 1 66 ? -19.497 14.509 -13.261 1.0 16.09 ? 56 A 1 +ATOM 1130 H HB . ILE A1 1 66 ? -18.557 12.002 -14.085 1.0 15.29 ? 56 A 1 +ATOM 1131 H HG12 A ILE A1 1 66 ? -16.874 14.273 -14.136 0.85 18.21 ? 56 A 1 +ATOM 1132 H HG13 A ILE A1 1 66 ? -16.812 13.197 -12.968 0.85 18.21 ? 56 A 1 +ATOM 1133 H HG21 . ILE A1 1 66 ? -18.137 13.096 -16.23 1.0 18.37 ? 56 A 1 +ATOM 1134 H HG22 . ILE A1 1 66 ? -19.676 13.209 -15.852 1.0 18.37 ? 56 A 1 +ATOM 1135 H HG23 . ILE A1 1 66 ? -18.707 14.447 -15.618 1.0 18.37 ? 56 A 1 +ATOM 1136 H HD11 A ILE A1 1 66 ? -15.307 12.2 -14.215 0.85 18.39 ? 56 A 1 +ATOM 1137 H HD12 A ILE A1 1 66 ? -16.544 11.686 -15.07 0.85 18.39 ? 56 A 1 +ATOM 1138 H HD13 A ILE A1 1 66 ? -15.754 12.989 -15.519 0.85 18.39 ? 56 A 1 +ATOM 1139 N N . ILE A1 1 67 ? -21.702 13.758 -14.059 1.0 12.78 ? 57 A 1 +ATOM 1140 C CA . ILE A1 1 67 ? -22.939 13.263 -14.644 1.0 12.95 ? 57 A 1 +ATOM 1141 C C . ILE A1 1 67 ? -22.849 13.529 -16.146 1.0 12.34 ? 57 A 1 +ATOM 1142 O O . ILE A1 1 67 ? -22.806 14.68 -16.586 1.0 12.7 ? 57 A 1 +ATOM 1143 C CB . ILE A1 1 67 ? -24.178 13.923 -14.024 1.0 13.42 ? 57 A 1 +ATOM 1144 C CG1 . ILE A1 1 67 ? -24.214 13.719 -12.525 1.0 14.6 ? 57 A 1 +ATOM 1145 C CG2 . ILE A1 1 67 ? -25.457 13.381 -14.681 1.0 14.97 ? 57 A 1 +ATOM 1146 C CD1 . ILE A1 1 67 ? -25.276 14.53 -11.811 1.0 16.1 ? 57 A 1 +ATOM 1147 H H . ILE A1 1 67 ? -21.606 14.611 -14.116 1.0 15.33 ? 57 A 1 +ATOM 1148 H HA . ILE A1 1 67 ? -23.012 12.306 -14.499 1.0 15.54 ? 57 A 1 +ATOM 1149 H HB . ILE A1 1 67 ? -24.124 14.877 -14.19 1.0 16.11 ? 57 A 1 +ATOM 1150 H HG12 . ILE A1 1 67 ? -24.39 12.782 -12.344 1.0 17.52 ? 57 A 1 +ATOM 1151 H HG13 . ILE A1 1 67 ? -23.354 13.972 -12.156 1.0 17.52 ? 57 A 1 +ATOM 1152 H HG21 . ILE A1 1 67 ? -26.228 13.792 -14.259 1.0 17.97 ? 57 A 1 +ATOM 1153 H HG22 . ILE A1 1 67 ? -25.443 13.599 -15.626 1.0 17.97 ? 57 A 1 +ATOM 1154 H HG23 . ILE A1 1 67 ? -25.489 12.419 -14.564 1.0 17.97 ? 57 A 1 +ATOM 1155 H HD11 . ILE A1 1 67 ? -25.146 14.446 -10.853 1.0 19.32 ? 57 A 1 +ATOM 1156 H HD12 . ILE A1 1 67 ? -25.195 15.459 -12.076 1.0 19.32 ? 57 A 1 +ATOM 1157 H HD13 . ILE A1 1 67 ? -26.151 14.191 -12.057 1.0 19.32 ? 57 A 1 +ATOM 1158 N N . GLU A1 1 68 ? -22.798 12.428 -16.918 1.0 12.47 ? 58 A 1 +ATOM 1159 C CA . GLU A1 1 68 ? -22.657 12.474 -18.382 1.0 12.62 ? 58 A 1 +ATOM 1160 C C . GLU A1 1 68 ? -24.074 12.393 -18.906 1.0 13.28 ? 58 A 1 +ATOM 1161 O O . GLU A1 1 68 ? -24.66 11.313 -19.023 1.0 14.3 ? 58 A 1 +ATOM 1162 C CB . GLU A1 1 68 ? -21.792 11.303 -18.837 1.0 13.32 ? 58 A 1 +ATOM 1163 C CG . GLU A1 1 68 ? -20.412 11.298 -18.23 1.0 14.9 ? 58 A 1 +ATOM 1164 C CD . GLU A1 1 68 ? -19.738 9.951 -18.162 1.0 17.79 ? 58 A 1 +ATOM 1165 O OE1 . GLU A1 1 68 ? -20.491 8.966 -17.981 1.0 19.87 ? 58 A 1 +ATOM 1166 O OE2 . GLU A1 1 68 ? -18.487 9.944 -18.049 1.0 18.94 ? 58 A 1 +ATOM 1167 H H . GLU A1 1 68 ? -22.844 11.627 -16.608 1.0 14.96 ? 58 A 1 +ATOM 1168 H HA . GLU A1 1 68 ? -22.239 13.291 -18.696 1.0 15.15 ? 58 A 1 +ATOM 1169 H HB2 . GLU A1 1 68 ? -22.23 10.475 -18.586 1.0 15.98 ? 58 A 1 +ATOM 1170 H HB3 . GLU A1 1 68 ? -21.692 11.346 -19.801 1.0 15.98 ? 58 A 1 +ATOM 1171 H HG2 . GLU A1 1 68 ? -19.843 11.879 -18.76 1.0 17.88 ? 58 A 1 +ATOM 1172 H HG3 . GLU A1 1 68 ? -20.476 11.635 -17.323 1.0 17.88 ? 58 A 1 +ATOM 1173 N N . PHE A1 1 69 ? -24.691 13.545 -19.114 1.0 13.59 ? 59 A 1 +ATOM 1174 C CA . PHE A1 1 69 ? -26.146 13.591 -19.161 1.0 13.32 ? 59 A 1 +ATOM 1175 C C . PHE A1 1 69 ? -26.756 13.395 -20.548 1.0 14.8 ? 59 A 1 +ATOM 1176 O O . PHE A1 1 69 ? -27.969 13.26 -20.668 1.0 14.31 ? 59 A 1 +ATOM 1177 C CB . PHE A1 1 69 ? -26.647 14.897 -18.494 1.0 13.66 ? 59 A 1 +ATOM 1178 C CG . PHE A1 1 69 ? -26.21 16.139 -19.191 1.0 13.82 ? 59 A 1 +ATOM 1179 C CD1 . PHE A1 1 69 ? -26.938 16.651 -20.262 1.0 14.13 ? 59 A 1 +ATOM 1180 C CD2 . PHE A1 1 69 ? -25.066 16.807 -18.809 1.0 14.64 ? 59 A 1 +ATOM 1181 C CE1 . PHE A1 1 69 ? -26.536 17.782 -20.91 1.0 14.31 ? 59 A 1 +ATOM 1182 C CE2 . PHE A1 1 69 ? -24.62 17.961 -19.457 1.0 13.27 ? 59 A 1 +ATOM 1183 C CZ . PHE A1 1 69 ? -25.381 18.43 -20.536 1.0 14.08 ? 59 A 1 +ATOM 1184 H H . PHE A1 1 69 ? -24.298 14.301 -19.23 1.0 16.31 ? 59 A 1 +ATOM 1185 H HA . PHE A1 1 69 ? -26.492 12.85 -18.639 1.0 15.99 ? 59 A 1 +ATOM 1186 H HB2 . PHE A1 1 69 ? -27.617 14.89 -18.486 1.0 16.39 ? 59 A 1 +ATOM 1187 H HB3 . PHE A1 1 69 ? -26.308 14.933 -17.586 1.0 16.39 ? 59 A 1 +ATOM 1188 H HD1 . PHE A1 1 69 ? -27.71 16.214 -20.54 1.0 16.96 ? 59 A 1 +ATOM 1189 H HD2 . PHE A1 1 69 ? -24.572 16.477 -18.093 1.0 17.57 ? 59 A 1 +ATOM 1190 H HE1 . PHE A1 1 69 ? -27.047 18.118 -21.61 1.0 17.18 ? 59 A 1 +ATOM 1191 H HE2 . PHE A1 1 69 ? -23.849 18.402 -19.183 1.0 15.93 ? 59 A 1 +ATOM 1192 H HZ . PHE A1 1 69 ? -25.104 19.184 -21.004 1.0 16.9 ? 59 A 1 +ATOM 1193 N N . SER A1 1 70 ? -25.925 13.436 -21.582 1.0 13.09 ? 60 A 1 +ATOM 1194 C CA . SER A1 1 70 ? -26.361 13.144 -22.946 1.0 13.3 ? 60 A 1 +ATOM 1195 C C . SER A1 1 70 ? -25.158 12.637 -23.702 1.0 12.5 ? 60 A 1 +ATOM 1196 O O . SER A1 1 70 ? -24.081 13.193 -23.58 1.0 13.47 ? 60 A 1 +ATOM 1197 C CB . SER A1 1 70 ? -26.885 14.432 -23.59 1.0 14.06 ? 60 A 1 +ATOM 1198 O OG . SER A1 1 70 ? -27.043 14.124 -25.006 1.0 14.73 ? 60 A 1 +ATOM 1199 H H . SER A1 1 70 ? -25.09 13.632 -21.522 1.0 15.7 ? 60 A 1 +ATOM 1200 H HA . SER A1 1 70 ? -27.055 12.467 -22.972 1.0 15.96 ? 60 A 1 +ATOM 1201 H HB2 . SER A1 1 70 ? -27.739 14.679 -23.202 1.0 16.87 ? 60 A 1 +ATOM 1202 H HB3 . SER A1 1 70 ? -26.246 15.152 -23.472 1.0 16.87 ? 60 A 1 +ATOM 1203 H HG . SER A1 1 70 ? -27.364 14.787 -25.409 1.0 17.68 ? 60 A 1 +ATOM 1204 N N . ASN A1 1 71 ? -25.354 11.615 -24.537 1.0 13.69 ? 61 A 1 +ATOM 1205 C CA . ASN A1 1 71 ? -24.301 11.149 -25.432 1.0 13.71 ? 61 A 1 +ATOM 1206 C C . ASN A1 1 71 ? -24.58 11.547 -26.874 1.0 14.61 ? 61 A 1 +ATOM 1207 O O . ASN A1 1 71 ? -23.942 10.982 -27.778 1.0 15.31 ? 61 A 1 +ATOM 1208 C CB . ASN A1 1 71 ? -24.052 9.647 -25.319 1.0 14.01 ? 61 A 1 +ATOM 1209 C CG . ASN A1 1 71 ? -25.134 8.824 -25.912 1.0 13.41 ? 61 A 1 +ATOM 1210 O OD1 . ASN A1 1 71 ? -26.19 9.329 -26.239 1.0 14.99 ? 61 A 1 +ATOM 1211 N ND2 . ASN A1 1 71 ? -24.938 7.504 -25.97 1.0 14.08 ? 61 A 1 +ATOM 1212 H H . ASN A1 1 71 ? -26.091 11.176 -24.601 1.0 16.43 ? 61 A 1 +ATOM 1213 H HA . ASN A1 1 71 ? -23.473 11.569 -25.15 1.0 16.45 ? 61 A 1 +ATOM 1214 H HB2 . ASN A1 1 71 ? -23.227 9.43 -25.781 1.0 16.81 ? 61 A 1 +ATOM 1215 H HB3 . ASN A1 1 71 ? -23.979 9.41 -24.381 1.0 16.81 ? 61 A 1 +ATOM 1216 H HD21 . ASN A1 1 71 ? -25.542 6.993 -26.307 1.0 16.89 ? 61 A 1 +ATOM 1217 H HD22 . ASN A1 1 71 ? -24.206 7.164 -25.67 1.0 16.89 ? 61 A 1 +ATOM 1218 N N . VAL A1 1 72 ? -25.455 12.516 -27.09 1.0 14.06 ? 62 A 1 +ATOM 1219 C CA . VAL A1 1 72 ? -25.731 13.037 -28.434 1.0 13.63 ? 62 A 1 +ATOM 1220 C C . VAL A1 1 72 ? -24.651 14.054 -28.739 1.0 14.16 ? 62 A 1 +ATOM 1221 O O . VAL A1 1 72 ? -24.392 14.973 -27.956 1.0 14.75 ? 62 A 1 +ATOM 1222 C CB . VAL A1 1 72 ? -27.089 13.705 -28.427 1.0 15.04 ? 62 A 1 +ATOM 1223 C CG1 . VAL A1 1 72 ? -27.377 14.4 -29.763 1.0 15.76 ? 62 A 1 +ATOM 1224 C CG2 . VAL A1 1 72 ? -28.182 12.69 -28.137 1.0 17.41 ? 62 A 1 +ATOM 1225 H H . VAL A1 1 72 ? -25.912 12.9 -26.471 1.0 16.87 ? 62 A 1 +ATOM 1226 H HA . VAL A1 1 72 ? -25.719 12.331 -29.099 1.0 16.35 ? 62 A 1 +ATOM 1227 H HB . VAL A1 1 72 ? -27.085 14.378 -27.729 1.0 18.04 ? 62 A 1 +ATOM 1228 H HG11 . VAL A1 1 72 ? -28.306 14.677 -29.78 1.0 18.92 ? 62 A 1 +ATOM 1229 H HG12 . VAL A1 1 72 ? -26.799 15.174 -29.847 1.0 18.92 ? 62 A 1 +ATOM 1230 H HG13 . VAL A1 1 72 ? -27.203 13.777 -30.486 1.0 18.92 ? 62 A 1 +ATOM 1231 H HG21 . VAL A1 1 72 ? -29.046 13.108 -28.28 1.0 20.89 ? 62 A 1 +ATOM 1232 H HG22 . VAL A1 1 72 ? -28.078 11.934 -28.735 1.0 20.89 ? 62 A 1 +ATOM 1233 H HG23 . VAL A1 1 72 ? -28.104 12.397 -27.216 1.0 20.89 ? 62 A 1 +ATOM 1234 N N . CYS A1 1 73 ? -24.05 13.958 -29.939 1.0 14.41 ? 63 A 1 +ATOM 1235 C CA . CYS A1 1 73 ? -23.058 14.927 -30.335 1.0 15.16 ? 63 A 1 +ATOM 1236 C C . CYS A1 1 73 ? -23.191 15.293 -31.811 1.0 14.66 ? 63 A 1 +ATOM 1237 O O . CYS A1 1 73 ? -23.315 14.421 -32.684 1.0 15.26 ? 63 A 1 +ATOM 1238 C CB . CYS A1 1 73 ? -21.603 14.453 -30.095 1.0 15.02 ? 63 A 1 +ATOM 1239 S SG . CYS A1 1 73 ? -20.438 15.815 -30.213 1.0 14.48 ? 63 A 1 +ATOM 1240 H H . CYS A1 1 73 ? -24.209 13.344 -30.519 1.0 17.3 ? 63 A 1 +ATOM 1241 H HA . CYS A1 1 73 ? -23.228 15.717 -29.799 1.0 18.2 ? 63 A 1 +ATOM 1242 H HB2 . CYS A1 1 73 ? -21.535 14.067 -29.207 1.0 18.03 ? 63 A 1 +ATOM 1243 H HB3 . CYS A1 1 73 ? -21.368 13.79 -30.763 1.0 18.03 ? 63 A 1 +ATOM 1244 N N . ARG A1 1 74 ? -23.11 16.59 -32.083 1.0 14.8 ? 64 A 1 +ATOM 1245 C CA . ARG A1 1 74 ? -23.112 17.116 -33.441 1.0 14.81 ? 64 A 1 +ATOM 1246 C C . ARG A1 1 74 ? -21.765 17.0 -34.127 1.0 14.23 ? 64 A 1 +ATOM 1247 O O . ARG A1 1 74 ? -21.734 17.159 -35.365 1.0 15.88 ? 64 A 1 +ATOM 1248 C CB . ARG A1 1 74 ? -23.569 18.578 -33.425 1.0 15.63 ? 64 A 1 +ATOM 1249 C CG . ARG A1 1 74 ? -22.613 19.534 -32.785 1.0 15.45 ? 64 A 1 +ATOM 1250 C CD . ARG A1 1 74 ? -23.148 20.904 -32.679 1.0 16.92 ? 64 A 1 +ATOM 1251 N NE . ARG A1 1 74 ? -22.25 21.772 -31.947 1.0 16.51 ? 64 A 1 +ATOM 1252 C CZ . ARG A1 1 74 ? -22.364 23.092 -31.867 1.0 19.43 ? 64 A 1 +ATOM 1253 N NH1 . ARG A1 1 74 ? -23.37 23.744 -32.489 1.0 21.87 ? 64 A 1 +ATOM 1254 N NH2 . ARG A1 1 74 ? -21.43 23.778 -31.212 1.0 19.85 ? 64 A 1 +ATOM 1255 H H . ARG A1 1 74 ? -23.053 17.203 -31.482 1.0 17.76 ? 64 A 1 +ATOM 1256 H HA . ARG A1 1 74 ? -23.746 16.611 -33.973 1.0 17.78 ? 64 A 1 +ATOM 1257 H HB2 . ARG A1 1 74 ? -23.699 18.868 -34.342 1.0 18.75 ? 64 A 1 +ATOM 1258 H HB3 . ARG A1 1 74 ? -24.405 18.632 -32.937 1.0 18.75 ? 64 A 1 +ATOM 1259 H HG2 . ARG A1 1 74 ? -22.41 19.224 -31.888 1.0 18.54 ? 64 A 1 +ATOM 1260 H HG3 . ARG A1 1 74 ? -21.801 19.571 -33.314 1.0 18.54 ? 64 A 1 +ATOM 1261 H HD2 . ARG A1 1 74 ? -23.268 21.271 -33.569 1.0 20.3 ? 64 A 1 +ATOM 1262 H HD3 . ARG A1 1 74 ? -23.998 20.881 -32.213 1.0 20.3 ? 64 A 1 +ATOM 1263 H HE . ARG A1 1 74 ? -21.592 21.405 -31.532 1.0 19.81 ? 64 A 1 +ATOM 1264 H HH11 . ARG A1 1 74 ? -23.95 23.304 -32.946 1.0 26.24 ? 64 A 1 +ATOM 1265 H HH12 . ARG A1 1 74 ? -23.43 24.6 -32.427 1.0 26.24 ? 64 A 1 +ATOM 1266 H HH21 . ARG A1 1 74 ? -20.769 23.365 -30.849 1.0 23.83 ? 64 A 1 +ATOM 1267 H HH22 . ARG A1 1 74 ? -21.489 24.633 -31.15 1.0 23.83 ? 64 A 1 +ATOM 1268 N N . LYS A1 1 75 ? -20.685 16.745 -33.422 1.0 14.49 ? 65 A 1 +ATOM 1269 C CA . LYS A1 1 75 ? -19.337 16.659 -33.993 1.0 15.88 ? 65 A 1 +ATOM 1270 C C . LYS A1 1 75 ? -18.981 15.206 -34.331 1.0 14.27 ? 65 A 1 +ATOM 1271 O O . LYS A1 1 75 ? -19.759 14.266 -34.097 1.0 15.73 ? 65 A 1 +ATOM 1272 C CB . LYS A1 1 75 ? -18.311 17.31 -33.064 1.0 15.35 ? 65 A 1 +ATOM 1273 C CG . LYS A1 1 75 ? -18.335 18.848 -33.196 1.0 16.35 ? 65 A 1 +ATOM 1274 C CD . LYS A1 1 75 ? -17.259 19.462 -32.282 1.0 16.49 ? 65 A 1 +ATOM 1275 C CE . LYS A1 1 75 ? -16.984 20.949 -32.582 1.0 17.47 ? 65 A 1 +ATOM 1276 N NZ . LYS A1 1 75 ? -18.213 21.791 -32.602 1.0 17.59 ? 65 A 1 +ATOM 1277 H H . LYS A1 1 75 ? -20.695 16.612 -32.573 1.0 17.39 ? 65 A 1 +ATOM 1278 H HA . LYS A1 1 75 ? -19.307 17.153 -34.827 1.0 19.06 ? 65 A 1 +ATOM 1279 H HB2 . LYS A1 1 75 ? -18.516 17.077 -32.145 1.0 18.42 ? 65 A 1 +ATOM 1280 H HB3 . LYS A1 1 75 ? -17.423 16.996 -33.295 1.0 18.42 ? 65 A 1 +ATOM 1281 H HG2 . LYS A1 1 75 ? -18.149 19.102 -34.113 1.0 19.62 ? 65 A 1 +ATOM 1282 H HG3 . LYS A1 1 75 ? -19.204 19.187 -32.928 1.0 19.62 ? 65 A 1 +ATOM 1283 H HD2 . LYS A1 1 75 ? -17.552 19.394 -31.36 1.0 19.78 ? 65 A 1 +ATOM 1284 H HD3 . LYS A1 1 75 ? -16.428 18.976 -32.403 1.0 19.78 ? 65 A 1 +ATOM 1285 H HE2 . LYS A1 1 75 ? -16.394 21.302 -31.898 1.0 20.97 ? 65 A 1 +ATOM 1286 H HE3 . LYS A1 1 75 ? -16.563 21.02 -33.453 1.0 20.97 ? 65 A 1 +ATOM 1287 H HZ1 . LYS A1 1 75 ? -18.001 22.635 -32.788 1.0 21.11 ? 65 A 1 +ATOM 1288 H HZ2 . LYS A1 1 75 ? -18.778 21.492 -33.221 1.0 21.11 ? 65 A 1 +ATOM 1289 H HZ3 . LYS A1 1 75 ? -18.614 21.763 -31.807 1.0 21.11 ? 65 A 1 +ATOM 1290 N N . ASN A1 1 76 ? -17.843 15.057 -34.982 1.0 15.29 ? 66 A 1 +ATOM 1291 C CA . ASN A1 1 76 ? -17.449 13.775 -35.579 1.0 15.71 ? 66 A 1 +ATOM 1292 C C . ASN A1 1 76 ? -15.965 13.479 -35.321 1.0 14.93 ? 66 A 1 +ATOM 1293 O O . ASN A1 1 76 ? -15.285 12.912 -36.193 1.0 15.97 ? 66 A 1 +ATOM 1294 C CB . ASN A1 1 76 ? -17.732 13.816 -37.091 1.0 15.52 ? 66 A 1 +ATOM 1295 C CG . ASN A1 1 76 ? -18.064 12.449 -37.697 1.0 16.48 ? 66 A 1 +ATOM 1296 O OD1 . ASN A1 1 76 ? -18.525 11.543 -37.025 1.0 16.62 ? 66 A 1 +ATOM 1297 N ND2 . ASN A1 1 76 ? -17.797 12.305 -38.977 1.0 18.35 ? 66 A 1 +ATOM 1298 H H . ASN A1 1 76 ? -17.269 15.687 -35.098 1.0 18.34 ? 66 A 1 +ATOM 1299 H HA . ASN A1 1 76 ? -17.955 13.058 -35.166 1.0 18.85 ? 66 A 1 +ATOM 1300 H HB2 . ASN A1 1 76 ? -18.488 14.402 -37.251 1.0 18.62 ? 66 A 1 +ATOM 1301 H HB3 . ASN A1 1 76 ? -16.946 14.158 -37.546 1.0 18.62 ? 66 A 1 +ATOM 1302 H HD21 . ASN A1 1 76 ? -17.963 11.558 -39.37 1.0 22.02 ? 66 A 1 +ATOM 1303 H HD22 . ASN A1 1 76 ? -17.456 12.958 -39.421 1.0 22.02 ? 66 A 1 +ATOM 1304 N N . CYS A1 1 77 ? -15.457 13.838 -34.14 1.0 14.33 ? 67 A 1 +ATOM 1305 C CA . CYS A1 1 77 ? -14.054 13.619 -33.832 1.0 13.89 ? 67 A 1 +ATOM 1306 C C . CYS A1 1 77 ? -13.665 12.175 -34.108 1.0 14.31 ? 67 A 1 +ATOM 1307 O O . CYS A1 1 77 ? -14.381 11.248 -33.721 1.0 15.41 ? 67 A 1 +ATOM 1308 C CB . CYS A1 1 77 ? -13.769 13.993 -32.387 1.0 13.78 ? 67 A 1 +ATOM 1309 S SG . CYS A1 1 77 ? -14.334 15.672 -31.912 1.0 15.24 ? 67 A 1 +ATOM 1310 H H . CYS A1 1 77 ? -15.906 14.207 -33.506 1.0 17.19 ? 67 A 1 +ATOM 1311 H HA . CYS A1 1 77 ? -13.505 14.186 -34.395 1.0 16.67 ? 67 A 1 +ATOM 1312 H HB2 . CYS A1 1 77 ? -14.219 13.358 -31.809 1.0 16.54 ? 67 A 1 +ATOM 1313 H HB3 . CYS A1 1 77 ? -12.811 13.954 -32.241 1.0 16.54 ? 67 A 1 +ATOM 1314 N N . LEU A1 1 78 ? -12.509 11.989 -34.738 1.0 14.47 ? 68 A 1 +ATOM 1315 C CA . LEU A1 1 78 ? -12.139 10.668 -35.238 1.0 15.23 ? 68 A 1 +ATOM 1316 C C . LEU A1 1 78 ? -11.861 9.688 -34.124 1.0 15.3 ? 68 A 1 +ATOM 1317 O O . LEU A1 1 78 ? -11.983 8.489 -34.319 1.0 15.55 ? 68 A 1 +ATOM 1318 C CB . LEU A1 1 78 ? -10.916 10.73 -36.172 1.0 15.24 ? 68 A 1 +ATOM 1319 C CG . LEU A1 1 78 ? -11.251 10.982 -37.646 1.0 18.47 ? 68 A 1 +ATOM 1320 C CD1 . LEU A1 1 78 ? -11.939 12.314 -37.89 1.0 20.04 ? 68 A 1 +ATOM 1321 C CD2 . LEU A1 1 78 ? -10.004 10.867 -38.518 1.0 18.49 ? 68 A 1 +ATOM 1322 H H . LEU A1 1 78 ? -11.927 12.603 -34.889 1.0 17.37 ? 68 A 1 +ATOM 1323 H HA . LEU A1 1 78 ? -12.894 10.348 -35.756 1.0 18.28 ? 68 A 1 +ATOM 1324 H HB2 . LEU A1 1 78 ? -10.339 11.45 -35.875 1.0 18.29 ? 68 A 1 +ATOM 1325 H HB3 . LEU A1 1 78 ? -10.445 9.884 -36.119 1.0 18.29 ? 68 A 1 +ATOM 1326 H HG . LEU A1 1 78 ? -11.885 10.295 -37.906 1.0 22.16 ? 68 A 1 +ATOM 1327 H HD11 . LEU A1 1 78 ? -12.12 12.407 -38.838 1.0 24.05 ? 68 A 1 +ATOM 1328 H HD12 . LEU A1 1 78 ? -12.77 12.337 -37.39 1.0 24.05 ? 68 A 1 +ATOM 1329 H HD13 . LEU A1 1 78 ? -11.355 13.03 -37.593 1.0 24.05 ? 68 A 1 +ATOM 1330 H HD21 . LEU A1 1 78 ? -10.252 11.015 -39.444 1.0 22.19 ? 68 A 1 +ATOM 1331 H HD22 . LEU A1 1 78 ? -9.36 11.535 -38.237 1.0 22.19 ? 68 A 1 +ATOM 1332 H HD23 . LEU A1 1 78 ? -9.627 9.979 -38.414 1.0 22.19 ? 68 A 1 +ATOM 1333 N N . TYR A1 1 79 ? -11.476 10.172 -32.961 1.0 14.81 ? 69 A 1 +ATOM 1334 C CA . TYR A1 1 79 ? -11.12 9.296 -31.835 1.0 14.2 ? 69 A 1 +ATOM 1335 C C . TYR A1 1 79 ? -12.317 8.868 -31.001 1.0 14.35 ? 69 A 1 +ATOM 1336 O O . TYR A1 1 79 ? -12.185 7.929 -30.166 1.0 14.68 ? 69 A 1 +ATOM 1337 C CB . TYR A1 1 79 ? -10.05 9.971 -30.967 1.0 14.19 ? 69 A 1 +ATOM 1338 C CG . TYR A1 1 79 ? -10.389 11.418 -30.619 1.0 13.33 ? 69 A 1 +ATOM 1339 C CD1 . TYR A1 1 79 ? -11.264 11.756 -29.596 1.0 14.16 ? 69 A 1 +ATOM 1340 C CD2 . TYR A1 1 79 ? -9.779 12.463 -31.305 1.0 13.87 ? 69 A 1 +ATOM 1341 C CE1 . TYR A1 1 79 ? -11.557 13.099 -29.308 1.0 13.38 ? 69 A 1 +ATOM 1342 C CE2 . TYR A1 1 79 ? -10.066 13.749 -31.021 1.0 15.1 ? 69 A 1 +ATOM 1343 C CZ . TYR A1 1 79 ? -10.934 14.087 -30.037 1.0 14.55 ? 69 A 1 +ATOM 1344 O OH . TYR A1 1 79 ? -11.175 15.447 -29.804 1.0 16.65 ? 69 A 1 +ATOM 1345 H H . TYR A1 1 79 ? -11.409 11.011 -32.785 1.0 17.78 ? 69 A 1 +ATOM 1346 H HA . TYR A1 1 79 ? -10.726 8.478 -32.176 1.0 17.04 ? 69 A 1 +ATOM 1347 H HB2 . TYR A1 1 79 ? -9.96 9.477 -30.137 1.0 17.03 ? 69 A 1 +ATOM 1348 H HB3 . TYR A1 1 79 ? -9.208 9.969 -31.448 1.0 17.03 ? 69 A 1 +ATOM 1349 H HD1 . TYR A1 1 79 ? -11.663 11.083 -29.093 1.0 16.99 ? 69 A 1 +ATOM 1350 H HD2 . TYR A1 1 79 ? -9.161 12.271 -31.974 1.0 16.64 ? 69 A 1 +ATOM 1351 H HE1 . TYR A1 1 79 ? -12.162 13.318 -28.636 1.0 16.05 ? 69 A 1 +ATOM 1352 H HE2 . TYR A1 1 79 ? -9.656 14.423 -31.513 1.0 18.12 ? 69 A 1 +ATOM 1353 H HH . TYR A1 1 79 ? -11.772 15.537 -29.221 1.0 19.98 ? 69 A 1 +ATOM 1354 N N . CYS A1 1 80 ? -13.44 9.558 -31.052 1.0 13.93 ? 70 A 1 +ATOM 1355 C CA . CYS A1 1 80 ? -14.444 9.474 -29.999 1.0 13.99 ? 70 A 1 +ATOM 1356 C C . CYS A1 1 80 ? -15.599 8.564 -30.367 1.0 12.82 ? 70 A 1 +ATOM 1357 O O . CYS A1 1 80 ? -16.193 8.71 -31.427 1.0 14.65 ? 70 A 1 +ATOM 1358 C CB . CYS A1 1 80 ? -14.962 10.878 -29.743 1.0 14.33 ? 70 A 1 +ATOM 1359 S SG . CYS A1 1 80 ? -16.178 10.968 -28.388 1.0 14.41 ? 70 A 1 +ATOM 1360 H H . CYS A1 1 80 ? -13.651 10.09 -31.694 1.0 16.72 ? 70 A 1 +ATOM 1361 H HA . CYS A1 1 80 ? -14.046 9.085 -29.204 1.0 16.79 ? 70 A 1 +ATOM 1362 H HB2 . CYS A1 1 80 ? -14.213 11.45 -29.509 1.0 17.19 ? 70 A 1 +ATOM 1363 H HB3 . CYS A1 1 80 ? -15.39 11.205 -30.549 1.0 17.19 ? 70 A 1 +ATOM 1364 N N . GLY A1 1 81 ? -15.978 7.649 -29.451 1.0 13.51 ? 71 A 1 +ATOM 1365 C CA . GLY A1 1 81 ? -17.103 6.788 -29.705 1.0 14.64 ? 71 A 1 +ATOM 1366 C C . GLY A1 1 81 ? -18.435 7.519 -29.861 1.0 14.03 ? 71 A 1 +ATOM 1367 O O . GLY A1 1 81 ? -19.379 6.932 -30.411 1.0 16.44 ? 71 A 1 +ATOM 1368 H H . GLY A1 1 81 ? -15.593 7.525 -28.692 1.0 16.21 ? 71 A 1 +ATOM 1369 H HA2 . GLY A1 1 81 ? -16.939 6.291 -30.522 1.0 17.57 ? 71 A 1 +ATOM 1370 H HA3 . GLY A1 1 81 ? -17.191 6.163 -28.968 1.0 17.57 ? 71 A 1 +ATOM 1371 N N . LEU A1 1 82 ? -18.542 8.764 -29.372 1.0 13.94 ? 72 A 1 +ATOM 1372 C CA . LEU A1 1 82 ? -19.793 9.497 -29.512 1.0 14.29 ? 72 A 1 +ATOM 1373 C C . LEU A1 1 82 ? -19.908 10.238 -30.829 1.0 14.57 ? 72 A 1 +ATOM 1374 O O . LEU A1 1 82 ? -20.944 10.904 -31.084 1.0 15.22 ? 72 A 1 +ATOM 1375 C CB . LEU A1 1 82 ? -20.003 10.504 -28.368 1.0 13.53 ? 72 A 1 +ATOM 1376 C CG . LEU A1 1 82 ? -19.868 9.926 -26.962 1.0 17.76 ? 72 A 1 +ATOM 1377 C CD1 . LEU A1 1 82 ? -20.347 10.991 -25.926 1.0 15.96 ? 72 A 1 +ATOM 1378 C CD2 . LEU A1 1 82 ? -20.527 8.652 -26.782 1.0 20.61 ? 72 A 1 +ATOM 1379 H H . LEU A1 1 82 ? -17.914 9.189 -28.965 1.0 16.73 ? 72 A 1 +ATOM 1380 H HA . LEU A1 1 82 ? -20.505 8.841 -29.456 1.0 17.14 ? 72 A 1 +ATOM 1381 H HB2 . LEU A1 1 82 ? -19.343 11.209 -28.457 1.0 16.24 ? 72 A 1 +ATOM 1382 H HB3 . LEU A1 1 82 ? -20.896 10.873 -28.446 1.0 16.24 ? 72 A 1 +ATOM 1383 H HG . LEU A1 1 82 ? -18.932 9.724 -26.805 1.0 21.31 ? 72 A 1 +ATOM 1384 H HD11 . LEU A1 1 82 ? -20.244 10.631 -25.032 1.0 19.15 ? 72 A 1 +ATOM 1385 H HD12 . LEU A1 1 82 ? -19.808 11.792 -26.024 1.0 19.15 ? 72 A 1 +ATOM 1386 H HD13 . LEU A1 1 82 ? -21.279 11.198 -26.094 1.0 19.15 ? 72 A 1 +ATOM 1387 H HD21 . LEU A1 1 82 ? -20.551 8.439 -25.836 1.0 24.73 ? 72 A 1 +ATOM 1388 H HD22 . LEU A1 1 82 ? -21.431 8.712 -27.13 1.0 24.73 ? 72 A 1 +ATOM 1389 H HD23 . LEU A1 1 82 ? -20.032 7.97 -27.263 1.0 24.73 ? 72 A 1 +ATOM 1390 N N . ARG A1 1 83 ? -18.894 10.175 -31.672 1.0 13.87 ? 73 A 1 +ATOM 1391 C CA . ARG A1 1 83 ? -18.962 10.878 -32.945 1.0 14.47 ? 73 A 1 +ATOM 1392 C C . ARG A1 1 83 ? -20.258 10.555 -33.666 1.0 15.01 ? 73 A 1 +ATOM 1393 O O . ARG A1 1 83 ? -20.778 9.445 -33.618 1.0 15.17 ? 73 A 1 +ATOM 1394 C CB . ARG A1 1 83 ? -17.749 10.51 -33.799 1.0 14.25 ? 73 A 1 +ATOM 1395 C CG . ARG A1 1 83 ? -17.697 9.063 -34.302 1.0 15.26 ? 73 A 1 +ATOM 1396 C CD . ARG A1 1 83 ? -16.281 8.646 -34.728 1.0 14.85 ? 73 A 1 +ATOM 1397 N NE . ARG A1 1 83 ? -15.746 9.59 -35.684 1.0 15.74 ? 73 A 1 +ATOM 1398 C CZ . ARG A1 1 83 ? -15.89 9.532 -36.996 1.0 15.66 ? 73 A 1 +ATOM 1399 N NH1 . ARG A1 1 83 ? -16.485 8.512 -37.58 1.0 16.69 ? 73 A 1 +ATOM 1400 N NH2 . ARG A1 1 83 ? -15.342 10.484 -37.733 1.0 18.07 ? 73 A 1 +ATOM 1401 H H . ARG A1 1 83 ? -18.165 9.739 -31.536 1.0 16.64 ? 73 A 1 +ATOM 1402 H HA . ARG A1 1 83 ? -18.943 11.837 -32.797 1.0 17.37 ? 73 A 1 +ATOM 1403 H HB2 . ARG A1 1 83 ? -17.742 11.085 -34.58 1.0 17.1 ? 73 A 1 +ATOM 1404 H HB3 . ARG A1 1 83 ? -16.949 10.659 -33.271 1.0 17.1 ? 73 A 1 +ATOM 1405 H HG2 . ARG A1 1 83 ? -17.986 8.469 -33.591 1.0 18.31 ? 73 A 1 +ATOM 1406 H HG3 . ARG A1 1 83 ? -18.282 8.972 -35.07 1.0 18.31 ? 73 A 1 +ATOM 1407 H HD2 . ARG A1 1 83 ? -15.7 8.627 -33.951 1.0 17.82 ? 73 A 1 +ATOM 1408 H HD3 . ARG A1 1 83 ? -16.311 7.768 -35.141 1.0 17.82 ? 73 A 1 +ATOM 1409 H HE . ARG A1 1 83 ? -15.294 10.251 -35.37 1.0 18.89 ? 73 A 1 +ATOM 1410 H HH11 . ARG A1 1 83 ? -16.791 7.863 -37.106 1.0 20.03 ? 73 A 1 +ATOM 1411 H HH12 . ARG A1 1 83 ? -16.567 8.495 -38.436 1.0 20.03 ? 73 A 1 +ATOM 1412 H HH21 . ARG A1 1 83 ? -14.905 11.122 -37.356 1.0 21.68 ? 73 A 1 +ATOM 1413 H HH22 . ARG A1 1 83 ? -15.422 10.466 -38.589 1.0 21.68 ? 73 A 1 +ATOM 1414 N N . ARG A1 1 84 ? -20.794 11.553 -34.345 1.0 14.7 ? 74 A 1 +ATOM 1415 C CA . ARG A1 1 84 ? -22.117 11.399 -34.938 1.0 16.31 ? 74 A 1 +ATOM 1416 C C . ARG A1 1 84 ? -22.19 10.263 -35.952 1.0 17.61 ? 74 A 1 +ATOM 1417 O O . ARG A1 1 84 ? -23.254 9.669 -36.119 1.0 17.79 ? 74 A 1 +ATOM 1418 C CB . ARG A1 1 84 ? -22.572 12.714 -35.597 1.0 16.4 ? 74 A 1 +ATOM 1419 C CG . ARG A1 1 84 ? -21.778 13.146 -36.79 1.0 18.14 ? 74 A 1 +ATOM 1420 C CD . ARG A1 1 84 ? -22.313 14.448 -37.433 1.0 19.42 ? 74 A 1 +ATOM 1421 N NE . ARG A1 1 84 ? -21.499 14.684 -38.618 1.0 19.31 ? 74 A 1 +ATOM 1422 C CZ . ARG A1 1 84 ? -20.47 15.55 -38.675 1.0 18.91 ? 74 A 1 +ATOM 1423 N NH1 . ARG A1 1 84 ? -20.164 16.363 -37.654 1.0 19.12 ? 74 A 1 +ATOM 1424 N NH2 . ARG A1 1 84 ? -19.702 15.554 -39.792 1.0 19.61 ? 74 A 1 +ATOM 1425 H H . ARG A1 1 84 ? -20.423 12.318 -34.477 1.0 17.64 ? 74 A 1 +ATOM 1426 H HA . ARG A1 1 84 ? -22.731 11.187 -34.217 1.0 19.57 ? 74 A 1 +ATOM 1427 H HB2 . ARG A1 1 84 ? -23.492 12.608 -35.885 1.0 19.68 ? 74 A 1 +ATOM 1428 H HB3 . ARG A1 1 84 ? -22.51 13.422 -34.937 1.0 19.68 ? 74 A 1 +ATOM 1429 H HG2 . ARG A1 1 84 ? -20.86 13.303 -36.518 1.0 21.76 ? 74 A 1 +ATOM 1430 H HG3 . ARG A1 1 84 ? -21.81 12.446 -37.461 1.0 21.76 ? 74 A 1 +ATOM 1431 H HD2 . ARG A1 1 84 ? -23.242 14.343 -37.691 1.0 23.3 ? 74 A 1 +ATOM 1432 H HD3 . ARG A1 1 84 ? -22.221 15.194 -36.82 1.0 23.3 ? 74 A 1 +ATOM 1433 H HE . ARG A1 1 84 ? -21.688 14.239 -39.33 1.0 23.17 ? 74 A 1 +ATOM 1434 H HH11 . ARG A1 1 84 ? -20.631 16.341 -36.932 1.0 22.94 ? 74 A 1 +ATOM 1435 H HH12 . ARG A1 1 84 ? -19.5 16.906 -37.721 1.0 22.94 ? 74 A 1 +ATOM 1436 H HH21 . ARG A1 1 84 ? -19.879 15.014 -40.437 1.0 23.54 ? 74 A 1 +ATOM 1437 H HH22 . ARG A1 1 84 ? -19.039 16.097 -39.856 1.0 23.54 ? 74 A 1 +ATOM 1438 N N . ASP A1 1 85 ? -21.08 9.941 -36.615 1.0 16.53 ? 75 A 1 +ATOM 1439 C CA . ASP A1 1 85 ? -21.121 8.846 -37.59 1.0 18.15 ? 75 A 1 +ATOM 1440 C C . ASP A1 1 85 ? -21.168 7.458 -36.959 1.0 18.43 ? 75 A 1 +ATOM 1441 O O . ASP A1 1 85 ? -21.384 6.484 -37.686 1.0 19.96 ? 75 A 1 +ATOM 1442 C CB . ASP A1 1 85 ? -19.951 8.937 -38.567 1.0 17.92 ? 75 A 1 +ATOM 1443 C CG . ASP A1 1 85 ? -20.131 9.955 -39.651 1.0 22.01 ? 75 A 1 +ATOM 1444 O OD1 . ASP A1 1 85 ? -21.228 10.518 -39.746 1.0 23.76 ? 75 A 1 +ATOM 1445 O OD2 . ASP A1 1 85 ? -19.163 10.122 -40.432 1.0 21.74 ? 75 A 1 +ATOM 1446 H H . ASP A1 1 85 ? -20.317 10.325 -36.522 1.0 19.83 ? 75 A 1 +ATOM 1447 H HA . ASP A1 1 85 ? -21.936 8.953 -38.106 1.0 21.78 ? 75 A 1 +ATOM 1448 H HB2 . ASP A1 1 85 ? -19.151 9.173 -38.072 1.0 21.5 ? 75 A 1 +ATOM 1449 H HB3 . ASP A1 1 85 ? -19.835 8.073 -38.993 1.0 21.5 ? 75 A 1 +ATOM 1450 N N . ASN A1 1 86 ? -21.003 7.302 -35.672 1.0 18.38 ? 76 A 1 +ATOM 1451 C CA . ASN A1 1 86 ? -21.101 5.984 -35.017 1.0 17.57 ? 76 A 1 +ATOM 1452 C C . ASN A1 1 86 ? -22.558 5.644 -34.813 1.0 20.12 ? 76 A 1 +ATOM 1453 O O . ASN A1 1 86 ? -23.203 6.083 -33.86 1.0 20.09 ? 76 A 1 +ATOM 1454 C CB . ASN A1 1 86 ? -20.365 5.984 -33.695 1.0 17.52 ? 76 A 1 +ATOM 1455 C CG . ASN A1 1 86 ? -20.488 4.657 -32.986 1.0 19.65 ? 76 A 1 +ATOM 1456 O OD1 . ASN A1 1 86 ? -20.999 3.673 -33.586 1.0 22.43 ? 76 A 1 +ATOM 1457 N ND2 . ASN A1 1 86 ? -20.082 4.594 -31.751 1.0 18.76 ? 76 A 1 +ATOM 1458 H H . ASN A1 1 86 ? -20.83 7.946 -35.129 1.0 22.05 ? 76 A 1 +ATOM 1459 H HA . ASN A1 1 86 ? -20.705 5.32 -35.603 1.0 21.09 ? 76 A 1 +ATOM 1460 H HB2 . ASN A1 1 86 ? -19.424 6.159 -33.852 1.0 21.03 ? 76 A 1 +ATOM 1461 H HB3 . ASN A1 1 86 ? -20.739 6.671 -33.121 1.0 21.03 ? 76 A 1 +ATOM 1462 H HD21 . ASN A1 1 86 ? -20.138 3.854 -31.318 1.0 22.52 ? 76 A 1 +ATOM 1463 H HD22 . ASN A1 1 86 ? -19.759 5.293 -31.369 1.0 22.52 ? 76 A 1 +ATOM 1464 N N . LYS A1 1 87 ? -23.133 4.904 -35.747 1.0 20.15 ? 77 A 1 +ATOM 1465 C CA . LYS A1 1 87 ? -24.521 4.505 -35.635 1.0 22.31 ? 77 A 1 +ATOM 1466 C C . LYS A1 1 87 ? -24.721 3.262 -34.775 1.0 21.09 ? 77 A 1 +ATOM 1467 O O . LYS A1 1 87 ? -25.875 2.879 -34.567 1.0 28.77 ? 77 A 1 +ATOM 1468 C CB . LYS A1 1 87 ? -25.125 4.283 -37.033 1.0 26.86 ? 77 A 1 +ATOM 1469 C CG . LYS A1 1 87 ? -24.921 5.409 -37.985 1.0 27.3 ? 77 A 1 +ATOM 1470 C CD . LYS A1 1 87 ? -25.397 6.763 -37.475 1.0 63.69 ? 77 A 1 +ATOM 1471 C CE . LYS A1 1 87 ? -25.074 7.879 -38.475 1.0 84.3 ? 77 A 1 +ATOM 1472 N NZ . LYS A1 1 87 ? -25.661 9.193 -38.086 1.0 76.04 ? 77 A 1 +ATOM 1473 H H . LYS A1 1 87 ? -22.739 4.62 -36.457 1.0 24.18 ? 77 A 1 +ATOM 1474 H HA . LYS A1 1 87 ? -25.015 5.227 -35.216 1.0 26.77 ? 77 A 1 +ATOM 1475 H HB2 . LYS A1 1 87 ? -24.717 3.494 -37.422 1.0 32.23 ? 77 A 1 +ATOM 1476 H HB3 . LYS A1 1 87 ? -26.081 4.15 -36.938 1.0 32.23 ? 77 A 1 +ATOM 1477 H HG2 . LYS A1 1 87 ? -23.973 5.486 -38.176 1.0 32.76 ? 77 A 1 +ATOM 1478 H HG3 . LYS A1 1 87 ? -25.409 5.217 -38.802 1.0 32.76 ? 77 A 1 +ATOM 1479 H HD2 . LYS A1 1 87 ? -26.358 6.738 -37.344 1.0 76.43 ? 77 A 1 +ATOM 1480 H HD3 . LYS A1 1 87 ? -24.953 6.965 -36.636 1.0 76.43 ? 77 A 1 +ATOM 1481 H HE2 . LYS A1 1 87 ? -24.111 7.985 -38.53 1.0 101.16 ? 77 A 1 +ATOM 1482 H HE3 . LYS A1 1 87 ? -25.43 7.637 -39.344 1.0 101.16 ? 77 A 1 +ATOM 1483 H HZ1 . LYS A1 1 87 ? -25.444 9.813 -38.686 1.0 91.25 ? 77 A 1 +ATOM 1484 H HZ2 . LYS A1 1 87 ? -26.548 9.13 -38.044 1.0 91.25 ? 77 A 1 +ATOM 1485 H HZ3 . LYS A1 1 87 ? -25.351 9.441 -37.29 1.0 91.25 ? 77 A 1 +ATOM 1486 N N A ASN A1 1 88 ? -23.665 2.597 -34.297 0.5 25.78 ? 78 A 1 +ATOM 1487 N N B ASN A1 1 88 ? -23.62 2.631 -34.295 0.5 18.86 ? 78 A 1 +ATOM 1488 C CA A ASN A1 1 88 ? -23.857 1.389 -33.476 0.5 22.56 ? 78 A 1 +ATOM 1489 C CA B ASN A1 1 88 ? -23.63 1.427 -33.458 0.5 23.5 ? 78 A 1 +ATOM 1490 C C A ASN A1 1 88 ? -24.401 1.764 -32.088 0.5 21.89 ? 78 A 1 +ATOM 1491 C C B ASN A1 1 88 ? -23.695 1.752 -31.968 0.5 23.67 ? 78 A 1 +ATOM 1492 O O A ASN A1 1 88 ? -25.16 1.005 -31.472 0.5 28.45 ? 78 A 1 +ATOM 1493 O O B ASN A1 1 88 ? -23.135 1.016 -31.149 0.5 28.08 ? 78 A 1 +ATOM 1494 C CB A ASN A1 1 88 ? -22.504 0.648 -33.422 0.5 23.87 ? 78 A 1 +ATOM 1495 C CB B ASN A1 1 88 ? -22.361 0.591 -33.667 0.5 31.48 ? 78 A 1 +ATOM 1496 C CG A ASN A1 1 88 ? -22.593 -0.811 -32.996 0.5 29.29 ? 78 A 1 +ATOM 1497 C CG B ASN A1 1 88 ? -22.286 -0.061 -35.017 0.5 33.48 ? 78 A 1 +ATOM 1498 O OD1 A ASN A1 1 88 ? -23.619 -1.461 -33.129 0.5 30.1 ? 78 A 1 +ATOM 1499 O OD1 B ASN A1 1 88 ? -23.304 -0.253 -35.687 0.5 41.53 ? 78 A 1 +ATOM 1500 N ND2 A ASN A1 1 88 ? -21.459 -1.347 -32.532 0.5 28.16 ? 78 A 1 +ATOM 1501 N ND2 B ASN A1 1 88 ? -21.067 -0.426 -35.422 0.5 40.74 ? 78 A 1 +ATOM 1502 H H A ASN A1 1 88 ? -22.844 2.815 -34.428 0.5 30.93 ? 78 A 1 +ATOM 1503 H H B ASN A1 1 88 ? -22.82 2.904 -34.455 0.5 22.64 ? 78 A 1 +ATOM 1504 H HA A ASN A1 1 88 ? -24.507 0.779 -33.859 0.5 27.08 ? 78 A 1 +ATOM 1505 H HA B ASN A1 1 88 ? -24.407 0.914 -33.732 0.5 28.19 ? 78 A 1 +ATOM 1506 H HB2 A ASN A1 1 88 ? -22.105 0.67 -34.306 0.5 28.64 ? 78 A 1 +ATOM 1507 H HB2 B ASN A1 1 88 ? -21.587 1.168 -33.574 0.5 37.78 ? 78 A 1 +ATOM 1508 H HB3 A ASN A1 1 88 ? -21.928 1.103 -32.787 0.5 28.64 ? 78 A 1 +ATOM 1509 H HB3 B ASN A1 1 88 ? -22.335 -0.111 -32.998 0.5 37.78 ? 78 A 1 +ATOM 1510 H HD21 A ASN A1 1 88 ? -21.445 -2.168 -32.275 0.5 33.8 ? 78 A 1 +ATOM 1511 H HD21 B ASN A1 1 88 ? -20.963 -0.804 -36.188 0.5 48.88 ? 78 A 1 +ATOM 1512 H HD22 A ASN A1 1 88 ? -20.744 -0.871 -32.489 0.5 33.8 ? 78 A 1 +ATOM 1513 H HD22 B ASN A1 1 88 ? -20.385 -0.283 -34.918 0.5 48.88 ? 78 A 1 +ATOM 1514 N N A LEU A1 1 89 ? -24.096 2.948 -31.62 0.41 25.62 ? 79 A 1 +ATOM 1515 N N B LEU A1 1 89 ? -24.305 2.866 -31.603 0.59 21.49 ? 79 A 1 +ATOM 1516 C CA A LEU A1 1 89 ? -24.366 3.305 -30.24 0.41 19.82 ? 79 A 1 +ATOM 1517 C CA B LEU A1 1 89 ? -24.377 3.295 -30.211 0.59 20.75 ? 79 A 1 +ATOM 1518 C C A LEU A1 1 89 ? -25.819 3.749 -30.034 0.41 16.97 ? 79 A 1 +ATOM 1519 C C B LEU A1 1 89 ? -25.766 3.837 -29.956 0.59 22.62 ? 79 A 1 +ATOM 1520 O O A LEU A1 1 89 ? -26.38 4.497 -30.839 0.41 20.31 ? 79 A 1 +ATOM 1521 O O B LEU A1 1 89 ? -26.188 4.778 -30.646 0.59 21.0 ? 79 A 1 +ATOM 1522 C CB . LEU A1 1 89 ? -23.384 4.415 -29.919 1.0 20.59 ? 79 A 1 +ATOM 1523 C CG . LEU A1 1 89 ? -23.366 4.875 -28.459 1.0 20.2 ? 79 A 1 +ATOM 1524 C CD1 . LEU A1 1 89 ? -22.958 3.73 -27.503 1.0 21.62 ? 79 A 1 +ATOM 1525 C CD2 . LEU A1 1 89 ? -22.428 6.025 -28.346 1.0 20.41 ? 79 A 1 +ATOM 1526 H H A LEU A1 1 89 ? -23.728 3.573 -32.081 0.5 30.75 ? 79 A 1 +ATOM 1527 H H B LEU A1 1 89 ? -24.694 3.403 -32.151 0.5 25.79 ? 79 A 1 +ATOM 1528 H HA A LEU A1 1 89 ? -24.257 2.555 -29.634 0.41 23.79 ? 79 A 1 +ATOM 1529 H HA B LEU A1 1 89 ? -24.192 2.532 -29.642 0.59 24.9 ? 79 A 1 +ATOM 1530 H HB2 A LEU A1 1 89 ? -22.491 4.104 -30.135 0.41 24.7 ? 79 A 1 +ATOM 1531 H HB2 B LEU A1 1 89 ? -22.493 4.103 -30.14 0.59 24.7 ? 79 A 1 +ATOM 1532 H HB3 A LEU A1 1 89 ? -23.608 5.186 -30.463 0.41 24.7 ? 79 A 1 +ATOM 1533 H HB3 B LEU A1 1 89 ? -23.613 5.182 -30.466 0.59 24.7 ? 79 A 1 +ATOM 1534 H HG . LEU A1 1 89 ? -24.256 5.148 -28.188 1.0 24.24 ? 79 A 1 +ATOM 1535 H HD11 . LEU A1 1 89 ? -22.819 4.095 -26.615 1.0 25.94 ? 79 A 1 +ATOM 1536 H HD12 . LEU A1 1 89 ? -23.668 3.069 -27.482 1.0 25.94 ? 79 A 1 +ATOM 1537 H HD13 . LEU A1 1 89 ? -22.139 3.325 -27.827 1.0 25.94 ? 79 A 1 +ATOM 1538 H HD21 . LEU A1 1 89 ? -22.401 6.321 -27.423 1.0 24.49 ? 79 A 1 +ATOM 1539 H HD22 . LEU A1 1 89 ? -21.544 5.741 -28.628 1.0 24.49 ? 79 A 1 +ATOM 1540 H HD23 . LEU A1 1 89 ? -22.741 6.745 -28.916 1.0 24.49 ? 79 A 1 +ATOM 1541 N N . LYS A1 1 90 ? -26.444 3.292 -28.952 1.0 19.55 ? 80 A 1 +ATOM 1542 C CA . LYS A1 1 90 ? -27.749 3.816 -28.57 1.0 19.16 ? 80 A 1 +ATOM 1543 C C . LYS A1 1 90 ? -27.542 5.194 -27.911 1.0 17.18 ? 80 A 1 +ATOM 1544 O O . LYS A1 1 90 ? -26.717 5.379 -27.034 1.0 17.73 ? 80 A 1 +ATOM 1545 C CB . LYS A1 1 90 ? -28.427 2.855 -27.586 1.0 20.38 ? 80 A 1 +ATOM 1546 C CG . LYS A1 1 90 ? -29.758 3.355 -27.028 1.0 27.39 ? 80 A 1 +ATOM 1547 C CD . LYS A1 1 90 ? -30.847 3.366 -28.04 1.0 68.87 ? 80 A 1 +ATOM 1548 C CE . LYS A1 1 90 ? -32.201 3.651 -27.4 1.0 54.25 ? 80 A 1 +ATOM 1549 N NZ . LYS A1 1 90 ? -33.222 3.847 -28.464 1.0 93.55 ? 80 A 1 +ATOM 1550 H HA . LYS A1 1 90 ? -28.325 3.908 -29.345 1.0 22.99 ? 80 A 1 +ATOM 1551 H HB2 . LYS A1 1 90 ? -28.597 2.015 -28.04 1.0 24.45 ? 80 A 1 +ATOM 1552 H HB3 . LYS A1 1 90 ? -27.83 2.711 -26.834 1.0 24.45 ? 80 A 1 +ATOM 1553 H HG2 . LYS A1 1 90 ? -30.033 2.775 -26.3 1.0 32.86 ? 80 A 1 +ATOM 1554 H HG3 . LYS A1 1 90 ? -29.643 4.262 -26.704 1.0 32.86 ? 80 A 1 +ATOM 1555 H HD2 . LYS A1 1 90 ? -30.669 4.057 -28.697 1.0 82.65 ? 80 A 1 +ATOM 1556 H HD3 . LYS A1 1 90 ? -30.892 2.5 -28.474 1.0 82.65 ? 80 A 1 +ATOM 1557 H HE2 . LYS A1 1 90 ? -32.467 2.901 -26.845 1.0 65.1 ? 80 A 1 +ATOM 1558 H HE3 . LYS A1 1 90 ? -32.148 4.458 -26.864 1.0 65.1 ? 80 A 1 +ATOM 1559 H HZ1 . LYS A1 1 90 ? -34.016 4.009 -28.097 1.0 112.27 ? 80 A 1 +ATOM 1560 H HZ2 . LYS A1 1 90 ? -32.996 4.537 -28.979 1.0 112.27 ? 80 A 1 +ATOM 1561 H HZ3 . LYS A1 1 90 ? -33.28 3.117 -28.969 1.0 112.27 ? 80 A 1 +ATOM 1562 N N . ARG A1 1 91 ? -28.304 6.176 -28.349 1.0 16.95 ? 81 A 1 +ATOM 1563 C CA . ARG A1 1 91 ? -28.193 7.527 -27.832 1.0 16.38 ? 81 A 1 +ATOM 1564 C C . ARG A1 1 91 ? -29.261 7.78 -26.774 1.0 16.3 ? 81 A 1 +ATOM 1565 O O . ARG A1 1 91 ? -30.337 7.185 -26.774 1.0 18.37 ? 81 A 1 +ATOM 1566 C CB . ARG A1 1 91 ? -28.31 8.5 -29.004 1.0 17.48 ? 81 A 1 +ATOM 1567 C CG . ARG A1 1 91 ? -27.266 8.255 -30.107 1.0 18.08 ? 81 A 1 +ATOM 1568 C CD . ARG A1 1 91 ? -25.897 8.677 -29.715 1.0 18.13 ? 81 A 1 +ATOM 1569 N NE . ARG A1 1 91 ? -24.977 8.354 -30.825 1.0 17.18 ? 81 A 1 +ATOM 1570 C CZ . ARG A1 1 91 ? -23.824 8.933 -31.028 1.0 17.88 ? 81 A 1 +ATOM 1571 N NH1 . ARG A1 1 91 ? -23.393 9.904 -30.245 1.0 16.98 ? 81 A 1 +ATOM 1572 N NH2 . ARG A1 1 91 ? -23.06 8.552 -32.077 1.0 18.16 ? 81 A 1 +ATOM 1573 H H . ARG A1 1 91 ? -28.906 6.085 -28.957 1.0 20.35 ? 81 A 1 +ATOM 1574 H HA . ARG A1 1 91 ? -27.342 7.674 -27.391 1.0 19.66 ? 81 A 1 +ATOM 1575 H HB2 . ARG A1 1 91 ? -29.19 8.408 -29.402 1.0 20.97 ? 81 A 1 +ATOM 1576 H HB3 . ARG A1 1 91 ? -28.189 9.404 -28.675 1.0 20.97 ? 81 A 1 +ATOM 1577 H HG2 . ARG A1 1 91 ? -27.238 7.306 -30.31 1.0 21.69 ? 81 A 1 +ATOM 1578 H HG3 . ARG A1 1 91 ? -27.518 8.756 -30.898 1.0 21.69 ? 81 A 1 +ATOM 1579 H HD2 . ARG A1 1 91 ? -25.877 9.634 -29.552 1.0 21.76 ? 81 A 1 +ATOM 1580 H HD3 . ARG A1 1 91 ? -25.616 8.2 -28.918 1.0 21.76 ? 81 A 1 +ATOM 1581 H HE . ARG A1 1 91 ? -25.218 7.741 -31.377 1.0 20.62 ? 81 A 1 +ATOM 1582 H HH11 . ARG A1 1 91 ? -23.875 10.169 -29.583 1.0 20.37 ? 81 A 1 +ATOM 1583 H HH12 . ARG A1 1 91 ? -22.63 10.272 -30.396 1.0 20.37 ? 81 A 1 +ATOM 1584 H HH21 . ARG A1 1 91 ? -23.334 7.932 -32.606 1.0 21.79 ? 81 A 1 +ATOM 1585 H HH22 . ARG A1 1 91 ? -22.3 8.93 -32.215 1.0 21.79 ? 81 A 1 +ATOM 1586 N N . TYR A1 1 92 ? -28.919 8.672 -25.85 1.0 15.62 ? 82 A 1 +ATOM 1587 C CA . TYR A1 1 92 ? -29.819 9.028 -24.769 1.0 15.92 ? 82 A 1 +ATOM 1588 C C . TYR A1 1 92 ? -29.619 10.489 -24.401 1.0 14.19 ? 82 A 1 +ATOM 1589 O O . TYR A1 1 92 ? -28.598 11.122 -24.662 1.0 14.75 ? 82 A 1 +ATOM 1590 C CB . TYR A1 1 92 ? -29.522 8.187 -23.478 1.0 14.89 ? 82 A 1 +ATOM 1591 C CG . TYR A1 1 92 ? -28.219 8.54 -22.795 1.0 14.99 ? 82 A 1 +ATOM 1592 C CD1 . TYR A1 1 92 ? -27.031 7.891 -23.142 1.0 15.54 ? 82 A 1 +ATOM 1593 C CD2 . TYR A1 1 92 ? -28.145 9.526 -21.815 1.0 15.45 ? 82 A 1 +ATOM 1594 C CE1 . TYR A1 1 92 ? -25.829 8.206 -22.543 1.0 14.69 ? 82 A 1 +ATOM 1595 C CE2 . TYR A1 1 92 ? -26.927 9.887 -21.215 1.0 13.92 ? 82 A 1 +ATOM 1596 C CZ . TYR A1 1 92 ? -25.778 9.216 -21.569 1.0 14.31 ? 82 A 1 +ATOM 1597 O OH . TYR A1 1 92 ? -24.555 9.481 -21.008 1.0 14.7 ? 82 A 1 +ATOM 1598 H H . TYR A1 1 92 ? -28.166 9.085 -25.831 1.0 18.74 ? 82 A 1 +ATOM 1599 H HA . TYR A1 1 92 ? -30.728 8.882 -25.077 1.0 19.11 ? 82 A 1 +ATOM 1600 H HB2 . TYR A1 1 92 ? -30.238 8.334 -22.84 1.0 17.87 ? 82 A 1 +ATOM 1601 H HB3 . TYR A1 1 92 ? -29.482 7.249 -23.722 1.0 17.87 ? 82 A 1 +ATOM 1602 H HD1 . TYR A1 1 92 ? -27.052 7.229 -23.795 1.0 18.65 ? 82 A 1 +ATOM 1603 H HD2 . TYR A1 1 92 ? -28.924 9.959 -21.549 1.0 18.53 ? 82 A 1 +ATOM 1604 H HE1 . TYR A1 1 92 ? -25.054 7.75 -22.784 1.0 17.63 ? 82 A 1 +ATOM 1605 H HE2 . TYR A1 1 92 ? -26.897 10.571 -20.586 1.0 16.71 ? 82 A 1 +ATOM 1606 H HH . TYR A1 1 92 ? -24.616 10.133 -20.481 1.0 17.64 ? 82 A 1 +ATOM 1607 N N . ARG A1 1 93 ? -30.651 11.003 -23.745 1.0 15.64 ? 83 A 1 +ATOM 1608 C CA . ARG A1 1 93 ? -30.632 12.292 -23.071 1.0 16.36 ? 83 A 1 +ATOM 1609 C C . ARG A1 1 93 ? -31.374 12.172 -21.775 1.0 16.74 ? 83 A 1 +ATOM 1610 O O . ARG A1 1 93 ? -32.48 11.657 -21.732 1.0 17.71 ? 83 A 1 +ATOM 1611 C CB . ARG A1 1 93 ? -31.494 13.302 -23.869 1.0 22.41 ? 83 A 1 +ATOM 1612 C CG . ARG A1 1 93 ? -30.876 13.75 -25.12 1.0 22.02 ? 83 A 1 +ATOM 1613 C CD . ARG A1 1 93 ? -31.826 14.719 -25.785 1.0 22.22 ? 83 A 1 +ATOM 1614 N NE . ARG A1 1 93 ? -31.118 15.293 -26.878 1.0 18.23 ? 83 A 1 +ATOM 1615 C CZ . ARG A1 1 93 ? -31.615 15.475 -28.082 1.0 19.48 ? 83 A 1 +ATOM 1616 N NH1 . ARG A1 1 93 ? -32.829 15.058 -28.405 1.0 20.36 ? 83 A 1 +ATOM 1617 N NH2 . ARG A1 1 93 ? -30.874 16.069 -28.985 1.0 18.83 ? 83 A 1 +ATOM 1618 H H . ARG A1 1 93 ? -31.41 10.605 -23.672 1.0 18.77 ? 83 A 1 +ATOM 1619 H HA . ARG A1 1 93 ? -29.711 12.572 -22.95 1.0 19.64 ? 83 A 1 +ATOM 1620 H HB2 . ARG A1 1 93 ? -32.34 12.883 -24.091 1.0 26.89 ? 83 A 1 +ATOM 1621 H HB3 . ARG A1 1 93 ? -31.647 14.086 -23.318 1.0 26.89 ? 83 A 1 +ATOM 1622 H HG2 . ARG A1 1 93 ? -30.036 14.199 -24.937 1.0 26.43 ? 83 A 1 +ATOM 1623 H HG3 . ARG A1 1 93 ? -30.726 12.994 -25.709 1.0 26.43 ? 83 A 1 +ATOM 1624 H HD2 . ARG A1 1 93 ? -32.611 14.255 -26.113 1.0 26.67 ? 83 A 1 +ATOM 1625 H HD3 . ARG A1 1 93 ? -32.088 15.417 -25.164 1.0 26.67 ? 83 A 1 +ATOM 1626 H HE . ARG A1 1 93 ? -30.305 15.539 -26.741 1.0 21.88 ? 83 A 1 +ATOM 1627 H HH11 . ARG A1 1 93 ? -33.315 14.655 -27.821 1.0 24.43 ? 83 A 1 +ATOM 1628 H HH12 . ARG A1 1 93 ? -33.132 15.189 -29.199 1.0 24.43 ? 83 A 1 +ATOM 1629 H HH21 . ARG A1 1 93 ? -30.08 16.331 -28.784 1.0 22.59 ? 83 A 1 +ATOM 1630 H HH22 . ARG A1 1 93 ? -31.182 16.197 -29.777 1.0 22.59 ? 83 A 1 +ATOM 1631 N N . MET A1 1 94 ? -30.788 12.74 -20.714 1.0 15.23 ? 84 A 1 +ATOM 1632 C CA . MET A1 1 94 ? -31.452 12.822 -19.399 1.0 15.13 ? 84 A 1 +ATOM 1633 C C . MET A1 1 94 ? -32.308 14.07 -19.314 1.0 15.62 ? 84 A 1 +ATOM 1634 O O . MET A1 1 94 ? -31.917 15.138 -19.811 1.0 16.74 ? 84 A 1 +ATOM 1635 C CB . MET A1 1 94 ? -30.413 12.845 -18.289 1.0 14.98 ? 84 A 1 +ATOM 1636 C CG . MET A1 1 94 ? -29.632 11.567 -18.21 1.0 15.5 ? 84 A 1 +ATOM 1637 S SD . MET A1 1 94 ? -28.323 11.539 -16.929 1.0 15.81 ? 84 A 1 +ATOM 1638 C CE . MET A1 1 94 ? -29.273 11.667 -15.41 1.0 16.82 ? 84 A 1 +ATOM 1639 H H . MET A1 1 94 ? -30.002 13.088 -20.727 1.0 18.28 ? 84 A 1 +ATOM 1640 H HA . MET A1 1 94 ? -32.017 12.043 -19.28 1.0 18.15 ? 84 A 1 +ATOM 1641 H HB2 . MET A1 1 94 ? -29.79 13.57 -18.453 1.0 17.98 ? 84 A 1 +ATOM 1642 H HB3 . MET A1 1 94 ? -30.86 12.979 -17.439 1.0 17.98 ? 84 A 1 +ATOM 1643 H HG2 . MET A1 1 94 ? -30.247 10.843 -18.013 1.0 18.6 ? 84 A 1 +ATOM 1644 H HG3 . MET A1 1 94 ? -29.204 11.415 -19.067 1.0 18.6 ? 84 A 1 +ATOM 1645 H HE1 . MET A1 1 94 ? -28.666 11.633 -14.654 1.0 20.18 ? 84 A 1 +ATOM 1646 H HE2 . MET A1 1 94 ? -29.756 12.508 -15.409 1.0 20.18 ? 84 A 1 +ATOM 1647 H HE3 . MET A1 1 94 ? -29.898 10.926 -15.365 1.0 20.18 ? 84 A 1 +ATOM 1648 N N . THR A1 1 95 ? -33.43 13.973 -18.637 1.0 17.11 ? 85 A 1 +ATOM 1649 C CA . THR A1 1 95 ? -34.204 15.158 -18.413 1.0 16.78 ? 85 A 1 +ATOM 1650 C C . THR A1 1 95 ? -33.522 16.062 -17.385 1.0 18.12 ? 85 A 1 +ATOM 1651 O O . THR A1 1 95 ? -32.725 15.6 -16.557 1.0 17.78 ? 85 A 1 +ATOM 1652 C CB . THR A1 1 95 ? -35.608 14.811 -17.893 1.0 18.59 ? 85 A 1 +ATOM 1653 O OG1 . THR A1 1 95 ? -35.473 14.24 -16.592 1.0 19.1 ? 85 A 1 +ATOM 1654 C CG2 . THR A1 1 95 ? -36.39 13.835 -18.775 1.0 20.46 ? 85 A 1 +ATOM 1655 H H . THR A1 1 95 ? -33.754 13.248 -18.307 1.0 20.53 ? 85 A 1 +ATOM 1656 H HA . THR A1 1 95 ? -34.288 15.63 -19.256 1.0 20.14 ? 85 A 1 +ATOM 1657 H HB . THR A1 1 95 ? -36.126 15.631 -17.887 1.0 22.31 ? 85 A 1 +ATOM 1658 H HG1 . THR A1 1 95 ? -35.815 14.75 -16.018 1.0 22.92 ? 85 A 1 +ATOM 1659 H HG21 . THR A1 1 95 ? -37.261 13.661 -18.385 1.0 24.55 ? 85 A 1 +ATOM 1660 H HG22 . THR A1 1 95 ? -36.511 14.212 -19.661 1.0 24.55 ? 85 A 1 +ATOM 1661 H HG23 . THR A1 1 95 ? -35.906 12.998 -18.853 1.0 24.55 ? 85 A 1 +ATOM 1662 N N . PRO A1 1 96 ? -33.929 17.326 -17.332 1.0 18.46 ? 86 A 1 +ATOM 1663 C CA . PRO A1 1 96 ? -33.405 18.186 -16.265 1.0 19.91 ? 86 A 1 +ATOM 1664 C C . PRO A1 1 96 ? -33.725 17.657 -14.881 1.0 21.3 ? 86 A 1 +ATOM 1665 O O . PRO A1 1 96 ? -32.847 17.719 -13.998 1.0 20.85 ? 86 A 1 +ATOM 1666 C CB . PRO A1 1 96 ? -34.046 19.553 -16.558 1.0 22.04 ? 86 A 1 +ATOM 1667 C CG . PRO A1 1 96 ? -34.35 19.533 -18.042 1.0 23.86 ? 86 A 1 +ATOM 1668 C CD . PRO A1 1 96 ? -34.649 18.111 -18.372 1.0 21.99 ? 86 A 1 +ATOM 1669 H HA . PRO A1 1 96 ? -32.444 18.285 -16.35 1.0 23.89 ? 86 A 1 +ATOM 1670 H HB2 . PRO A1 1 96 ? -34.859 19.655 -16.039 1.0 26.45 ? 86 A 1 +ATOM 1671 H HB3 . PRO A1 1 96 ? -33.422 20.263 -16.341 1.0 26.45 ? 86 A 1 +ATOM 1672 H HG2 . PRO A1 1 96 ? -35.117 20.097 -18.227 1.0 28.63 ? 86 A 1 +ATOM 1673 H HG3 . PRO A1 1 96 ? -33.579 19.847 -18.539 1.0 28.63 ? 86 A 1 +ATOM 1674 H HD2 . PRO A1 1 96 ? -35.603 17.944 -18.325 1.0 26.39 ? 86 A 1 +ATOM 1675 H HD3 . PRO A1 1 96 ? -34.317 17.89 -19.256 1.0 26.39 ? 86 A 1 +ATOM 1676 N N . GLU A1 1 97 ? -34.913 17.095 -14.678 1.0 20.88 ? 87 A 1 +ATOM 1677 C CA . GLU A1 1 97 ? -35.248 16.53 -13.376 1.0 23.25 ? 87 A 1 +ATOM 1678 C C . GLU A1 1 97 ? -34.32 15.384 -13.028 1.0 22.29 ? 87 A 1 +ATOM 1679 O O . GLU A1 1 97 ? -33.896 15.249 -11.868 1.0 22.46 ? 87 A 1 +ATOM 1680 C CB . GLU A1 1 97 ? -36.726 16.062 -13.378 1.0 24.95 ? 87 A 1 +ATOM 1681 C CG . GLU A1 1 97 ? -37.172 15.456 -12.039 1.0 28.58 ? 87 A 1 +ATOM 1682 C CD . GLU A1 1 97 ? -37.193 13.916 -11.941 1.0 45.22 ? 87 A 1 +ATOM 1683 O OE1 . GLU A1 1 97 ? -37.011 13.143 -12.932 1.0 28.91 ? 87 A 1 +ATOM 1684 O OE2 . GLU A1 1 97 ? -37.407 13.448 -10.804 1.0 52.28 ? 87 A 1 +ATOM 1685 H H . GLU A1 1 97 ? -35.535 17.029 -15.269 1.0 25.06 ? 87 A 1 +ATOM 1686 H HA . GLU A1 1 97 ? -35.146 17.214 -12.696 1.0 27.9 ? 87 A 1 +ATOM 1687 H HB2 . GLU A1 1 97 ? -37.296 16.824 -13.565 1.0 29.94 ? 87 A 1 +ATOM 1688 H HB3 . GLU A1 1 97 ? -36.839 15.385 -14.064 1.0 29.94 ? 87 A 1 +ATOM 1689 H HG2 . GLU A1 1 97 ? -36.568 15.774 -11.349 1.0 34.3 ? 87 A 1 +ATOM 1690 H HG3 . GLU A1 1 97 ? -38.074 15.762 -11.857 1.0 34.3 ? 87 A 1 +ATOM 1691 N N . GLU A1 1 98 ? -34.071 14.482 -13.981 1.0 20.18 ? 88 A 1 +ATOM 1692 C CA . GLU A1 1 98 ? -33.161 13.373 -13.714 1.0 19.89 ? 88 A 1 +ATOM 1693 C C . GLU A1 1 98 ? -31.803 13.903 -13.314 1.0 18.11 ? 88 A 1 +ATOM 1694 O O . GLU A1 1 98 ? -31.186 13.405 -12.387 1.0 18.98 ? 88 A 1 +ATOM 1695 C CB . GLU A1 1 98 ? -33.014 12.467 -14.946 1.0 19.19 ? 88 A 1 +ATOM 1696 C CG . GLU A1 1 98 ? -34.106 11.498 -15.15 1.0 21.43 ? 88 A 1 +ATOM 1697 C CD . GLU A1 1 98 ? -33.849 10.736 -16.427 1.0 24.23 ? 88 A 1 +ATOM 1698 O OE1 . GLU A1 1 98 ? -33.757 11.338 -17.533 1.0 22.3 ? 88 A 1 +ATOM 1699 O OE2 . GLU A1 1 98 ? -33.855 9.489 -16.373 1.0 26.44 ? 88 A 1 +ATOM 1700 H H . GLU A1 1 98 ? -34.409 14.491 -14.772 1.0 24.21 ? 88 A 1 +ATOM 1701 H HA . GLU A1 1 98 ? -33.532 12.837 -12.996 1.0 23.87 ? 88 A 1 +ATOM 1702 H HB2 . GLU A1 1 98 ? -32.975 13.028 -15.736 1.0 23.03 ? 88 A 1 +ATOM 1703 H HB3 . GLU A1 1 98 ? -32.192 11.961 -14.857 1.0 23.03 ? 88 A 1 +ATOM 1704 H HG2 . GLU A1 1 98 ? -34.137 10.873 -14.409 1.0 25.72 ? 88 A 1 +ATOM 1705 H HG3 . GLU A1 1 98 ? -34.953 11.965 -15.226 1.0 25.72 ? 88 A 1 +ATOM 1706 N N . ILE A1 1 99 ? -31.31 14.899 -14.045 1.0 16.94 ? 89 A 1 +ATOM 1707 C CA . ILE A1 1 99 ? -29.969 15.431 -13.787 1.0 17.09 ? 89 A 1 +ATOM 1708 C C . ILE A1 1 99 ? -29.89 16.103 -12.414 1.0 15.71 ? 89 A 1 +ATOM 1709 O O . ILE A1 1 99 ? -28.961 15.853 -11.647 1.0 16.59 ? 89 A 1 +ATOM 1710 C CB . ILE A1 1 99 ? -29.544 16.386 -14.905 1.0 15.41 ? 89 A 1 +ATOM 1711 C CG1 . ILE A1 1 99 ? -29.521 15.7 -16.272 1.0 15.57 ? 89 A 1 +ATOM 1712 C CG2 . ILE A1 1 99 ? -28.183 17.005 -14.57 1.0 15.85 ? 89 A 1 +ATOM 1713 C CD1 . ILE A1 1 99 ? -29.507 16.642 -17.451 1.0 15.94 ? 89 A 1 +ATOM 1714 H H . ILE A1 1 99 ? -31.725 15.283 -14.692 1.0 20.33 ? 89 A 1 +ATOM 1715 H HA . ILE A1 1 99 ? -29.353 14.682 -13.777 1.0 20.5 ? 89 A 1 +ATOM 1716 H HB . ILE A1 1 99 ? -30.208 17.091 -14.961 1.0 18.49 ? 89 A 1 +ATOM 1717 H HG12 . ILE A1 1 99 ? -28.724 15.151 -16.328 1.0 18.69 ? 89 A 1 +ATOM 1718 H HG13 . ILE A1 1 99 ? -30.313 15.145 -16.352 1.0 18.69 ? 89 A 1 +ATOM 1719 H HG21 . ILE A1 1 99 ? -27.815 17.411 -15.371 1.0 19.02 ? 89 A 1 +ATOM 1720 H HG22 . ILE A1 1 99 ? -28.303 17.679 -13.883 1.0 19.02 ? 89 A 1 +ATOM 1721 H HG23 . ILE A1 1 99 ? -27.59 16.308 -14.249 1.0 19.02 ? 89 A 1 +ATOM 1722 H HD11 . ILE A1 1 99 ? -29.593 16.127 -18.268 1.0 19.13 ? 89 A 1 +ATOM 1723 H HD12 . ILE A1 1 99 ? -30.25 17.26 -17.37 1.0 19.13 ? 89 A 1 +ATOM 1724 H HD13 . ILE A1 1 99 ? -28.669 17.131 -17.454 1.0 19.13 ? 89 A 1 +ATOM 1725 N N . VAL A1 1 100 ? -30.836 16.987 -12.131 1.0 16.79 ? 90 A 1 +ATOM 1726 C CA . VAL A1 1 100 ? -30.813 17.704 -10.843 1.0 17.53 ? 90 A 1 +ATOM 1727 C C . VAL A1 1 100 ? -30.925 16.727 -9.695 1.0 17.23 ? 90 A 1 +ATOM 1728 O O . VAL A1 1 100 ? -30.188 16.839 -8.684 1.0 17.2 ? 90 A 1 +ATOM 1729 C CB . VAL A1 1 100 ? -31.91 18.774 -10.819 1.0 17.86 ? 90 A 1 +ATOM 1730 C CG1 . VAL A1 1 100 ? -32.101 19.362 -9.426 1.0 19.56 ? 90 A 1 +ATOM 1731 C CG2 . VAL A1 1 100 ? -31.616 19.875 -11.823 1.0 20.33 ? 90 A 1 +ATOM 1732 H H . VAL A1 1 100 ? -31.492 17.192 -12.648 1.0 20.15 ? 90 A 1 +ATOM 1733 H HA . VAL A1 1 100 ? -29.962 18.159 -10.746 1.0 21.04 ? 90 A 1 +ATOM 1734 H HB . VAL A1 1 100 ? -32.743 18.343 -11.069 1.0 21.44 ? 90 A 1 +ATOM 1735 H HG11 . VAL A1 1 100 ? -32.625 20.175 -9.496 1.0 23.47 ? 90 A 1 +ATOM 1736 H HG12 . VAL A1 1 100 ? -32.566 18.716 -8.872 1.0 23.47 ? 90 A 1 +ATOM 1737 H HG13 . VAL A1 1 100 ? -31.232 19.56 -9.045 1.0 23.47 ? 90 A 1 +ATOM 1738 H HG21 . VAL A1 1 100 ? -32.33 20.53 -11.79 1.0 24.39 ? 90 A 1 +ATOM 1739 H HG22 . VAL A1 1 100 ? -30.772 20.293 -11.594 1.0 24.39 ? 90 A 1 +ATOM 1740 H HG23 . VAL A1 1 100 ? -31.563 19.487 -12.71 1.0 24.39 ? 90 A 1 +ATOM 1741 N N . GLU A1 1 101 ? -31.857 15.771 -9.782 1.0 17.42 ? 91 A 1 +ATOM 1742 C CA . GLU A1 1 101 ? -32.002 14.834 -8.655 1.0 19.21 ? 91 A 1 +ATOM 1743 C C . GLU A1 1 101 ? -30.795 13.934 -8.482 1.0 18.69 ? 91 A 1 +ATOM 1744 O O . GLU A1 1 101 ? -30.398 13.577 -7.36 1.0 19.18 ? 91 A 1 +ATOM 1745 C CB . GLU A1 1 101 ? -33.324 14.059 -8.787 1.0 21.48 ? 91 A 1 +ATOM 1746 C CG . GLU A1 1 101 ? -34.532 14.953 -8.603 1.0 25.57 ? 91 A 1 +ATOM 1747 C CD . GLU A1 1 101 ? -34.43 15.831 -7.335 1.0 35.3 ? 91 A 1 +ATOM 1748 O OE1 . GLU A1 1 101 ? -34.153 15.286 -6.237 1.0 28.5 ? 91 A 1 +ATOM 1749 O OE2 . GLU A1 1 101 ? -34.551 17.071 -7.472 1.0 34.9 ? 91 A 1 +ATOM 1750 H H . GLU A1 1 101 ? -32.391 15.647 -10.445 1.0 20.9 ? 91 A 1 +ATOM 1751 H HA . GLU A1 1 101 ? -32.06 15.337 -7.828 1.0 23.05 ? 91 A 1 +ATOM 1752 H HB2 . GLU A1 1 101 ? -33.373 13.662 -9.671 1.0 25.78 ? 91 A 1 +ATOM 1753 H HB3 . GLU A1 1 101 ? -33.354 13.365 -8.11 1.0 25.78 ? 91 A 1 +ATOM 1754 H HG2 . GLU A1 1 101 ? -34.612 15.54 -9.371 1.0 30.69 ? 91 A 1 +ATOM 1755 H HG3 . GLU A1 1 101 ? -35.326 14.401 -8.524 1.0 30.69 ? 91 A 1 +ATOM 1756 N N . ARG A1 1 102 ? -30.167 13.552 -9.581 1.0 17.85 ? 92 A 1 +ATOM 1757 C CA . ARG A1 1 102 ? -28.951 12.768 -9.49 1.0 17.65 ? 92 A 1 +ATOM 1758 C C . ARG A1 1 102 ? -27.815 13.566 -8.894 1.0 16.65 ? 92 A 1 +ATOM 1759 O O . ARG A1 1 102 ? -27.04 13.053 -8.062 1.0 17.54 ? 92 A 1 +ATOM 1760 C CB . ARG A1 1 102 ? -28.602 12.215 -10.868 1.0 17.86 ? 92 A 1 +ATOM 1761 C CG . ARG A1 1 102 ? -27.485 11.262 -10.881 1.0 18.98 ? 92 A 1 +ATOM 1762 C CD . ARG A1 1 102 ? -27.745 9.949 -10.188 1.0 19.95 ? 92 A 1 +ATOM 1763 N NE . ARG A1 1 102 ? -26.622 9.087 -10.366 1.0 19.6 ? 92 A 1 +ATOM 1764 C CZ . ARG A1 1 102 ? -26.511 7.851 -9.915 1.0 19.2 ? 92 A 1 +ATOM 1765 N NH1 . ARG A1 1 102 ? -27.499 7.247 -9.294 1.0 21.48 ? 92 A 1 +ATOM 1766 N NH2 . ARG A1 1 102 ? -25.399 7.229 -10.235 1.0 21.52 ? 92 A 1 +ATOM 1767 H H . ARG A1 1 102 ? -30.421 13.73 -10.383 1.0 21.42 ? 92 A 1 +ATOM 1768 H HA . ARG A1 1 102 ? -29.097 12.014 -8.897 1.0 21.18 ? 92 A 1 +ATOM 1769 H HB2 . ARG A1 1 102 ? -29.38 11.757 -11.222 1.0 21.44 ? 92 A 1 +ATOM 1770 H HB3 . ARG A1 1 102 ? -28.361 12.955 -11.446 1.0 21.44 ? 92 A 1 +ATOM 1771 H HG2 . ARG A1 1 102 ? -27.264 11.062 -11.804 1.0 22.77 ? 92 A 1 +ATOM 1772 H HG3 . ARG A1 1 102 ? -26.726 11.675 -10.44 1.0 22.77 ? 92 A 1 +ATOM 1773 H HD2 . ARG A1 1 102 ? -27.878 10.099 -9.239 1.0 23.94 ? 92 A 1 +ATOM 1774 H HD3 . ARG A1 1 102 ? -28.529 9.526 -10.571 1.0 23.94 ? 92 A 1 +ATOM 1775 H HE . ARG A1 1 102 ? -25.955 9.401 -10.809 1.0 23.52 ? 92 A 1 +ATOM 1776 H HH11 . ARG A1 1 102 ? -28.245 7.658 -9.172 1.0 25.77 ? 92 A 1 +ATOM 1777 H HH12 . ARG A1 1 102 ? -27.4 6.442 -9.01 1.0 25.77 ? 92 A 1 +ATOM 1778 H HH21 . ARG A1 1 102 ? -24.804 7.629 -10.709 1.0 25.83 ? 92 A 1 +ATOM 1779 H HH22 . ARG A1 1 102 ? -25.266 6.421 -9.971 1.0 25.83 ? 92 A 1 +ATOM 1780 N N . ALA A1 1 103 ? -27.717 14.828 -9.251 1.0 15.86 ? 93 A 1 +ATOM 1781 C CA . ALA A1 1 103 ? -26.745 15.715 -8.631 1.0 15.06 ? 93 A 1 +ATOM 1782 C C . ALA A1 1 103 ? -27.015 15.856 -7.142 1.0 16.83 ? 93 A 1 +ATOM 1783 O O . ALA A1 1 103 ? -26.067 15.788 -6.347 1.0 16.4 ? 93 A 1 +ATOM 1784 C CB . ALA A1 1 103 ? -26.761 17.09 -9.275 1.0 16.52 ? 93 A 1 +ATOM 1785 H H . ALA A1 1 103 ? -28.201 15.205 -9.854 1.0 19.03 ? 93 A 1 +ATOM 1786 H HA . ALA A1 1 103 ? -25.865 15.331 -8.768 1.0 18.08 ? 93 A 1 +ATOM 1787 H HB1 . ALA A1 1 103 ? -26.107 17.654 -8.832 1.0 19.82 ? 93 A 1 +ATOM 1788 H HB2 . ALA A1 1 103 ? -26.537 17.001 -10.215 1.0 19.82 ? 93 A 1 +ATOM 1789 H HB3 . ALA A1 1 103 ? -27.647 17.473 -9.18 1.0 19.82 ? 93 A 1 +ATOM 1790 N N . ARG A1 1 104 ? -28.281 16.01 -6.75 1.0 15.59 ? 94 A 1 +ATOM 1791 C CA . ARG A1 1 104 ? -28.584 16.096 -5.321 1.0 17.86 ? 94 A 1 +ATOM 1792 C C . ARG A1 1 104 ? -28.084 14.869 -4.575 1.0 17.77 ? 94 A 1 +ATOM 1793 O O . ARG A1 1 104 ? -27.555 14.987 -3.463 1.0 17.57 ? 94 A 1 +ATOM 1794 C CB . ARG A1 1 104 ? -30.09 16.259 -5.188 1.0 18.79 ? 94 A 1 +ATOM 1795 C CG . ARG A1 1 104 ? -30.51 16.538 -3.763 1.0 19.86 ? 94 A 1 +ATOM 1796 C CD . ARG A1 1 104 ? -32.026 16.571 -3.558 1.0 23.56 ? 94 A 1 +ATOM 1797 N NE . ARG A1 1 104 ? -32.723 17.33 -4.563 1.0 24.05 ? 94 A 1 +ATOM 1798 C CZ . ARG A1 1 104 ? -32.682 18.656 -4.675 1.0 26.69 ? 94 A 1 +ATOM 1799 N NH1 . ARG A1 1 104 ? -33.33 19.259 -5.671 1.0 27.31 ? 94 A 1 +ATOM 1800 N NH2 . ARG A1 1 104 ? -32.066 19.406 -3.77 1.0 28.92 ? 94 A 1 +ATOM 1801 H H . ARG A1 1 104 ? -28.96 16.067 -7.274 1.0 18.71 ? 94 A 1 +ATOM 1802 H HA . ARG A1 1 104 ? -28.142 16.859 -4.917 1.0 21.43 ? 94 A 1 +ATOM 1803 H HB2 . ARG A1 1 104 ? -30.379 17.001 -5.741 1.0 22.55 ? 94 A 1 +ATOM 1804 H HB3 . ARG A1 1 104 ? -30.525 15.441 -5.477 1.0 22.55 ? 94 A 1 +ATOM 1805 H HG2 . ARG A1 1 104 ? -30.15 15.843 -3.19 1.0 23.83 ? 94 A 1 +ATOM 1806 H HG3 . ARG A1 1 104 ? -30.158 17.402 -3.498 1.0 23.83 ? 94 A 1 +ATOM 1807 H HD2 . ARG A1 1 104 ? -32.365 15.663 -3.583 1.0 28.27 ? 94 A 1 +ATOM 1808 H HD3 . ARG A1 1 104 ? -32.217 16.974 -2.696 1.0 28.27 ? 94 A 1 +ATOM 1809 H HE . ARG A1 1 104 ? -33.2 16.896 -5.132 1.0 28.86 ? 94 A 1 +ATOM 1810 H HH11 . ARG A1 1 104 ? -33.774 18.791 -6.24 1.0 32.78 ? 94 A 1 +ATOM 1811 H HH12 . ARG A1 1 104 ? -33.305 20.115 -5.745 1.0 32.78 ? 94 A 1 +ATOM 1812 H HH21 . ARG A1 1 104 ? -31.683 19.036 -3.095 1.0 34.71 ? 94 A 1 +ATOM 1813 H HH22 . ARG A1 1 104 ? -32.05 20.261 -3.859 1.0 34.71 ? 94 A 1 +ATOM 1814 N N . LEU A1 1 105 ? -28.234 13.679 -5.148 1.0 17.01 ? 95 A 1 +ATOM 1815 C CA . LEU A1 1 105 ? -27.759 12.48 -4.495 1.0 17.43 ? 95 A 1 +ATOM 1816 C C . LEU A1 1 105 ? -26.245 12.478 -4.359 1.0 16.61 ? 95 A 1 +ATOM 1817 O O . LEU A1 1 105 ? -25.715 12.113 -3.298 1.0 17.64 ? 95 A 1 +ATOM 1818 C CB . LEU A1 1 105 ? -28.241 11.266 -5.281 1.0 19.54 ? 95 A 1 +ATOM 1819 C CG . LEU A1 1 105 ? -28.135 9.959 -4.545 1.0 22.21 ? 95 A 1 +ATOM 1820 C CD1 . LEU A1 1 105 ? -29.04 9.943 -3.295 1.0 24.47 ? 95 A 1 +ATOM 1821 C CD2 . LEU A1 1 105 ? -28.571 8.894 -5.56 1.0 28.69 ? 95 A 1 +ATOM 1822 H H . LEU A1 1 105 ? -28.606 13.545 -5.911 1.0 20.41 ? 95 A 1 +ATOM 1823 H HA . LEU A1 1 105 ? -28.125 12.434 -3.598 1.0 20.92 ? 95 A 1 +ATOM 1824 H HB2 . LEU A1 1 105 ? -29.174 11.398 -5.51 1.0 23.45 ? 95 A 1 +ATOM 1825 H HB3 . LEU A1 1 105 ? -27.709 11.191 -6.089 1.0 23.45 ? 95 A 1 +ATOM 1826 H HG . LEU A1 1 105 ? -27.238 9.794 -4.216 1.0 26.65 ? 95 A 1 +ATOM 1827 H HD11 . LEU A1 1 105 ? -29.112 9.033 -2.969 1.0 29.37 ? 95 A 1 +ATOM 1828 H HD12 . LEU A1 1 105 ? -28.646 10.509 -2.613 1.0 29.37 ? 95 A 1 +ATOM 1829 H HD13 . LEU A1 1 105 ? -29.918 10.278 -3.536 1.0 29.37 ? 95 A 1 +ATOM 1830 H HD21 . LEU A1 1 105 ? -28.552 8.023 -5.132 1.0 34.42 ? 95 A 1 +ATOM 1831 H HD22 . LEU A1 1 105 ? -29.471 9.094 -5.862 1.0 34.42 ? 95 A 1 +ATOM 1832 H HD23 . LEU A1 1 105 ? -27.96 8.905 -6.313 1.0 34.42 ? 95 A 1 +ATOM 1833 N N . ALA A1 1 106 ? -25.521 12.917 -5.393 1.0 15.44 ? 96 A 1 +ATOM 1834 C CA . ALA A1 1 106 ? -24.07 13.006 -5.255 1.0 16.0 ? 96 A 1 +ATOM 1835 C C . ALA A1 1 106 ? -23.652 13.971 -4.166 1.0 16.36 ? 96 A 1 +ATOM 1836 O O . ALA A1 1 106 ? -22.719 13.688 -3.412 1.0 16.63 ? 96 A 1 +ATOM 1837 C CB . ALA A1 1 106 ? -23.449 13.466 -6.588 1.0 14.84 ? 96 A 1 +ATOM 1838 H H . ALA A1 1 106 ? -25.836 13.16 -6.156 1.0 18.53 ? 96 A 1 +ATOM 1839 H HA . ALA A1 1 106 ? -23.743 12.122 -5.024 1.0 19.21 ? 96 A 1 +ATOM 1840 H HB1 . ALA A1 1 106 ? -22.52 13.703 -6.439 1.0 17.81 ? 96 A 1 +ATOM 1841 H HB2 . ALA A1 1 106 ? -23.506 12.742 -7.23 1.0 17.81 ? 96 A 1 +ATOM 1842 H HB3 . ALA A1 1 106 ? -23.938 14.238 -6.915 1.0 17.81 ? 96 A 1 +ATOM 1843 N N . VAL A1 1 107 ? -24.341 15.124 -4.074 1.0 16.46 ? 97 A 1 +ATOM 1844 C CA . VAL A1 1 107 ? -24.052 16.077 -2.997 1.0 16.86 ? 97 A 1 +ATOM 1845 C C . VAL A1 1 107 ? -24.272 15.43 -1.641 1.0 18.03 ? 97 A 1 +ATOM 1846 O O . VAL A1 1 107 ? -23.455 15.596 -0.741 1.0 18.63 ? 97 A 1 +ATOM 1847 C CB . VAL A1 1 107 ? -24.883 17.332 -3.232 1.0 16.98 ? 97 A 1 +ATOM 1848 C CG1 . VAL A1 1 107 ? -24.796 18.309 -2.072 1.0 20.67 ? 97 A 1 +ATOM 1849 C CG2 . VAL A1 1 107 ? -24.49 18.031 -4.52 1.0 18.41 ? 97 A 1 +ATOM 1850 H H . VAL A1 1 107 ? -24.965 15.369 -4.613 1.0 19.75 ? 97 A 1 +ATOM 1851 H HA . VAL A1 1 107 ? -23.118 16.338 -3.009 1.0 20.24 ? 97 A 1 +ATOM 1852 H HB . VAL A1 1 107 ? -25.804 17.04 -3.306 1.0 20.38 ? 97 A 1 +ATOM 1853 H HG11 . VAL A1 1 107 ? -25.22 19.143 -2.329 1.0 24.8 ? 97 A 1 +ATOM 1854 H HG12 . VAL A1 1 107 ? -25.251 17.929 -1.304 1.0 24.8 ? 97 A 1 +ATOM 1855 H HG13 . VAL A1 1 107 ? -23.862 18.465 -1.86 1.0 24.8 ? 97 A 1 +ATOM 1856 H HG21 . VAL A1 1 107 ? -25.0 18.853 -4.602 1.0 22.09 ? 97 A 1 +ATOM 1857 H HG22 . VAL A1 1 107 ? -23.541 18.232 -4.493 1.0 22.09 ? 97 A 1 +ATOM 1858 H HG23 . VAL A1 1 107 ? -24.683 17.446 -5.269 1.0 22.09 ? 97 A 1 +ATOM 1859 N N . GLN A1 1 108 ? -25.355 14.658 -1.505 1.0 18.27 ? 98 A 1 +ATOM 1860 C CA . GLN A1 1 108 ? -25.642 13.987 -0.235 1.0 18.74 ? 98 A 1 +ATOM 1861 C C . GLN A1 1 108 ? -24.575 12.951 0.071 1.0 18.55 ? 98 A 1 +ATOM 1862 O O . GLN A1 1 108 ? -24.306 12.694 1.253 1.0 20.9 ? 98 A 1 +ATOM 1863 C CB . GLN A1 1 108 ? -27.027 13.4 -0.304 1.0 19.1 ? 98 A 1 +ATOM 1864 C CG . GLN A1 1 108 ? -28.065 14.512 -0.226 1.0 19.98 ? 98 A 1 +ATOM 1865 C CD . GLN A1 1 108 ? -29.493 14.093 -0.449 1.0 24.26 ? 98 A 1 +ATOM 1866 O OE1 . GLN A1 1 108 ? -29.771 12.97 -0.858 1.0 25.89 ? 98 A 1 +ATOM 1867 N NE2 . GLN A1 1 108 ? -30.428 15.004 -0.171 1.0 23.13 ? 98 A 1 +ATOM 1868 H H . GLN A1 1 108 ? -25.932 14.507 -2.125 1.0 21.93 ? 98 A 1 +ATOM 1869 H HA . GLN A1 1 108 ? -25.634 14.616 0.504 1.0 22.48 ? 98 A 1 +ATOM 1870 H HB2 . GLN A1 1 108 ? -27.14 12.927 -1.143 1.0 22.93 ? 98 A 1 +ATOM 1871 H HB3 . GLN A1 1 108 ? -27.163 12.793 0.44 1.0 22.93 ? 98 A 1 +ATOM 1872 H HG2 . GLN A1 1 108 ? -28.018 14.91 0.657 1.0 23.98 ? 98 A 1 +ATOM 1873 H HG3 . GLN A1 1 108 ? -27.852 15.175 -0.901 1.0 23.98 ? 98 A 1 +ATOM 1874 H HE21 . GLN A1 1 108 ? -30.198 15.78 0.119 1.0 27.76 ? 98 A 1 +ATOM 1875 H HE22 . GLN A1 1 108 ? -31.259 14.815 -0.281 1.0 27.76 ? 98 A 1 +ATOM 1876 N N . PHE A1 1 109 ? -24.049 12.262 -0.922 1.0 19.14 ? 99 A 1 +ATOM 1877 C CA . PHE A1 1 109 ? -22.95 11.33 -0.751 1.0 19.16 ? 99 A 1 +ATOM 1878 C C . PHE A1 1 109 ? -21.632 12.002 -0.48 1.0 20.68 ? 99 A 1 +ATOM 1879 O O . PHE A1 1 109 ? -20.646 11.312 -0.205 1.0 23.33 ? 99 A 1 +ATOM 1880 C CB . PHE A1 1 109 ? -22.811 10.436 -1.999 1.0 18.38 ? 99 A 1 +ATOM 1881 C CG . PHE A1 1 109 ? -23.651 9.193 -2.0 1.0 20.54 ? 99 A 1 +ATOM 1882 C CD1 . PHE A1 1 109 ? -24.975 9.224 -2.318 1.0 26.44 ? 99 A 1 +ATOM 1883 C CD2 . PHE A1 1 109 ? -23.082 7.959 -1.744 1.0 25.82 ? 99 A 1 +ATOM 1884 C CE1 . PHE A1 1 109 ? -25.751 8.051 -2.354 1.0 27.25 ? 99 A 1 +ATOM 1885 C CE2 . PHE A1 1 109 ? -23.848 6.794 -1.781 1.0 29.92 ? 99 A 1 +ATOM 1886 C CZ . PHE A1 1 109 ? -25.183 6.849 -2.083 1.0 23.96 ? 99 A 1 +ATOM 1887 H H . PHE A1 1 109 ? -24.32 12.315 -1.737 1.0 22.97 ? 99 A 1 +ATOM 1888 H HA . PHE A1 1 109 ? -23.157 10.766 0.01 1.0 23.0 ? 99 A 1 +ATOM 1889 H HB2 . PHE A1 1 109 ? -23.065 10.957 -2.777 1.0 22.05 ? 99 A 1 +ATOM 1890 H HB3 . PHE A1 1 109 ? -21.884 10.158 -2.074 1.0 22.05 ? 99 A 1 +ATOM 1891 H HD1 . PHE A1 1 109 ? -25.375 10.039 -2.517 1.0 31.73 ? 99 A 1 +ATOM 1892 H HD2 . PHE A1 1 109 ? -22.175 7.904 -1.546 1.0 30.99 ? 99 A 1 +ATOM 1893 H HE1 . PHE A1 1 109 ? -26.655 8.1 -2.564 1.0 32.69 ? 99 A 1 +ATOM 1894 H HE2 . PHE A1 1 109 ? -23.45 5.974 -1.598 1.0 35.91 ? 99 A 1 +ATOM 1895 H HZ . PHE A1 1 109 ? -25.694 6.072 -2.103 1.0 28.76 ? 99 A 1 +ATOM 1896 N N . GLY A1 1 110 ? -21.568 13.337 -0.568 1.0 20.14 ? 100 A 1 +ATOM 1897 C CA . GLY A1 1 110 ? -20.394 14.085 -0.178 1.0 20.48 ? 100 A 1 +ATOM 1898 C C . GLY A1 1 110 ? -19.597 14.761 -1.272 1.0 20.13 ? 100 A 1 +ATOM 1899 O O . GLY A1 1 110 ? -18.539 15.328 -0.989 1.0 21.86 ? 100 A 1 +ATOM 1900 H H . GLY A1 1 110 ? -22.21 13.83 -0.858 1.0 24.16 ? 100 A 1 +ATOM 1901 H HA2 . GLY A1 1 110 ? -20.673 14.779 0.44 1.0 24.58 ? 100 A 1 +ATOM 1902 H HA3 . GLY A1 1 110 ? -19.791 13.478 0.28 1.0 24.58 ? 100 A 1 +ATOM 1903 N N . ALA A1 1 111 ? -20.005 14.675 -2.56 1.0 19.63 ? 101 A 1 +ATOM 1904 C CA . ALA A1 1 111 ? -19.303 15.392 -3.622 1.0 18.21 ? 101 A 1 +ATOM 1905 C C . ALA A1 1 111 ? -19.462 16.889 -3.41 1.0 16.3 ? 101 A 1 +ATOM 1906 O O . ALA A1 1 111 ? -20.561 17.382 -3.225 1.0 19.7 ? 101 A 1 +ATOM 1907 C CB . ALA A1 1 111 ? -19.892 15.002 -4.973 1.0 21.16 ? 101 A 1 +ATOM 1908 H H . ALA A1 1 111 ? -20.678 14.212 -2.829 1.0 23.55 ? 101 A 1 +ATOM 1909 H HA . ALA A1 1 111 ? -18.359 15.167 -3.613 1.0 21.85 ? 101 A 1 +ATOM 1910 H HB1 . ALA A1 1 111 ? -19.428 15.487 -5.673 1.0 25.4 ? 101 A 1 +ATOM 1911 H HB2 . ALA A1 1 111 ? -19.78 14.047 -5.103 1.0 25.4 ? 101 A 1 +ATOM 1912 H HB3 . ALA A1 1 111 ? -20.835 15.228 -4.984 1.0 25.4 ? 101 A 1 +ATOM 1913 N N . LYS A1 1 112 ? -18.339 17.596 -3.546 1.0 15.96 ? 102 A 1 +ATOM 1914 C CA . LYS A1 1 112 ? -18.362 19.051 -3.39 1.0 16.22 ? 102 A 1 +ATOM 1915 C C . LYS A1 1 112 ? -18.31 19.818 -4.695 1.0 14.89 ? 102 A 1 +ATOM 1916 O O . LYS A1 1 112 ? -18.438 21.064 -4.682 1.0 15.68 ? 102 A 1 +ATOM 1917 C CB . LYS A1 1 112 ? -17.237 19.49 -2.461 1.0 17.91 ? 102 A 1 +ATOM 1918 C CG . LYS A1 1 112 ? -17.488 18.882 -1.023 1.0 22.19 ? 102 A 1 +ATOM 1919 C CD . LYS A1 1 112 ? -16.602 19.533 0.016 1.0 29.85 ? 102 A 1 +ATOM 1920 C CE . LYS A1 1 112 ? -17.034 19.13 1.469 1.0 36.89 ? 102 A 1 +ATOM 1921 N NZ . LYS A1 1 112 ? -17.071 17.667 1.653 1.0 87.05 ? 102 A 1 +ATOM 1922 H H . LYS A1 1 112 ? -17.567 17.262 -3.725 1.0 19.15 ? 102 A 1 +ATOM 1923 H HA . LYS A1 1 112 ? -19.2 19.304 -2.971 1.0 19.46 ? 102 A 1 +ATOM 1924 H HB2 . LYS A1 1 112 ? -16.387 19.165 -2.797 1.0 21.49 ? 102 A 1 +ATOM 1925 H HB3 . LYS A1 1 112 ? -17.221 20.457 -2.396 1.0 21.49 ? 102 A 1 +ATOM 1926 H HG2 . LYS A1 1 112 ? -18.412 19.028 -0.769 1.0 26.63 ? 102 A 1 +ATOM 1927 H HG3 . LYS A1 1 112 ? -17.293 17.932 -1.037 1.0 26.63 ? 102 A 1 +ATOM 1928 H HD2 . LYS A1 1 112 ? -15.684 19.249 -0.12 1.0 35.81 ? 102 A 1 +ATOM 1929 H HD3 . LYS A1 1 112 ? -16.665 20.498 -0.066 1.0 35.81 ? 102 A 1 +ATOM 1930 H HE2 . LYS A1 1 112 ? -16.401 19.499 2.104 1.0 44.27 ? 102 A 1 +ATOM 1931 H HE3 . LYS A1 1 112 ? -17.922 19.479 1.645 1.0 44.27 ? 102 A 1 +ATOM 1932 H HZ1 . LYS A1 1 112 ? -17.643 17.301 1.078 1.0 104.47 ? 102 A 1 +ATOM 1933 H HZ2 . LYS A1 1 112 ? -16.262 17.322 1.515 1.0 104.47 ? 102 A 1 +ATOM 1934 H HZ3 . LYS A1 1 112 ? -17.33 17.471 2.482 1.0 104.47 ? 102 A 1 +ATOM 1935 N N . THR A1 1 113 ? -18.147 19.102 -5.8 1.0 13.98 ? 103 A 1 +ATOM 1936 C CA . THR A1 1 113 ? -18.277 19.636 -7.141 1.0 13.19 ? 103 A 1 +ATOM 1937 C C . THR A1 1 113 ? -19.093 18.639 -7.935 1.0 12.81 ? 103 A 1 +ATOM 1938 O O . THR A1 1 113 ? -18.889 17.436 -7.841 1.0 13.78 ? 103 A 1 +ATOM 1939 C CB . THR A1 1 113 ? -16.914 19.774 -7.834 1.0 13.09 ? 103 A 1 +ATOM 1940 O OG1 . THR A1 1 113 ? -16.083 20.701 -7.143 1.0 14.76 ? 103 A 1 +ATOM 1941 C CG2 . THR A1 1 113 ? -17.037 20.292 -9.259 1.0 14.76 ? 103 A 1 +ATOM 1942 H H . THR A1 1 113 ? -17.953 18.264 -5.795 1.0 16.77 ? 103 A 1 +ATOM 1943 H HA . THR A1 1 113 ? -18.704 20.507 -7.112 1.0 15.82 ? 103 A 1 +ATOM 1944 H HB . THR A1 1 113 ? -16.522 18.887 -7.841 1.0 15.71 ? 103 A 1 +ATOM 1945 H HG1 . THR A1 1 113 ? -15.928 20.424 -6.365 1.0 17.72 ? 103 A 1 +ATOM 1946 H HG21 . THR A1 1 113 ? -16.162 20.532 -9.601 1.0 17.71 ? 103 A 1 +ATOM 1947 H HG22 . THR A1 1 113 ? -17.422 19.607 -9.829 1.0 17.71 ? 103 A 1 +ATOM 1948 H HG23 . THR A1 1 113 ? -17.609 21.075 -9.279 1.0 17.71 ? 103 A 1 +ATOM 1949 N N . ILE A1 1 114 ? -20.011 19.156 -8.745 1.0 13.08 ? 104 A 1 +ATOM 1950 C CA . ILE A1 1 114 ? -20.727 18.394 -9.758 1.0 13.61 ? 104 A 1 +ATOM 1951 C C . ILE A1 1 114 ? -20.203 18.828 -11.121 1.0 12.8 ? 104 A 1 +ATOM 1952 O O . ILE A1 1 114 ? -20.152 20.037 -11.415 1.0 13.46 ? 104 A 1 +ATOM 1953 C CB . ILE A1 1 114 ? -22.234 18.629 -9.687 1.0 14.2 ? 104 A 1 +ATOM 1954 C CG1 . ILE A1 1 114 ? -22.779 18.297 -8.312 1.0 16.81 ? 104 A 1 +ATOM 1955 C CG2 . ILE A1 1 114 ? -22.953 17.853 -10.797 1.0 15.44 ? 104 A 1 +ATOM 1956 C CD1 . ILE A1 1 114 ? -22.628 16.865 -7.898 1.0 15.82 ? 104 A 1 +ATOM 1957 H H . ILE A1 1 114 ? -20.245 19.983 -8.724 1.0 15.7 ? 104 A 1 +ATOM 1958 H HA . ILE A1 1 114 ? -20.552 17.449 -9.624 1.0 16.33 ? 104 A 1 +ATOM 1959 H HB . ILE A1 1 114 ? -22.402 19.573 -9.832 1.0 17.04 ? 104 A 1 +ATOM 1960 H HG12 . ILE A1 1 114 ? -22.312 18.839 -7.658 1.0 20.17 ? 104 A 1 +ATOM 1961 H HG13 . ILE A1 1 114 ? -23.727 18.505 -8.299 1.0 20.17 ? 104 A 1 +ATOM 1962 H HG21 . ILE A1 1 114 ? -23.906 17.849 -10.614 1.0 18.53 ? 104 A 1 +ATOM 1963 H HG22 . ILE A1 1 114 ? -22.782 18.288 -11.648 1.0 18.53 ? 104 A 1 +ATOM 1964 H HG23 . ILE A1 1 114 ? -22.616 16.944 -10.817 1.0 18.53 ? 104 A 1 +ATOM 1965 H HD11 . ILE A1 1 114 ? -23.05 16.74 -7.034 1.0 18.98 ? 104 A 1 +ATOM 1966 H HD12 . ILE A1 1 114 ? -23.056 16.299 -8.56 1.0 18.98 ? 104 A 1 +ATOM 1967 H HD13 . ILE A1 1 114 ? -21.684 16.651 -7.84 1.0 18.98 ? 104 A 1 +ATOM 1968 N N . VAL A1 1 115 ? -19.837 17.852 -11.934 1.0 12.77 ? 105 A 1 +ATOM 1969 C CA . VAL A1 1 115 ? -19.363 18.063 -13.323 1.0 12.82 ? 105 A 1 +ATOM 1970 C C . VAL A1 1 115 ? -20.46 17.593 -14.247 1.0 13.05 ? 105 A 1 +ATOM 1971 O O . VAL A1 1 115 ? -20.88 16.447 -14.172 1.0 14.67 ? 105 A 1 +ATOM 1972 C CB . VAL A1 1 115 ? -18.09 17.272 -13.601 1.0 11.95 ? 105 A 1 +ATOM 1973 C CG1 . VAL A1 1 115 ? -17.596 17.57 -15.017 1.0 14.34 ? 105 A 1 +ATOM 1974 C CG2 . VAL A1 1 115 ? -16.99 17.586 -12.616 1.0 14.13 ? 105 A 1 +ATOM 1975 H H . VAL A1 1 115 ? -19.848 17.022 -11.709 1.0 15.32 ? 105 A 1 +ATOM 1976 H HA . VAL A1 1 115 ? -19.194 19.007 -13.467 1.0 15.38 ? 105 A 1 +ATOM 1977 H HB . VAL A1 1 115 ? -18.304 16.331 -13.509 1.0 14.34 ? 105 A 1 +ATOM 1978 H HG11 . VAL A1 1 115 ? -16.705 17.202 -15.125 1.0 17.21 ? 105 A 1 +ATOM 1979 H HG12 . VAL A1 1 115 ? -18.202 17.161 -15.655 1.0 17.21 ? 105 A 1 +ATOM 1980 H HG13 . VAL A1 1 115 ? -17.576 18.53 -15.149 1.0 17.21 ? 105 A 1 +ATOM 1981 H HG21 . VAL A1 1 115 ? -16.265 16.955 -12.741 1.0 16.95 ? 105 A 1 +ATOM 1982 H HG22 . VAL A1 1 115 ? -16.674 18.489 -12.774 1.0 16.95 ? 105 A 1 +ATOM 1983 H HG23 . VAL A1 1 115 ? -17.342 17.511 -11.715 1.0 16.95 ? 105 A 1 +ATOM 1984 N N . LEU A1 1 116 ? -20.96 18.492 -15.086 1.0 12.48 ? 106 A 1 +ATOM 1985 C CA . LEU A1 1 116 ? -21.943 18.126 -16.114 1.0 12.64 ? 106 A 1 +ATOM 1986 C C . LEU A1 1 116 ? -21.177 18.025 -17.439 1.0 12.87 ? 106 A 1 +ATOM 1987 O O . LEU A1 1 116 ? -20.604 19.026 -17.876 1.0 13.06 ? 106 A 1 +ATOM 1988 C CB . LEU A1 1 116 ? -23.036 19.159 -16.206 1.0 13.39 ? 106 A 1 +ATOM 1989 C CG . LEU A1 1 116 ? -23.807 19.411 -14.887 1.0 14.35 ? 106 A 1 +ATOM 1990 C CD1 . LEU A1 1 116 ? -24.824 20.505 -15.138 1.0 17.73 ? 106 A 1 +ATOM 1991 C CD2 . LEU A1 1 116 ? -24.475 18.144 -14.418 1.0 16.07 ? 106 A 1 +ATOM 1992 H H . LEU A1 1 116 ? -20.748 19.325 -15.083 1.0 14.98 ? 106 A 1 +ATOM 1993 H HA . LEU A1 1 116 ? -22.364 17.276 -15.908 1.0 15.17 ? 106 A 1 +ATOM 1994 H HB2 . LEU A1 1 116 ? -22.639 20.001 -16.478 1.0 16.06 ? 106 A 1 +ATOM 1995 H HB3 . LEU A1 1 116 ? -23.68 18.866 -16.869 1.0 16.06 ? 106 A 1 +ATOM 1996 H HG . LEU A1 1 116 ? -23.203 19.689 -14.181 1.0 17.22 ? 106 A 1 +ATOM 1997 H HD11 . LEU A1 1 116 ? -25.312 20.677 -14.318 1.0 21.28 ? 106 A 1 +ATOM 1998 H HD12 . LEU A1 1 116 ? -24.36 21.309 -15.421 1.0 21.28 ? 106 A 1 +ATOM 1999 H HD13 . LEU A1 1 116 ? -25.436 20.214 -15.832 1.0 21.28 ? 106 A 1 +ATOM 2000 H HD21 . LEU A1 1 116 ? -25.064 18.354 -13.676 1.0 19.28 ? 106 A 1 +ATOM 2001 H HD22 . LEU A1 1 116 ? -24.987 17.767 -15.15 1.0 19.28 ? 106 A 1 +ATOM 2002 H HD23 . LEU A1 1 116 ? -23.794 17.515 -14.132 1.0 19.28 ? 106 A 1 +ATOM 2003 N N . GLN A1 1 117 ? -21.102 16.839 -17.999 1.0 12.2 ? 107 A 1 +ATOM 2004 C CA . GLN A1 1 117 ? -20.397 16.613 -19.265 1.0 12.65 ? 107 A 1 +ATOM 2005 C C . GLN A1 1 117 ? -21.364 15.971 -20.235 1.0 12.44 ? 107 A 1 +ATOM 2006 O O . GLN A1 1 117 ? -22.228 15.173 -19.866 1.0 13.26 ? 107 A 1 +ATOM 2007 C CB . GLN A1 1 117 ? -19.168 15.733 -19.052 1.0 12.51 ? 107 A 1 +ATOM 2008 C CG . GLN A1 1 117 ? -18.257 15.708 -20.301 1.0 13.33 ? 107 A 1 +ATOM 2009 C CD . GLN A1 1 117 ? -17.039 14.862 -20.122 1.0 14.7 ? 107 A 1 +ATOM 2010 O OE1 . GLN A1 1 117 ? -17.104 13.634 -20.291 1.0 16.38 ? 107 A 1 +ATOM 2011 N NE2 . GLN A1 1 117 ? -15.912 15.477 -19.813 1.0 13.98 ? 107 A 1 +ATOM 2012 H H . GLN A1 1 117 ? -21.454 16.129 -17.668 1.0 14.64 ? 107 A 1 +ATOM 2013 H HA . GLN A1 1 117 ? -20.087 17.448 -19.649 1.0 15.17 ? 107 A 1 +ATOM 2014 H HB2 . GLN A1 1 117 ? -18.653 16.078 -18.306 1.0 15.01 ? 107 A 1 +ATOM 2015 H HB3 . GLN A1 1 117 ? -19.454 14.825 -18.866 1.0 15.01 ? 107 A 1 +ATOM 2016 H HG2 . GLN A1 1 117 ? -18.759 15.353 -21.051 1.0 16.0 ? 107 A 1 +ATOM 2017 H HG3 . GLN A1 1 117 ? -17.965 16.613 -20.496 1.0 16.0 ? 107 A 1 +ATOM 2018 H HE21 . GLN A1 1 117 ? -15.899 16.332 -19.722 1.0 16.78 ? 107 A 1 +ATOM 2019 H HE22 . GLN A1 1 117 ? -15.19 15.022 -19.702 1.0 16.78 ? 107 A 1 +ATOM 2020 N N . SER A1 1 118 ? -21.204 16.32 -21.519 1.0 12.68 ? 108 A 1 +ATOM 2021 C CA . SER A1 1 118 ? -22.047 15.737 -22.55 1.0 13.6 ? 108 A 1 +ATOM 2022 C C . SER A1 1 118 ? -21.337 15.803 -23.891 1.0 13.37 ? 108 A 1 +ATOM 2023 O O . SER A1 1 118 ? -20.369 16.531 -24.091 1.0 13.4 ? 108 A 1 +ATOM 2024 C CB . SER A1 1 118 ? -23.37 16.482 -22.639 1.0 13.97 ? 108 A 1 +ATOM 2025 O OG . SER A1 1 118 ? -23.208 17.819 -22.981 1.0 14.77 ? 108 A 1 +ATOM 2026 H H . SER A1 1 118 ? -20.621 16.883 -21.805 1.0 15.22 ? 108 A 1 +ATOM 2027 H HA . SER A1 1 118 ? -22.199 14.804 -22.332 1.0 16.32 ? 108 A 1 +ATOM 2028 H HB2 . SER A1 1 118 ? -23.92 16.055 -23.314 1.0 16.76 ? 108 A 1 +ATOM 2029 H HB3 . SER A1 1 118 ? -23.809 16.435 -21.775 1.0 16.76 ? 108 A 1 +ATOM 2030 H HG . SER A1 1 118 ? -22.918 17.881 -23.767 1.0 17.73 ? 108 A 1 +ATOM 2031 N N . GLY A1 1 119 ? -21.914 15.086 -24.847 1.0 13.33 ? 109 A 1 +ATOM 2032 C CA . GLY A1 1 119 ? -21.678 15.434 -26.241 1.0 13.09 ? 109 A 1 +ATOM 2033 C C . GLY A1 1 119 ? -22.16 16.839 -26.514 1.0 14.04 ? 109 A 1 +ATOM 2034 O O . GLY A1 1 119 ? -22.906 17.449 -25.74 1.0 13.31 ? 109 A 1 +ATOM 2035 H H . GLY A1 1 119 ? -22.432 14.412 -24.719 1.0 16.0 ? 109 A 1 +ATOM 2036 H HA2 . GLY A1 1 119 ? -20.729 15.383 -26.438 1.0 15.71 ? 109 A 1 +ATOM 2037 H HA3 . GLY A1 1 119 ? -22.154 14.819 -26.82 1.0 15.71 ? 109 A 1 +ATOM 2038 N N . GLU A1 1 120 ? -21.776 17.392 -27.66 1.0 13.75 ? 110 A 1 +ATOM 2039 C CA . GLU A1 1 120 ? -22.276 18.693 -28.063 1.0 13.45 ? 110 A 1 +ATOM 2040 C C . GLU A1 1 120 ? -23.704 18.503 -28.568 1.0 14.77 ? 110 A 1 +ATOM 2041 O O . GLU A1 1 120 ? -23.951 18.304 -29.77 1.0 15.41 ? 110 A 1 +ATOM 2042 C CB . GLU A1 1 120 ? -21.378 19.309 -29.125 1.0 14.23 ? 110 A 1 +ATOM 2043 C CG . GLU A1 1 120 ? -20.036 19.747 -28.621 1.0 14.93 ? 110 A 1 +ATOM 2044 C CD . GLU A1 1 120 ? -19.29 20.711 -29.55 1.0 14.55 ? 110 A 1 +ATOM 2045 O OE1 . GLU A1 1 120 ? -19.896 21.129 -30.565 1.0 15.56 ? 110 A 1 +ATOM 2046 O OE2 . GLU A1 1 120 ? -18.13 21.0 -29.247 1.0 15.58 ? 110 A 1 +ATOM 2047 H H . GLU A1 1 120 ? -21.228 17.031 -28.217 1.0 16.5 ? 110 A 1 +ATOM 2048 H HA . GLU A1 1 120 ? -22.292 19.291 -27.3 1.0 16.14 ? 110 A 1 +ATOM 2049 H HB2 . GLU A1 1 120 ? -21.23 18.653 -29.823 1.0 17.07 ? 110 A 1 +ATOM 2050 H HB3 . GLU A1 1 120 ? -21.823 20.089 -29.491 1.0 17.07 ? 110 A 1 +ATOM 2051 H HG2 . GLU A1 1 120 ? -20.157 20.196 -27.77 1.0 17.91 ? 110 A 1 +ATOM 2052 H HG3 . GLU A1 1 120 ? -19.478 18.962 -28.505 1.0 17.91 ? 110 A 1 +ATOM 2053 N N . ASP A1 1 121 ? -24.663 18.573 -27.633 1.0 14.65 ? 111 A 1 +ATOM 2054 C CA . ASP A1 1 121 ? -26.062 18.225 -27.874 1.0 14.74 ? 111 A 1 +ATOM 2055 C C . ASP A1 1 121 ? -26.884 19.505 -27.89 1.0 16.49 ? 111 A 1 +ATOM 2056 O O . ASP A1 1 121 ? -27.129 20.115 -26.845 1.0 15.77 ? 111 A 1 +ATOM 2057 C CB . ASP A1 1 121 ? -26.57 17.284 -26.799 1.0 14.79 ? 111 A 1 +ATOM 2058 C CG . ASP A1 1 121 ? -28.012 16.911 -27.0 1.0 16.53 ? 111 A 1 +ATOM 2059 O OD1 . ASP A1 1 121 ? -28.7 17.493 -27.889 1.0 16.22 ? 111 A 1 +ATOM 2060 O OD2 . ASP A1 1 121 ? -28.508 16.039 -26.28 1.0 15.68 ? 111 A 1 +ATOM 2061 H H . ASP A1 1 121 ? -24.518 18.83 -26.825 1.0 17.58 ? 111 A 1 +ATOM 2062 H HA . ASP A1 1 121 ? -26.147 17.78 -28.732 1.0 17.69 ? 111 A 1 +ATOM 2063 H HB2 . ASP A1 1 121 ? -26.043 16.47 -26.815 1.0 17.75 ? 111 A 1 +ATOM 2064 H HB3 . ASP A1 1 121 ? -26.488 17.717 -25.935 1.0 17.75 ? 111 A 1 +ATOM 2065 N N . PRO A1 1 122 ? -27.289 19.994 -29.082 1.0 15.75 ? 112 A 1 +ATOM 2066 C CA . PRO A1 1 122 ? -27.978 21.275 -29.163 1.0 16.31 ? 112 A 1 +ATOM 2067 C C . PRO A1 1 122 ? -29.253 21.354 -28.382 1.0 17.19 ? 112 A 1 +ATOM 2068 O O . PRO A1 1 122 ? -29.76 22.443 -28.114 1.0 17.55 ? 112 A 1 +ATOM 2069 C CB . PRO A1 1 122 ? -28.195 21.427 -30.685 1.0 17.38 ? 112 A 1 +ATOM 2070 C CG . PRO A1 1 122 ? -27.151 20.599 -31.305 1.0 21.55 ? 112 A 1 +ATOM 2071 C CD . PRO A1 1 122 ? -27.012 19.401 -30.409 1.0 16.84 ? 112 A 1 +ATOM 2072 H HA . PRO A1 1 122 ? -27.405 21.99 -28.846 1.0 19.57 ? 112 A 1 +ATOM 2073 H HB2 . PRO A1 1 122 ? -29.079 21.107 -30.926 1.0 20.85 ? 112 A 1 +ATOM 2074 H HB3 . PRO A1 1 122 ? -28.098 22.357 -30.941 1.0 20.85 ? 112 A 1 +ATOM 2075 H HG2 . PRO A1 1 122 ? -27.426 20.334 -32.196 1.0 25.86 ? 112 A 1 +ATOM 2076 H HG3 . PRO A1 1 122 ? -26.319 21.096 -31.348 1.0 25.86 ? 112 A 1 +ATOM 2077 H HD2 . PRO A1 1 122 ? -27.662 18.717 -30.632 1.0 20.21 ? 112 A 1 +ATOM 2078 H HD3 . PRO A1 1 122 ? -26.115 19.033 -30.45 1.0 20.21 ? 112 A 1 +ATOM 2079 N N . TYR A1 1 123 ? -29.88 20.231 -28.015 1.0 16.21 ? 113 A 1 +ATOM 2080 C CA . TYR A1 1 123 ? -31.145 20.297 -27.293 1.0 17.36 ? 113 A 1 +ATOM 2081 C C . TYR A1 1 123 ? -31.087 21.237 -26.093 1.0 16.04 ? 113 A 1 +ATOM 2082 O O . TYR A1 1 123 ? -32.039 21.942 -25.785 1.0 17.76 ? 113 A 1 +ATOM 2083 C CB . TYR A1 1 123 ? -31.607 18.903 -26.806 1.0 16.93 ? 113 A 1 +ATOM 2084 C CG . TYR A1 1 123 ? -32.848 18.983 -25.987 1.0 17.71 ? 113 A 1 +ATOM 2085 C CD1 . TYR A1 1 123 ? -34.102 19.036 -26.579 1.0 20.26 ? 113 A 1 +ATOM 2086 C CD2 . TYR A1 1 123 ? -32.763 19.093 -24.604 1.0 17.93 ? 113 A 1 +ATOM 2087 C CE1 . TYR A1 1 123 ? -35.236 19.162 -25.809 1.0 23.02 ? 113 A 1 +ATOM 2088 C CE2 . TYR A1 1 123 ? -33.893 19.213 -23.844 1.0 20.55 ? 113 A 1 +ATOM 2089 C CZ . TYR A1 1 123 ? -35.095 19.26 -24.455 1.0 20.76 ? 113 A 1 +ATOM 2090 O OH . TYR A1 1 123 ? -36.265 19.397 -23.744 1.0 25.67 ? 113 A 1 +ATOM 2091 H H . TYR A1 1 123 ? -29.595 19.435 -28.169 1.0 19.46 ? 113 A 1 +ATOM 2092 H HA . TYR A1 1 123 ? -31.796 20.632 -27.93 1.0 20.84 ? 113 A 1 +ATOM 2093 H HB2 . TYR A1 1 123 ? -31.786 18.34 -27.574 1.0 20.32 ? 113 A 1 +ATOM 2094 H HB3 . TYR A1 1 123 ? -30.908 18.509 -26.261 1.0 20.32 ? 113 A 1 +ATOM 2095 H HD1 . TYR A1 1 123 ? -34.177 18.987 -27.505 1.0 24.31 ? 113 A 1 +ATOM 2096 H HD2 . TYR A1 1 123 ? -31.929 19.085 -24.191 1.0 21.51 ? 113 A 1 +ATOM 2097 H HE1 . TYR A1 1 123 ? -36.079 19.179 -26.202 1.0 27.63 ? 113 A 1 +ATOM 2098 H HE2 . TYR A1 1 123 ? -33.834 19.262 -22.918 1.0 24.66 ? 113 A 1 +ATOM 2099 H HH . TYR A1 1 123 ? -36.095 19.487 -22.926 1.0 30.81 ? 113 A 1 +ATOM 2100 N N . TYR A1 1 124 ? -29.988 21.172 -25.344 1.0 15.72 ? 114 A 1 +ATOM 2101 C CA . TYR A1 1 124 ? -29.925 21.795 -24.024 1.0 16.29 ? 114 A 1 +ATOM 2102 C C . TYR A1 1 124 ? -29.482 23.237 -24.064 1.0 17.53 ? 114 A 1 +ATOM 2103 O O . TYR A1 1 124 ? -29.503 23.936 -23.035 1.0 17.82 ? 114 A 1 +ATOM 2104 C CB . TYR A1 1 124 ? -28.936 21.021 -23.113 1.0 15.61 ? 114 A 1 +ATOM 2105 C CG . TYR A1 1 124 ? -29.356 19.614 -22.806 1.0 14.3 ? 114 A 1 +ATOM 2106 C CD1 . TYR A1 1 124 ? -29.015 18.567 -23.624 1.0 15.43 ? 114 A 1 +ATOM 2107 C CD2 . TYR A1 1 124 ? -30.017 19.315 -21.624 1.0 16.05 ? 114 A 1 +ATOM 2108 C CE1 . TYR A1 1 124 ? -29.375 17.285 -23.356 1.0 15.16 ? 114 A 1 +ATOM 2109 C CE2 . TYR A1 1 124 ? -30.363 18.016 -21.329 1.0 16.03 ? 114 A 1 +ATOM 2110 C CZ . TYR A1 1 124 ? -30.049 17.008 -22.186 1.0 15.52 ? 114 A 1 +ATOM 2111 O OH . TYR A1 1 124 ? -30.33 15.695 -21.919 1.0 17.17 ? 114 A 1 +ATOM 2112 H H . TYR A1 1 124 ? -29.264 20.772 -25.579 1.0 18.86 ? 114 A 1 +ATOM 2113 H HA . TYR A1 1 124 ? -30.812 21.754 -23.634 1.0 19.54 ? 114 A 1 +ATOM 2114 H HB2 . TYR A1 1 124 ? -28.074 20.981 -23.556 1.0 18.73 ? 114 A 1 +ATOM 2115 H HB3 . TYR A1 1 124 ? -28.855 21.495 -22.271 1.0 18.73 ? 114 A 1 +ATOM 2116 H HD1 . TYR A1 1 124 ? -28.518 18.742 -24.39 1.0 18.52 ? 114 A 1 +ATOM 2117 H HD2 . TYR A1 1 124 ? -30.228 19.996 -21.027 1.0 19.26 ? 114 A 1 +ATOM 2118 H HE1 . TYR A1 1 124 ? -29.169 16.603 -23.954 1.0 18.19 ? 114 A 1 +ATOM 2119 H HE2 . TYR A1 1 124 ? -30.815 17.826 -20.539 1.0 19.24 ? 114 A 1 +ATOM 2120 H HH . TYR A1 1 124 ? -30.745 15.632 -21.192 1.0 20.6 ? 114 A 1 +ATOM 2121 N N . MET A1 1 125 ? -29.059 23.721 -25.211 1.0 18.28 ? 115 A 1 +ATOM 2122 C CA . MET A1 1 125 ? -28.132 24.859 -25.255 1.0 18.49 ? 115 A 1 +ATOM 2123 C C . MET A1 1 125 ? -28.874 26.105 -25.703 1.0 21.2 ? 115 A 1 +ATOM 2124 O O . MET A1 1 125 ? -29.493 26.071 -26.781 1.0 21.1 ? 115 A 1 +ATOM 2125 C CB . MET A1 1 125 ? -26.977 24.623 -26.209 1.0 18.29 ? 115 A 1 +ATOM 2126 C CG . MET A1 1 125 ? -26.278 23.302 -26.019 1.0 16.72 ? 115 A 1 +ATOM 2127 S SD . MET A1 1 125 ? -25.729 23.013 -24.343 1.0 18.06 ? 115 A 1 +ATOM 2128 C CE . MET A1 1 125 ? -24.923 21.481 -24.586 1.0 18.06 ? 115 A 1 +ATOM 2129 H H . MET A1 1 125 ? -29.286 23.417 -25.982 1.0 21.94 ? 115 A 1 +ATOM 2130 H HA . MET A1 1 125 ? -27.762 24.973 -24.365 1.0 22.19 ? 115 A 1 +ATOM 2131 H HB2 . MET A1 1 125 ? -27.316 24.648 -27.117 1.0 21.95 ? 115 A 1 +ATOM 2132 H HB3 . MET A1 1 125 ? -26.32 25.325 -26.08 1.0 21.95 ? 115 A 1 +ATOM 2133 H HG2 . MET A1 1 125 ? -26.89 22.588 -26.257 1.0 20.06 ? 115 A 1 +ATOM 2134 H HG3 . MET A1 1 125 ? -25.498 23.276 -26.595 1.0 20.06 ? 115 A 1 +ATOM 2135 H HE1 . MET A1 1 125 ? -24.59 21.16 -23.733 1.0 21.67 ? 115 A 1 +ATOM 2136 H HE2 . MET A1 1 125 ? -25.558 20.846 -24.953 1.0 21.67 ? 115 A 1 +ATOM 2137 H HE3 . MET A1 1 125 ? -24.186 21.606 -25.203 1.0 21.67 ? 115 A 1 +ATOM 2138 N N . PRO A1 1 126 ? -28.848 27.242 -24.972 1.0 18.85 ? 116 A 1 +ATOM 2139 C CA . PRO A1 1 126 ? -28.198 27.417 -23.659 1.0 19.25 ? 116 A 1 +ATOM 2140 C C . PRO A1 1 126 ? -29.114 27.275 -22.473 1.0 18.86 ? 116 A 1 +ATOM 2141 O O . PRO A1 1 126 ? -28.591 27.163 -21.358 1.0 17.76 ? 116 A 1 +ATOM 2142 C CB . PRO A1 1 126 ? -27.734 28.885 -23.739 1.0 20.32 ? 116 A 1 +ATOM 2143 C CG . PRO A1 1 126 ? -28.788 29.584 -24.541 1.0 21.89 ? 116 A 1 +ATOM 2144 C CD . PRO A1 1 126 ? -29.257 28.548 -25.54 1.0 20.64 ? 116 A 1 +ATOM 2145 H HA . PRO A1 1 126 ? -27.467 26.786 -23.57 1.0 23.1 ? 116 A 1 +ATOM 2146 H HB2 . PRO A1 1 126 ? -27.671 29.261 -22.847 1.0 24.38 ? 116 A 1 +ATOM 2147 H HB3 . PRO A1 1 126 ? -26.872 28.935 -24.181 1.0 24.38 ? 116 A 1 +ATOM 2148 H HG2 . PRO A1 1 126 ? -29.515 29.864 -23.962 1.0 26.27 ? 116 A 1 +ATOM 2149 H HG3 . PRO A1 1 126 ? -28.407 30.355 -24.991 1.0 26.27 ? 116 A 1 +ATOM 2150 H HD2 . PRO A1 1 126 ? -30.222 28.585 -25.638 1.0 24.76 ? 116 A 1 +ATOM 2151 H HD3 . PRO A1 1 126 ? -28.831 28.69 -26.4 1.0 24.76 ? 116 A 1 +ATOM 2152 N N . ASP A1 1 127 ? -30.407 27.38 -22.618 1.0 18.94 ? 117 A 1 +ATOM 2153 C CA . ASP A1 1 127 ? -31.258 27.71 -21.491 1.0 19.75 ? 117 A 1 +ATOM 2154 C C . ASP A1 1 127 ? -31.505 26.513 -20.584 1.0 18.99 ? 117 A 1 +ATOM 2155 O O . ASP A1 1 127 ? -31.697 26.69 -19.378 1.0 20.4 ? 117 A 1 +ATOM 2156 C CB . ASP A1 1 127 ? -32.604 28.267 -21.96 1.0 23.81 ? 117 A 1 +ATOM 2157 C CG . ASP A1 1 127 ? -32.46 29.595 -22.67 1.0 27.12 ? 117 A 1 +ATOM 2158 O OD1 . ASP A1 1 127 ? -31.499 30.356 -22.405 1.0 26.44 ? 117 A 1 +ATOM 2159 O OD2 . ASP A1 1 127 ? -33.327 29.924 -23.519 1.0 33.63 ? 117 A 1 +ATOM 2160 H H . ASP A1 1 127 ? -30.827 27.267 -23.36 1.0 22.73 ? 117 A 1 +ATOM 2161 H HA . ASP A1 1 127 ? -30.809 28.402 -20.98 1.0 23.69 ? 117 A 1 +ATOM 2162 H HB2 . ASP A1 1 127 ? -33.011 27.638 -22.576 1.0 28.57 ? 117 A 1 +ATOM 2163 H HB3 . ASP A1 1 127 ? -33.18 28.398 -21.19 1.0 28.57 ? 117 A 1 +ATOM 2164 N N . VAL A1 1 128 ? -31.536 25.292 -21.111 1.0 18.95 ? 118 A 1 +ATOM 2165 C CA . VAL A1 1 128 ? -31.775 24.143 -20.252 1.0 18.63 ? 118 A 1 +ATOM 2166 C C . VAL A1 1 128 ? -30.578 23.98 -19.309 1.0 18.64 ? 118 A 1 +ATOM 2167 O O . VAL A1 1 128 ? -30.745 23.726 -18.103 1.0 17.85 ? 118 A 1 +ATOM 2168 C CB . VAL A1 1 128 ? -32.042 22.856 -21.04 1.0 19.76 ? 118 A 1 +ATOM 2169 C CG1 . VAL A1 1 128 ? -32.447 21.737 -20.118 1.0 20.84 ? 118 A 1 +ATOM 2170 C CG2 . VAL A1 1 128 ? -33.15 23.053 -22.11 1.0 21.88 ? 118 A 1 +ATOM 2171 H H . VAL A1 1 128 ? -31.425 25.108 -21.944 1.0 22.74 ? 118 A 1 +ATOM 2172 H HA . VAL A1 1 128 ? -32.583 24.313 -19.743 1.0 22.36 ? 118 A 1 +ATOM 2173 H HB . VAL A1 1 128 ? -31.216 22.623 -21.492 1.0 23.71 ? 118 A 1 +ATOM 2174 H HG11 . VAL A1 1 128 ? -32.702 20.966 -20.649 1.0 25.0 ? 118 A 1 +ATOM 2175 H HG12 . VAL A1 1 128 ? -31.697 21.511 -19.546 1.0 25.0 ? 118 A 1 +ATOM 2176 H HG13 . VAL A1 1 128 ? -33.199 22.029 -19.578 1.0 25.0 ? 118 A 1 +ATOM 2177 H HG21 . VAL A1 1 128 ? -33.316 22.206 -22.552 1.0 26.26 ? 118 A 1 +ATOM 2178 H HG22 . VAL A1 1 128 ? -33.96 23.362 -21.673 1.0 26.26 ? 118 A 1 +ATOM 2179 H HG23 . VAL A1 1 128 ? -32.852 23.711 -22.757 1.0 26.26 ? 118 A 1 +ATOM 2180 N N . ILE A1 1 129 ? -29.363 24.141 -19.826 1.0 16.04 ? 119 A 1 +ATOM 2181 C CA . ILE A1 1 129 ? -28.16 24.112 -18.982 1.0 16.29 ? 119 A 1 +ATOM 2182 C C . ILE A1 1 129 ? -28.243 25.182 -17.917 1.0 15.88 ? 119 A 1 +ATOM 2183 O O . ILE A1 1 129 ? -27.981 24.904 -16.737 1.0 15.79 ? 119 A 1 +ATOM 2184 C CB . ILE A1 1 129 ? -26.903 24.344 -19.833 1.0 16.22 ? 119 A 1 +ATOM 2185 C CG1 . ILE A1 1 129 ? -26.707 23.256 -20.891 1.0 16.97 ? 119 A 1 +ATOM 2186 C CG2 . ILE A1 1 129 ? -25.667 24.489 -18.964 1.0 14.94 ? 119 A 1 +ATOM 2187 C CD1 . ILE A1 1 129 ? -26.678 21.857 -20.357 1.0 18.29 ? 119 A 1 +ATOM 2188 H H . ILE A1 1 129 ? -29.201 24.269 -20.661 1.0 19.25 ? 119 A 1 +ATOM 2189 H HA . ILE A1 1 129 ? -28.112 23.239 -18.563 1.0 19.55 ? 119 A 1 +ATOM 2190 H HB . ILE A1 1 129 ? -27.043 25.179 -20.307 1.0 19.47 ? 119 A 1 +ATOM 2191 H HG12 . ILE A1 1 129 ? -27.437 23.31 -21.528 1.0 20.36 ? 119 A 1 +ATOM 2192 H HG13 . ILE A1 1 129 ? -25.862 23.414 -21.341 1.0 20.36 ? 119 A 1 +ATOM 2193 H HG21 . ILE A1 1 129 ? -24.878 24.338 -19.509 1.0 17.93 ? 119 A 1 +ATOM 2194 H HG22 . ILE A1 1 129 ? -25.645 25.385 -18.592 1.0 17.93 ? 119 A 1 +ATOM 2195 H HG23 . ILE A1 1 129 ? -25.704 23.835 -18.249 1.0 17.93 ? 119 A 1 +ATOM 2196 H HD11 . ILE A1 1 129 ? -26.396 21.255 -21.063 1.0 21.95 ? 119 A 1 +ATOM 2197 H HD12 . ILE A1 1 129 ? -26.052 21.814 -19.617 1.0 21.95 ? 119 A 1 +ATOM 2198 H HD13 . ILE A1 1 129 ? -27.567 21.617 -20.053 1.0 21.95 ? 119 A 1 +ATOM 2199 N N . SER A1 1 130 ? -28.621 26.41 -18.268 1.0 16.3 ? 120 A 1 +ATOM 2200 C CA . SER A1 1 130 ? -28.699 27.469 -17.257 1.0 15.71 ? 120 A 1 +ATOM 2201 C C . SER A1 1 130 ? -29.637 27.087 -16.136 1.0 18.12 ? 120 A 1 +ATOM 2202 O O . SER A1 1 130 ? -29.318 27.286 -14.968 1.0 19.04 ? 120 A 1 +ATOM 2203 C CB . SER A1 1 130 ? -29.164 28.768 -17.869 1.0 18.76 ? 120 A 1 +ATOM 2204 O OG . SER A1 1 130 ? -28.172 29.208 -18.769 1.0 19.8 ? 120 A 1 +ATOM 2205 H H . SER A1 1 130 ? -28.834 26.653 -19.065 1.0 19.56 ? 120 A 1 +ATOM 2206 H HA . SER A1 1 130 ? -27.807 27.602 -16.899 1.0 18.85 ? 120 A 1 +ATOM 2207 H HB2 . SER A1 1 130 ? -29.997 28.625 -18.345 1.0 22.52 ? 120 A 1 +ATOM 2208 H HB3 . SER A1 1 130 ? -29.29 29.431 -17.172 1.0 22.52 ? 120 A 1 +ATOM 2209 H HG . SER A1 1 130 ? -28.412 29.926 -19.132 1.0 23.75 ? 120 A 1 +ATOM 2210 N N . ASP A1 1 131 ? -30.768 26.516 -16.452 1.0 18.03 ? 121 A 1 +ATOM 2211 C CA . ASP A1 1 131 ? -31.736 26.153 -15.436 1.0 21.53 ? 121 A 1 +ATOM 2212 C C . ASP A1 1 131 ? -31.179 25.072 -14.53 1.0 19.58 ? 121 A 1 +ATOM 2213 O O . ASP A1 1 131 ? -31.334 25.134 -13.298 1.0 20.13 ? 121 A 1 +ATOM 2214 C CB . ASP A1 1 131 ? -33.02 25.587 -16.077 1.0 25.56 ? 121 A 1 +ATOM 2215 C CG . ASP A1 1 131 ? -33.826 26.597 -16.854 1.0 54.82 ? 121 A 1 +ATOM 2216 O OD1 . ASP A1 1 131 ? -33.747 27.796 -16.551 1.0 34.2 ? 121 A 1 +ATOM 2217 O OD2 . ASP A1 1 131 ? -34.588 26.151 -17.746 1.0 41.48 ? 121 A 1 +ATOM 2218 H H . ASP A1 1 131 ? -31.011 26.322 -17.254 1.0 21.64 ? 121 A 1 +ATOM 2219 H HA . ASP A1 1 131 ? -31.948 26.956 -14.935 1.0 25.83 ? 121 A 1 +ATOM 2220 H HB2 . ASP A1 1 131 ? -32.774 24.876 -16.689 1.0 30.67 ? 121 A 1 +ATOM 2221 H HB3 . ASP A1 1 131 ? -33.589 25.237 -15.374 1.0 30.67 ? 121 A 1 +ATOM 2222 N N . ILE A1 1 132 ? -30.54 24.065 -15.112 1.0 16.61 ? 122 A 1 +ATOM 2223 C CA . ILE A1 1 132 ? -29.942 22.991 -14.327 1.0 18.11 ? 122 A 1 +ATOM 2224 C C . ILE A1 1 132 ? -28.866 23.538 -13.399 1.0 16.92 ? 122 A 1 +ATOM 2225 O O . ILE A1 1 132 ? -28.793 23.17 -12.214 1.0 17.4 ? 122 A 1 +ATOM 2226 C CB . ILE A1 1 132 ? -29.383 21.899 -15.25 1.0 17.21 ? 122 A 1 +ATOM 2227 C CG1 . ILE A1 1 132 ? -30.544 21.168 -15.934 1.0 18.78 ? 122 A 1 +ATOM 2228 C CG2 . ILE A1 1 132 ? -28.549 20.896 -14.458 1.0 17.25 ? 122 A 1 +ATOM 2229 C CD1 . ILE A1 1 132 ? -30.1 20.363 -17.2 1.0 19.21 ? 122 A 1 +ATOM 2230 H H . ILE A1 1 132 ? -30.438 23.978 -15.961 1.0 19.94 ? 122 A 1 +ATOM 2231 H HA . ILE A1 1 132 ? -30.635 22.595 -13.776 1.0 21.73 ? 122 A 1 +ATOM 2232 H HB . ILE A1 1 132 ? -28.816 22.319 -15.915 1.0 20.65 ? 122 A 1 +ATOM 2233 H HG12 . ILE A1 1 132 ? -30.937 20.543 -15.305 1.0 22.53 ? 122 A 1 +ATOM 2234 H HG13 . ILE A1 1 132 ? -31.207 21.82 -16.212 1.0 22.53 ? 122 A 1 +ATOM 2235 H HG21 . ILE A1 1 132 ? -28.434 20.092 -14.988 1.0 20.7 ? 122 A 1 +ATOM 2236 H HG22 . ILE A1 1 132 ? -27.684 21.289 -14.262 1.0 20.7 ? 122 A 1 +ATOM 2237 H HG23 . ILE A1 1 132 ? -29.01 20.684 -13.631 1.0 20.7 ? 122 A 1 +ATOM 2238 H HD11 . ILE A1 1 132 ? -30.883 19.968 -17.614 1.0 23.05 ? 122 A 1 +ATOM 2239 H HD12 . ILE A1 1 132 ? -29.665 20.968 -17.822 1.0 23.05 ? 122 A 1 +ATOM 2240 H HD13 . ILE A1 1 132 ? -29.481 19.666 -16.93 1.0 23.05 ? 122 A 1 +ATOM 2241 N N . VAL A1 1 133 ? -27.961 24.353 -13.922 1.0 15.95 ? 123 A 1 +ATOM 2242 C CA . VAL A1 1 133 ? -26.894 24.953 -13.131 1.0 16.3 ? 123 A 1 +ATOM 2243 C C . VAL A1 1 133 ? -27.455 25.736 -11.963 1.0 17.8 ? 123 A 1 +ATOM 2244 O O . VAL A1 1 133 ? -26.947 25.594 -10.831 1.0 17.54 ? 123 A 1 +ATOM 2245 C CB . VAL A1 1 133 ? -25.994 25.826 -14.02 1.0 16.81 ? 123 A 1 +ATOM 2246 C CG1 . VAL A1 1 133 ? -25.044 26.622 -13.17 1.0 16.85 ? 123 A 1 +ATOM 2247 C CG2 . VAL A1 1 133 ? -25.229 25.007 -15.014 1.0 16.34 ? 123 A 1 +ATOM 2248 H H . VAL A1 1 133 ? -27.94 24.581 -14.75 1.0 19.14 ? 123 A 1 +ATOM 2249 H HA . VAL A1 1 133 ? -26.352 24.235 -12.767 1.0 19.56 ? 123 A 1 +ATOM 2250 H HB . VAL A1 1 133 ? -26.564 26.433 -14.519 1.0 20.18 ? 123 A 1 +ATOM 2251 H HG11 . VAL A1 1 133 ? -24.301 26.918 -13.718 1.0 20.23 ? 123 A 1 +ATOM 2252 H HG12 . VAL A1 1 133 ? -25.513 27.389 -12.805 1.0 20.23 ? 123 A 1 +ATOM 2253 H HG13 . VAL A1 1 133 ? -24.719 26.06 -12.449 1.0 20.23 ? 123 A 1 +ATOM 2254 H HG21 . VAL A1 1 133 ? -24.713 25.601 -15.581 1.0 19.61 ? 123 A 1 +ATOM 2255 H HG22 . VAL A1 1 133 ? -24.636 24.406 -14.537 1.0 19.61 ? 123 A 1 +ATOM 2256 H HG23 . VAL A1 1 133 ? -25.855 24.497 -15.551 1.0 19.61 ? 123 A 1 +ATOM 2257 N N . LYS A1 1 134 ? -28.479 26.538 -12.171 1.0 17.29 ? 124 A 1 +ATOM 2258 C CA . LYS A1 1 134 ? -29.066 27.31 -11.083 1.0 18.56 ? 124 A 1 +ATOM 2259 C C . LYS A1 1 134 ? -29.567 26.39 -9.993 1.0 18.72 ? 124 A 1 +ATOM 2260 O O . LYS A1 1 134 ? -29.358 26.663 -8.775 1.0 20.13 ? 124 A 1 +ATOM 2261 C CB . LYS A1 1 134 ? -30.196 28.168 -11.628 1.0 21.03 ? 124 A 1 +ATOM 2262 C CG . LYS A1 1 134 ? -29.718 29.417 -12.337 1.0 24.5 ? 124 A 1 +ATOM 2263 C CD . LYS A1 1 134 ? -30.874 30.249 -12.911 1.0 33.56 ? 124 A 1 +ATOM 2264 C CE . LYS A1 1 134 ? -30.336 31.35 -13.855 1.0 52.79 ? 124 A 1 +ATOM 2265 N NZ . LYS A1 1 134 ? -31.418 32.046 -14.625 1.0 67.53 ? 124 A 1 +ATOM 2266 H H . LYS A1 1 134 ? -28.859 26.659 -12.933 1.0 20.75 ? 124 A 1 +ATOM 2267 H HA . LYS A1 1 134 ? -28.399 27.899 -10.698 1.0 22.27 ? 124 A 1 +ATOM 2268 H HB2 . LYS A1 1 134 ? -30.708 27.644 -12.263 1.0 25.23 ? 124 A 1 +ATOM 2269 H HB3 . LYS A1 1 134 ? -30.763 28.443 -10.891 1.0 25.23 ? 124 A 1 +ATOM 2270 H HG2 . LYS A1 1 134 ? -29.232 29.973 -11.708 1.0 29.4 ? 124 A 1 +ATOM 2271 H HG3 . LYS A1 1 134 ? -29.138 29.163 -13.072 1.0 29.4 ? 124 A 1 +ATOM 2272 H HD2 . LYS A1 1 134 ? -31.469 29.673 -13.416 1.0 40.28 ? 124 A 1 +ATOM 2273 H HD3 . LYS A1 1 134 ? -31.359 30.674 -12.186 1.0 40.28 ? 124 A 1 +ATOM 2274 H HE2 . LYS A1 1 134 ? -29.869 32.017 -13.328 1.0 63.35 ? 124 A 1 +ATOM 2275 H HE3 . LYS A1 1 134 ? -29.727 30.947 -14.494 1.0 63.35 ? 124 A 1 +ATOM 2276 H HZ1 . LYS A1 1 134 ? -31.064 32.674 -15.148 1.0 81.04 ? 124 A 1 +ATOM 2277 H HZ2 . LYS A1 1 134 ? -31.855 31.46 -15.133 1.0 81.04 ? 124 A 1 +ATOM 2278 H HZ3 . LYS A1 1 134 ? -31.994 32.428 -14.064 1.0 81.04 ? 124 A 1 +ATOM 2279 N N . GLU A1 1 135 ? -30.19 25.274 -10.379 1.0 18.74 ? 125 A 1 +ATOM 2280 C CA . GLU A1 1 135 ? -30.693 24.349 -9.356 1.0 19.77 ? 125 A 1 +ATOM 2281 C C . GLU A1 1 135 ? -29.561 23.703 -8.6 1.0 17.22 ? 125 A 1 +ATOM 2282 O O . GLU A1 1 135 ? -29.648 23.534 -7.379 1.0 19.06 ? 125 A 1 +ATOM 2283 C CB . GLU A1 1 135 ? -31.586 23.271 -9.971 1.0 21.49 ? 125 A 1 +ATOM 2284 C CG . GLU A1 1 135 ? -32.895 23.816 -10.465 1.0 23.31 ? 125 A 1 +ATOM 2285 C CD . GLU A1 1 135 ? -33.636 24.498 -9.346 1.0 46.33 ? 125 A 1 +ATOM 2286 O OE1 . GLU A1 1 135 ? -33.863 23.851 -8.318 1.0 31.61 ? 125 A 1 +ATOM 2287 O OE2 . GLU A1 1 135 ? -33.893 25.699 -9.44 1.0 36.83 ? 125 A 1 +ATOM 2288 H H . GLU A1 1 135 ? -30.331 25.036 -11.193 1.0 22.49 ? 125 A 1 +ATOM 2289 H HA . GLU A1 1 135 ? -31.235 24.862 -8.736 1.0 23.72 ? 125 A 1 +ATOM 2290 H HB2 . GLU A1 1 135 ? -31.123 22.87 -10.723 1.0 25.78 ? 125 A 1 +ATOM 2291 H HB3 . GLU A1 1 135 ? -31.775 22.597 -9.3 1.0 25.78 ? 125 A 1 +ATOM 2292 H HG2 . GLU A1 1 135 ? -32.732 24.464 -11.169 1.0 27.97 ? 125 A 1 +ATOM 2293 H HG3 . GLU A1 1 135 ? -33.442 23.09 -10.803 1.0 27.97 ? 125 A 1 +ATOM 2294 N N . ILE A1 1 136 ? -28.478 23.299 -9.25 1.0 16.87 ? 126 A 1 +ATOM 2295 C CA . ILE A1 1 136 ? -27.406 22.628 -8.556 1.0 16.82 ? 126 A 1 +ATOM 2296 C C . ILE A1 1 136 ? -26.659 23.602 -7.672 1.0 16.47 ? 126 A 1 +ATOM 2297 O O . ILE A1 1 136 ? -26.235 23.246 -6.551 1.0 17.0 ? 126 A 1 +ATOM 2298 C CB . ILE A1 1 136 ? -26.489 21.878 -9.539 1.0 16.66 ? 126 A 1 +ATOM 2299 C CG1 . ILE A1 1 136 ? -27.303 20.81 -10.251 1.0 17.13 ? 126 A 1 +ATOM 2300 C CG2 . ILE A1 1 136 ? -25.303 21.289 -8.789 1.0 16.76 ? 126 A 1 +ATOM 2301 C CD1 . ILE A1 1 136 ? -26.543 20.113 -11.396 1.0 16.7 ? 126 A 1 +ATOM 2302 H H . ILE A1 1 136 ? -28.345 23.404 -10.094 1.0 20.25 ? 126 A 1 +ATOM 2303 H HA . ILE A1 1 136 ? -27.789 21.95 -7.977 1.0 20.19 ? 126 A 1 +ATOM 2304 H HB . ILE A1 1 136 ? -26.137 22.487 -10.207 1.0 19.99 ? 126 A 1 +ATOM 2305 H HG12 . ILE A1 1 136 ? -27.557 20.13 -9.607 1.0 20.56 ? 126 A 1 +ATOM 2306 H HG13 . ILE A1 1 136 ? -28.096 21.221 -10.629 1.0 20.56 ? 126 A 1 +ATOM 2307 H HG21 . ILE A1 1 136 ? -24.832 20.676 -9.374 1.0 20.11 ? 126 A 1 +ATOM 2308 H HG22 . ILE A1 1 136 ? -24.712 22.009 -8.519 1.0 20.11 ? 126 A 1 +ATOM 2309 H HG23 . ILE A1 1 136 ? -25.628 20.817 -8.006 1.0 20.11 ? 126 A 1 +ATOM 2310 H HD11 . ILE A1 1 136 ? -27.16 19.552 -11.89 1.0 20.03 ? 126 A 1 +ATOM 2311 H HD12 . ILE A1 1 136 ? -26.168 20.789 -11.983 1.0 20.03 ? 126 A 1 +ATOM 2312 H HD13 . ILE A1 1 136 ? -25.832 19.572 -11.019 1.0 20.03 ? 126 A 1 +ATOM 2313 N N . LYS A1 1 137 ? -26.519 24.854 -8.07 1.0 16.93 ? 127 A 1 +ATOM 2314 C CA . LYS A1 1 137 ? -25.833 25.821 -7.245 1.0 16.98 ? 127 A 1 +ATOM 2315 C C . LYS A1 1 137 ? -26.57 26.077 -5.933 1.0 17.71 ? 127 A 1 +ATOM 2316 O O . LYS A1 1 137 ? -25.908 26.372 -4.92 1.0 19.25 ? 127 A 1 +ATOM 2317 C CB . LYS A1 1 137 ? -25.619 27.137 -7.997 1.0 17.84 ? 127 A 1 +ATOM 2318 C CG . LYS A1 1 137 ? -24.492 27.029 -9.077 1.0 17.36 ? 127 A 1 +ATOM 2319 C CD . LYS A1 1 137 ? -23.122 26.709 -8.519 1.0 19.07 ? 127 A 1 +ATOM 2320 C CE . LYS A1 1 137 ? -22.619 27.882 -7.761 1.0 20.9 ? 127 A 1 +ATOM 2321 N NZ . LYS A1 1 137 ? -21.329 27.563 -7.14 1.0 21.64 ? 127 A 1 +ATOM 2322 H H . LYS A1 1 137 ? -26.812 25.167 -8.815 1.0 20.32 ? 127 A 1 +ATOM 2323 H HA . LYS A1 1 137 ? -24.957 25.46 -7.036 1.0 20.38 ? 127 A 1 +ATOM 2324 H HB2 . LYS A1 1 137 ? -26.443 27.385 -8.445 1.0 21.41 ? 127 A 1 +ATOM 2325 H HB3 . LYS A1 1 137 ? -25.365 27.826 -7.364 1.0 21.41 ? 127 A 1 +ATOM 2326 H HG2 . LYS A1 1 137 ? -24.726 26.324 -9.701 1.0 20.84 ? 127 A 1 +ATOM 2327 H HG3 . LYS A1 1 137 ? -24.427 27.877 -9.544 1.0 20.84 ? 127 A 1 +ATOM 2328 H HD2 . LYS A1 1 137 ? -23.179 25.948 -7.919 1.0 22.89 ? 127 A 1 +ATOM 2329 H HD3 . LYS A1 1 137 ? -22.507 26.515 -9.243 1.0 22.89 ? 127 A 1 +ATOM 2330 H HE2 . LYS A1 1 137 ? -22.497 28.633 -8.364 1.0 25.08 ? 127 A 1 +ATOM 2331 H HE3 . LYS A1 1 137 ? -23.251 28.116 -7.063 1.0 25.08 ? 127 A 1 +ATOM 2332 H HZ1 . LYS A1 1 137 ? -21.424 26.884 -6.573 1.0 25.97 ? 127 A 1 +ATOM 2333 H HZ2 . LYS A1 1 137 ? -20.738 27.336 -7.765 1.0 25.97 ? 127 A 1 +ATOM 2334 H HZ3 . LYS A1 1 137 ? -21.022 28.27 -6.695 1.0 25.97 ? 127 A 1 +ATOM 2335 N N . LYS A1 1 138 ? -27.876 25.872 -5.888 1.0 17.14 ? 128 A 1 +ATOM 2336 C CA . LYS A1 1 138 ? -28.618 25.978 -4.634 1.0 17.79 ? 128 A 1 +ATOM 2337 C C . LYS A1 1 138 ? -28.208 24.897 -3.629 1.0 17.59 ? 128 A 1 +ATOM 2338 O O . LYS A1 1 138 ? -28.516 25.045 -2.436 1.0 18.27 ? 128 A 1 +ATOM 2339 C CB . LYS A1 1 138 ? -30.125 25.887 -4.903 1.0 19.53 ? 128 A 1 +ATOM 2340 C CG . LYS A1 1 138 ? -30.653 27.036 -5.743 1.0 20.47 ? 128 A 1 +ATOM 2341 C CD . LYS A1 1 138 ? -32.128 26.89 -6.009 1.0 24.65 ? 128 A 1 +ATOM 2342 C CE . LYS A1 1 138 ? -32.611 27.993 -6.943 1.0 29.55 ? 128 A 1 +ATOM 2343 N NZ . LYS A1 1 138 ? -34.01 27.755 -7.363 1.0 39.49 ? 128 A 1 +ATOM 2344 H H . LYS A1 1 138 ? -28.361 25.668 -6.568 1.0 20.57 ? 128 A 1 +ATOM 2345 H HA . LYS A1 1 138 ? -28.435 26.845 -4.239 1.0 21.35 ? 128 A 1 +ATOM 2346 H HB2 . LYS A1 1 138 ? -30.31 25.061 -5.378 1.0 23.44 ? 128 A 1 +ATOM 2347 H HB3 . LYS A1 1 138 ? -30.596 25.895 -4.056 1.0 23.44 ? 128 A 1 +ATOM 2348 H HG2 . LYS A1 1 138 ? -30.51 27.872 -5.272 1.0 24.57 ? 128 A 1 +ATOM 2349 H HG3 . LYS A1 1 138 ? -30.189 27.052 -6.595 1.0 24.57 ? 128 A 1 +ATOM 2350 H HD2 . LYS A1 1 138 ? -32.299 26.032 -6.429 1.0 29.58 ? 128 A 1 +ATOM 2351 H HD3 . LYS A1 1 138 ? -32.617 26.955 -5.175 1.0 29.58 ? 128 A 1 +ATOM 2352 H HE2 . LYS A1 1 138 ? -32.568 28.847 -6.485 1.0 35.46 ? 128 A 1 +ATOM 2353 H HE3 . LYS A1 1 138 ? -32.051 28.014 -7.736 1.0 35.46 ? 128 A 1 +ATOM 2354 H HZ1 . LYS A1 1 138 ? -34.278 28.404 -7.909 1.0 47.38 ? 128 A 1 +ATOM 2355 H HZ2 . LYS A1 1 138 ? -34.072 26.976 -7.788 1.0 47.38 ? 128 A 1 +ATOM 2356 H HZ3 . LYS A1 1 138 ? -34.542 27.739 -6.65 1.0 47.38 ? 128 A 1 +ATOM 2357 N N . MET A1 1 139 ? -27.548 23.847 -4.051 1.0 17.96 ? 129 A 1 +ATOM 2358 C CA . MET A1 1 139 ? -27.159 22.735 -3.185 1.0 17.99 ? 129 A 1 +ATOM 2359 C C . MET A1 1 139 ? -25.878 23.031 -2.452 1.0 20.55 ? 129 A 1 +ATOM 2360 O O . MET A1 1 139 ? -25.442 22.179 -1.669 1.0 22.4 ? 129 A 1 +ATOM 2361 C CB . MET A1 1 139 ? -27.044 21.46 -4.008 1.0 18.54 ? 129 A 1 +ATOM 2362 C CG . MET A1 1 139 ? -28.289 21.087 -4.769 1.0 18.58 ? 129 A 1 +ATOM 2363 S SD . MET A1 1 139 ? -28.029 19.662 -5.815 1.0 18.99 ? 129 A 1 +ATOM 2364 C CE . MET A1 1 139 ? -29.589 19.709 -6.729 1.0 22.17 ? 129 A 1 +ATOM 2365 H H . MET A1 1 139 ? -27.299 23.739 -4.867 1.0 21.55 ? 129 A 1 +ATOM 2366 H HA . MET A1 1 139 ? -27.852 22.567 -2.527 1.0 21.59 ? 129 A 1 +ATOM 2367 H HB2 . MET A1 1 139 ? -26.329 21.573 -4.654 1.0 22.25 ? 129 A 1 +ATOM 2368 H HB3 . MET A1 1 139 ? -26.836 20.725 -3.409 1.0 22.25 ? 129 A 1 +ATOM 2369 H HG2 . MET A1 1 139 ? -28.998 20.878 -4.14 1.0 22.29 ? 129 A 1 +ATOM 2370 H HG3 . MET A1 1 139 ? -28.555 21.832 -5.331 1.0 22.29 ? 129 A 1 +ATOM 2371 H HE1 . MET A1 1 139 ? -29.606 18.977 -7.365 1.0 26.61 ? 129 A 1 +ATOM 2372 H HE2 . MET A1 1 139 ? -30.325 19.621 -6.103 1.0 26.61 ? 129 A 1 +ATOM 2373 H HE3 . MET A1 1 139 ? -29.654 20.556 -7.199 1.0 26.61 ? 129 A 1 +ATOM 2374 N N . GLY A1 1 140 ? -25.212 24.152 -2.691 1.0 16.86 ? 130 A 1 +ATOM 2375 C CA . GLY A1 1 140 ? -24.04 24.516 -1.921 1.0 18.96 ? 130 A 1 +ATOM 2376 C C . GLY A1 1 140 ? -22.727 23.95 -2.397 1.0 18.87 ? 130 A 1 +ATOM 2377 O O . GLY A1 1 140 ? -21.744 23.892 -1.638 1.0 20.3 ? 130 A 1 +ATOM 2378 H H . GLY A1 1 140 ? -25.422 24.722 -3.3 1.0 20.23 ? 130 A 1 +ATOM 2379 H HA2 . GLY A1 1 140 ? -23.959 25.482 -1.928 1.0 22.75 ? 130 A 1 +ATOM 2380 H HA3 . GLY A1 1 140 ? -24.17 24.216 -1.008 1.0 22.75 ? 130 A 1 +ATOM 2381 N N . VAL A1 1 141 ? -22.65 23.574 -3.659 1.0 16.33 ? 131 A 1 +ATOM 2382 C CA . VAL A1 1 141 ? -21.482 22.943 -4.27 1.0 16.2 ? 131 A 1 +ATOM 2383 C C . VAL A1 1 141 ? -20.997 23.767 -5.466 1.0 15.36 ? 131 A 1 +ATOM 2384 O O . VAL A1 1 141 ? -21.696 24.641 -5.97 1.0 17.31 ? 131 A 1 +ATOM 2385 C CB . VAL A1 1 141 ? -21.766 21.487 -4.682 1.0 16.54 ? 131 A 1 +ATOM 2386 C CG1 . VAL A1 1 141 ? -22.029 20.654 -3.438 1.0 19.47 ? 131 A 1 +ATOM 2387 C CG2 . VAL A1 1 141 ? -22.888 21.44 -5.733 1.0 18.49 ? 131 A 1 +ATOM 2388 H H . VAL A1 1 141 ? -23.294 23.678 -4.219 1.0 19.59 ? 131 A 1 +ATOM 2389 H HA . VAL A1 1 141 ? -20.762 22.948 -3.619 1.0 19.44 ? 131 A 1 +ATOM 2390 H HB . VAL A1 1 141 ? -20.996 21.087 -5.115 1.0 19.84 ? 131 A 1 +ATOM 2391 H HG11 . VAL A1 1 141 ? -22.086 19.719 -3.691 1.0 23.36 ? 131 A 1 +ATOM 2392 H HG12 . VAL A1 1 141 ? -21.301 20.783 -2.811 1.0 23.36 ? 131 A 1 +ATOM 2393 H HG13 . VAL A1 1 141 ? -22.865 20.94 -3.038 1.0 23.36 ? 131 A 1 +ATOM 2394 H HG21 . VAL A1 1 141 ? -23.115 20.514 -5.912 1.0 22.19 ? 131 A 1 +ATOM 2395 H HG22 . VAL A1 1 141 ? -23.664 21.909 -5.388 1.0 22.19 ? 131 A 1 +ATOM 2396 H HG23 . VAL A1 1 141 ? -22.578 21.868 -6.546 1.0 22.19 ? 131 A 1 +ATOM 2397 N N . ALA A1 1 142 ? -19.8 23.446 -5.924 1.0 14.53 ? 132 A 1 +ATOM 2398 C CA . ALA A1 1 142 ? -19.285 24.01 -7.175 1.0 14.5 ? 132 A 1 +ATOM 2399 C C . ALA A1 1 142 ? -19.84 23.24 -8.361 1.0 14.41 ? 132 A 1 +ATOM 2400 O O . ALA A1 1 142 ? -20.17 22.058 -8.255 1.0 14.0 ? 132 A 1 +ATOM 2401 C CB . ALA A1 1 142 ? -17.772 23.902 -7.196 1.0 15.14 ? 132 A 1 +ATOM 2402 H H . ALA A1 1 142 ? -19.26 22.903 -5.533 1.0 17.44 ? 132 A 1 +ATOM 2403 H HA . ALA A1 1 142 ? -19.545 24.941 -7.249 1.0 17.4 ? 132 A 1 +ATOM 2404 H HB1 . ALA A1 1 142 ? -17.442 24.259 -8.035 1.0 18.17 ? 132 A 1 +ATOM 2405 H HB2 . ALA A1 1 142 ? -17.409 24.41 -6.454 1.0 18.17 ? 132 A 1 +ATOM 2406 H HB3 . ALA A1 1 142 ? -17.521 22.968 -7.112 1.0 18.17 ? 132 A 1 +ATOM 2407 N N . VAL A1 1 143 ? -19.96 23.939 -9.484 1.0 14.13 ? 133 A 1 +ATOM 2408 C CA . VAL A1 1 143 ? -20.405 23.344 -10.743 1.0 13.94 ? 133 A 1 +ATOM 2409 C C . VAL A1 1 143 ? -19.333 23.551 -11.796 1.0 14.39 ? 133 A 1 +ATOM 2410 O O . VAL A1 1 143 ? -18.883 24.686 -12.05 1.0 14.63 ? 133 A 1 +ATOM 2411 C CB . VAL A1 1 143 ? -21.728 23.926 -11.204 1.0 14.94 ? 133 A 1 +ATOM 2412 C CG1 . VAL A1 1 143 ? -22.057 23.464 -12.623 1.0 16.57 ? 133 A 1 +ATOM 2413 C CG2 . VAL A1 1 143 ? -22.834 23.507 -10.242 1.0 16.54 ? 133 A 1 +ATOM 2414 H H . VAL A1 1 143 ? -19.787 24.78 -9.544 1.0 16.96 ? 133 A 1 +ATOM 2415 H HA . VAL A1 1 143 ? -20.515 22.389 -10.612 1.0 16.73 ? 133 A 1 +ATOM 2416 H HB . VAL A1 1 143 ? -21.665 24.894 -11.213 1.0 17.92 ? 133 A 1 +ATOM 2417 H HG11 . VAL A1 1 143 ? -23.0 23.616 -12.794 1.0 19.88 ? 133 A 1 +ATOM 2418 H HG12 . VAL A1 1 143 ? -21.521 23.971 -13.252 1.0 19.88 ? 133 A 1 +ATOM 2419 H HG13 . VAL A1 1 143 ? -21.855 22.519 -12.702 1.0 19.88 ? 133 A 1 +ATOM 2420 H HG21 . VAL A1 1 143 ? -23.672 23.898 -10.535 1.0 19.85 ? 133 A 1 +ATOM 2421 H HG22 . VAL A1 1 143 ? -22.902 22.539 -10.242 1.0 19.85 ? 133 A 1 +ATOM 2422 H HG23 . VAL A1 1 143 ? -22.614 23.823 -9.352 1.0 19.85 ? 133 A 1 +ATOM 2423 N N . THR A1 1 144 ? -18.962 22.461 -12.445 1.0 12.72 ? 134 A 1 +ATOM 2424 C CA . THR A1 1 144 ? -18.064 22.447 -13.596 1.0 12.7 ? 134 A 1 +ATOM 2425 C C . THR A1 1 144 ? -18.851 21.987 -14.805 1.0 13.16 ? 134 A 1 +ATOM 2426 O O . THR A1 1 144 ? -19.548 20.973 -14.742 1.0 14.3 ? 134 A 1 +ATOM 2427 C CB . THR A1 1 144 ? -16.914 21.512 -13.383 1.0 13.07 ? 134 A 1 +ATOM 2428 O OG1 . THR A1 1 144 ? -16.163 22.04 -12.249 1.0 14.42 ? 134 A 1 +ATOM 2429 C CG2 . THR A1 1 144 ? -15.999 21.41 -14.599 1.0 13.95 ? 134 A 1 +ATOM 2430 H H . THR A1 1 144 ? -19.229 21.672 -12.228 1.0 15.27 ? 134 A 1 +ATOM 2431 H HA . THR A1 1 144 ? -17.714 23.339 -13.743 1.0 15.24 ? 134 A 1 +ATOM 2432 H HB . THR A1 1 144 ? -17.237 20.611 -13.225 1.0 15.68 ? 134 A 1 +ATOM 2433 H HG1 . THR A1 1 144 ? -15.493 21.557 -12.098 1.0 17.31 ? 134 A 1 +ATOM 2434 H HG21 . THR A1 1 144 ? -15.185 20.939 -14.363 1.0 16.74 ? 134 A 1 +ATOM 2435 H HG22 . THR A1 1 144 ? -16.447 20.927 -15.311 1.0 16.74 ? 134 A 1 +ATOM 2436 H HG23 . THR A1 1 144 ? -15.769 22.297 -14.917 1.0 16.74 ? 134 A 1 +ATOM 2437 N N . LEU A1 1 145 ? -18.748 22.731 -15.921 1.0 13.36 ? 135 A 1 +ATOM 2438 C CA . LEU A1 1 145 ? -19.361 22.335 -17.195 1.0 12.46 ? 135 A 1 +ATOM 2439 C C . LEU A1 1 145 ? -18.287 21.798 -18.119 1.0 12.7 ? 135 A 1 +ATOM 2440 O O . LEU A1 1 145 ? -17.165 22.285 -18.139 1.0 12.96 ? 135 A 1 +ATOM 2441 C CB . LEU A1 1 145 ? -20.052 23.529 -17.832 1.0 13.9 ? 135 A 1 +ATOM 2442 C CG . LEU A1 1 145 ? -21.195 24.155 -17.011 1.0 13.81 ? 135 A 1 +ATOM 2443 C CD1 . LEU A1 1 145 ? -21.793 25.313 -17.754 1.0 15.57 ? 135 A 1 +ATOM 2444 C CD2 . LEU A1 1 145 ? -22.251 23.12 -16.737 1.0 15.0 ? 135 A 1 +ATOM 2445 H H . LEU A1 1 145 ? -18.323 23.477 -15.962 1.0 16.04 ? 135 A 1 +ATOM 2446 H HA . LEU A1 1 145 ? -20.024 21.64 -17.058 1.0 14.96 ? 135 A 1 +ATOM 2447 H HB2 . LEU A1 1 145 ? -19.389 24.222 -17.977 1.0 16.68 ? 135 A 1 +ATOM 2448 H HB3 . LEU A1 1 145 ? -20.428 23.246 -18.68 1.0 16.68 ? 135 A 1 +ATOM 2449 H HG . LEU A1 1 145 ? -20.847 24.48 -16.166 1.0 16.58 ? 135 A 1 +ATOM 2450 H HD11 . LEU A1 1 145 ? -22.506 25.697 -17.22 1.0 18.69 ? 135 A 1 +ATOM 2451 H HD12 . LEU A1 1 145 ? -21.104 25.976 -17.913 1.0 18.69 ? 135 A 1 +ATOM 2452 H HD13 . LEU A1 1 145 ? -22.148 24.996 -18.6 1.0 18.69 ? 135 A 1 +ATOM 2453 H HD21 . LEU A1 1 145 ? -23.026 23.555 -16.35 1.0 18.0 ? 135 A 1 +ATOM 2454 H HD22 . LEU A1 1 145 ? -22.495 22.689 -17.571 1.0 18.0 ? 135 A 1 +ATOM 2455 H HD23 . LEU A1 1 145 ? -21.896 22.463 -16.118 1.0 18.0 ? 135 A 1 +ATOM 2456 N N . SER A1 1 146 ? -18.672 20.805 -18.931 1.0 12.28 ? 136 A 1 +ATOM 2457 C CA . SER A1 1 146 ? -17.774 20.235 -19.944 1.0 12.79 ? 136 A 1 +ATOM 2458 C C . SER A1 1 146 ? -18.641 19.836 -21.141 1.0 12.24 ? 136 A 1 +ATOM 2459 O O . SER A1 1 146 ? -18.982 18.688 -21.331 1.0 12.39 ? 136 A 1 +ATOM 2460 C CB . SER A1 1 146 ? -17.047 19.061 -19.299 1.0 12.59 ? 136 A 1 +ATOM 2461 O OG . SER A1 1 146 ? -16.072 18.477 -20.167 1.0 13.06 ? 136 A 1 +ATOM 2462 H H . SER A1 1 146 ? -19.452 20.443 -18.914 1.0 14.73 ? 136 A 1 +ATOM 2463 H HA . SER A1 1 146 ? -17.13 20.873 -20.289 1.0 15.34 ? 136 A 1 +ATOM 2464 H HB2 . SER A1 1 146 ? -16.599 19.377 -18.499 1.0 15.11 ? 136 A 1 +ATOM 2465 H HB3 . SER A1 1 146 ? -17.7 18.382 -19.068 1.0 15.11 ? 136 A 1 +ATOM 2466 H HG . SER A1 1 146 ? -15.478 19.041 -20.351 1.0 15.67 ? 136 A 1 +ATOM 2467 N N . LEU A1 1 147 ? -19.044 20.849 -21.906 1.0 12.26 ? 137 A 1 +ATOM 2468 C CA . LEU A1 1 147 ? -20.071 20.708 -22.934 1.0 12.74 ? 137 A 1 +ATOM 2469 C C . LEU A1 1 147 ? -19.539 20.945 -24.34 1.0 13.2 ? 137 A 1 +ATOM 2470 O O . LEU A1 1 147 ? -20.326 20.889 -25.271 1.0 14.1 ? 137 A 1 +ATOM 2471 C CB . LEU A1 1 147 ? -21.248 21.666 -22.664 1.0 13.04 ? 137 A 1 +ATOM 2472 C CG . LEU A1 1 147 ? -21.771 21.701 -21.208 1.0 12.19 ? 137 A 1 +ATOM 2473 C CD1 . LEU A1 1 147 ? -22.877 22.696 -21.096 1.0 14.3 ? 137 A 1 +ATOM 2474 C CD2 . LEU A1 1 147 ? -22.177 20.309 -20.731 1.0 15.39 ? 137 A 1 +ATOM 2475 H H . LEU A1 1 147 ? -18.731 21.648 -21.846 1.0 14.71 ? 137 A 1 +ATOM 2476 H HA . LEU A1 1 147 ? -20.418 19.803 -22.895 1.0 15.28 ? 137 A 1 +ATOM 2477 H HB2 . LEU A1 1 147 ? -20.963 22.566 -22.889 1.0 15.65 ? 137 A 1 +ATOM 2478 H HB3 . LEU A1 1 147 ? -21.99 21.402 -23.23 1.0 15.65 ? 137 A 1 +ATOM 2479 H HG . LEU A1 1 147 ? -21.064 21.986 -20.609 1.0 14.63 ? 137 A 1 +ATOM 2480 H HD11 . LEU A1 1 147 ? -23.217 22.689 -20.188 1.0 17.16 ? 137 A 1 +ATOM 2481 H HD12 . LEU A1 1 147 ? -22.533 23.576 -21.314 1.0 17.16 ? 137 A 1 +ATOM 2482 H HD13 . LEU A1 1 147 ? -23.583 22.454 -21.716 1.0 17.16 ? 137 A 1 +ATOM 2483 H HD21 . LEU A1 1 147 ? -22.568 20.379 -19.847 1.0 18.46 ? 137 A 1 +ATOM 2484 H HD22 . LEU A1 1 147 ? -22.825 19.939 -21.351 1.0 18.46 ? 137 A 1 +ATOM 2485 H HD23 . LEU A1 1 147 ? -21.389 19.744 -20.7 1.0 18.46 ? 137 A 1 +ATOM 2486 N N . GLY A1 1 148 ? -18.263 21.22 -24.49 1.0 13.1 ? 138 A 1 +ATOM 2487 C CA . GLY A1 1 148 ? -17.7 21.478 -25.82 1.0 13.04 ? 138 A 1 +ATOM 2488 C C . GLY A1 1 148 ? -17.673 22.943 -26.17 1.0 13.25 ? 138 A 1 +ATOM 2489 O O . GLY A1 1 148 ? -17.632 23.838 -25.307 1.0 13.85 ? 138 A 1 +ATOM 2490 H H . GLY A1 1 148 ? -17.694 21.267 -23.846 1.0 15.72 ? 138 A 1 +ATOM 2491 H HA2 . GLY A1 1 148 ? -16.79 21.141 -25.852 1.0 15.65 ? 138 A 1 +ATOM 2492 H HA3 . GLY A1 1 148 ? -18.231 21.015 -26.486 1.0 15.65 ? 138 A 1 +ATOM 2493 N N . GLU A1 1 149 ? -17.631 23.17 -27.487 1.0 13.38 ? 139 A 1 +ATOM 2494 C CA . GLU A1 1 149 ? -17.408 24.481 -28.099 1.0 13.65 ? 139 A 1 +ATOM 2495 C C . GLU A1 1 149 ? -18.739 25.13 -28.435 1.0 15.2 ? 139 A 1 +ATOM 2496 O O . GLU A1 1 149 ? -19.528 24.605 -29.22 1.0 16.11 ? 139 A 1 +ATOM 2497 C CB . GLU A1 1 149 ? -16.609 24.311 -29.394 1.0 13.93 ? 139 A 1 +ATOM 2498 C CG . GLU A1 1 149 ? -15.241 23.744 -29.161 1.0 15.54 ? 139 A 1 +ATOM 2499 C CD . GLU A1 1 149 ? -14.51 23.319 -30.398 1.0 14.31 ? 139 A 1 +ATOM 2500 O OE1 . GLU A1 1 149 ? -14.749 23.922 -31.467 1.0 16.27 ? 139 A 1 +ATOM 2501 O OE2 . GLU A1 1 149 ? -13.648 22.444 -30.306 1.0 15.33 ? 139 A 1 +ATOM 2502 H H . GLU A1 1 149 ? -17.733 22.55 -28.074 1.0 16.05 ? 139 A 1 +ATOM 2503 H HA . GLU A1 1 149 ? -16.929 25.045 -27.471 1.0 16.38 ? 139 A 1 +ATOM 2504 H HB2 . GLU A1 1 149 ? -17.088 23.708 -29.983 1.0 16.72 ? 139 A 1 +ATOM 2505 H HB3 . GLU A1 1 149 ? -16.507 25.177 -29.818 1.0 16.72 ? 139 A 1 +ATOM 2506 H HG2 . GLU A1 1 149 ? -14.7 24.419 -28.722 1.0 18.65 ? 139 A 1 +ATOM 2507 H HG3 . GLU A1 1 149 ? -15.325 22.964 -28.591 1.0 18.65 ? 139 A 1 +ATOM 2508 N N . TRP A1 1 150 ? -19.013 26.305 -27.813 1.0 16.31 ? 140 A 1 +ATOM 2509 C CA . TRP A1 1 150 ? -20.259 27.047 -27.982 1.0 15.36 ? 140 A 1 +ATOM 2510 C C . TRP A1 1 150 ? -19.942 28.525 -28.117 1.0 16.76 ? 140 A 1 +ATOM 2511 O O . TRP A1 1 150 ? -18.855 28.961 -27.728 1.0 19.63 ? 140 A 1 +ATOM 2512 C CB . TRP A1 1 150 ? -21.244 26.757 -26.801 1.0 16.48 ? 140 A 1 +ATOM 2513 C CG . TRP A1 1 150 ? -21.649 25.302 -26.78 1.0 15.82 ? 140 A 1 +ATOM 2514 C CD1 . TRP A1 1 150 ? -21.092 24.313 -26.014 1.0 14.09 ? 140 A 1 +ATOM 2515 C CD2 . TRP A1 1 150 ? -22.613 24.66 -27.619 1.0 15.34 ? 140 A 1 +ATOM 2516 N NE1 . TRP A1 1 150 ? -21.625 23.091 -26.352 1.0 15.09 ? 140 A 1 +ATOM 2517 C CE2 . TRP A1 1 150 ? -22.563 23.277 -27.344 1.0 16.02 ? 140 A 1 +ATOM 2518 C CE3 . TRP A1 1 150 ? -23.48 25.121 -28.63 1.0 17.63 ? 140 A 1 +ATOM 2519 C CZ2 . TRP A1 1 150 ? -23.379 22.365 -27.983 1.0 17.53 ? 140 A 1 +ATOM 2520 C CZ3 . TRP A1 1 150 ? -24.295 24.219 -29.238 1.0 19.93 ? 140 A 1 +ATOM 2521 C CH2 . TRP A1 1 150 ? -24.224 22.844 -28.962 1.0 18.65 ? 140 A 1 +ATOM 2522 H H . TRP A1 1 150 ? -18.467 26.693 -27.274 1.0 19.57 ? 140 A 1 +ATOM 2523 H HA . TRP A1 1 150 ? -20.712 26.767 -28.793 1.0 18.43 ? 140 A 1 +ATOM 2524 H HB2 . TRP A1 1 150 ? -20.809 26.967 -25.959 1.0 19.78 ? 140 A 1 +ATOM 2525 H HB3 . TRP A1 1 150 ? -22.042 27.297 -26.906 1.0 19.78 ? 140 A 1 +ATOM 2526 H HD1 . TRP A1 1 150 ? -20.445 24.447 -25.359 1.0 16.91 ? 140 A 1 +ATOM 2527 H HE1 . TRP A1 1 150 ? -21.41 22.336 -26.002 1.0 18.1 ? 140 A 1 +ATOM 2528 H HE3 . TRP A1 1 150 ? -23.494 26.018 -28.875 1.0 21.16 ? 140 A 1 +ATOM 2529 H HZ2 . TRP A1 1 150 ? -23.36 21.462 -27.761 1.0 21.04 ? 140 A 1 +ATOM 2530 H HZ3 . TRP A1 1 150 ? -24.92 24.522 -29.857 1.0 23.92 ? 140 A 1 +ATOM 2531 H HH2 . TRP A1 1 150 ? -24.753 22.251 -29.445 1.0 22.38 ? 140 A 1 +ATOM 2532 N N . PRO A1 1 151 ? -20.932 29.315 -28.539 1.0 18.3 ? 141 A 1 +ATOM 2533 C CA . PRO A1 1 151 ? -20.713 30.748 -28.626 1.0 19.87 ? 141 A 1 +ATOM 2534 C C . PRO A1 1 151 ? -20.437 31.384 -27.293 1.0 19.85 ? 141 A 1 +ATOM 2535 O O . PRO A1 1 151 ? -20.884 30.932 -26.234 1.0 19.12 ? 141 A 1 +ATOM 2536 C CB . PRO A1 1 151 ? -22.035 31.273 -29.203 1.0 22.63 ? 141 A 1 +ATOM 2537 C CG . PRO A1 1 151 ? -22.593 30.093 -29.955 1.0 22.0 ? 141 A 1 +ATOM 2538 C CD . PRO A1 1 151 ? -22.229 28.915 -29.105 1.0 18.04 ? 141 A 1 +ATOM 2539 H HA . PRO A1 1 151 ? -19.972 30.927 -29.227 1.0 23.85 ? 141 A 1 +ATOM 2540 H HB2 . PRO A1 1 151 ? -22.628 31.546 -28.486 1.0 27.15 ? 141 A 1 +ATOM 2541 H HB3 . PRO A1 1 151 ? -21.867 32.021 -29.798 1.0 27.15 ? 141 A 1 +ATOM 2542 H HG2 . PRO A1 1 151 ? -23.555 30.177 -30.043 1.0 26.4 ? 141 A 1 +ATOM 2543 H HG3 . PRO A1 1 151 ? -22.184 30.031 -30.832 1.0 26.4 ? 141 A 1 +ATOM 2544 H HD2 . PRO A1 1 151 ? -22.885 28.775 -28.405 1.0 21.65 ? 141 A 1 +ATOM 2545 H HD3 . PRO A1 1 151 ? -22.141 28.112 -29.642 1.0 21.65 ? 141 A 1 +ATOM 2546 N N . ARG A1 1 152 ? -19.733 32.509 -27.357 1.0 20.55 ? 142 A 1 +ATOM 2547 C CA A ARG A1 1 152 ? -19.456 33.275 -26.146 0.54 24.03 ? 142 A 1 +ATOM 2548 C CA B ARG A1 1 152 ? -19.457 33.271 -26.145 0.46 19.67 ? 142 A 1 +ATOM 2549 C C . ARG A1 1 152 ? -20.733 33.568 -25.36 1.0 18.71 ? 142 A 1 +ATOM 2550 O O . ARG A1 1 152 ? -20.745 33.537 -24.126 1.0 20.15 ? 142 A 1 +ATOM 2551 C CB A ARG A1 1 152 ? -18.765 34.59 -26.515 0.54 35.57 ? 142 A 1 +ATOM 2552 C CB B ARG A1 1 152 ? -18.763 34.59 -26.498 0.46 18.66 ? 142 A 1 +ATOM 2553 C CG A ARG A1 1 152 ? -18.522 35.519 -25.344 0.54 28.36 ? 142 A 1 +ATOM 2554 C CG B ARG A1 1 152 ? -18.684 35.581 -25.332 0.46 27.14 ? 142 A 1 +ATOM 2555 C CD A ARG A1 1 152 ? -17.933 36.847 -25.787 0.54 33.91 ? 142 A 1 +ATOM 2556 C CD B ARG A1 1 152 ? -18.059 36.898 -25.752 0.46 35.05 ? 142 A 1 +ATOM 2557 N NE A ARG A1 1 152 ? -17.591 37.643 -24.61 0.54 54.69 ? 142 A 1 +ATOM 2558 N NE B ARG A1 1 152 ? -16.989 37.29 -24.836 0.46 40.24 ? 142 A 1 +ATOM 2559 C CZ A ARG A1 1 152 ? -16.359 37.808 -24.134 0.54 46.38 ? 142 A 1 +ATOM 2560 C CZ B ARG A1 1 152 ? -17.153 37.986 -23.714 0.46 55.66 ? 142 A 1 +ATOM 2561 N NH1 A ARG A1 1 152 ? -16.177 38.542 -23.046 0.54 88.15 ? 142 A 1 +ATOM 2562 N NH1 B ARG A1 1 152 ? -16.094 38.276 -22.975 0.46 82.11 ? 142 A 1 +ATOM 2563 N NH2 A ARG A1 1 152 ? -15.314 37.265 -24.748 0.54 34.07 ? 142 A 1 +ATOM 2564 N NH2 B ARG A1 1 152 ? -18.357 38.396 -23.324 0.46 41.89 ? 142 A 1 +ATOM 2565 H H A ARG A1 1 152 ? -19.409 32.848 -28.078 0.54 24.66 ? 142 A 1 +ATOM 2566 H H B ARG A1 1 152 ? -19.41 32.849 -28.078 0.46 24.66 ? 142 A 1 +ATOM 2567 H HA A ARG A1 1 152 ? -18.864 32.754 -25.581 0.54 28.83 ? 142 A 1 +ATOM 2568 H HA B ARG A1 1 152 ? -18.865 32.742 -25.587 0.46 23.6 ? 142 A 1 +ATOM 2569 H HB2 A ARG A1 1 152 ? -17.904 34.387 -26.912 0.54 42.69 ? 142 A 1 +ATOM 2570 H HB2 B ARG A1 1 152 ? -17.857 34.398 -26.784 0.46 22.39 ? 142 A 1 +ATOM 2571 H HB3 A ARG A1 1 152 ? -19.321 35.063 -27.154 0.54 42.69 ? 142 A 1 +ATOM 2572 H HB3 B ARG A1 1 152 ? -19.255 35.017 -27.217 0.46 22.39 ? 142 A 1 +ATOM 2573 H HG2 A ARG A1 1 152 ? -19.364 35.695 -24.895 0.54 34.04 ? 142 A 1 +ATOM 2574 H HG2 B ARG A1 1 152 ? -19.579 35.761 -25.004 0.46 32.57 ? 142 A 1 +ATOM 2575 H HG3 A ARG A1 1 152 ? -17.899 35.101 -24.729 0.54 34.04 ? 142 A 1 +ATOM 2576 H HG3 B ARG A1 1 152 ? -18.142 35.2 -24.624 0.46 32.57 ? 142 A 1 +ATOM 2577 H HD2 A ARG A1 1 152 ? -17.129 36.693 -26.307 0.54 40.7 ? 142 A 1 +ATOM 2578 H HD2 B ARG A1 1 152 ? -17.683 36.808 -26.642 0.46 42.06 ? 142 A 1 +ATOM 2579 H HD3 A ARG A1 1 152 ? -18.583 37.334 -26.317 0.54 40.7 ? 142 A 1 +ATOM 2580 H HD3 B ARG A1 1 152 ? -18.736 37.593 -25.748 0.46 42.06 ? 142 A 1 +ATOM 2581 H HE A ARG A1 1 152 ? -18.234 38.034 -24.193 0.54 65.63 ? 142 A 1 +ATOM 2582 H HE B ARG A1 1 152 ? -16.189 37.05 -25.039 0.46 48.29 ? 142 A 1 +ATOM 2583 H HH11 A ARG A1 1 152 ? -16.851 38.905 -22.655 0.54 105.78 ? 142 A 1 +ATOM 2584 H HH11 B ARG A1 1 152 ? -15.312 38.014 -23.222 0.46 98.53 ? 142 A 1 +ATOM 2585 H HH12 A ARG A1 1 152 ? -15.385 38.654 -22.731 0.54 105.78 ? 142 A 1 +ATOM 2586 H HH12 B ARG A1 1 152 ? -16.186 38.725 -22.248 0.46 98.53 ? 142 A 1 +ATOM 2587 H HH21 A ARG A1 1 152 ? -15.429 36.8 -25.462 0.54 40.88 ? 142 A 1 +ATOM 2588 H HH21 B ARG A1 1 152 ? -19.049 38.212 -23.799 0.46 50.27 ? 142 A 1 +ATOM 2589 H HH22 A ARG A1 1 152 ? -14.523 37.379 -24.431 0.54 40.88 ? 142 A 1 +ATOM 2590 H HH22 B ARG A1 1 152 ? -18.443 38.845 -22.595 0.46 50.27 ? 142 A 1 +ATOM 2591 N N . GLU A1 1 153 ? -21.824 33.888 -26.053 1.0 19.83 ? 143 A 1 +ATOM 2592 C CA . GLU A1 1 153 ? -23.067 34.181 -25.364 1.0 20.98 ? 143 A 1 +ATOM 2593 C C . GLU A1 1 153 ? -23.522 33.048 -24.467 1.0 18.41 ? 143 A 1 +ATOM 2594 O O . GLU A1 1 153 ? -24.141 33.308 -23.416 1.0 20.53 ? 143 A 1 +ATOM 2595 C CB . GLU A1 1 153 ? -24.164 34.529 -26.391 1.0 25.9 ? 143 A 1 +ATOM 2596 C CG . GLU A1 1 153 ? -25.612 34.427 -25.925 1.0 74.38 ? 143 A 1 +ATOM 2597 C CD . GLU A1 1 153 ? -26.642 34.793 -27.01 1.0 98.04 ? 143 A 1 +ATOM 2598 O OE1 . GLU A1 1 153 ? -26.723 34.095 -28.048 1.0 55.09 ? 143 A 1 +ATOM 2599 O OE2 . GLU A1 1 153 ? -27.382 35.782 -26.812 1.0 86.62 ? 143 A 1 +ATOM 2600 H H . GLU A1 1 153 ? -21.866 33.94 -26.91 1.0 23.79 ? 143 A 1 +ATOM 2601 H HA . GLU A1 1 153 ? -22.916 34.951 -24.793 1.0 25.18 ? 143 A 1 +ATOM 2602 H HB2 . GLU A1 1 153 ? -24.025 35.445 -26.679 1.0 31.08 ? 143 A 1 +ATOM 2603 H HB3 . GLU A1 1 153 ? -24.069 33.926 -27.146 1.0 31.08 ? 143 A 1 +ATOM 2604 H HG2 . GLU A1 1 153 ? -25.787 33.514 -25.647 1.0 89.26 ? 143 A 1 +ATOM 2605 H HG3 . GLU A1 1 153 ? -25.743 35.032 -25.178 1.0 89.26 ? 143 A 1 +ATOM 2606 N N . TYR A1 1 154 ? -23.333 31.807 -24.921 1.0 18.19 ? 144 A 1 +ATOM 2607 C CA . TYR A1 1 154 ? -23.728 30.663 -24.099 1.0 17.84 ? 144 A 1 +ATOM 2608 C C . TYR A1 1 154 ? -22.85 30.59 -22.869 1.0 17.2 ? 144 A 1 +ATOM 2609 O O . TYR A1 1 154 ? -23.36 30.434 -21.765 1.0 17.6 ? 144 A 1 +ATOM 2610 C CB . TYR A1 1 154 ? -23.636 29.348 -24.903 1.0 17.7 ? 144 A 1 +ATOM 2611 C CG . TYR A1 1 154 ? -24.696 29.168 -26.02 1.0 18.06 ? 144 A 1 +ATOM 2612 C CD1 . TYR A1 1 154 ? -25.426 30.225 -26.51 1.0 20.74 ? 144 A 1 +ATOM 2613 C CD2 . TYR A1 1 154 ? -24.843 27.932 -26.592 1.0 18.91 ? 144 A 1 +ATOM 2614 C CE1 . TYR A1 1 154 ? -26.334 30.021 -27.552 1.0 22.51 ? 144 A 1 +ATOM 2615 C CE2 . TYR A1 1 154 ? -25.736 27.708 -27.618 1.0 20.33 ? 144 A 1 +ATOM 2616 C CZ . TYR A1 1 154 ? -26.451 28.745 -28.069 1.0 22.15 ? 144 A 1 +ATOM 2617 O OH . TYR A1 1 154 ? -27.369 28.583 -29.111 1.0 25.92 ? 144 A 1 +ATOM 2618 H H . TYR A1 1 154 ? -22.988 31.605 -25.682 1.0 21.83 ? 144 A 1 +ATOM 2619 H HA . TYR A1 1 154 ? -24.654 30.771 -23.831 1.0 21.4 ? 144 A 1 +ATOM 2620 H HB2 . TYR A1 1 154 ? -22.764 29.31 -25.326 1.0 21.23 ? 144 A 1 +ATOM 2621 H HB3 . TYR A1 1 154 ? -23.739 28.606 -24.287 1.0 21.23 ? 144 A 1 +ATOM 2622 H HD1 . TYR A1 1 154 ? -25.315 31.075 -26.148 1.0 24.89 ? 144 A 1 +ATOM 2623 H HD2 . TYR A1 1 154 ? -24.326 27.225 -26.279 1.0 22.7 ? 144 A 1 +ATOM 2624 H HE1 . TYR A1 1 154 ? -26.844 30.722 -27.887 1.0 27.01 ? 144 A 1 +ATOM 2625 H HE2 . TYR A1 1 154 ? -25.839 26.86 -27.987 1.0 24.4 ? 144 A 1 +ATOM 2626 H HH . TYR A1 1 154 ? -27.352 27.79 -29.388 1.0 31.1 ? 144 A 1 +ATOM 2627 N N . TYR A1 1 155 ? -21.541 30.688 -23.044 1.0 16.5 ? 145 A 1 +ATOM 2628 C CA . TYR A1 1 155 ? -20.648 30.648 -21.89 1.0 16.82 ? 145 A 1 +ATOM 2629 C C . TYR A1 1 155 ? -20.982 31.763 -20.91 1.0 18.28 ? 145 A 1 +ATOM 2630 O O . TYR A1 1 155 ? -20.912 31.557 -19.69 1.0 17.87 ? 145 A 1 +ATOM 2631 C CB . TYR A1 1 155 ? -19.204 30.759 -22.364 1.0 17.41 ? 145 A 1 +ATOM 2632 C CG . TYR A1 1 155 ? -18.668 29.616 -23.204 1.0 15.84 ? 145 A 1 +ATOM 2633 C CD1 . TYR A1 1 155 ? -19.118 28.321 -23.072 1.0 16.39 ? 145 A 1 +ATOM 2634 C CD2 . TYR A1 1 155 ? -17.616 29.844 -24.098 1.0 16.88 ? 145 A 1 +ATOM 2635 C CE1 . TYR A1 1 155 ? -18.596 27.288 -23.819 1.0 15.35 ? 145 A 1 +ATOM 2636 C CE2 . TYR A1 1 155 ? -17.089 28.836 -24.813 1.0 18.93 ? 145 A 1 +ATOM 2637 C CZ . TYR A1 1 155 ? -17.549 27.56 -24.693 1.0 15.99 ? 145 A 1 +ATOM 2638 O OH . TYR A1 1 155 ? -16.933 26.56 -25.431 1.0 16.36 ? 145 A 1 +ATOM 2639 H H . TYR A1 1 155 ? -21.148 30.777 -23.804 1.0 19.8 ? 145 A 1 +ATOM 2640 H HA . TYR A1 1 155 ? -20.751 29.801 -21.427 1.0 20.18 ? 145 A 1 +ATOM 2641 H HB2 . TYR A1 1 155 ? -19.126 31.564 -22.899 1.0 20.89 ? 145 A 1 +ATOM 2642 H HB3 . TYR A1 1 155 ? -18.636 30.825 -21.58 1.0 20.89 ? 145 A 1 +ATOM 2643 H HD1 . TYR A1 1 155 ? -19.795 28.138 -22.46 1.0 19.67 ? 145 A 1 +ATOM 2644 H HD2 . TYR A1 1 155 ? -17.277 30.704 -24.198 1.0 20.25 ? 145 A 1 +ATOM 2645 H HE1 . TYR A1 1 155 ? -18.937 26.426 -23.74 1.0 18.42 ? 145 A 1 +ATOM 2646 H HE2 . TYR A1 1 155 ? -16.394 29.014 -25.405 1.0 22.71 ? 145 A 1 +ATOM 2647 H HH . TYR A1 1 155 ? -17.285 25.817 -25.258 1.0 19.64 ? 145 A 1 +ATOM 2648 N N . GLU A1 1 156 ? -21.352 32.94 -21.413 1.0 17.63 ? 146 A 1 +ATOM 2649 C CA A GLU A1 1 156 ? -21.739 34.067 -20.566 0.41 20.64 ? 146 A 1 +ATOM 2650 C CA B GLU A1 1 156 ? -21.714 34.048 -20.535 0.59 19.4 ? 146 A 1 +ATOM 2651 C C . GLU A1 1 156 ? -22.99 33.74 -19.765 1.0 18.42 ? 146 A 1 +ATOM 2652 O O . GLU A1 1 156 ? -23.055 33.97 -18.544 1.0 19.55 ? 146 A 1 +ATOM 2653 C CB A GLU A1 1 156 ? -22.021 35.292 -21.451 0.41 28.7 ? 146 A 1 +ATOM 2654 C CB B GLU A1 1 156 ? -21.871 35.31 -21.389 0.59 20.2 ? 146 A 1 +ATOM 2655 C CG A GLU A1 1 156 ? -20.799 36.081 -21.895 0.41 42.03 ? 146 A 1 +ATOM 2656 C CG B GLU A1 1 156 ? -22.072 36.603 -20.611 0.59 45.33 ? 146 A 1 +ATOM 2657 C CD A GLU A1 1 156 ? -21.13 37.291 -22.779 0.41 52.58 ? 146 A 1 +ATOM 2658 C CD B GLU A1 1 156 ? -21.837 37.86 -21.444 0.59 33.02 ? 146 A 1 +ATOM 2659 O OE1 A GLU A1 1 156 ? -22.151 37.28 -23.523 0.41 28.21 ? 146 A 1 +ATOM 2660 O OE1 B GLU A1 1 156 ? -22.096 37.838 -22.663 0.59 51.38 ? 146 A 1 +ATOM 2661 O OE2 A GLU A1 1 156 ? -20.344 38.258 -22.719 0.41 51.09 ? 146 A 1 +ATOM 2662 O OE2 B GLU A1 1 156 ? -21.411 38.873 -20.851 0.59 44.83 ? 146 A 1 +ATOM 2663 H H A GLU A1 1 156 ? -21.388 33.117 -22.254 0.41 21.16 ? 146 A 1 +ATOM 2664 H H B GLU A1 1 156 ? -21.401 33.122 -22.252 0.59 21.16 ? 146 A 1 +ATOM 2665 H HA A GLU A1 1 156 ? -21.012 34.264 -19.954 0.41 24.77 ? 146 A 1 +ATOM 2666 H HA B GLU A1 1 156 ? -21.015 34.202 -19.881 0.59 23.28 ? 146 A 1 +ATOM 2667 H HB2 A GLU A1 1 156 ? -22.474 34.989 -22.254 0.41 34.44 ? 146 A 1 +ATOM 2668 H HB2 B GLU A1 1 156 ? -21.07 35.417 -21.926 0.59 24.25 ? 146 A 1 +ATOM 2669 H HB3 A GLU A1 1 156 ? -22.592 35.9 -20.957 0.41 34.44 ? 146 A 1 +ATOM 2670 H HB3 B GLU A1 1 156 ? -22.643 35.195 -21.964 0.59 24.25 ? 146 A 1 +ATOM 2671 H HG2 A GLU A1 1 156 ? -20.336 36.408 -21.107 0.41 50.44 ? 146 A 1 +ATOM 2672 H HG2 B GLU A1 1 156 ? -22.984 36.632 -20.281 0.59 54.4 ? 146 A 1 +ATOM 2673 H HG3 A GLU A1 1 156 ? -20.216 35.495 -22.402 0.41 50.44 ? 146 A 1 +ATOM 2674 H HG3 B GLU A1 1 156 ? -21.449 36.621 -19.867 0.59 54.4 ? 146 A 1 +ATOM 2675 N N . LYS A1 1 157 ? -24.016 33.203 -20.43 1.0 19.21 ? 147 A 1 +ATOM 2676 C CA . LYS A1 1 157 ? -25.249 32.836 -19.746 1.0 19.18 ? 147 A 1 +ATOM 2677 C C . LYS A1 1 157 ? -24.989 31.792 -18.656 1.0 18.43 ? 147 A 1 +ATOM 2678 O O . LYS A1 1 157 ? -25.565 31.857 -17.549 1.0 19.11 ? 147 A 1 +ATOM 2679 C CB . LYS A1 1 157 ? -26.265 32.295 -20.757 1.0 18.36 ? 147 A 1 +ATOM 2680 C CG . LYS A1 1 157 ? -26.979 33.384 -21.538 1.0 21.85 ? 147 A 1 +ATOM 2681 C CD . LYS A1 1 157 ? -27.726 32.852 -22.742 1.0 24.12 ? 147 A 1 +ATOM 2682 C CE . LYS A1 1 157 ? -28.501 34.013 -23.459 1.0 38.79 ? 147 A 1 +ATOM 2683 N NZ . LYS A1 1 157 ? -29.134 33.541 -24.723 1.0 93.87 ? 147 A 1 +ATOM 2684 H H . LYS A1 1 157 ? -24.021 33.042 -21.274 1.0 23.05 ? 147 A 1 +ATOM 2685 H HA . LYS A1 1 157 ? -25.621 33.628 -19.328 1.0 23.01 ? 147 A 1 +ATOM 2686 H HB2 . LYS A1 1 157 ? -25.802 31.728 -21.393 1.0 22.03 ? 147 A 1 +ATOM 2687 H HB3 . LYS A1 1 157 ? -26.936 31.781 -20.282 1.0 22.03 ? 147 A 1 +ATOM 2688 H HG2 . LYS A1 1 157 ? -27.621 33.82 -20.957 1.0 26.22 ? 147 A 1 +ATOM 2689 H HG3 . LYS A1 1 157 ? -26.325 34.028 -21.853 1.0 26.22 ? 147 A 1 +ATOM 2690 H HD2 . LYS A1 1 157 ? -27.096 32.466 -23.371 1.0 28.95 ? 147 A 1 +ATOM 2691 H HD3 . LYS A1 1 157 ? -28.366 32.181 -22.459 1.0 28.95 ? 147 A 1 +ATOM 2692 H HE2 . LYS A1 1 157 ? -29.199 34.344 -22.872 1.0 46.55 ? 147 A 1 +ATOM 2693 H HE3 . LYS A1 1 157 ? -27.883 34.728 -23.675 1.0 46.55 ? 147 A 1 +ATOM 2694 H HZ1 . LYS A1 1 157 ? -29.559 34.214 -25.121 1.0 112.64 ? 147 A 1 +ATOM 2695 H HZ2 . LYS A1 1 157 ? -28.512 33.225 -25.275 1.0 112.64 ? 147 A 1 +ATOM 2696 H HZ3 . LYS A1 1 157 ? -29.719 32.894 -24.547 1.0 112.64 ? 147 A 1 +ATOM 2697 N N . TRP A1 1 158 ? -24.106 30.829 -18.918 1.0 16.35 ? 148 A 1 +ATOM 2698 C CA . TRP A1 1 158 ? -23.86 29.78 -17.935 1.0 16.27 ? 148 A 1 +ATOM 2699 C C . TRP A1 1 158 ? -23.059 30.315 -16.764 1.0 17.1 ? 148 A 1 +ATOM 2700 O O . TRP A1 1 158 ? -23.251 29.846 -15.64 1.0 17.52 ? 148 A 1 +ATOM 2701 C CB . TRP A1 1 158 ? -23.138 28.607 -18.607 1.0 16.34 ? 148 A 1 +ATOM 2702 C CG . TRP A1 1 158 ? -23.954 27.967 -19.697 1.0 16.21 ? 148 A 1 +ATOM 2703 C CD1 . TRP A1 1 158 ? -25.321 28.033 -19.821 1.0 16.52 ? 148 A 1 +ATOM 2704 C CD2 . TRP A1 1 158 ? -23.462 27.278 -20.828 1.0 15.66 ? 148 A 1 +ATOM 2705 N NE1 . TRP A1 1 158 ? -25.726 27.398 -20.971 1.0 16.87 ? 148 A 1 +ATOM 2706 C CE2 . TRP A1 1 158 ? -24.606 26.871 -21.585 1.0 16.11 ? 148 A 1 +ATOM 2707 C CE3 . TRP A1 1 158 ? -22.186 26.865 -21.237 1.0 15.1 ? 148 A 1 +ATOM 2708 C CZ2 . TRP A1 1 158 ? -24.479 26.168 -22.774 1.0 16.38 ? 148 A 1 +ATOM 2709 C CZ3 . TRP A1 1 158 ? -22.082 26.174 -22.453 1.0 15.17 ? 148 A 1 +ATOM 2710 C CH2 . TRP A1 1 158 ? -23.228 25.801 -23.185 1.0 15.86 ? 148 A 1 +ATOM 2711 H H . TRP A1 1 158 ? -23.647 30.763 -19.642 1.0 19.62 ? 148 A 1 +ATOM 2712 H HA . TRP A1 1 158 ? -24.702 29.445 -17.591 1.0 19.53 ? 148 A 1 +ATOM 2713 H HB2 . TRP A1 1 158 ? -22.311 28.929 -19.0 1.0 19.61 ? 148 A 1 +ATOM 2714 H HB3 . TRP A1 1 158 ? -22.946 27.93 -17.939 1.0 19.61 ? 148 A 1 +ATOM 2715 H HD1 . TRP A1 1 158 ? -25.89 28.448 -19.214 1.0 19.83 ? 148 A 1 +ATOM 2716 H HE1 . TRP A1 1 158 ? -26.534 27.338 -21.258 1.0 20.25 ? 148 A 1 +ATOM 2717 H HE3 . TRP A1 1 158 ? -21.435 27.043 -20.719 1.0 18.13 ? 148 A 1 +ATOM 2718 H HZ2 . TRP A1 1 158 ? -25.229 25.951 -23.28 1.0 19.66 ? 148 A 1 +ATOM 2719 H HZ3 . TRP A1 1 158 ? -21.24 25.957 -22.783 1.0 18.21 ? 148 A 1 +ATOM 2720 H HH2 . TRP A1 1 158 ? -23.131 25.297 -23.961 1.0 19.03 ? 148 A 1 +ATOM 2721 N N . LYS A1 1 159 ? -22.195 31.299 -16.985 1.0 16.3 ? 149 A 1 +ATOM 2722 C CA . LYS A1 1 159 ? -21.485 31.952 -15.899 1.0 16.91 ? 149 A 1 +ATOM 2723 C C . LYS A1 1 159 ? -22.465 32.732 -15.015 1.0 18.67 ? 149 A 1 +ATOM 2724 O O . LYS A1 1 159 ? -22.436 32.596 -13.783 1.0 18.85 ? 149 A 1 +ATOM 2725 C CB . LYS A1 1 159 ? -20.389 32.865 -16.442 1.0 18.2 ? 149 A 1 +ATOM 2726 C CG . LYS A1 1 159 ? -19.453 33.394 -15.346 1.0 19.07 ? 149 A 1 +ATOM 2727 C CD . LYS A1 1 159 ? -18.543 32.31 -14.833 1.0 20.13 ? 149 A 1 +ATOM 2728 C CE . LYS A1 1 159 ? -17.531 32.868 -13.79 1.0 23.07 ? 149 A 1 +ATOM 2729 N NZ . LYS A1 1 159 ? -18.147 33.507 -12.612 1.0 29.88 ? 149 A 1 +ATOM 2730 H H . LYS A1 1 159 ? -22.0 31.609 -17.763 1.0 19.56 ? 149 A 1 +ATOM 2731 H HA . LYS A1 1 159 ? -21.046 31.28 -15.356 1.0 20.29 ? 149 A 1 +ATOM 2732 H HB2 . LYS A1 1 159 ? -19.852 32.368 -17.08 1.0 21.84 ? 149 A 1 +ATOM 2733 H HB3 . LYS A1 1 159 ? -20.801 33.627 -16.877 1.0 21.84 ? 149 A 1 +ATOM 2734 H HG2 . LYS A1 1 159 ? -18.904 34.107 -15.708 1.0 22.89 ? 149 A 1 +ATOM 2735 H HG3 . LYS A1 1 159 ? -19.981 33.725 -14.603 1.0 22.89 ? 149 A 1 +ATOM 2736 H HD2 . LYS A1 1 159 ? -19.074 31.62 -14.405 1.0 24.16 ? 149 A 1 +ATOM 2737 H HD3 . LYS A1 1 159 ? -18.043 31.932 -15.573 1.0 24.16 ? 149 A 1 +ATOM 2738 H HE2 . LYS A1 1 159 ? -16.981 32.135 -13.47 1.0 27.69 ? 149 A 1 +ATOM 2739 H HE3 . LYS A1 1 159 ? -16.975 33.534 -14.225 1.0 27.69 ? 149 A 1 +ATOM 2740 H HZ1 . LYS A1 1 159 ? -17.514 33.794 -12.056 1.0 35.86 ? 149 A 1 +ATOM 2741 H HZ2 . LYS A1 1 159 ? -18.644 34.2 -12.866 1.0 35.86 ? 149 A 1 +ATOM 2742 H HZ3 . LYS A1 1 159 ? -18.664 32.922 -12.184 1.0 35.86 ? 149 A 1 +ATOM 2743 N N . GLU A1 1 160 ? -23.382 33.478 -15.617 1.0 19.44 ? 150 A 1 +ATOM 2744 C CA . GLU A1 1 160 ? -24.371 34.2 -14.849 1.0 19.87 ? 150 A 1 +ATOM 2745 C C . GLU A1 1 160 ? -25.287 33.248 -14.122 1.0 20.67 ? 150 A 1 +ATOM 2746 O O . GLU A1 1 160 ? -25.742 33.56 -13.021 1.0 22.53 ? 150 A 1 +ATOM 2747 C CB . GLU A1 1 160 ? -25.19 35.06 -15.793 1.0 25.21 ? 150 A 1 +ATOM 2748 C CG . GLU A1 1 160 ? -24.41 36.123 -16.52 1.0 66.89 ? 150 A 1 +ATOM 2749 C CD . GLU A1 1 160 ? -24.952 37.515 -16.275 0.0 23.15 ? 150 A 1 +ATOM 2750 O OE1 . GLU A1 1 160 ? -25.232 37.851 -15.103 0.85 81.32 ? 150 A 1 +ATOM 2751 O OE2 . GLU A1 1 160 ? -25.098 38.267 -17.261 0.51 60.67 ? 150 A 1 +ATOM 2752 H H . GLU A1 1 160 ? -23.449 33.58 -16.468 1.0 23.33 ? 150 A 1 +ATOM 2753 H HA . GLU A1 1 160 ? -23.93 34.767 -14.197 1.0 23.84 ? 150 A 1 +ATOM 2754 H HB2 . GLU A1 1 160 ? -25.593 34.485 -16.462 1.0 30.26 ? 150 A 1 +ATOM 2755 H HB3 . GLU A1 1 160 ? -25.882 35.507 -15.279 1.0 30.26 ? 150 A 1 +ATOM 2756 H HG2 . GLU A1 1 160 ? -23.489 36.102 -16.218 1.0 80.27 ? 150 A 1 +ATOM 2757 H HG3 . GLU A1 1 160 ? -24.451 35.948 -17.473 1.0 80.27 ? 150 A 1 +ATOM 2758 N N . ALA A1 1 161 ? -25.53 32.057 -14.674 1.0 20.33 ? 151 A 1 +ATOM 2759 C CA . ALA A1 1 161 ? -26.33 31.036 -13.984 1.0 18.6 ? 151 A 1 +ATOM 2760 C C . ALA A1 1 161 ? -25.615 30.484 -12.774 1.0 20.53 ? 151 A 1 +ATOM 2761 O O . ALA A1 1 161 ? -26.228 29.767 -11.964 1.0 20.3 ? 151 A 1 +ATOM 2762 C CB . ALA A1 1 161 ? -26.664 29.878 -14.935 1.0 20.2 ? 151 A 1 +ATOM 2763 H H . ALA A1 1 161 ? -25.245 31.812 -15.448 1.0 24.39 ? 151 A 1 +ATOM 2764 H HA . ALA A1 1 161 ? -27.163 31.445 -13.701 1.0 22.32 ? 151 A 1 +ATOM 2765 H HB1 . ALA A1 1 161 ? -27.187 29.217 -14.455 1.0 24.24 ? 151 A 1 +ATOM 2766 H HB2 . ALA A1 1 161 ? -27.174 30.222 -15.685 1.0 24.24 ? 151 A 1 +ATOM 2767 H HB3 . ALA A1 1 161 ? -25.838 29.481 -15.252 1.0 24.24 ? 151 A 1 +ATOM 2768 N N . GLY A1 1 162 ? -24.303 30.682 -12.7 1.0 18.11 ? 152 A 1 +ATOM 2769 C CA . GLY A1 1 162 ? -23.556 30.271 -11.514 1.0 18.74 ? 152 A 1 +ATOM 2770 C C . GLY A1 1 162 ? -22.476 29.23 -11.756 1.0 18.37 ? 152 A 1 +ATOM 2771 O O . GLY A1 1 162 ? -21.821 28.8 -10.794 1.0 18.52 ? 152 A 1 +ATOM 2772 H H . GLY A1 1 162 ? -23.828 31.049 -13.316 1.0 21.73 ? 152 A 1 +ATOM 2773 H HA2 . GLY A1 1 162 ? -23.13 31.053 -11.131 1.0 22.49 ? 152 A 1 +ATOM 2774 H HA3 . GLY A1 1 162 ? -24.18 29.902 -10.869 1.0 22.49 ? 152 A 1 +ATOM 2775 N N . ALA A1 1 163 ? -22.196 28.798 -12.978 1.0 16.5 ? 153 A 1 +ATOM 2776 C CA . ALA A1 1 163 ? -21.151 27.834 -13.194 1.0 15.67 ? 153 A 1 +ATOM 2777 C C . ALA A1 1 163 ? -19.81 28.401 -12.734 1.0 16.22 ? 153 A 1 +ATOM 2778 O O . ALA A1 1 163 ? -19.501 29.563 -12.946 1.0 18.06 ? 153 A 1 +ATOM 2779 C CB . ALA A1 1 163 ? -21.065 27.453 -14.691 1.0 17.49 ? 153 A 1 +ATOM 2780 H H . ALA A1 1 163 ? -22.601 29.052 -13.693 1.0 19.8 ? 153 A 1 +ATOM 2781 H HA . ALA A1 1 163 ? -21.348 27.031 -12.686 1.0 18.8 ? 153 A 1 +ATOM 2782 H HB1 . ALA A1 1 163 ? -20.353 26.805 -14.812 1.0 20.99 ? 153 A 1 +ATOM 2783 H HB2 . ALA A1 1 163 ? -21.912 27.07 -14.969 1.0 20.99 ? 153 A 1 +ATOM 2784 H HB3 . ALA A1 1 163 ? -20.877 28.251 -15.21 1.0 20.99 ? 153 A 1 +ATOM 2785 N N . ASP A1 1 164 ? -19.012 27.543 -12.111 1.0 14.26 ? 154 A 1 +ATOM 2786 C CA . ASP A1 1 164 ? -17.727 27.929 -11.563 1.0 15.25 ? 154 A 1 +ATOM 2787 C C . ASP A1 1 164 ? -16.536 27.631 -12.466 1.0 15.19 ? 154 A 1 +ATOM 2788 O O . ASP A1 1 164 ? -15.568 28.394 -12.495 1.0 16.34 ? 154 A 1 +ATOM 2789 C CB . ASP A1 1 164 ? -17.485 27.217 -10.205 1.0 15.06 ? 154 A 1 +ATOM 2790 C CG . ASP A1 1 164 ? -18.524 27.546 -9.18 1.0 16.18 ? 154 A 1 +ATOM 2791 O OD1 . ASP A1 1 164 ? -18.406 28.658 -8.613 1.0 19.4 ? 154 A 1 +ATOM 2792 O OD2 . ASP A1 1 164 ? -19.463 26.757 -9.039 1.0 15.6 ? 154 A 1 +ATOM 2793 H H . ASP A1 1 164 ? -19.201 26.712 -11.993 1.0 17.11 ? 154 A 1 +ATOM 2794 H HA . ASP A1 1 164 ? -17.757 28.889 -11.423 1.0 18.3 ? 154 A 1 +ATOM 2795 H HB2 . ASP A1 1 164 ? -17.497 26.257 -10.345 1.0 18.07 ? 154 A 1 +ATOM 2796 H HB3 . ASP A1 1 164 ? -16.623 27.49 -9.855 1.0 18.07 ? 154 A 1 +ATOM 2797 N N . ARG A1 1 165 ? -16.572 26.499 -13.154 1.0 14.8 ? 155 A 1 +ATOM 2798 C CA . ARG A1 1 165 ? -15.444 25.98 -13.905 1.0 13.33 ? 155 A 1 +ATOM 2799 C C . ARG A1 1 165 ? -15.91 25.436 -15.237 1.0 13.77 ? 155 A 1 +ATOM 2800 O O . ARG A1 1 165 ? -17.068 25.094 -15.407 1.0 13.47 ? 155 A 1 +ATOM 2801 C CB . ARG A1 1 165 ? -14.681 24.904 -13.127 1.0 14.2 ? 155 A 1 +ATOM 2802 C CG . ARG A1 1 165 ? -14.612 25.105 -11.618 1.0 14.41 ? 155 A 1 +ATOM 2803 C CD . ARG A1 1 165 ? -13.564 24.192 -10.987 1.0 15.04 ? 155 A 1 +ATOM 2804 N NE . ARG A1 1 165 ? -13.521 24.432 -9.54 1.0 16.4 ? 155 A 1 +ATOM 2805 C CZ . ARG A1 1 165 ? -13.987 23.617 -8.612 1.0 15.77 ? 155 A 1 +ATOM 2806 N NH1 . ARG A1 1 165 ? -14.338 22.376 -8.855 1.0 15.47 ? 155 A 1 +ATOM 2807 N NH2 . ARG A1 1 165 ? -14.089 24.072 -7.386 1.0 16.42 ? 155 A 1 +ATOM 2808 H H . ARG A1 1 165 ? -17.267 25.995 -13.202 1.0 17.75 ? 155 A 1 +ATOM 2809 H HA . ARG A1 1 165 ? -14.834 26.712 -14.086 1.0 16.0 ? 155 A 1 +ATOM 2810 H HB2 . ARG A1 1 165 ? -15.114 24.05 -13.284 1.0 17.04 ? 155 A 1 +ATOM 2811 H HB3 . ARG A1 1 165 ? -13.769 24.879 -13.457 1.0 17.04 ? 155 A 1 +ATOM 2812 H HG2 . ARG A1 1 165 ? -14.371 26.025 -11.426 1.0 17.29 ? 155 A 1 +ATOM 2813 H HG3 . ARG A1 1 165 ? -15.475 24.899 -11.225 1.0 17.29 ? 155 A 1 +ATOM 2814 H HD2 . ARG A1 1 165 ? -13.798 23.264 -11.144 1.0 18.05 ? 155 A 1 +ATOM 2815 H HD3 . ARG A1 1 165 ? -12.691 24.382 -11.363 1.0 18.05 ? 155 A 1 +ATOM 2816 H HE . ARG A1 1 165 ? -13.16 25.166 -9.274 1.0 19.68 ? 155 A 1 +ATOM 2817 H HH11 . ARG A1 1 165 ? -14.269 22.058 -9.651 1.0 18.56 ? 155 A 1 +ATOM 2818 H HH12 . ARG A1 1 165 ? -14.637 21.881 -8.219 1.0 18.56 ? 155 A 1 +ATOM 2819 H HH21 . ARG A1 1 165 ? -13.855 24.88 -7.206 1.0 19.7 ? 155 A 1 +ATOM 2820 H HH22 . ARG A1 1 165 ? -14.39 23.563 -6.761 1.0 19.7 ? 155 A 1 +ATOM 2821 N N . TYR A1 1 166 ? -14.955 25.348 -16.178 1.0 13.41 ? 156 A 1 +ATOM 2822 C CA . TYR A1 1 166 ? -15.267 24.763 -17.48 1.0 12.42 ? 156 A 1 +ATOM 2823 C C . TYR A1 1 166 ? -14.078 23.924 -17.901 1.0 13.99 ? 156 A 1 +ATOM 2824 O O . TYR A1 1 166 ? -12.963 24.433 -17.95 1.0 14.26 ? 156 A 1 +ATOM 2825 C CB . TYR A1 1 166 ? -15.578 25.838 -18.501 1.0 12.86 ? 156 A 1 +ATOM 2826 C CG . TYR A1 1 166 ? -16.41 25.339 -19.688 1.0 13.25 ? 156 A 1 +ATOM 2827 C CD1 . TYR A1 1 166 ? -15.872 24.49 -20.65 1.0 12.84 ? 156 A 1 +ATOM 2828 C CD2 . TYR A1 1 166 ? -17.739 25.655 -19.811 1.0 13.69 ? 156 A 1 +ATOM 2829 C CE1 . TYR A1 1 166 ? -16.622 24.019 -21.719 1.0 13.24 ? 156 A 1 +ATOM 2830 C CE2 . TYR A1 1 166 ? -18.513 25.173 -20.855 1.0 13.09 ? 156 A 1 +ATOM 2831 C CZ . TYR A1 1 166 ? -17.937 24.373 -21.797 1.0 13.34 ? 156 A 1 +ATOM 2832 O OH . TYR A1 1 166 ? -18.765 23.904 -22.806 1.0 14.09 ? 156 A 1 +ATOM 2833 H H . TYR A1 1 166 ? -14.143 25.615 -16.082 1.0 16.09 ? 156 A 1 +ATOM 2834 H HA . TYR A1 1 166 ? -16.046 24.187 -17.425 1.0 14.9 ? 156 A 1 +ATOM 2835 H HB2 . TYR A1 1 166 ? -16.077 26.547 -18.066 1.0 15.44 ? 156 A 1 +ATOM 2836 H HB3 . TYR A1 1 166 ? -14.743 26.187 -18.851 1.0 15.44 ? 156 A 1 +ATOM 2837 H HD1 . TYR A1 1 166 ? -14.982 24.23 -20.575 1.0 15.41 ? 156 A 1 +ATOM 2838 H HD2 . TYR A1 1 166 ? -18.132 26.208 -19.175 1.0 16.43 ? 156 A 1 +ATOM 2839 H HE1 . TYR A1 1 166 ? -16.236 23.476 -22.368 1.0 15.89 ? 156 A 1 +ATOM 2840 H HE2 . TYR A1 1 166 ? -19.415 25.394 -20.913 1.0 15.7 ? 156 A 1 +ATOM 2841 H HH . TYR A1 1 166 ? -18.322 23.441 -23.349 1.0 16.91 ? 156 A 1 +ATOM 2842 N N . LEU A1 1 167 ? -14.326 22.668 -18.224 1.0 11.99 ? 157 A 1 +ATOM 2843 C CA . LEU A1 1 167 ? -13.301 21.737 -18.683 1.0 12.83 ? 157 A 1 +ATOM 2844 C C . LEU A1 1 167 ? -13.458 21.56 -20.191 1.0 13.34 ? 157 A 1 +ATOM 2845 O O . LEU A1 1 167 ? -14.47 21.005 -20.642 1.0 13.63 ? 157 A 1 +ATOM 2846 C CB . LEU A1 1 167 ? -13.426 20.4 -17.98 1.0 14.17 ? 157 A 1 +ATOM 2847 C CG . LEU A1 1 167 ? -12.46 19.343 -18.478 1.0 14.28 ? 157 A 1 +ATOM 2848 C CD1 . LEU A1 1 167 ? -11.04 19.664 -18.163 1.0 16.61 ? 157 A 1 +ATOM 2849 C CD2 . LEU A1 1 167 ? -12.86 18.061 -17.846 1.0 19.46 ? 157 A 1 +ATOM 2850 H H . LEU A1 1 167 ? -15.108 22.314 -18.186 1.0 14.39 ? 157 A 1 +ATOM 2851 H HA . LEU A1 1 167 ? -12.425 22.107 -18.493 1.0 15.4 ? 157 A 1 +ATOM 2852 H HB2 . LEU A1 1 167 ? -13.258 20.531 -17.034 1.0 17.01 ? 157 A 1 +ATOM 2853 H HB3 . LEU A1 1 167 ? -14.326 20.064 -18.114 1.0 17.01 ? 157 A 1 +ATOM 2854 H HG . LEU A1 1 167 ? -12.5 19.288 -19.446 1.0 17.14 ? 157 A 1 +ATOM 2855 H HD11 . LEU A1 1 167 ? -10.482 18.914 -18.423 1.0 19.94 ? 157 A 1 +ATOM 2856 H HD12 . LEU A1 1 167 ? -10.779 20.458 -18.655 1.0 19.94 ? 157 A 1 +ATOM 2857 H HD13 . LEU A1 1 167 ? -10.957 19.823 -17.209 1.0 19.94 ? 157 A 1 +ATOM 2858 H HD21 . LEU A1 1 167 ? -12.798 17.351 -18.504 1.0 23.36 ? 157 A 1 +ATOM 2859 H HD22 . LEU A1 1 167 ? -12.264 17.876 -17.103 1.0 23.36 ? 157 A 1 +ATOM 2860 H HD23 . LEU A1 1 167 ? -13.772 18.137 -17.526 1.0 23.36 ? 157 A 1 +ATOM 2861 N N . LEU A1 1 168 ? -12.489 22.052 -20.937 1.0 12.45 ? 158 A 1 +ATOM 2862 C CA . LEU A1 1 168 ? -12.464 21.971 -22.415 1.0 12.01 ? 158 A 1 +ATOM 2863 C C . LEU A1 1 168 ? -11.056 21.501 -22.773 1.0 12.52 ? 158 A 1 +ATOM 2864 O O . LEU A1 1 168 ? -10.172 22.297 -23.081 1.0 12.77 ? 158 A 1 +ATOM 2865 C CB . LEU A1 1 168 ? -12.812 23.313 -23.004 1.0 13.9 ? 158 A 1 +ATOM 2866 C CG . LEU A1 1 168 ? -13.013 23.292 -24.541 1.0 13.57 ? 158 A 1 +ATOM 2867 C CD1 . LEU A1 1 168 ? -14.305 22.688 -24.886 1.0 16.21 ? 158 A 1 +ATOM 2868 C CD2 . LEU A1 1 168 ? -12.974 24.712 -25.095 1.0 18.41 ? 158 A 1 +ATOM 2869 H H . LEU A1 1 168 ? -11.802 22.456 -20.612 1.0 14.94 ? 158 A 1 +ATOM 2870 H HA . LEU A1 1 168 ? -13.103 21.325 -22.756 1.0 14.42 ? 158 A 1 +ATOM 2871 H HB2 . LEU A1 1 168 ? -13.637 23.624 -22.601 1.0 16.68 ? 158 A 1 +ATOM 2872 H HB3 . LEU A1 1 168 ? -12.092 23.934 -22.808 1.0 16.68 ? 158 A 1 +ATOM 2873 H HG . LEU A1 1 168 ? -12.3 22.767 -24.938 1.0 16.29 ? 158 A 1 +ATOM 2874 H HD11 . LEU A1 1 168 ? -14.431 22.737 -25.847 1.0 19.45 ? 158 A 1 +ATOM 2875 H HD12 . LEU A1 1 168 ? -14.307 21.761 -24.599 1.0 19.45 ? 158 A 1 +ATOM 2876 H HD13 . LEU A1 1 168 ? -15.012 23.175 -24.435 1.0 19.45 ? 158 A 1 +ATOM 2877 H HD21 . LEU A1 1 168 ? -13.09 24.679 -26.057 1.0 22.09 ? 158 A 1 +ATOM 2878 H HD22 . LEU A1 1 168 ? -13.691 25.227 -24.693 1.0 22.09 ? 158 A 1 +ATOM 2879 H HD23 . LEU A1 1 168 ? -12.118 25.112 -24.878 1.0 22.09 ? 158 A 1 +ATOM 2880 N N . ARG A1 1 169 ? -10.852 20.185 -22.674 1.0 13.09 ? 159 A 1 +ATOM 2881 C CA . ARG A1 1 169 ? -9.519 19.619 -22.93 1.0 12.94 ? 159 A 1 +ATOM 2882 C C . ARG A1 1 169 ? -9.072 20.043 -24.331 1.0 13.57 ? 159 A 1 +ATOM 2883 O O . ARG A1 1 169 ? -9.855 19.99 -25.278 1.0 14.37 ? 159 A 1 +ATOM 2884 C CB . ARG A1 1 169 ? -9.57 18.102 -22.758 1.0 13.63 ? 159 A 1 +ATOM 2885 C CG . ARG A1 1 169 ? -9.823 17.728 -21.292 1.0 13.48 ? 159 A 1 +ATOM 2886 C CD . ARG A1 1 169 ? -10.055 16.256 -21.059 1.0 15.89 ? 159 A 1 +ATOM 2887 N NE . ARG A1 1 169 ? -8.803 15.522 -21.301 1.0 14.63 ? 159 A 1 +ATOM 2888 C CZ . ARG A1 1 169 ? -8.677 14.201 -21.368 1.0 15.24 ? 159 A 1 +ATOM 2889 N NH1 . ARG A1 1 169 ? -7.541 13.625 -21.688 1.0 16.68 ? 159 A 1 +ATOM 2890 N NH2 . ARG A1 1 169 ? -9.723 13.474 -21.105 1.0 16.5 ? 159 A 1 +ATOM 2891 H H . ARG A1 1 169 ? -11.454 19.607 -22.465 1.0 15.7 ? 159 A 1 +ATOM 2892 H HA . ARG A1 1 169 ? -8.858 19.944 -22.299 1.0 15.53 ? 159 A 1 +ATOM 2893 H HB2 . ARG A1 1 169 ? -10.29 17.74 -23.298 1.0 16.36 ? 159 A 1 +ATOM 2894 H HB3 . ARG A1 1 169 ? -8.723 17.717 -23.033 1.0 16.36 ? 159 A 1 +ATOM 2895 H HG2 . ARG A1 1 169 ? -9.051 17.99 -20.766 1.0 16.18 ? 159 A 1 +ATOM 2896 H HG3 . ARG A1 1 169 ? -10.611 18.201 -20.982 1.0 16.18 ? 159 A 1 +ATOM 2897 H HD2 . ARG A1 1 169 ? -10.335 16.107 -20.142 1.0 19.06 ? 159 A 1 +ATOM 2898 H HD3 . ARG A1 1 169 ? -10.734 15.928 -21.67 1.0 19.06 ? 159 A 1 +ATOM 2899 H HE . ARG A1 1 169 ? -8.089 15.989 -21.408 1.0 17.56 ? 159 A 1 +ATOM 2900 H HH11 . ARG A1 1 169 ? -6.849 14.106 -21.861 1.0 20.02 ? 159 A 1 +ATOM 2901 H HH12 . ARG A1 1 169 ? -7.488 12.768 -21.723 1.0 20.02 ? 159 A 1 +ATOM 2902 H HH21 . ARG A1 1 169 ? -10.466 13.852 -20.896 1.0 19.8 ? 159 A 1 +ATOM 2903 H HH22 . ARG A1 1 169 ? -9.67 12.617 -21.141 1.0 19.8 ? 159 A 1 +ATOM 2904 N N . HIS A1 1 170 ? -7.824 20.536 -24.447 1.0 13.58 ? 160 A 1 +ATOM 2905 C CA . HIS A1 1 170 ? -7.404 21.02 -25.761 1.0 13.51 ? 160 A 1 +ATOM 2906 C C . HIS A1 1 170 ? -7.076 19.92 -26.766 1.0 13.54 ? 160 A 1 +ATOM 2907 O O . HIS A1 1 170 ? -6.96 20.206 -27.973 1.0 14.17 ? 160 A 1 +ATOM 2908 C CB . HIS A1 1 170 ? -6.276 22.035 -25.631 1.0 14.22 ? 160 A 1 +ATOM 2909 C CG . HIS A1 1 170 ? -4.955 21.449 -25.304 1.0 14.53 ? 160 A 1 +ATOM 2910 N ND1 . HIS A1 1 170 ? -4.508 21.144 -24.016 1.0 15.2 ? 160 A 1 +ATOM 2911 C CD2 . HIS A1 1 170 ? -3.946 21.094 -26.139 1.0 16.05 ? 160 A 1 +ATOM 2912 C CE1 . HIS A1 1 170 ? -3.303 20.632 -24.114 1.0 14.74 ? 160 A 1 +ATOM 2913 N NE2 . HIS A1 1 170 ? -2.927 20.613 -25.392 1.0 15.69 ? 160 A 1 +ATOM 2914 H H . HIS A1 1 170 ? -7.244 20.594 -23.816 1.0 16.29 ? 160 A 1 +ATOM 2915 H HA . HIS A1 1 170 ? -8.151 21.5 -26.153 1.0 16.22 ? 160 A 1 +ATOM 2916 H HB2 . HIS A1 1 170 ? -6.186 22.508 -26.473 1.0 17.07 ? 160 A 1 +ATOM 2917 H HB3 . HIS A1 1 170 ? -6.502 22.659 -24.923 1.0 17.07 ? 160 A 1 +ATOM 2918 H HD2 . HIS A1 1 170 ? -3.954 21.168 -27.066 1.0 19.26 ? 160 A 1 +ATOM 2919 H HE1 . HIS A1 1 170 ? -2.79 20.328 -23.4 1.0 17.69 ? 160 A 1 +ATOM 2920 H HE2 . HIS A1 1 170 ? -2.168 20.343 -25.69 1.0 18.83 ? 160 A 1 +ATOM 2921 N N . GLU A1 1 171 ? -6.902 18.693 -26.301 1.0 13.91 ? 161 A 1 +ATOM 2922 C CA . GLU A1 1 171 ? -6.73 17.463 -27.078 1.0 14.36 ? 161 A 1 +ATOM 2923 C C . GLU A1 1 171 ? -5.338 17.311 -27.657 1.0 13.81 ? 161 A 1 +ATOM 2924 O O . GLU A1 1 171 ? -4.609 16.377 -27.36 1.0 14.04 ? 161 A 1 +ATOM 2925 C CB . GLU A1 1 171 ? -7.824 17.327 -28.146 1.0 15.16 ? 161 A 1 +ATOM 2926 C CG . GLU A1 1 171 ? -9.246 17.641 -27.712 1.0 14.74 ? 161 A 1 +ATOM 2927 C CD . GLU A1 1 171 ? -9.766 16.888 -26.529 1.0 16.22 ? 161 A 1 +ATOM 2928 O OE1 . GLU A1 1 171 ? -9.065 16.106 -25.895 1.0 16.7 ? 161 A 1 +ATOM 2929 O OE2 . GLU A1 1 171 ? -10.97 17.087 -26.274 1.0 16.96 ? 161 A 1 +ATOM 2930 H H . GLU A1 1 171 ? -6.876 18.523 -25.459 1.0 16.69 ? 161 A 1 +ATOM 2931 H HA . GLU A1 1 171 ? -6.832 16.715 -26.469 1.0 17.24 ? 161 A 1 +ATOM 2932 H HB2 . GLU A1 1 171 ? -7.61 17.932 -28.874 1.0 18.2 ? 161 A 1 +ATOM 2933 H HB3 . GLU A1 1 171 ? -7.821 16.411 -28.464 1.0 18.2 ? 161 A 1 +ATOM 2934 H HG2 . GLU A1 1 171 ? -9.292 18.584 -27.491 1.0 17.69 ? 161 A 1 +ATOM 2935 H HG3 . GLU A1 1 171 ? -9.838 17.446 -28.456 1.0 17.69 ? 161 A 1 +ATOM 2936 N N . THR A1 1 172 ? -4.974 18.248 -28.521 1.0 14.83 ? 162 A 1 +ATOM 2937 C CA . THR A1 1 172 ? -3.628 18.361 -29.103 1.0 15.52 ? 162 A 1 +ATOM 2938 C C . THR A1 1 172 ? -3.39 19.817 -29.486 1.0 14.14 ? 162 A 1 +ATOM 2939 O O . THR A1 1 172 ? -4.259 20.443 -30.098 1.0 15.14 ? 162 A 1 +ATOM 2940 C CB . THR A1 1 172 ? -3.434 17.421 -30.309 1.0 15.04 ? 162 A 1 +ATOM 2941 O OG1 . THR A1 1 172 ? -2.164 17.689 -30.907 1.0 16.04 ? 162 A 1 +ATOM 2942 C CG2 . THR A1 1 172 ? -4.484 17.581 -31.401 1.0 16.66 ? 162 A 1 +ATOM 2943 H H . THR A1 1 172 ? -5.506 18.862 -28.804 1.0 17.79 ? 162 A 1 +ATOM 2944 H HA . THR A1 1 172 ? -2.962 18.11 -28.445 1.0 18.63 ? 162 A 1 +ATOM 2945 H HB . THR A1 1 172 ? -3.505 16.514 -29.971 1.0 18.05 ? 162 A 1 +ATOM 2946 H HG1 . THR A1 1 172 ? -1.55 17.553 -30.351 1.0 19.25 ? 162 A 1 +ATOM 2947 H HG21 . THR A1 1 172 ? -4.308 16.961 -32.125 1.0 19.99 ? 162 A 1 +ATOM 2948 H HG22 . THR A1 1 172 ? -5.367 17.402 -31.04 1.0 19.99 ? 162 A 1 +ATOM 2949 H HG23 . THR A1 1 172 ? -4.465 18.486 -31.75 1.0 19.99 ? 162 A 1 +ATOM 2950 N N . ALA A1 1 173 ? -2.216 20.32 -29.16 1.0 14.73 ? 163 A 1 +ATOM 2951 C CA . ALA A1 1 173 ? -1.826 21.656 -29.551 1.0 15.07 ? 163 A 1 +ATOM 2952 C C . ALA A1 1 173 ? -1.236 21.7 -30.946 1.0 18.64 ? 163 A 1 +ATOM 2953 O O . ALA A1 1 173 ? -0.85 22.786 -31.406 1.0 20.15 ? 163 A 1 +ATOM 2954 C CB . ALA A1 1 173 ? -0.843 22.211 -28.521 1.0 17.8 ? 163 A 1 +ATOM 2955 H H . ALA A1 1 173 ? -1.619 19.9 -28.705 1.0 17.67 ? 163 A 1 +ATOM 2956 H HA . ALA A1 1 173 ? -2.601 22.24 -29.556 1.0 18.09 ? 163 A 1 +ATOM 2957 H HB1 . ALA A1 1 173 ? -0.574 23.104 -28.79 1.0 21.36 ? 163 A 1 +ATOM 2958 H HB2 . ALA A1 1 173 ? -1.278 22.244 -27.654 1.0 21.36 ? 163 A 1 +ATOM 2959 H HB3 . ALA A1 1 173 ? -0.067 21.63 -28.48 1.0 21.36 ? 163 A 1 +ATOM 2960 N N . ASN A1 1 174 ? -1.115 20.596 -31.659 1.0 16.02 ? 164 A 1 +ATOM 2961 C CA . ASN A1 1 174 ? -0.619 20.624 -33.039 1.0 15.99 ? 164 A 1 +ATOM 2962 C C . ASN A1 1 174 ? -1.806 20.975 -33.933 1.0 15.66 ? 164 A 1 +ATOM 2963 O O . ASN A1 1 174 ? -2.766 20.205 -34.016 1.0 15.69 ? 164 A 1 +ATOM 2964 C CB . ASN A1 1 174 ? -0.11 19.208 -33.355 1.0 16.61 ? 164 A 1 +ATOM 2965 C CG . ASN A1 1 174 ? 0.37 19.065 -34.777 1.0 16.91 ? 164 A 1 +ATOM 2966 O OD1 . ASN A1 1 174 ? -0.224 19.61 -35.727 1.0 17.5 ? 164 A 1 +ATOM 2967 N ND2 . ASN A1 1 174 ? 1.457 18.382 -34.951 1.0 20.74 ? 164 A 1 +ATOM 2968 H H . ASN A1 1 174 ? -1.313 19.81 -31.373 1.0 19.22 ? 164 A 1 +ATOM 2969 H HA . ASN A1 1 174 ? 0.09 21.269 -33.185 1.0 19.18 ? 164 A 1 +ATOM 2970 H HB2 . ASN A1 1 174 ? 0.632 19.0 -32.766 1.0 19.93 ? 164 A 1 +ATOM 2971 H HB3 . ASN A1 1 174 ? -0.831 18.574 -33.217 1.0 19.93 ? 164 A 1 +ATOM 2972 H HD21 . ASN A1 1 174 ? 1.773 18.271 -35.742 1.0 24.89 ? 164 A 1 +ATOM 2973 H HD22 . ASN A1 1 174 ? 1.862 18.04 -34.274 1.0 24.89 ? 164 A 1 +ATOM 2974 N N . PRO A1 1 175 ? -1.822 22.15 -34.587 1.0 16.01 ? 165 A 1 +ATOM 2975 C CA . PRO A1 1 175 ? -3.031 22.543 -35.294 1.0 16.67 ? 165 A 1 +ATOM 2976 C C . PRO A1 1 175 ? -3.313 21.701 -36.524 1.0 15.88 ? 165 A 1 +ATOM 2977 O O . PRO A1 1 175 ? -4.493 21.571 -36.88 1.0 16.76 ? 165 A 1 +ATOM 2978 C CB . PRO A1 1 175 ? -2.752 24.006 -35.68 1.0 18.89 ? 165 A 1 +ATOM 2979 C CG . PRO A1 1 175 ? -1.281 24.162 -35.632 1.0 25.21 ? 165 A 1 +ATOM 2980 C CD . PRO A1 1 175 ? -0.78 23.171 -34.612 1.0 17.94 ? 165 A 1 +ATOM 2981 H HA . PRO A1 1 175 ? -3.79 22.501 -34.693 1.0 20.01 ? 165 A 1 +ATOM 2982 H HB2 . PRO A1 1 175 ? -3.088 24.178 -36.574 1.0 22.66 ? 165 A 1 +ATOM 2983 H HB3 . PRO A1 1 175 ? -3.182 24.599 -35.044 1.0 22.66 ? 165 A 1 +ATOM 2984 H HG2 . PRO A1 1 175 ? -0.906 23.971 -36.506 1.0 30.25 ? 165 A 1 +ATOM 2985 H HG3 . PRO A1 1 175 ? -1.059 25.068 -35.366 1.0 30.25 ? 165 A 1 +ATOM 2986 H HD2 . PRO A1 1 175 ? 0.068 22.791 -34.889 1.0 21.52 ? 165 A 1 +ATOM 2987 H HD3 . PRO A1 1 175 ? -0.687 23.59 -33.742 1.0 21.52 ? 165 A 1 +ATOM 2988 N N . VAL A1 1 176 ? -2.284 21.131 -37.143 1.0 16.36 ? 166 A 1 +ATOM 2989 C CA . VAL A1 1 176 ? -2.493 20.266 -38.29 1.0 16.56 ? 166 A 1 +ATOM 2990 C C . VAL A1 1 176 ? -3.184 18.988 -37.83 1.0 16.62 ? 166 A 1 +ATOM 2991 O O . VAL A1 1 176 ? -4.201 18.562 -38.395 1.0 17.35 ? 166 A 1 +ATOM 2992 C CB . VAL A1 1 176 ? -1.149 20.038 -39.011 1.0 17.3 ? 166 A 1 +ATOM 2993 C CG1 . VAL A1 1 176 ? -1.276 18.967 -40.08 1.0 18.43 ? 166 A 1 +ATOM 2994 C CG2 . VAL A1 1 176 ? -0.65 21.321 -39.607 1.0 17.97 ? 166 A 1 +ATOM 2995 H H . VAL A1 1 176 ? -1.46 21.23 -36.917 1.0 19.63 ? 166 A 1 +ATOM 2996 H HA . VAL A1 1 176 ? -3.082 20.681 -38.94 1.0 19.87 ? 166 A 1 +ATOM 2997 H HB . VAL A1 1 176 ? -0.5 19.729 -38.359 1.0 20.76 ? 166 A 1 +ATOM 2998 H HG11 . VAL A1 1 176 ? -0.463 18.952 -40.61 1.0 22.12 ? 166 A 1 +ATOM 2999 H HG12 . VAL A1 1 176 ? -1.408 18.107 -39.652 1.0 22.12 ? 166 A 1 +ATOM 3000 H HG13 . VAL A1 1 176 ? -2.035 19.176 -40.647 1.0 22.12 ? 166 A 1 +ATOM 3001 H HG21 . VAL A1 1 176 ? 0.198 21.155 -40.048 1.0 21.56 ? 166 A 1 +ATOM 3002 H HG22 . VAL A1 1 176 ? -1.3 21.644 -40.25 1.0 21.56 ? 166 A 1 +ATOM 3003 H HG23 . VAL A1 1 176 ? -0.532 21.973 -38.899 1.0 21.56 ? 166 A 1 +ATOM 3004 N N . LEU A1 1 177 ? -2.618 18.331 -36.829 1.0 16.21 ? 167 A 1 +ATOM 3005 C CA . LEU A1 1 177 ? -3.235 17.12 -36.291 1.0 16.88 ? 167 A 1 +ATOM 3006 C C . LEU A1 1 177 ? -4.613 17.423 -35.751 1.0 15.39 ? 167 A 1 +ATOM 3007 O O . LEU A1 1 177 ? -5.534 16.586 -35.845 1.0 15.81 ? 167 A 1 +ATOM 3008 C CB . LEU A1 1 177 ? -2.342 16.569 -35.202 1.0 18.25 ? 167 A 1 +ATOM 3009 C CG . LEU A1 1 177 ? -2.755 15.207 -34.72 1.0 19.18 ? 167 A 1 +ATOM 3010 C CD1 . LEU A1 1 177 ? -2.801 14.194 -35.769 1.0 22.07 ? 167 A 1 +ATOM 3011 C CD2 . LEU A1 1 177 ? -1.824 14.793 -33.538 1.0 23.66 ? 167 A 1 +ATOM 3012 H H . LEU A1 1 177 ? -1.884 18.559 -36.444 1.0 19.45 ? 167 A 1 +ATOM 3013 H HA . LEU A1 1 177 ? -3.327 16.451 -36.987 1.0 20.25 ? 167 A 1 +ATOM 3014 H HB2 . LEU A1 1 177 ? -1.437 16.502 -35.544 1.0 21.89 ? 167 A 1 +ATOM 3015 H HB3 . LEU A1 1 177 ? -2.366 17.173 -34.443 1.0 21.89 ? 167 A 1 +ATOM 3016 H HG . LEU A1 1 177 ? -3.673 15.255 -34.41 1.0 23.02 ? 167 A 1 +ATOM 3017 H HD11 . LEU A1 1 177 ? -2.878 13.318 -35.359 1.0 26.49 ? 167 A 1 +ATOM 3018 H HD12 . LEU A1 1 177 ? -3.569 14.362 -36.337 1.0 26.49 ? 167 A 1 +ATOM 3019 H HD13 . LEU A1 1 177 ? -1.985 14.243 -36.291 1.0 26.49 ? 167 A 1 +ATOM 3020 H HD21 . LEU A1 1 177 ? -2.09 13.917 -33.218 1.0 28.39 ? 167 A 1 +ATOM 3021 H HD22 . LEU A1 1 177 ? -0.907 14.766 -33.852 1.0 28.39 ? 167 A 1 +ATOM 3022 H HD23 . LEU A1 1 177 ? -1.911 15.445 -32.825 1.0 28.39 ? 167 A 1 +ATOM 3023 N N . HIS A1 1 178 ? -4.773 18.551 -35.048 1.0 14.71 ? 168 A 1 +ATOM 3024 C CA . HIS A1 1 178 ? -6.075 18.856 -34.433 1.0 14.19 ? 168 A 1 +ATOM 3025 C C . HIS A1 1 178 ? -7.177 18.816 -35.474 1.0 14.82 ? 168 A 1 +ATOM 3026 O O . HIS A1 1 178 ? -8.227 18.225 -35.269 1.0 15.09 ? 168 A 1 +ATOM 3027 C CB . HIS A1 1 178 ? -5.99 20.221 -33.726 1.0 14.57 ? 168 A 1 +ATOM 3028 C CG . HIS A1 1 178 ? -7.098 20.491 -32.764 1.0 13.59 ? 168 A 1 +ATOM 3029 N ND1 . HIS A1 1 178 ? -6.899 20.484 -31.401 1.0 14.19 ? 168 A 1 +ATOM 3030 C CD2 . HIS A1 1 178 ? -8.412 20.734 -32.95 1.0 13.43 ? 168 A 1 +ATOM 3031 C CE1 . HIS A1 1 178 ? -8.056 20.745 -30.806 1.0 14.89 ? 168 A 1 +ATOM 3032 N NE2 . HIS A1 1 178 ? -9.001 20.89 -31.71 1.0 14.51 ? 168 A 1 +ATOM 3033 H H . HIS A1 1 178 ? -4.163 19.141 -34.915 1.0 17.65 ? 168 A 1 +ATOM 3034 H HA . HIS A1 1 178 ? -6.295 18.194 -33.76 1.0 17.03 ? 168 A 1 +ATOM 3035 H HB2 . HIS A1 1 178 ? -5.157 20.26 -33.231 1.0 17.48 ? 168 A 1 +ATOM 3036 H HB3 . HIS A1 1 178 ? -6.009 20.919 -34.398 1.0 17.48 ? 168 A 1 +ATOM 3037 H HD1 . HIS A1 1 178 ? -6.151 20.335 -31.003 1.0 17.02 ? 168 A 1 +ATOM 3038 H HD2 . HIS A1 1 178 ? -8.846 20.788 -33.771 1.0 16.12 ? 168 A 1 +ATOM 3039 H HE1 . HIS A1 1 178 ? -8.18 20.816 -29.887 1.0 17.86 ? 168 A 1 +ATOM 3040 N N . ARG A1 1 179 ? -6.93 19.47 -36.637 1.0 14.75 ? 169 A 1 +ATOM 3041 C CA . ARG A1 1 179 ? -7.937 19.523 -37.699 1.0 15.36 ? 169 A 1 +ATOM 3042 C C . ARG A1 1 179 ? -8.155 18.168 -38.322 1.0 16.14 ? 169 A 1 +ATOM 3043 O O . ARG A1 1 179 ? -9.291 17.844 -38.662 1.0 17.41 ? 169 A 1 +ATOM 3044 C CB . ARG A1 1 179 ? -7.515 20.546 -38.744 1.0 17.93 ? 169 A 1 +ATOM 3045 C CG . ARG A1 1 179 ? -8.44 20.653 -39.991 1.0 19.83 ? 169 A 1 +ATOM 3046 C CD . ARG A1 1 179 ? -9.819 21.096 -39.601 1.0 18.64 ? 169 A 1 +ATOM 3047 N NE . ARG A1 1 179 ? -10.652 21.177 -40.824 0.91 20.36 ? 169 A 1 +ATOM 3048 C CZ . ARG A1 1 179 ? -11.823 21.772 -40.869 0.7 16.7 ? 169 A 1 +ATOM 3049 N NH1 . ARG A1 1 179 ? -12.34 22.354 -39.801 1.0 20.35 ? 169 A 1 +ATOM 3050 N NH2 . ARG A1 1 179 ? -12.509 21.803 -42.008 0.79 20.76 ? 169 A 1 +ATOM 3051 H H . ARG A1 1 179 ? -6.197 19.88 -36.823 1.0 17.7 ? 169 A 1 +ATOM 3052 H HA . ARG A1 1 179 ? -8.785 19.805 -37.323 1.0 18.44 ? 169 A 1 +ATOM 3053 H HB2 . ARG A1 1 179 ? -7.495 21.42 -38.324 1.0 21.52 ? 169 A 1 +ATOM 3054 H HB3 . ARG A1 1 179 ? -6.63 20.31 -39.062 1.0 21.52 ? 169 A 1 +ATOM 3055 H HG2 . ARG A1 1 179 ? -8.074 21.302 -40.611 1.0 23.8 ? 169 A 1 +ATOM 3056 H HG3 . ARG A1 1 179 ? -8.507 19.785 -40.42 1.0 23.8 ? 169 A 1 +ATOM 3057 H HD2 . ARG A1 1 179 ? -10.214 20.454 -38.99 1.0 22.37 ? 169 A 1 +ATOM 3058 H HD3 . ARG A1 1 179 ? -9.782 21.97 -39.183 1.0 22.37 ? 169 A 1 +ATOM 3059 H HE . ARG A1 1 179 ? -10.352 20.815 -41.545 0.94 24.44 ? 169 A 1 +ATOM 3060 H HH11 . ARG A1 1 179 ? -11.909 22.349 -39.057 1.0 24.42 ? 169 A 1 +ATOM 3061 H HH12 . ARG A1 1 179 ? -13.108 22.738 -39.85 1.0 24.42 ? 169 A 1 +ATOM 3062 H HH21 . ARG A1 1 179 ? -12.186 21.435 -42.715 0.84 24.91 ? 169 A 1 +ATOM 3063 H HH22 . ARG A1 1 179 ? -13.275 22.192 -42.038 0.84 24.91 ? 169 A 1 +ATOM 3064 N N . LYS A1 1 180 ? -7.113 17.367 -38.478 1.0 15.5 ? 170 A 1 +ATOM 3065 C CA . LYS A1 1 180 ? -7.266 16.027 -39.022 1.0 16.18 ? 170 A 1 +ATOM 3066 C C . LYS A1 1 180 ? -8.154 15.184 -38.112 1.0 16.83 ? 170 A 1 +ATOM 3067 O O . LYS A1 1 180 ? -8.998 14.415 -38.576 1.0 18.26 ? 170 A 1 +ATOM 3068 C CB . LYS A1 1 180 ? -5.931 15.36 -39.212 1.0 18.26 ? 170 A 1 +ATOM 3069 C CG . LYS A1 1 180 ? -5.102 15.969 -40.334 0.91 20.92 ? 170 A 1 +ATOM 3070 C CD . LYS A1 1 180 ? -3.747 15.312 -40.453 0.97 29.52 ? 170 A 1 +ATOM 3071 C CE . LYS A1 1 180 ? -2.912 15.822 -41.649 1.0 33.57 ? 170 A 1 +ATOM 3072 N NZ . LYS A1 1 180 ? -1.579 15.197 -41.5 0.56 29.19 ? 170 A 1 +ATOM 3073 H H . LYS A1 1 180 ? -6.303 17.574 -38.277 1.0 18.6 ? 170 A 1 +ATOM 3074 H HA . LYS A1 1 180 ? -7.678 16.094 -39.898 1.0 19.42 ? 170 A 1 +ATOM 3075 H HB2 . LYS A1 1 180 ? -5.423 15.44 -38.39 1.0 21.91 ? 170 A 1 +ATOM 3076 H HB3 . LYS A1 1 180 ? -6.076 14.425 -39.423 1.0 21.91 ? 170 A 1 +ATOM 3077 H HG2 . LYS A1 1 180 ? -5.569 15.853 -41.176 0.89 25.11 ? 170 A 1 +ATOM 3078 H HG3 . LYS A1 1 180 ? -4.967 16.913 -40.156 0.88 25.11 ? 170 A 1 +ATOM 3079 H HD2 . LYS A1 1 180 ? -3.242 15.488 -39.643 0.97 35.42 ? 170 A 1 +ATOM 3080 H HD3 . LYS A1 1 180 ? -3.871 14.357 -40.565 0.98 35.42 ? 170 A 1 +ATOM 3081 H HE2 . LYS A1 1 180 ? -3.312 15.548 -42.489 1.0 40.28 ? 170 A 1 +ATOM 3082 H HE3 . LYS A1 1 180 ? -2.827 16.788 -41.621 1.0 40.28 ? 170 A 1 +ATOM 3083 H HZ1 . LYS A1 1 180 ? -1.212 15.441 -40.726 0.52 35.02 ? 170 A 1 +ATOM 3084 H HZ2 . LYS A1 1 180 ? -1.655 14.31 -41.516 0.52 35.02 ? 170 A 1 +ATOM 3085 H HZ3 . LYS A1 1 180 ? -1.046 15.453 -42.165 0.52 35.02 ? 170 A 1 +ATOM 3086 N N . LEU A1 1 181 ? -7.993 15.308 -36.778 1.0 15.03 ? 171 A 1 +ATOM 3087 C CA . LEU A1 1 181 ? -8.727 14.463 -35.836 1.0 15.13 ? 171 A 1 +ATOM 3088 C C . LEU A1 1 181 ? -10.085 15.032 -35.473 1.0 14.47 ? 171 A 1 +ATOM 3089 O O . LEU A1 1 181 ? -10.953 14.286 -34.989 1.0 15.46 ? 171 A 1 +ATOM 3090 C CB . LEU A1 1 181 ? -7.883 14.281 -34.58 1.0 15.33 ? 171 A 1 +ATOM 3091 C CG . LEU A1 1 181 ? -6.603 13.56 -34.792 1.0 17.8 ? 171 A 1 +ATOM 3092 C CD1 . LEU A1 1 181 ? -5.837 13.555 -33.437 1.0 21.67 ? 171 A 1 +ATOM 3093 C CD2 . LEU A1 1 181 ? -6.786 12.175 -35.255 1.0 26.61 ? 171 A 1 +ATOM 3094 H H . LEU A1 1 181 ? -7.465 15.874 -36.403 1.0 18.04 ? 171 A 1 +ATOM 3095 H HA . LEU A1 1 181 ? -8.883 13.588 -36.225 1.0 18.16 ? 171 A 1 +ATOM 3096 H HB2 . LEU A1 1 181 ? -7.669 15.157 -34.223 1.0 18.4 ? 171 A 1 +ATOM 3097 H HB3 . LEU A1 1 181 ? -8.399 13.776 -33.932 1.0 18.4 ? 171 A 1 +ATOM 3098 H HG . LEU A1 1 181 ? -6.102 14.011 -35.49 1.0 21.36 ? 171 A 1 +ATOM 3099 H HD11 . LEU A1 1 181 ? -4.992 13.093 -33.553 1.0 26.0 ? 171 A 1 +ATOM 3100 H HD12 . LEU A1 1 181 ? -5.677 14.471 -33.161 1.0 26.0 ? 171 A 1 +ATOM 3101 H HD13 . LEU A1 1 181 ? -6.375 13.099 -32.771 1.0 26.0 ? 171 A 1 +ATOM 3102 H HD21 . LEU A1 1 181 ? -5.935 11.712 -35.209 1.0 31.93 ? 171 A 1 +ATOM 3103 H HD22 . LEU A1 1 181 ? -7.433 11.734 -34.683 1.0 31.93 ? 171 A 1 +ATOM 3104 H HD23 . LEU A1 1 181 ? -7.107 12.187 -36.17 1.0 31.93 ? 171 A 1 +ATOM 3105 N N . ARG A1 1 182 ? -10.309 16.324 -35.693 1.0 14.44 ? 172 A 1 +ATOM 3106 C CA . ARG A1 1 182 ? -11.513 17.049 -35.271 1.0 15.36 ? 172 A 1 +ATOM 3107 C C . ARG A1 1 182 ? -11.984 17.856 -36.478 1.0 16.65 ? 172 A 1 +ATOM 3108 O O . ARG A1 1 182 ? -11.844 19.077 -36.527 1.0 16.03 ? 172 A 1 +ATOM 3109 C CB . ARG A1 1 182 ? -11.227 17.919 -34.047 1.0 14.93 ? 172 A 1 +ATOM 3110 C CG . ARG A1 1 182 ? -10.549 17.103 -32.93 1.0 14.04 ? 172 A 1 +ATOM 3111 C CD . ARG A1 1 182 ? -10.448 17.867 -31.618 1.0 15.15 ? 172 A 1 +ATOM 3112 N NE . ARG A1 1 182 ? -11.805 18.034 -31.068 1.0 15.22 ? 172 A 1 +ATOM 3113 C CZ . ARG A1 1 182 ? -12.451 19.183 -30.883 1.0 15.25 ? 172 A 1 +ATOM 3114 N NH1 . ARG A1 1 182 ? -11.868 20.348 -31.065 1.0 14.87 ? 172 A 1 +ATOM 3115 N NH2 . ARG A1 1 182 ? -13.757 19.121 -30.546 1.0 16.02 ? 172 A 1 +ATOM 3116 H H . ARG A1 1 182 ? -9.751 16.832 -36.105 1.0 17.33 ? 172 A 1 +ATOM 3117 H HA . ARG A1 1 182 ? -12.221 16.439 -35.012 1.0 18.43 ? 172 A 1 +ATOM 3118 H HB2 . ARG A1 1 182 ? -10.636 18.645 -34.299 1.0 17.92 ? 172 A 1 +ATOM 3119 H HB3 . ARG A1 1 182 ? -12.062 18.274 -33.704 1.0 17.92 ? 172 A 1 +ATOM 3120 H HG2 . ARG A1 1 182 ? -11.066 16.298 -32.768 1.0 16.85 ? 172 A 1 +ATOM 3121 H HG3 . ARG A1 1 182 ? -9.65 16.869 -33.21 1.0 16.85 ? 172 A 1 +ATOM 3122 H HD2 . ARG A1 1 182 ? -9.908 17.37 -30.984 1.0 18.19 ? 172 A 1 +ATOM 3123 H HD3 . ARG A1 1 182 ? -10.058 18.742 -31.771 1.0 18.19 ? 172 A 1 +ATOM 3124 H HE . ARG A1 1 182 ? -12.223 17.316 -30.845 1.0 18.26 ? 172 A 1 +ATOM 3125 H HH11 . ARG A1 1 182 ? -11.045 20.383 -31.311 1.0 17.85 ? 172 A 1 +ATOM 3126 H HH12 . ARG A1 1 182 ? -12.31 21.074 -30.937 1.0 17.85 ? 172 A 1 +ATOM 3127 H HH21 . ARG A1 1 182 ? -14.143 18.358 -30.458 1.0 19.22 ? 172 A 1 +ATOM 3128 H HH22 . ARG A1 1 182 ? -14.203 19.845 -30.418 1.0 19.22 ? 172 A 1 +ATOM 3129 N N . PRO A1 1 183 ? -12.56 17.179 -37.467 1.0 16.51 ? 173 A 1 +ATOM 3130 C CA . PRO A1 1 183 ? -12.758 17.788 -38.794 1.0 15.91 ? 173 A 1 +ATOM 3131 C C . PRO A1 1 183 ? -13.825 18.842 -38.819 1.0 17.73 ? 173 A 1 +ATOM 3132 O O . PRO A1 1 183 ? -13.948 19.528 -39.849 1.0 20.77 ? 173 A 1 +ATOM 3133 C CB . PRO A1 1 183 ? -13.121 16.576 -39.667 1.0 18.74 ? 173 A 1 +ATOM 3134 C CG . PRO A1 1 183 ? -13.742 15.596 -38.693 1.0 20.41 ? 173 A 1 +ATOM 3135 C CD . PRO A1 1 183 ? -12.9 15.753 -37.44 1.0 18.35 ? 173 A 1 +ATOM 3136 H HA . PRO A1 1 183 ? -11.934 18.178 -39.123 1.0 19.1 ? 173 A 1 +ATOM 3137 H HB2 . PRO A1 1 183 ? -13.755 16.837 -40.354 1.0 22.49 ? 173 A 1 +ATOM 3138 H HB3 . PRO A1 1 183 ? -12.322 16.207 -40.075 1.0 22.49 ? 173 A 1 +ATOM 3139 H HG2 . PRO A1 1 183 ? -14.668 15.83 -38.525 1.0 24.49 ? 173 A 1 +ATOM 3140 H HG3 . PRO A1 1 183 ? -13.686 14.693 -39.043 1.0 24.49 ? 173 A 1 +ATOM 3141 H HD2 . PRO A1 1 183 ? -13.411 15.531 -36.646 1.0 22.02 ? 173 A 1 +ATOM 3142 H HD3 . PRO A1 1 183 ? -12.102 15.203 -37.484 1.0 22.02 ? 173 A 1 +ATOM 3143 N N . ASP A1 1 184 ? -14.589 19.016 -37.754 1.0 16.83 ? 174 A 1 +ATOM 3144 C CA . ASP A1 1 184 ? -15.603 20.044 -37.645 1.0 17.62 ? 174 A 1 +ATOM 3145 C C . ASP A1 1 184 ? -15.039 21.372 -37.208 1.0 18.66 ? 174 A 1 +ATOM 3146 O O . ASP A1 1 184 ? -15.772 22.365 -37.245 1.0 21.15 ? 174 A 1 +ATOM 3147 C CB . ASP A1 1 184 ? -16.651 19.627 -36.58 1.0 17.72 ? 174 A 1 +ATOM 3148 C CG . ASP A1 1 184 ? -17.26 18.324 -36.912 1.0 17.86 ? 174 A 1 +ATOM 3149 O OD1 . ASP A1 1 184 ? -18.078 18.254 -37.85 1.0 21.8 ? 174 A 1 +ATOM 3150 O OD2 . ASP A1 1 184 ? -16.927 17.331 -36.246 1.0 21.03 ? 174 A 1 +ATOM 3151 H H . ASP A1 1 184 ? -14.537 18.527 -37.049 1.0 20.19 ? 174 A 1 +ATOM 3152 H HA . ASP A1 1 184 ? -16.031 20.142 -38.511 1.0 21.14 ? 174 A 1 +ATOM 3153 H HB2 . ASP A1 1 184 ? -16.219 19.551 -35.715 1.0 21.26 ? 174 A 1 +ATOM 3154 H HB3 . ASP A1 1 184 ? -17.355 20.293 -36.543 1.0 21.26 ? 174 A 1 +ATOM 3155 N N . THR A1 1 185 ? -13.802 21.415 -36.728 1.0 15.82 ? 175 A 1 +ATOM 3156 C CA . THR A1 1 185 ? -13.351 22.579 -35.989 1.0 15.75 ? 175 A 1 +ATOM 3157 C C . THR A1 1 185 ? -11.857 22.743 -36.13 1.0 16.0 ? 175 A 1 +ATOM 3158 O O . THR A1 1 185 ? -11.293 22.313 -37.139 1.0 16.61 ? 175 A 1 +ATOM 3159 C CB . THR A1 1 185 ? -13.907 22.485 -34.557 1.0 15.43 ? 175 A 1 +ATOM 3160 O OG1 . THR A1 1 185 ? -13.567 23.704 -33.872 1.0 16.44 ? 175 A 1 +ATOM 3161 C CG2 . THR A1 1 185 ? -13.387 21.28 -33.783 1.0 15.42 ? 175 A 1 +ATOM 3162 H H . THR A1 1 185 ? -13.216 20.791 -36.817 1.0 18.99 ? 175 A 1 +ATOM 3163 H HA . THR A1 1 185 ? -13.697 23.416 -36.337 1.0 18.91 ? 175 A 1 +ATOM 3164 H HB . THR A1 1 185 ? -14.868 22.363 -34.596 1.0 18.52 ? 175 A 1 +ATOM 3165 H HG1 . THR A1 1 185 ? -13.831 23.669 -33.075 1.0 19.73 ? 175 A 1 +ATOM 3166 H HG21 . THR A1 1 185 ? -13.76 21.275 -32.887 1.0 18.5 ? 175 A 1 +ATOM 3167 H HG22 . THR A1 1 185 ? -13.642 20.461 -34.235 1.0 18.5 ? 175 A 1 +ATOM 3168 H HG23 . THR A1 1 185 ? -12.42 21.318 -33.721 1.0 18.5 ? 175 A 1 +ATOM 3169 N N . SER A1 1 186 ? -11.191 23.381 -35.167 1.0 16.36 ? 176 A 1 +ATOM 3170 C CA . SER A1 1 186 ? -9.781 23.702 -35.312 1.0 16.12 ? 176 A 1 +ATOM 3171 C C . SER A1 1 186 ? -9.211 24.004 -33.955 1.0 15.75 ? 176 A 1 +ATOM 3172 O O . SER A1 1 186 ? -9.952 24.336 -33.002 1.0 15.6 ? 176 A 1 +ATOM 3173 C CB . SER A1 1 186 ? -9.587 24.908 -36.21 1.0 16.76 ? 176 A 1 +ATOM 3174 O OG . SER A1 1 186 ? -10.182 26.057 -35.62 1.0 18.4 ? 176 A 1 +ATOM 3175 H H . SER A1 1 186 ? -11.538 23.637 -34.422 1.0 19.63 ? 176 A 1 +ATOM 3176 H HA . SER A1 1 186 ? -9.32 22.936 -35.69 1.0 19.35 ? 176 A 1 +ATOM 3177 H HB2 . SER A1 1 186 ? -8.637 25.067 -36.329 1.0 20.12 ? 176 A 1 +ATOM 3178 H HB3 . SER A1 1 186 ? -10.005 24.737 -37.068 1.0 20.12 ? 176 A 1 +ATOM 3179 H HG . SER A1 1 186 ? -10.083 26.722 -36.123 1.0 22.08 ? 176 A 1 +ATOM 3180 N N . PHE A1 1 187 ? -7.891 23.931 -33.861 1.0 15.84 ? 177 A 1 +ATOM 3181 C CA . PHE A1 1 187 ? -7.234 24.321 -32.62 1.0 16.52 ? 177 A 1 +ATOM 3182 C C . PHE A1 1 187 ? -7.499 25.792 -32.329 1.0 17.1 ? 177 A 1 +ATOM 3183 O O . PHE A1 1 187 ? -7.735 26.168 -31.186 1.0 17.16 ? 177 A 1 +ATOM 3184 C CB . PHE A1 1 187 ? -5.734 24.055 -32.702 1.0 16.95 ? 177 A 1 +ATOM 3185 C CG . PHE A1 1 187 ? -5.017 24.52 -31.466 1.0 18.37 ? 177 A 1 +ATOM 3186 C CD1 . PHE A1 1 187 ? -5.061 23.83 -30.321 1.0 20.83 ? 177 A 1 +ATOM 3187 C CD2 . PHE A1 1 187 ? -4.358 25.718 -31.523 1.0 23.95 ? 177 A 1 +ATOM 3188 C CE1 . PHE A1 1 187 ? -4.428 24.321 -29.153 1.0 21.32 ? 177 A 1 +ATOM 3189 C CE2 . PHE A1 1 187 ? -3.707 26.205 -30.371 1.0 28.46 ? 177 A 1 +ATOM 3190 C CZ . PHE A1 1 187 ? -3.74 25.48 -29.238 1.0 23.62 ? 177 A 1 +ATOM 3191 H H . PHE A1 1 187 ? -7.363 23.665 -34.485 1.0 19.0 ? 177 A 1 +ATOM 3192 H HA . PHE A1 1 187 ? -7.585 23.786 -31.892 1.0 19.83 ? 177 A 1 +ATOM 3193 H HB2 . PHE A1 1 187 ? -5.584 23.102 -32.8 1.0 20.35 ? 177 A 1 +ATOM 3194 H HB3 . PHE A1 1 187 ? -5.366 24.529 -33.464 1.0 20.35 ? 177 A 1 +ATOM 3195 H HD1 . PHE A1 1 187 ? -5.514 23.018 -30.291 1.0 25.0 ? 177 A 1 +ATOM 3196 H HD2 . PHE A1 1 187 ? -4.34 26.206 -32.315 1.0 28.73 ? 177 A 1 +ATOM 3197 H HE1 . PHE A1 1 187 ? -4.485 23.857 -28.349 1.0 25.59 ? 177 A 1 +ATOM 3198 H HE2 . PHE A1 1 187 ? -3.259 27.019 -30.394 1.0 34.16 ? 177 A 1 +ATOM 3199 H HZ . PHE A1 1 187 ? -3.275 25.786 -28.492 1.0 28.34 ? 177 A 1 +ATOM 3200 N N . GLU A1 1 188 ? -7.492 26.647 -33.362 1.0 17.04 ? 178 A 1 +ATOM 3201 C CA . GLU A1 1 188 ? -7.808 28.06 -33.145 1.0 18.15 ? 178 A 1 +ATOM 3202 C C . GLU A1 1 188 ? -9.16 28.228 -32.487 1.0 17.91 ? 178 A 1 +ATOM 3203 O O . GLU A1 1 188 ? -9.293 29.028 -31.561 1.0 17.8 ? 178 A 1 +ATOM 3204 C CB . GLU A1 1 188 ? -7.761 28.77 -34.496 1.0 20.38 ? 178 A 1 +ATOM 3205 C CG . GLU A1 1 188 ? -8.205 30.247 -34.468 1.0 27.3 ? 178 A 1 +ATOM 3206 C CD . GLU A1 1 188 ? -8.187 30.909 -35.877 0.76 32.55 ? 178 A 1 +ATOM 3207 O OE1 . GLU A1 1 188 ? -7.788 30.254 -36.853 0.63 34.22 ? 178 A 1 +ATOM 3208 O OE2 . GLU A1 1 188 ? -8.583 32.087 -35.985 0.72 32.33 ? 178 A 1 +ATOM 3209 H H . GLU A1 1 188 ? -7.312 26.437 -34.176 1.0 20.45 ? 178 A 1 +ATOM 3210 H HA . GLU A1 1 188 ? -7.154 28.463 -32.553 1.0 21.78 ? 178 A 1 +ATOM 3211 H HB2 . GLU A1 1 188 ? -6.849 28.746 -34.825 1.0 24.46 ? 178 A 1 +ATOM 3212 H HB3 . GLU A1 1 188 ? -8.347 28.301 -35.111 1.0 24.46 ? 178 A 1 +ATOM 3213 H HG2 . GLU A1 1 188 ? -9.111 30.297 -34.125 1.0 32.76 ? 178 A 1 +ATOM 3214 H HG3 . GLU A1 1 188 ? -7.604 30.746 -33.894 1.0 32.76 ? 178 A 1 +ATOM 3215 N N . ASN A1 1 189 ? -10.178 27.491 -32.924 1.0 16.85 ? 179 A 1 +ATOM 3216 C CA A ASN A1 1 189 ? -11.495 27.583 -32.287 0.58 19.45 ? 179 A 1 +ATOM 3217 C CA B ASN A1 1 189 ? -11.463 27.666 -32.264 0.42 14.99 ? 179 A 1 +ATOM 3218 C C . ASN A1 1 189 ? -11.41 27.162 -30.838 1.0 18.07 ? 179 A 1 +ATOM 3219 O O . ASN A1 1 189 ? -11.966 27.817 -29.948 1.0 18.18 ? 179 A 1 +ATOM 3220 C CB A ASN A1 1 189 ? -12.513 26.664 -32.991 0.58 19.73 ? 179 A 1 +ATOM 3221 C CB B ASN A1 1 189 ? -12.631 27.048 -33.042 0.42 15.31 ? 179 A 1 +ATOM 3222 C CG A ASN A1 1 189 ? -13.05 27.237 -34.274 0.58 20.73 ? 179 A 1 +ATOM 3223 C CG B ASN A1 1 189 ? -13.968 27.593 -32.564 0.42 18.49 ? 179 A 1 +ATOM 3224 O OD1 A ASN A1 1 189 ? -12.799 28.391 -34.62 0.58 24.47 ? 179 A 1 +ATOM 3225 O OD1 B ASN A1 1 189 ? -14.249 28.795 -32.716 0.42 26.37 ? 179 A 1 +ATOM 3226 N ND2 A ASN A1 1 189 ? -13.811 26.408 -35.01 0.58 21.55 ? 179 A 1 +ATOM 3227 N ND2 B ASN A1 1 189 ? -14.796 26.735 -31.969 0.42 16.91 ? 179 A 1 +ATOM 3228 H H A ASN A1 1 189 ? -10.137 26.936 -33.58 0.58 20.22 ? 179 A 1 +ATOM 3229 H H B ASN A1 1 189 ? -10.151 26.917 -33.564 0.42 20.22 ? 179 A 1 +ATOM 3230 H HA A ASN A1 1 189 ? -11.794 28.503 -32.359 0.58 23.34 ? 179 A 1 +ATOM 3231 H HA B ASN A1 1 189 ? -11.653 28.618 -32.25 0.42 17.98 ? 179 A 1 +ATOM 3232 H HB2 A ASN A1 1 189 ? -12.082 25.821 -33.199 0.58 23.68 ? 179 A 1 +ATOM 3233 H HB2 B ASN A1 1 189 ? -12.536 27.256 -33.984 0.42 18.38 ? 179 A 1 +ATOM 3234 H HB3 A ASN A1 1 189 ? -13.264 26.515 -32.395 0.58 23.68 ? 179 A 1 +ATOM 3235 H HB3 B ASN A1 1 189 ? -12.63 26.086 -32.913 0.42 18.38 ? 179 A 1 +ATOM 3236 H HD21 A ASN A1 1 189 ? -14.146 26.679 -35.754 0.58 25.86 ? 179 A 1 +ATOM 3237 H HD21 B ASN A1 1 189 ? -15.562 27.004 -31.684 0.42 20.3 ? 179 A 1 +ATOM 3238 H HD22 A ASN A1 1 189 ? -13.963 25.607 -34.737 0.58 25.86 ? 179 A 1 +ATOM 3239 H HD22 B ASN A1 1 189 ? -14.565 25.912 -31.87 0.42 20.3 ? 179 A 1 +ATOM 3240 N N . ARG A1 1 190 ? -10.77 26.025 -30.606 1.0 16.49 ? 180 A 1 +ATOM 3241 C CA . ARG A1 1 190 ? -10.691 25.475 -29.262 1.0 15.82 ? 180 A 1 +ATOM 3242 C C . ARG A1 1 190 ? -10.0 26.475 -28.332 1.0 15.08 ? 180 A 1 +ATOM 3243 O O . ARG A1 1 190 ? -10.439 26.727 -27.188 1.0 15.55 ? 180 A 1 +ATOM 3244 C CB . ARG A1 1 190 ? -9.909 24.154 -29.315 1.0 17.32 ? 180 A 1 +ATOM 3245 C CG . ARG A1 1 190 ? -10.059 23.255 -28.067 1.0 20.29 ? 180 A 1 +ATOM 3246 C CD . ARG A1 1 190 ? -11.112 22.356 -28.231 1.0 17.85 ? 180 A 1 +ATOM 3247 N NE . ARG A1 1 190 ? -11.308 21.313 -27.191 1.0 14.56 ? 180 A 1 +ATOM 3248 C CZ . ARG A1 1 190 ? -12.457 20.689 -27.056 1.0 13.4 ? 180 A 1 +ATOM 3249 N NH1 . ARG A1 1 190 ? -13.505 20.969 -27.827 1.0 14.54 ? 180 A 1 +ATOM 3250 N NH2 . ARG A1 1 190 ? -12.59 19.783 -26.098 1.0 14.1 ? 180 A 1 +ATOM 3251 H H . ARG A1 1 190 ? -10.374 25.554 -31.207 1.0 19.78 ? 180 A 1 +ATOM 3252 H HA . ARG A1 1 190 ? -11.579 25.295 -28.917 1.0 18.98 ? 180 A 1 +ATOM 3253 H HB2 . ARG A1 1 190 ? -10.219 23.645 -30.08 1.0 20.79 ? 180 A 1 +ATOM 3254 H HB3 . ARG A1 1 190 ? -8.966 24.36 -29.413 1.0 20.79 ? 180 A 1 +ATOM 3255 H HG2 . ARG A1 1 190 ? -9.241 22.75 -27.931 1.0 24.35 ? 180 A 1 +ATOM 3256 H HG3 . ARG A1 1 190 ? -10.242 23.806 -27.29 1.0 24.35 ? 180 A 1 +ATOM 3257 H HD2 . ARG A1 1 190 ? -11.935 22.868 -28.268 1.0 21.42 ? 180 A 1 +ATOM 3258 H HD3 . ARG A1 1 190 ? -10.974 21.888 -29.069 1.0 21.42 ? 180 A 1 +ATOM 3259 H HE . ARG A1 1 190 ? -10.656 21.113 -26.666 1.0 17.47 ? 180 A 1 +ATOM 3260 H HH11 . ARG A1 1 190 ? -13.442 21.573 -28.435 1.0 17.45 ? 180 A 1 +ATOM 3261 H HH12 . ARG A1 1 190 ? -14.245 20.545 -27.717 1.0 17.45 ? 180 A 1 +ATOM 3262 H HH21 . ARG A1 1 190 ? -11.93 19.61 -25.575 1.0 16.91 ? 180 A 1 +ATOM 3263 H HH22 . ARG A1 1 190 ? -13.337 19.368 -26.0 1.0 16.91 ? 180 A 1 +ATOM 3264 N N . LEU A1 1 191 ? -8.88 27.026 -28.769 1.0 15.44 ? 181 A 1 +ATOM 3265 C CA . LEU A1 1 191 ? -8.187 28.027 -27.984 1.0 16.84 ? 181 A 1 +ATOM 3266 C C . LEU A1 1 191 ? -9.027 29.287 -27.765 1.0 16.31 ? 181 A 1 +ATOM 3267 O O . LEU A1 1 191 ? -9.084 29.814 -26.645 1.0 16.84 ? 181 A 1 +ATOM 3268 C CB . LEU A1 1 191 ? -6.867 28.371 -28.656 1.0 18.34 ? 181 A 1 +ATOM 3269 C CG . LEU A1 1 191 ? -6.082 29.534 -28.038 1.0 19.33 ? 181 A 1 +ATOM 3270 C CD1 . LEU A1 1 191 ? -5.744 29.236 -26.615 1.0 23.2 ? 181 A 1 +ATOM 3271 C CD2 . LEU A1 1 191 ? -4.829 29.752 -28.848 1.0 26.11 ? 181 A 1 +ATOM 3272 H H . LEU A1 1 191 ? -8.5 26.837 -29.517 1.0 18.53 ? 181 A 1 +ATOM 3273 H HA . LEU A1 1 191 ? -8.005 27.656 -27.106 1.0 20.21 ? 181 A 1 +ATOM 3274 H HB2 . LEU A1 1 191 ? -6.296 27.587 -28.62 1.0 22.0 ? 181 A 1 +ATOM 3275 H HB3 . LEU A1 1 191 ? -7.05 28.605 -29.579 1.0 22.0 ? 181 A 1 +ATOM 3276 H HG . LEU A1 1 191 ? -6.615 30.345 -28.047 1.0 23.19 ? 181 A 1 +ATOM 3277 H HD11 . LEU A1 1 191 ? -5.153 29.927 -26.279 1.0 27.84 ? 181 A 1 +ATOM 3278 H HD12 . LEU A1 1 191 ? -6.562 29.218 -26.094 1.0 27.84 ? 181 A 1 +ATOM 3279 H HD13 . LEU A1 1 191 ? -5.304 28.373 -26.57 1.0 27.84 ? 181 A 1 +ATOM 3280 H HD21 . LEU A1 1 191 ? -4.321 30.478 -28.454 1.0 31.33 ? 181 A 1 +ATOM 3281 H HD22 . LEU A1 1 191 ? -4.302 28.938 -28.84 1.0 31.33 ? 181 A 1 +ATOM 3282 H HD23 . LEU A1 1 191 ? -5.077 29.977 -29.759 1.0 31.33 ? 181 A 1 +ATOM 3283 N N . ASN A1 1 192 ? -9.741 29.757 -28.783 1.0 16.83 ? 182 A 1 +ATOM 3284 C CA . ASN A1 1 192 ? -10.603 30.907 -28.59 1.0 18.04 ? 182 A 1 +ATOM 3285 C C . ASN A1 1 192 ? -11.645 30.64 -27.526 1.0 17.2 ? 182 A 1 +ATOM 3286 O O . ASN A1 1 192 ? -11.946 31.521 -26.717 1.0 17.18 ? 182 A 1 +ATOM 3287 C CB . ASN A1 1 192 ? -11.251 31.29 -29.907 1.0 18.85 ? 182 A 1 +ATOM 3288 C CG . ASN A1 1 192 ? -10.29 32.007 -30.795 1.0 26.15 ? 182 A 1 +ATOM 3289 O OD1 . ASN A1 1 192 ? -9.31 32.613 -30.307 1.0 28.13 ? 182 A 1 +ATOM 3290 N ND2 . ASN A1 1 192 ? -10.561 31.998 -32.092 1.0 30.94 ? 182 A 1 +ATOM 3291 H H . ASN A1 1 192 ? -9.742 29.432 -29.579 1.0 20.19 ? 182 A 1 +ATOM 3292 H HA . ASN A1 1 192 ? -10.068 31.659 -28.292 1.0 21.65 ? 182 A 1 +ATOM 3293 H HB2 . ASN A1 1 192 ? -11.55 30.488 -30.363 1.0 22.62 ? 182 A 1 +ATOM 3294 H HB3 . ASN A1 1 192 ? -12.006 31.875 -29.736 1.0 22.62 ? 182 A 1 +ATOM 3295 H HD21 . ASN A1 1 192 ? -10.036 32.398 -32.644 1.0 37.13 ? 182 A 1 +ATOM 3296 H HD22 . ASN A1 1 192 ? -11.261 31.592 -32.383 1.0 37.13 ? 182 A 1 +ATOM 3297 N N . CYS A1 1 193 ? -12.214 29.442 -27.499 1.0 15.78 ? 183 A 1 +ATOM 3298 C CA . CYS A1 1 193 ? -13.152 29.079 -26.433 1.0 15.6 ? 183 A 1 +ATOM 3299 C C . CYS A1 1 193 ? -12.469 29.127 -25.071 1.0 15.96 ? 183 A 1 +ATOM 3300 O O . CYS A1 1 193 ? -13.009 29.728 -24.135 1.0 16.27 ? 183 A 1 +ATOM 3301 C CB . CYS A1 1 193 ? -13.726 27.684 -26.684 1.0 14.69 ? 183 A 1 +ATOM 3302 S SG . CYS A1 1 193 ? -14.872 27.56 -28.068 1.0 17.55 ? 183 A 1 +ATOM 3303 H H . CYS A1 1 193 ? -12.079 28.822 -28.08 1.0 18.93 ? 183 A 1 +ATOM 3304 H HA . CYS A1 1 193 ? -13.884 29.715 -26.437 1.0 18.72 ? 183 A 1 +ATOM 3305 H HB2 . CYS A1 1 193 ? -12.99 27.077 -26.862 1.0 17.63 ? 183 A 1 +ATOM 3306 H HB3 . CYS A1 1 193 ? -14.203 27.402 -25.887 1.0 17.63 ? 183 A 1 +ATOM 3307 H HG . CYS A1 1 193 ? -14.31 27.9 -29.073 1.0 21.06 ? 183 A 1 +ATOM 3308 N N . LEU A1 1 194 ? -11.285 28.527 -24.955 1.0 14.25 ? 184 A 1 +ATOM 3309 C CA . LEU A1 1 194 ? -10.549 28.566 -23.674 1.0 15.1 ? 184 A 1 +ATOM 3310 C C . LEU A1 1 194 ? -10.252 29.99 -23.251 1.0 15.98 ? 184 A 1 +ATOM 3311 O O . LEU A1 1 194 ? -10.411 30.328 -22.046 1.0 16.97 ? 184 A 1 +ATOM 3312 C CB . LEU A1 1 194 ? -9.233 27.794 -23.822 1.0 16.12 ? 184 A 1 +ATOM 3313 C CG . LEU A1 1 194 ? -9.404 26.256 -23.814 1.0 14.93 ? 184 A 1 +ATOM 3314 C CD1 . LEU A1 1 194 ? -8.178 25.552 -24.271 1.0 17.83 ? 184 A 1 +ATOM 3315 C CD2 . LEU A1 1 194 ? -9.756 25.751 -22.425 1.0 16.59 ? 184 A 1 +ATOM 3316 H H . LEU A1 1 194 ? -10.886 28.097 -25.585 1.0 17.1 ? 184 A 1 +ATOM 3317 H HA . LEU A1 1 194 ? -11.094 28.149 -22.988 1.0 18.12 ? 184 A 1 +ATOM 3318 H HB2 . LEU A1 1 194 ? -8.82 28.042 -24.664 1.0 19.34 ? 184 A 1 +ATOM 3319 H HB3 . LEU A1 1 194 ? -8.65 28.03 -23.084 1.0 19.34 ? 184 A 1 +ATOM 3320 H HG . LEU A1 1 194 ? -10.126 26.054 -24.431 1.0 17.92 ? 184 A 1 +ATOM 3321 H HD11 . LEU A1 1 194 ? -8.35 24.597 -24.287 1.0 21.39 ? 184 A 1 +ATOM 3322 H HD12 . LEU A1 1 194 ? -7.949 25.862 -25.161 1.0 21.39 ? 184 A 1 +ATOM 3323 H HD13 . LEU A1 1 194 ? -7.455 25.747 -23.655 1.0 21.39 ? 184 A 1 +ATOM 3324 H HD21 . LEU A1 1 194 ? -9.774 24.781 -22.436 1.0 19.91 ? 184 A 1 +ATOM 3325 H HD22 . LEU A1 1 194 ? -9.086 26.062 -21.796 1.0 19.91 ? 184 A 1 +ATOM 3326 H HD23 . LEU A1 1 194 ? -10.629 26.094 -22.175 1.0 19.91 ? 184 A 1 +ATOM 3327 N N . LEU A1 1 195 ? -9.84 30.876 -24.177 1.0 16.21 ? 185 A 1 +ATOM 3328 C CA . LEU A1 1 195 ? -9.575 32.266 -23.819 1.0 17.67 ? 185 A 1 +ATOM 3329 C C . LEU A1 1 195 ? -10.834 32.978 -23.382 1.0 18.33 ? 185 A 1 +ATOM 3330 O O . LEU A1 1 195 ? -10.782 33.801 -22.449 1.0 18.65 ? 185 A 1 +ATOM 3331 C CB . LEU A1 1 195 ? -8.911 33.013 -24.978 1.0 21.23 ? 185 A 1 +ATOM 3332 C CG . LEU A1 1 195 ? -7.53 32.472 -25.35 1.0 21.47 ? 185 A 1 +ATOM 3333 C CD1 . LEU A1 1 195 ? -7.058 33.138 -26.642 1.0 24.07 ? 185 A 1 +ATOM 3334 C CD2 . LEU A1 1 195 ? -6.558 32.694 -24.217 1.0 28.07 ? 185 A 1 +ATOM 3335 H H . LEU A1 1 195 ? -9.711 30.693 -25.008 1.0 19.45 ? 185 A 1 +ATOM 3336 H HA . LEU A1 1 195 ? -8.953 32.269 -23.074 1.0 21.21 ? 185 A 1 +ATOM 3337 H HB2 . LEU A1 1 195 ? -9.479 32.94 -25.761 1.0 25.47 ? 185 A 1 +ATOM 3338 H HB3 . LEU A1 1 195 ? -8.808 33.945 -24.73 1.0 25.47 ? 185 A 1 +ATOM 3339 H HG . LEU A1 1 195 ? -7.572 31.515 -25.503 1.0 25.76 ? 185 A 1 +ATOM 3340 H HD11 . LEU A1 1 195 ? -6.173 32.807 -26.863 1.0 28.88 ? 185 A 1 +ATOM 3341 H HD12 . LEU A1 1 195 ? -7.679 32.921 -27.355 1.0 28.88 ? 185 A 1 +ATOM 3342 H HD13 . LEU A1 1 195 ? -7.028 34.098 -26.51 1.0 28.88 ? 185 A 1 +ATOM 3343 H HD21 . LEU A1 1 195 ? -5.658 32.516 -24.534 1.0 33.68 ? 185 A 1 +ATOM 3344 H HD22 . LEU A1 1 195 ? -6.627 33.613 -23.916 1.0 33.68 ? 185 A 1 +ATOM 3345 H HD23 . LEU A1 1 195 ? -6.777 32.09 -23.49 1.0 33.68 ? 185 A 1 +ATOM 3346 N N . THR A1 1 196 ? -11.962 32.699 -24.044 1.0 17.38 ? 186 A 1 +ATOM 3347 C CA . THR A1 1 196 ? -13.225 33.334 -23.674 1.0 19.54 ? 186 A 1 +ATOM 3348 C C . THR A1 1 196 ? -13.618 32.869 -22.282 1.0 18.14 ? 186 A 1 +ATOM 3349 O O . THR A1 1 196 ? -14.003 33.68 -21.427 1.0 19.74 ? 186 A 1 +ATOM 3350 C CB . THR A1 1 196 ? -14.281 32.969 -24.704 1.0 19.47 ? 186 A 1 +ATOM 3351 O OG1 . THR A1 1 196 ? -13.924 33.542 -25.966 1.0 22.21 ? 186 A 1 +ATOM 3352 C CG2 . THR A1 1 196 ? -15.639 33.499 -24.352 1.0 22.86 ? 186 A 1 +ATOM 3353 H H . THR A1 1 196 ? -12.02 32.152 -24.705 1.0 20.86 ? 186 A 1 +ATOM 3354 H HA . THR A1 1 196 ? -13.146 34.301 -23.667 1.0 23.45 ? 186 A 1 +ATOM 3355 H HB . THR A1 1 196 ? -14.33 32.001 -24.744 1.0 23.36 ? 186 A 1 +ATOM 3356 H HG1 . THR A1 1 196 ? -13.18 33.242 -26.217 1.0 26.65 ? 186 A 1 +ATOM 3357 H HG21 . THR A1 1 196 ? -16.244 33.386 -25.101 1.0 27.43 ? 186 A 1 +ATOM 3358 H HG22 . THR A1 1 196 ? -15.993 33.021 -23.586 1.0 27.43 ? 186 A 1 +ATOM 3359 H HG23 . THR A1 1 196 ? -15.58 34.443 -24.134 1.0 27.43 ? 186 A 1 +ATOM 3360 N N . LEU A1 1 197 ? -13.522 31.584 -22.016 1.0 16.88 ? 187 A 1 +ATOM 3361 C CA . LEU A1 1 197 ? -13.878 31.074 -20.687 1.0 16.43 ? 187 A 1 +ATOM 3362 C C . LEU A1 1 197 ? -13.042 31.748 -19.621 1.0 18.73 ? 187 A 1 +ATOM 3363 O O . LEU A1 1 197 ? -13.569 32.13 -18.56 1.0 18.75 ? 187 A 1 +ATOM 3364 C CB . LEU A1 1 197 ? -13.684 29.575 -20.687 1.0 15.56 ? 187 A 1 +ATOM 3365 C CG . LEU A1 1 197 ? -14.685 28.791 -21.531 1.0 16.06 ? 187 A 1 +ATOM 3366 C CD1 . LEU A1 1 197 ? -14.19 27.399 -21.815 1.0 17.01 ? 187 A 1 +ATOM 3367 C CD2 . LEU A1 1 197 ? -16.074 28.743 -20.92 1.0 16.89 ? 187 A 1 +ATOM 3368 H H . LEU A1 1 197 ? -13.257 30.984 -22.572 1.0 20.26 ? 187 A 1 +ATOM 3369 H HA . LEU A1 1 197 ? -14.808 31.26 -20.482 1.0 19.71 ? 187 A 1 +ATOM 3370 H HB2 . LEU A1 1 197 ? -12.799 29.382 -21.032 1.0 18.68 ? 187 A 1 +ATOM 3371 H HB3 . LEU A1 1 197 ? -13.762 29.257 -19.774 1.0 18.68 ? 187 A 1 +ATOM 3372 H HG . LEU A1 1 197 ? -14.768 29.267 -22.372 1.0 19.27 ? 187 A 1 +ATOM 3373 H HD11 . LEU A1 1 197 ? -14.857 26.927 -22.337 1.0 20.41 ? 187 A 1 +ATOM 3374 H HD12 . LEU A1 1 197 ? -13.359 27.455 -22.313 1.0 20.41 ? 187 A 1 +ATOM 3375 H HD13 . LEU A1 1 197 ? -14.041 26.939 -20.974 1.0 20.41 ? 187 A 1 +ATOM 3376 H HD21 . LEU A1 1 197 ? -16.652 28.214 -21.491 1.0 20.26 ? 187 A 1 +ATOM 3377 H HD22 . LEU A1 1 197 ? -16.018 28.339 -20.04 1.0 20.26 ? 187 A 1 +ATOM 3378 H HD23 . LEU A1 1 197 ? -16.418 29.647 -20.847 1.0 20.26 ? 187 A 1 +ATOM 3379 N N . LYS A1 1 198 ? -11.743 31.909 -19.84 1.0 17.29 ? 188 A 1 +ATOM 3380 C CA A LYS A1 1 198 ? -10.914 32.583 -18.844 0.72 18.4 ? 188 A 1 +ATOM 3381 C CA B LYS A1 1 198 ? -10.939 32.595 -18.815 0.28 19.31 ? 188 A 1 +ATOM 3382 C C . LYS A1 1 198 ? -11.357 34.039 -18.665 1.0 19.45 ? 188 A 1 +ATOM 3383 O O . LYS A1 1 198 ? -11.458 34.544 -17.545 1.0 21.57 ? 188 A 1 +ATOM 3384 C CB A LYS A1 1 198 ? -9.456 32.503 -19.229 0.72 19.04 ? 188 A 1 +ATOM 3385 C CB B LYS A1 1 198 ? -9.457 32.659 -19.084 0.28 24.88 ? 188 A 1 +ATOM 3386 C CG A LYS A1 1 198 ? -8.535 32.872 -18.023 0.72 42.5 ? 188 A 1 +ATOM 3387 C CG B LYS A1 1 198 ? -8.773 31.409 -19.368 0.28 21.61 ? 188 A 1 +ATOM 3388 C CD A LYS A1 1 198 ? -7.02 32.848 -18.297 0.72 64.04 ? 188 A 1 +ATOM 3389 C CD B LYS A1 1 198 ? -7.906 31.675 -20.6 0.28 59.29 ? 188 A 1 +ATOM 3390 C CE A LYS A1 1 198 ? -6.452 31.466 -18.639 0.72 55.02 ? 188 A 1 +ATOM 3391 C CE B LYS A1 1 198 ? -6.507 31.137 -20.448 0.28 31.91 ? 188 A 1 +ATOM 3392 N NZ A LYS A1 1 198 ? -6.54 31.121 -20.101 0.72 39.29 ? 188 A 1 +ATOM 3393 N NZ B LYS A1 1 198 ? -6.023 31.481 -19.085 0.28 49.58 ? 188 A 1 +ATOM 3394 H H . LYS A1 1 198 ? -11.32 31.645 -20.54 1.0 20.75 ? 188 A 1 +ATOM 3395 H HA . LYS A1 1 198 ? -11.011 32.13 -17.992 1.0 23.17 ? 188 A 1 +ATOM 3396 H HB2 A LYS A1 1 198 ? -9.247 31.599 -19.511 0.72 22.85 ? 188 A 1 +ATOM 3397 H HB2 B LYS A1 1 198 ? -9.319 33.235 -19.852 0.28 29.86 ? 188 A 1 +ATOM 3398 H HB3 A LYS A1 1 198 ? -9.279 33.126 -19.952 0.72 22.85 ? 188 A 1 +ATOM 3399 H HB3 B LYS A1 1 198 ? -9.03 33.041 -18.301 0.28 29.86 ? 188 A 1 +ATOM 3400 H HG2 A LYS A1 1 198 ? -8.758 33.771 -17.734 0.72 51.0 ? 188 A 1 +ATOM 3401 H HG2 B LYS A1 1 198 ? -8.212 31.149 -18.621 0.28 25.93 ? 188 A 1 +ATOM 3402 H HG3 A LYS A1 1 198 ? -8.705 32.241 -17.306 0.72 51.0 ? 188 A 1 +ATOM 3403 H HG3 B LYS A1 1 198 ? -9.413 30.706 -19.563 0.28 25.93 ? 188 A 1 +ATOM 3404 H HD2 A LYS A1 1 198 ? -6.832 33.433 -19.047 0.72 76.84 ? 188 A 1 +ATOM 3405 H HD2 B LYS A1 1 198 ? -8.31 31.248 -21.371 0.28 71.15 ? 188 A 1 +ATOM 3406 H HD3 A LYS A1 1 198 ? -6.558 33.165 -17.505 0.72 76.84 ? 188 A 1 +ATOM 3407 H HD3 B LYS A1 1 198 ? -7.845 32.632 -20.744 0.28 71.15 ? 188 A 1 +ATOM 3408 H HE2 A LYS A1 1 198 ? -5.517 31.44 -18.384 0.72 66.03 ? 188 A 1 +ATOM 3409 H HE2 B LYS A1 1 198 ? -6.507 30.172 -20.552 0.28 38.29 ? 188 A 1 +ATOM 3410 H HE3 A LYS A1 1 198 ? -6.949 30.794 -18.146 0.72 66.03 ? 188 A 1 +ATOM 3411 H HE3 B LYS A1 1 198 ? -5.92 31.541 -21.106 0.28 38.29 ? 188 A 1 +ATOM 3412 H HZ1 A LYS A1 1 198 ? -6.167 30.327 -20.249 0.72 47.15 ? 188 A 1 +ATOM 3413 H HZ1 B LYS A1 1 198 ? -5.135 31.546 -19.085 0.28 59.49 ? 188 A 1 +ATOM 3414 H HZ2 A LYS A1 1 198 ? -7.392 31.093 -20.357 0.72 47.15 ? 188 A 1 +ATOM 3415 H HZ2 B LYS A1 1 198 ? -6.369 32.259 -18.826 0.28 59.49 ? 188 A 1 +ATOM 3416 H HZ3 A LYS A1 1 198 ? -6.114 31.735 -20.584 0.72 47.15 ? 188 A 1 +ATOM 3417 H HZ3 B LYS A1 1 198 ? -6.267 30.849 -18.507 0.28 59.49 ? 188 A 1 +ATOM 3418 N N . GLU A1 1 199 ? -11.611 34.737 -19.772 1.0 19.18 ? 189 A 1 +ATOM 3419 C CA . GLU A1 1 199 ? -11.983 36.132 -19.699 1.0 19.84 ? 189 A 1 +ATOM 3420 C C . GLU A1 1 199 ? -13.281 36.308 -18.911 1.0 23.09 ? 189 A 1 +ATOM 3421 O O . GLU A1 1 199 ? -13.453 37.3 -18.203 1.0 24.22 ? 189 A 1 +ATOM 3422 C CB . GLU A1 1 199 ? -12.148 36.71 -21.11 1.0 23.41 ? 189 A 1 +ATOM 3423 C CG . GLU A1 1 199 ? -12.503 38.166 -21.165 1.0 31.06 ? 189 A 1 +ATOM 3424 C CD . GLU A1 1 199 ? -13.012 38.587 -22.532 1.0 62.68 ? 189 A 1 +ATOM 3425 O OE1 . GLU A1 1 199 ? -12.983 37.759 -23.471 1.0 56.93 ? 189 A 1 +ATOM 3426 O OE2 . GLU A1 1 199 ? -13.464 39.742 -22.659 1.0 93.12 ? 189 A 1 +ATOM 3427 H H . GLU A1 1 199 ? -11.573 34.42 -20.571 1.0 23.01 ? 189 A 1 +ATOM 3428 H HA . GLU A1 1 199 ? -11.276 36.624 -19.253 1.0 23.81 ? 189 A 1 +ATOM 3429 H HB2 . GLU A1 1 199 ? -11.31 36.598 -21.586 1.0 28.09 ? 189 A 1 +ATOM 3430 H HB3 . GLU A1 1 199 ? -12.854 36.222 -21.561 1.0 28.09 ? 189 A 1 +ATOM 3431 H HG2 . GLU A1 1 199 ? -13.199 38.348 -20.515 1.0 37.28 ? 189 A 1 +ATOM 3432 H HG3 . GLU A1 1 199 ? -11.714 38.693 -20.963 1.0 37.28 ? 189 A 1 +ATOM 3433 N N . LEU A1 1 200 ? -14.196 35.344 -19.006 1.0 20.31 ? 190 A 1 +ATOM 3434 C CA . LEU A1 1 200 ? -15.455 35.392 -18.284 1.0 22.03 ? 190 A 1 +ATOM 3435 C C . LEU A1 1 200 ? -15.315 35.022 -16.804 1.0 20.35 ? 190 A 1 +ATOM 3436 O O . LEU A1 1 200 ? -16.311 35.096 -16.074 1.0 24.22 ? 190 A 1 +ATOM 3437 C CB . LEU A1 1 200 ? -16.474 34.434 -18.942 1.0 20.64 ? 190 A 1 +ATOM 3438 C CG . LEU A1 1 200 ? -16.939 34.884 -20.339 1.0 21.97 ? 190 A 1 +ATOM 3439 C CD1 . LEU A1 1 200 ? -17.764 33.86 -21.045 1.0 21.03 ? 190 A 1 +ATOM 3440 C CD2 . LEU A1 1 200 ? -17.739 36.194 -20.26 1.0 30.45 ? 190 A 1 +ATOM 3441 H H . LEU A1 1 200 ? -14.106 34.64 -19.492 1.0 24.37 ? 190 A 1 +ATOM 3442 H HA . LEU A1 1 200 ? -15.801 36.297 -18.336 1.0 26.44 ? 190 A 1 +ATOM 3443 H HB2 . LEU A1 1 200 ? -16.064 33.559 -19.033 1.0 24.76 ? 190 A 1 +ATOM 3444 H HB3 . LEU A1 1 200 ? -17.258 34.375 -18.373 1.0 24.76 ? 190 A 1 +ATOM 3445 H HG . LEU A1 1 200 ? -16.131 35.019 -20.859 1.0 26.36 ? 190 A 1 +ATOM 3446 H HD11 . LEU A1 1 200 ? -17.996 34.194 -21.925 1.0 25.24 ? 190 A 1 +ATOM 3447 H HD12 . LEU A1 1 200 ? -17.251 33.042 -21.126 1.0 25.24 ? 190 A 1 +ATOM 3448 H HD13 . LEU A1 1 200 ? -18.571 33.696 -20.531 1.0 25.24 ? 190 A 1 +ATOM 3449 H HD21 . LEU A1 1 200 ? -18.118 36.385 -21.132 1.0 36.54 ? 190 A 1 +ATOM 3450 H HD22 . LEU A1 1 200 ? -18.448 36.092 -19.606 1.0 36.54 ? 190 A 1 +ATOM 3451 H HD23 . LEU A1 1 200 ? -17.143 36.912 -19.993 1.0 36.54 ? 190 A 1 +ATOM 3452 N N . GLY A1 1 201 ? -14.153 34.585 -16.387 1.0 19.9 ? 191 A 1 +ATOM 3453 C CA . GLY A1 1 201 ? -13.873 34.295 -14.977 1.0 20.89 ? 191 A 1 +ATOM 3454 C C . GLY A1 1 201 ? -14.11 32.867 -14.565 1.0 20.83 ? 191 A 1 +ATOM 3455 O O . GLY A1 1 201 ? -14.092 32.56 -13.363 1.0 20.68 ? 191 A 1 +ATOM 3456 H H . GLY A1 1 201 ? -13.482 34.44 -16.904 1.0 23.88 ? 191 A 1 +ATOM 3457 H HA2 . GLY A1 1 201 ? -12.944 34.505 -14.796 1.0 25.06 ? 191 A 1 +ATOM 3458 H HA3 . GLY A1 1 201 ? -14.438 34.859 -14.426 1.0 25.06 ? 191 A 1 +ATOM 3459 N N . TYR A1 1 202 ? -14.299 31.946 -15.493 1.0 16.84 ? 192 A 1 +ATOM 3460 C CA . TYR A1 1 202 ? -14.29 30.552 -15.138 1.0 15.87 ? 192 A 1 +ATOM 3461 C C . TYR A1 1 202 ? -12.903 30.117 -14.69 1.0 16.97 ? 192 A 1 +ATOM 3462 O O . TYR A1 1 202 ? -11.867 30.58 -15.216 1.0 18.7 ? 192 A 1 +ATOM 3463 C CB . TYR A1 1 202 ? -14.621 29.712 -16.377 1.0 17.03 ? 192 A 1 +ATOM 3464 C CG . TYR A1 1 202 ? -16.051 29.706 -16.834 1.0 15.56 ? 192 A 1 +ATOM 3465 C CD1 . TYR A1 1 202 ? -16.499 30.628 -17.751 1.0 16.17 ? 192 A 1 +ATOM 3466 C CD2 . TYR A1 1 202 ? -16.926 28.708 -16.426 1.0 16.42 ? 192 A 1 +ATOM 3467 C CE1 . TYR A1 1 202 ? -17.784 30.586 -18.242 1.0 16.09 ? 192 A 1 +ATOM 3468 C CE2 . TYR A1 1 202 ? -18.21 28.65 -16.915 1.0 15.89 ? 192 A 1 +ATOM 3469 C CZ . TYR A1 1 202 ? -18.618 29.56 -17.839 1.0 15.74 ? 192 A 1 +ATOM 3470 O OH . TYR A1 1 202 ? -19.907 29.435 -18.316 1.0 17.34 ? 192 A 1 +ATOM 3471 H H . TYR A1 1 202 ? -14.434 32.106 -16.328 1.0 20.2 ? 192 A 1 +ATOM 3472 H HA . TYR A1 1 202 ? -14.933 30.406 -14.426 1.0 19.04 ? 192 A 1 +ATOM 3473 H HB2 . TYR A1 1 202 ? -14.09 30.048 -17.116 1.0 20.44 ? 192 A 1 +ATOM 3474 H HB3 . TYR A1 1 202 ? -14.381 28.792 -16.187 1.0 20.44 ? 192 A 1 +ATOM 3475 H HD1 . TYR A1 1 202 ? -15.921 31.294 -18.045 1.0 19.4 ? 192 A 1 +ATOM 3476 H HD2 . TYR A1 1 202 ? -16.639 28.069 -15.814 1.0 19.71 ? 192 A 1 +ATOM 3477 H HE1 . TYR A1 1 202 ? -18.086 31.236 -18.835 1.0 19.31 ? 192 A 1 +ATOM 3478 H HE2 . TYR A1 1 202 ? -18.796 27.993 -16.616 1.0 19.06 ? 192 A 1 +ATOM 3479 H HH . TYR A1 1 202 ? -20.074 30.055 -18.857 1.0 20.8 ? 192 A 1 +ATOM 3480 N N . GLU A1 1 203 ? -12.854 29.172 -13.749 1.0 16.26 ? 193 A 1 +ATOM 3481 C CA A GLU A1 1 203 ? -11.682 28.311 -13.631 0.58 16.3 ? 193 A 1 +ATOM 3482 C CA B GLU A1 1 203 ? -11.687 28.307 -13.635 0.42 15.17 ? 193 A 1 +ATOM 3483 C C . GLU A1 1 203 ? -11.68 27.407 -14.848 1.0 17.0 ? 193 A 1 +ATOM 3484 O O . GLU A1 1 203 ? -12.674 26.711 -15.106 1.0 17.13 ? 193 A 1 +ATOM 3485 C CB A GLU A1 1 203 ? -11.721 27.503 -12.334 0.58 16.74 ? 193 A 1 +ATOM 3486 C CB B GLU A1 1 203 ? -11.779 27.454 -12.387 0.42 14.42 ? 193 A 1 +ATOM 3487 C CG A GLU A1 1 203 ? -11.631 28.418 -11.104 0.58 14.98 ? 193 A 1 +ATOM 3488 C CG B GLU A1 1 203 ? -11.183 28.078 -11.18 0.42 39.44 ? 193 A 1 +ATOM 3489 C CD A GLU A1 1 203 ? -11.641 27.723 -9.744 0.58 26.4 ? 193 A 1 +ATOM 3490 C CD B GLU A1 1 203 ? -11.397 27.181 -10.027 0.42 34.9 ? 193 A 1 +ATOM 3491 O OE1 A GLU A1 1 203 ? -11.356 26.503 -9.65 0.58 17.05 ? 193 A 1 +ATOM 3492 O OE1 B GLU A1 1 203 ? -12.464 27.327 -9.399 0.42 19.43 ? 193 A 1 +ATOM 3493 O OE2 A GLU A1 1 203 ? -11.958 28.444 -8.742 0.58 20.37 ? 193 A 1 +ATOM 3494 O OE2 B GLU A1 1 203 ? -10.55 26.267 -9.846 0.42 19.77 ? 193 A 1 +ATOM 3495 H H A GLU A1 1 203 ? -13.477 29.014 -13.178 0.58 19.51 ? 193 A 1 +ATOM 3496 H H B GLU A1 1 203 ? -13.475 29.017 -13.175 0.42 19.51 ? 193 A 1 +ATOM 3497 H HA A GLU A1 1 203 ? -10.865 28.833 -13.596 0.58 19.57 ? 193 A 1 +ATOM 3498 H HA B GLU A1 1 203 ? -10.877 28.838 -13.581 0.42 18.2 ? 193 A 1 +ATOM 3499 H HB2 A GLU A1 1 203 ? -12.554 27.009 -12.288 0.58 20.08 ? 193 A 1 +ATOM 3500 H HB2 B GLU A1 1 203 ? -12.714 27.281 -12.198 0.42 17.3 ? 193 A 1 +ATOM 3501 H HB3 A GLU A1 1 203 ? -10.97 26.889 -12.314 0.58 20.08 ? 193 A 1 +ATOM 3502 H HB3 B GLU A1 1 203 ? -11.312 26.619 -12.548 0.42 17.3 ? 193 A 1 +ATOM 3503 H HG2 A GLU A1 1 203 ? -10.803 28.921 -11.161 0.58 17.97 ? 193 A 1 +ATOM 3504 H HG2 B GLU A1 1 203 ? -10.23 28.205 -11.31 0.42 47.33 ? 193 A 1 +ATOM 3505 H HG3 A GLU A1 1 203 ? -12.389 29.024 -11.121 0.58 17.97 ? 193 A 1 +ATOM 3506 H HG3 B GLU A1 1 203 ? -11.611 28.93 -11.003 0.42 47.33 ? 193 A 1 +ATOM 3507 N N A THR A1 1 204 ? -10.603 27.444 -15.618 0.59 14.17 ? 194 A 1 +ATOM 3508 N N B THR A1 1 204 ? -10.655 27.525 -15.674 0.41 18.99 ? 194 A 1 +ATOM 3509 C CA A THR A1 1 204 ? -10.578 26.886 -16.961 0.59 13.92 ? 194 A 1 +ATOM 3510 C CA B THR A1 1 204 ? -10.663 26.835 -16.948 0.41 20.19 ? 194 A 1 +ATOM 3511 C C A THR A1 1 204 ? -9.636 25.715 -17.021 0.59 16.15 ? 194 A 1 +ATOM 3512 C C B THR A1 1 204 ? -9.679 25.692 -16.961 0.41 13.49 ? 194 A 1 +ATOM 3513 O O A THR A1 1 204 ? -8.471 25.809 -16.598 0.59 16.86 ? 194 A 1 +ATOM 3514 O O B THR A1 1 204 ? -8.537 25.796 -16.479 0.41 15.24 ? 194 A 1 +ATOM 3515 C CB A THR A1 1 204 ? -10.168 27.981 -17.935 0.59 14.37 ? 194 A 1 +ATOM 3516 C CB B THR A1 1 204 ? -10.402 27.76 -18.123 0.41 18.49 ? 194 A 1 +ATOM 3517 O OG1 A THR A1 1 204 ? -11.071 29.094 -17.79 0.59 21.25 ? 194 A 1 +ATOM 3518 O OG1 B THR A1 1 204 ? -9.054 28.211 -18.086 0.41 17.55 ? 194 A 1 +ATOM 3519 C CG2 A THR A1 1 204 ? -10.262 27.535 -19.373 0.59 18.06 ? 194 A 1 +ATOM 3520 C CG2 B THR A1 1 204 ? -11.353 28.933 -18.065 0.41 14.79 ? 194 A 1 +ATOM 3521 H H A THR A1 1 204 ? -9.856 27.796 -15.378 0.59 17.01 ? 194 A 1 +ATOM 3522 H H B THR A1 1 204 ? -9.952 27.995 -15.519 0.41 22.79 ? 194 A 1 +ATOM 3523 H HA A THR A1 1 204 ? -11.45 26.543 -17.211 0.59 16.71 ? 194 A 1 +ATOM 3524 H HA B THR A1 1 204 ? -11.551 26.463 -17.065 0.41 24.22 ? 194 A 1 +ATOM 3525 H HB A THR A1 1 204 ? -9.248 28.222 -17.742 0.59 17.24 ? 194 A 1 +ATOM 3526 H HB B THR A1 1 204 ? -10.545 27.292 -18.961 0.41 22.18 ? 194 A 1 +ATOM 3527 H HG1 A THR A1 1 204 ? -10.833 29.724 -18.292 0.59 25.5 ? 194 A 1 +ATOM 3528 H HG1 B THR A1 1 204 ? -8.91 28.737 -18.724 0.41 21.06 ? 194 A 1 +ATOM 3529 H HG21 A THR A1 1 204 ? -10.551 28.274 -19.931 0.59 21.68 ? 194 A 1 +ATOM 3530 H HG21 B THR A1 1 204 ? -11.308 29.438 -18.893 0.41 17.75 ? 194 A 1 +ATOM 3531 H HG22 A THR A1 1 204 ? -9.396 27.227 -19.682 0.59 21.68 ? 194 A 1 +ATOM 3532 H HG22 B THR A1 1 204 ? -12.261 28.619 -17.937 0.41 17.75 ? 194 A 1 +ATOM 3533 H HG23 A THR A1 1 204 ? -10.902 26.81 -19.454 0.59 21.68 ? 194 A 1 +ATOM 3534 H HG23 B THR A1 1 204 ? -11.115 29.517 -17.328 0.41 17.75 ? 194 A 1 +ATOM 3535 N N . GLY A1 1 205 ? -10.13 24.606 -17.559 1.0 13.93 ? 195 A 1 +ATOM 3536 C CA . GLY A1 1 205 ? -9.357 23.407 -17.717 1.0 13.8 ? 195 A 1 +ATOM 3537 C C . GLY A1 1 205 ? -9.048 23.05 -19.148 1.0 13.04 ? 195 A 1 +ATOM 3538 O O . GLY A1 1 205 ? -9.973 23.042 -19.993 1.0 13.89 ? 195 A 1 +ATOM 3539 H H A GLY A1 1 205 ? -10.938 24.532 -17.845 0.59 16.72 ? 195 A 1 +ATOM 3540 H H B GLY A1 1 205 ? -10.919 24.541 -17.895 0.41 16.72 ? 195 A 1 +ATOM 3541 H HA2 . GLY A1 1 205 ? -8.514 23.514 -17.249 1.0 16.55 ? 195 A 1 +ATOM 3542 H HA3 . GLY A1 1 205 ? -9.844 22.666 -17.324 1.0 16.55 ? 195 A 1 +ATOM 3543 N N . ALA A1 1 206 ? -7.806 22.718 -19.44 1.0 13.08 ? 196 A 1 +ATOM 3544 C CA . ALA A1 1 206 ? -7.401 22.198 -20.733 1.0 12.71 ? 196 A 1 +ATOM 3545 C C . ALA A1 1 206 ? -6.81 20.819 -20.532 1.0 13.44 ? 196 A 1 +ATOM 3546 O O . ALA A1 1 206 ? -7.172 20.154 -19.558 1.0 13.34 ? 196 A 1 +ATOM 3547 C CB . ALA A1 1 206 ? -6.451 23.179 -21.436 1.0 15.34 ? 196 A 1 +ATOM 3548 H H . ALA A1 1 206 ? -7.152 22.785 -18.886 1.0 15.69 ? 196 A 1 +ATOM 3549 H HA . ALA A1 1 206 ? -8.156 22.107 -21.336 1.0 15.25 ? 196 A 1 +ATOM 3550 H HB1 . ALA A1 1 206 ? -6.247 22.841 -22.322 1.0 18.41 ? 196 A 1 +ATOM 3551 H HB2 . ALA A1 1 206 ? -6.884 24.045 -21.503 1.0 18.41 ? 196 A 1 +ATOM 3552 H HB3 . ALA A1 1 206 ? -5.636 23.256 -20.916 1.0 18.41 ? 196 A 1 +ATOM 3553 N N . GLY A1 1 207 ? -5.891 20.363 -21.401 1.0 13.18 ? 197 A 1 +ATOM 3554 C CA . GLY A1 1 207 ? -5.284 19.054 -21.279 1.0 13.84 ? 197 A 1 +ATOM 3555 C C . GLY A1 1 207 ? -5.395 18.274 -22.563 1.0 13.37 ? 197 A 1 +ATOM 3556 O O . GLY A1 1 207 ? -6.34 18.419 -23.315 1.0 15.46 ? 197 A 1 +ATOM 3557 H H . GLY A1 1 207 ? -5.606 20.811 -22.077 1.0 15.81 ? 197 A 1 +ATOM 3558 H HA2 . GLY A1 1 207 ? -4.344 19.151 -21.056 1.0 16.61 ? 197 A 1 +ATOM 3559 H HA3 . GLY A1 1 207 ? -5.725 18.555 -20.574 1.0 16.61 ? 197 A 1 +ATOM 3560 N N . SER A1 1 208 ? -4.47 17.379 -22.75 1.0 15.08 ? 198 A 1 +ATOM 3561 C CA . SER A1 1 208 ? -4.345 16.634 -24.009 1.0 16.12 ? 198 A 1 +ATOM 3562 C C . SER A1 1 208 ? -4.596 15.147 -23.81 1.0 13.43 ? 198 A 1 +ATOM 3563 O O . SER A1 1 208 ? -4.648 14.602 -22.686 1.0 15.02 ? 198 A 1 +ATOM 3564 C CB . SER A1 1 208 ? -2.972 16.891 -24.642 1.0 18.92 ? 198 A 1 +ATOM 3565 O OG . SER A1 1 208 ? -1.98 16.674 -23.62 1.0 21.07 ? 198 A 1 +ATOM 3566 H H . SER A1 1 208 ? -3.88 17.167 -22.161 1.0 18.09 ? 198 A 1 +ATOM 3567 H HA . SER A1 1 208 ? -5.032 16.937 -24.623 1.0 19.34 ? 198 A 1 +ATOM 3568 H HB2 . SER A1 1 208 ? -2.827 16.274 -25.377 1.0 22.7 ? 198 A 1 +ATOM 3569 H HB3 . SER A1 1 208 ? -2.922 17.805 -24.962 1.0 22.7 ? 198 A 1 +ATOM 3570 H HG . SER A1 1 208 ? -2.013 15.879 -23.351 1.0 25.29 ? 198 A 1 +ATOM 3571 N N . MET A1 1 209 ? -4.717 14.464 -24.941 1.0 13.63 ? 199 A 1 +ATOM 3572 C CA . MET A1 1 209 ? -4.597 13.01 -24.998 1.0 14.49 ? 199 A 1 +ATOM 3573 C C . MET A1 1 209 ? -3.187 12.678 -25.402 1.0 14.29 ? 199 A 1 +ATOM 3574 O O . MET A1 1 209 ? -2.531 13.449 -26.136 1.0 15.85 ? 199 A 1 +ATOM 3575 C CB . MET A1 1 209 ? -5.598 12.377 -25.989 1.0 16.11 ? 199 A 1 +ATOM 3576 C CG . MET A1 1 209 ? -7.013 12.374 -25.503 1.0 15.5 ? 199 A 1 +ATOM 3577 S SD . MET A1 1 209 ? -8.188 11.771 -26.729 1.0 17.22 ? 199 A 1 +ATOM 3578 C CE . MET A1 1 209 ? -8.315 13.214 -27.726 1.0 17.48 ? 199 A 1 +ATOM 3579 H H . MET A1 1 209 ? -4.872 14.827 -25.705 1.0 16.36 ? 199 A 1 +ATOM 3580 H HA . MET A1 1 209 ? -4.807 12.629 -24.131 1.0 17.39 ? 199 A 1 +ATOM 3581 H HB2 . MET A1 1 209 ? -5.571 12.877 -26.82 1.0 19.34 ? 199 A 1 +ATOM 3582 H HB3 . MET A1 1 209 ? -5.338 11.456 -26.148 1.0 19.34 ? 199 A 1 +ATOM 3583 H HG2 . MET A1 1 209 ? -7.076 11.8 -24.723 1.0 18.61 ? 199 A 1 +ATOM 3584 H HG3 . MET A1 1 209 ? -7.266 13.28 -25.269 1.0 18.61 ? 199 A 1 +ATOM 3585 H HE1 . MET A1 1 209 ? -8.875 13.018 -28.494 1.0 20.98 ? 199 A 1 +ATOM 3586 H HE2 . MET A1 1 209 ? -8.711 13.927 -27.201 1.0 20.98 ? 199 A 1 +ATOM 3587 H HE3 . MET A1 1 209 ? -7.429 13.473 -28.021 1.0 20.98 ? 199 A 1 +ATOM 3588 N N . VAL A1 1 210 ? -2.674 11.574 -24.884 1.0 13.42 ? 200 A 1 +ATOM 3589 C CA . VAL A1 1 210 ? -1.325 11.098 -25.158 1.0 13.8 ? 200 A 1 +ATOM 3590 C C . VAL A1 1 210 ? -1.39 9.827 -25.962 1.0 14.42 ? 200 A 1 +ATOM 3591 O O . VAL A1 1 210 ? -2.121 8.9 -25.63 1.0 15.0 ? 200 A 1 +ATOM 3592 C CB . VAL A1 1 210 ? -0.574 10.874 -23.829 1.0 14.42 ? 200 A 1 +ATOM 3593 C CG1 . VAL A1 1 210 ? 0.78 10.27 -24.078 1.0 17.25 ? 200 A 1 +ATOM 3594 C CG2 . VAL A1 1 210 ? -0.532 12.124 -23.063 1.0 15.93 ? 200 A 1 +ATOM 3595 H H . VAL A1 1 210 ? -3.106 11.059 -24.347 1.0 16.11 ? 200 A 1 +ATOM 3596 H HA . VAL A1 1 210 ? -0.852 11.749 -25.7 1.0 16.56 ? 200 A 1 +ATOM 3597 H HB . VAL A1 1 210 ? -1.048 10.231 -23.279 1.0 17.3 ? 200 A 1 +ATOM 3598 H HG11 . VAL A1 1 210 ? 1.324 10.375 -23.282 1.0 20.7 ? 200 A 1 +ATOM 3599 H HG12 . VAL A1 1 210 ? 0.673 9.327 -24.282 1.0 20.7 ? 200 A 1 +ATOM 3600 H HG13 . VAL A1 1 210 ? 1.197 10.725 -24.826 1.0 20.7 ? 200 A 1 +ATOM 3601 H HG21 . VAL A1 1 210 ? 0.012 11.991 -22.271 1.0 19.11 ? 200 A 1 +ATOM 3602 H HG22 . VAL A1 1 210 ? -0.145 12.821 -23.616 1.0 19.11 ? 200 A 1 +ATOM 3603 H HG23 . VAL A1 1 210 ? -1.435 12.368 -22.807 1.0 19.11 ? 200 A 1 +ATOM 3604 N N . GLY A1 1 211 ? -0.669 9.813 -27.082 1.0 15.39 ? 201 A 1 +ATOM 3605 C CA . GLY A1 1 211 ? -0.647 8.658 -27.962 1.0 15.42 ? 201 A 1 +ATOM 3606 C C . GLY A1 1 211 ? -1.602 8.718 -29.106 1.0 15.63 ? 201 A 1 +ATOM 3607 O O . GLY A1 1 211 ? -1.87 7.683 -29.719 1.0 16.86 ? 201 A 1 +ATOM 3608 H H . GLY A1 1 211 ? -0.181 10.467 -27.352 1.0 18.46 ? 201 A 1 +ATOM 3609 H HA2 . GLY A1 1 211 ? 0.246 8.564 -28.327 1.0 18.51 ? 201 A 1 +ATOM 3610 H HA3 . GLY A1 1 211 ? -0.86 7.868 -27.441 1.0 18.51 ? 201 A 1 +ATOM 3611 N N . LEU A1 1 212 ? -2.085 9.891 -29.454 1.0 15.86 ? 202 A 1 +ATOM 3612 C CA . LEU A1 1 212 ? -2.93 10.023 -30.638 1.0 15.93 ? 202 A 1 +ATOM 3613 C C . LEU A1 1 212 ? -2.153 9.617 -31.875 1.0 17.2 ? 202 A 1 +ATOM 3614 O O . LEU A1 1 212 ? -0.945 9.792 -31.952 1.0 17.52 ? 202 A 1 +ATOM 3615 C CB . LEU A1 1 212 ? -3.433 11.467 -30.789 1.0 16.81 ? 202 A 1 +ATOM 3616 C CG . LEU A1 1 212 ? -4.432 11.918 -29.735 1.0 15.41 ? 202 A 1 +ATOM 3617 C CD1 . LEU A1 1 212 ? -4.528 13.427 -29.764 1.0 16.92 ? 202 A 1 +ATOM 3618 C CD2 . LEU A1 1 212 ? -5.746 11.317 -30.009 1.0 17.18 ? 202 A 1 +ATOM 3619 H H . LEU A1 1 212 ? -1.945 10.626 -29.03 1.0 19.04 ? 202 A 1 +ATOM 3620 H HA . LEU A1 1 212 ? -3.703 9.443 -30.549 1.0 19.11 ? 202 A 1 +ATOM 3621 H HB2 . LEU A1 1 212 ? -2.669 12.063 -30.74 1.0 20.18 ? 202 A 1 +ATOM 3622 H HB3 . LEU A1 1 212 ? -3.864 11.551 -31.654 1.0 20.18 ? 202 A 1 +ATOM 3623 H HG . LEU A1 1 212 ? -4.146 11.636 -28.852 1.0 18.5 ? 202 A 1 +ATOM 3624 H HD11 . LEU A1 1 212 ? -5.166 13.715 -29.092 1.0 20.31 ? 202 A 1 +ATOM 3625 H HD12 . LEU A1 1 212 ? -3.654 13.802 -29.573 1.0 20.31 ? 202 A 1 +ATOM 3626 H HD13 . LEU A1 1 212 ? -4.824 13.707 -30.644 1.0 20.31 ? 202 A 1 +ATOM 3627 H HD21 . LEU A1 1 212 ? -6.384 11.642 -29.355 1.0 20.61 ? 202 A 1 +ATOM 3628 H HD22 . LEU A1 1 212 ? -6.028 11.57 -30.902 1.0 20.61 ? 202 A 1 +ATOM 3629 H HD23 . LEU A1 1 212 ? -5.671 10.352 -29.947 1.0 20.61 ? 202 A 1 +ATOM 3630 N N . PRO A1 1 213 ? -2.842 9.103 -32.895 1.0 18.01 ? 203 A 1 +ATOM 3631 C CA . PRO A1 1 213 ? -2.145 8.763 -34.147 1.0 18.71 ? 203 A 1 +ATOM 3632 C C . PRO A1 1 213 ? -1.521 10.012 -34.762 1.0 19.41 ? 203 A 1 +ATOM 3633 O O . PRO A1 1 213 ? -2.157 11.078 -34.766 1.0 24.53 ? 203 A 1 +ATOM 3634 C CB . PRO A1 1 213 ? -3.265 8.22 -35.043 1.0 23.31 ? 203 A 1 +ATOM 3635 C CG . PRO A1 1 213 ? -4.389 8.13 -34.291 1.0 24.34 ? 203 A 1 +ATOM 3636 C CD . PRO A1 1 213 ? -4.27 8.833 -32.964 1.0 20.27 ? 203 A 1 +ATOM 3637 H HA . PRO A1 1 213 ? -1.474 8.079 -33.997 1.0 22.45 ? 203 A 1 +ATOM 3638 H HB2 . PRO A1 1 213 ? -3.403 8.829 -35.785 1.0 27.98 ? 203 A 1 +ATOM 3639 H HB3 . PRO A1 1 213 ? -3.01 7.345 -35.375 1.0 27.98 ? 203 A 1 +ATOM 3640 H HG2 . PRO A1 1 213 ? -5.116 8.527 -34.796 1.0 29.21 ? 203 A 1 +ATOM 3641 H HG3 . PRO A1 1 213 ? -4.568 7.189 -34.136 1.0 29.21 ? 203 A 1 +ATOM 3642 H HD2 . PRO A1 1 213 ? -4.783 9.656 -32.957 1.0 24.33 ? 203 A 1 +ATOM 3643 H HD3 . PRO A1 1 213 ? -4.554 8.258 -32.236 1.0 24.33 ? 203 A 1 +ATOM 3644 N N . GLY A1 1 214 ? -0.286 9.899 -35.145 1.0 21.5 ? 204 A 1 +ATOM 3645 C CA . GLY A1 1 214 ? 0.464 10.995 -35.737 1.0 24.62 ? 204 A 1 +ATOM 3646 C C . GLY A1 1 214 ? 1.11 11.939 -34.735 1.0 25.01 ? 204 A 1 +ATOM 3647 O O . GLY A1 1 214 ? 1.816 12.865 -35.141 1.0 28.2 ? 204 A 1 +ATOM 3648 H H . GLY A1 1 214 ? 0.171 9.174 -35.075 1.0 25.8 ? 204 A 1 +ATOM 3649 H HA2 . GLY A1 1 214 ? 1.168 10.626 -36.293 1.0 29.54 ? 204 A 1 +ATOM 3650 H HA3 . GLY A1 1 214 ? -0.136 11.518 -36.293 1.0 29.54 ? 204 A 1 +ATOM 3651 N N . GLN A1 1 215 ? 0.916 11.741 -33.437 1.0 19.85 ? 205 A 1 +ATOM 3652 C CA . GLN A1 1 215 ? 1.454 12.626 -32.436 1.0 21.81 ? 205 A 1 +ATOM 3653 C C . GLN A1 1 215 ? 2.831 12.117 -32.048 1.0 19.64 ? 205 A 1 +ATOM 3654 O O . GLN A1 1 215 ? 3.017 10.922 -31.807 1.0 23.67 ? 205 A 1 +ATOM 3655 C CB . GLN A1 1 215 ? 0.516 12.546 -31.242 1.0 19.04 ? 205 A 1 +ATOM 3656 C CG . GLN A1 1 215 ? 0.821 13.484 -30.093 1.0 17.29 ? 205 A 1 +ATOM 3657 C CD . GLN A1 1 215 ? -0.148 13.252 -28.966 1.0 17.7 ? 205 A 1 +ATOM 3658 O OE1 . GLN A1 1 215 ? -0.28 12.107 -28.552 1.0 19.51 ? 205 A 1 +ATOM 3659 N NE2 . GLN A1 1 215 ? -0.811 14.267 -28.518 1.0 16.52 ? 205 A 1 +ATOM 3660 H H . GLN A1 1 215 ? 0.465 11.085 -33.112 1.0 23.82 ? 205 A 1 +ATOM 3661 H HA . GLN A1 1 215 ? 1.539 13.543 -32.739 1.0 26.17 ? 205 A 1 +ATOM 3662 H HB2 . GLN A1 1 215 ? -0.381 12.749 -31.547 1.0 22.85 ? 205 A 1 +ATOM 3663 H HB3 . GLN A1 1 215 ? 0.55 11.642 -30.89 1.0 22.85 ? 205 A 1 +ATOM 3664 H HG2 . GLN A1 1 215 ? 1.72 13.321 -29.769 1.0 20.75 ? 205 A 1 +ATOM 3665 H HG3 . GLN A1 1 215 ? 0.736 14.403 -30.391 1.0 20.75 ? 205 A 1 +ATOM 3666 H HE21 . GLN A1 1 215 ? -0.692 15.046 -28.864 1.0 19.83 ? 205 A 1 +ATOM 3667 H HE22 . GLN A1 1 215 ? -1.372 14.164 -27.874 1.0 19.83 ? 205 A 1 +ATOM 3668 N N . THR A1 1 216 ? 3.796 13.019 -31.926 1.0 17.89 ? 206 A 1 +ATOM 3669 C CA . THR A1 1 216 ? 5.172 12.704 -31.564 1.0 19.41 ? 206 A 1 +ATOM 3670 C C . THR A1 1 216 ? 5.558 13.291 -30.207 1.0 18.6 ? 206 A 1 +ATOM 3671 O O . THR A1 1 216 ? 4.801 14.067 -29.57 1.0 17.52 ? 206 A 1 +ATOM 3672 C CB . THR A1 1 216 ? 6.152 13.315 -32.597 1.0 19.84 ? 206 A 1 +ATOM 3673 O OG1 . THR A1 1 216 ? 6.036 14.73 -32.489 1.0 21.87 ? 206 A 1 +ATOM 3674 C CG2 . THR A1 1 216 ? 5.783 12.888 -33.999 1.0 23.91 ? 206 A 1 +ATOM 3675 H H . THR A1 1 216 ? 3.673 13.861 -32.054 1.0 21.47 ? 206 A 1 +ATOM 3676 H HA . THR A1 1 216 ? 5.239 11.737 -31.529 1.0 23.29 ? 206 A 1 +ATOM 3677 H HB . THR A1 1 216 ? 7.062 13.021 -32.432 1.0 23.81 ? 206 A 1 +ATOM 3678 H HG1 . THR A1 1 216 ? 6.552 15.103 -33.037 1.0 26.25 ? 206 A 1 +ATOM 3679 H HG21 . THR A1 1 216 ? 6.458 13.191 -34.626 1.0 28.7 ? 206 A 1 +ATOM 3680 H HG22 . THR A1 1 216 ? 5.722 11.921 -34.046 1.0 28.7 ? 206 A 1 +ATOM 3681 H HG23 . THR A1 1 216 ? 4.928 13.271 -34.248 1.0 28.7 ? 206 A 1 +ATOM 3682 N N . ILE A1 1 217 ? 6.769 12.948 -29.753 1.0 20.29 ? 207 A 1 +ATOM 3683 C CA . ILE A1 1 217 ? 7.247 13.531 -28.511 1.0 18.86 ? 207 A 1 +ATOM 3684 C C . ILE A1 1 217 ? 7.343 15.026 -28.63 1.0 18.74 ? 207 A 1 +ATOM 3685 O O . ILE A1 1 217 ? 7.032 15.75 -27.686 1.0 17.73 ? 207 A 1 +ATOM 3686 C CB . ILE A1 1 217 ? 8.599 12.917 -28.079 1.0 22.03 ? 207 A 1 +ATOM 3687 C CG1 . ILE A1 1 217 ? 8.438 11.431 -27.837 1.0 28.02 ? 207 A 1 +ATOM 3688 C CG2 . ILE A1 1 217 ? 9.187 13.653 -26.906 1.0 22.21 ? 207 A 1 +ATOM 3689 C CD1 . ILE A1 1 217 ? 7.691 11.12 -26.603 1.0 31.06 ? 207 A 1 +ATOM 3690 H H . ILE A1 1 217 ? 7.309 12.399 -30.136 1.0 24.34 ? 207 A 1 +ATOM 3691 H HA . ILE A1 1 217 ? 6.597 13.318 -27.823 1.0 22.63 ? 207 A 1 +ATOM 3692 H HB . ILE A1 1 217 ? 9.238 13.021 -28.801 1.0 26.43 ? 207 A 1 +ATOM 3693 H HG12 . ILE A1 1 217 ? 7.957 11.042 -28.584 1.0 33.62 ? 207 A 1 +ATOM 3694 H HG13 . ILE A1 1 217 ? 9.317 11.028 -27.763 1.0 33.62 ? 207 A 1 +ATOM 3695 H HG21 . ILE A1 1 217 ? 9.891 13.112 -26.514 1.0 26.65 ? 207 A 1 +ATOM 3696 H HG22 . ILE A1 1 217 ? 9.551 14.498 -27.213 1.0 26.65 ? 207 A 1 +ATOM 3697 H HG23 . ILE A1 1 217 ? 8.489 13.812 -26.251 1.0 26.65 ? 207 A 1 +ATOM 3698 H HD11 . ILE A1 1 217 ? 7.591 10.158 -26.529 1.0 37.27 ? 207 A 1 +ATOM 3699 H HD12 . ILE A1 1 217 ? 8.184 11.462 -25.841 1.0 37.27 ? 207 A 1 +ATOM 3700 H HD13 . ILE A1 1 217 ? 6.818 11.541 -26.648 1.0 37.27 ? 207 A 1 +ATOM 3701 N N . ASP A1 1 218 ? 7.74 15.539 -29.798 1.0 18.49 ? 208 A 1 +ATOM 3702 C CA . ASP A1 1 218 ? 7.784 16.984 -29.94 1.0 18.79 ? 208 A 1 +ATOM 3703 C C . ASP A1 1 218 ? 6.399 17.609 -29.778 1.0 17.21 ? 208 A 1 +ATOM 3704 O O . ASP A1 1 218 ? 6.275 18.715 -29.218 1.0 17.07 ? 208 A 1 +ATOM 3705 C CB . ASP A1 1 218 ? 8.322 17.379 -31.336 1.0 20.3 ? 208 A 1 +ATOM 3706 C CG . ASP A1 1 218 ? 9.781 17.134 -31.495 1.0 31.72 ? 208 A 1 +ATOM 3707 O OD1 . ASP A1 1 218 ? 10.521 17.373 -30.557 1.0 31.36 ? 208 A 1 +ATOM 3708 O OD2 . ASP A1 1 218 ? 10.193 16.743 -32.611 1.0 47.86 ? 208 A 1 +ATOM 3709 H H . ASP A1 1 218 ? 7.977 15.087 -30.49 1.0 22.19 ? 208 A 1 +ATOM 3710 H HA . ASP A1 1 218 ? 8.382 17.326 -29.258 1.0 22.55 ? 208 A 1 +ATOM 3711 H HB2 . ASP A1 1 218 ? 7.857 16.858 -32.01 1.0 24.36 ? 208 A 1 +ATOM 3712 H HB3 . ASP A1 1 218 ? 8.161 18.325 -31.479 1.0 24.36 ? 208 A 1 +ATOM 3713 N N . ASP A1 1 219 ? 5.351 16.922 -30.217 1.0 15.88 ? 209 A 1 +ATOM 3714 C CA . ASP A1 1 219 ? 4.009 17.43 -30.007 1.0 16.11 ? 209 A 1 +ATOM 3715 C C . ASP A1 1 219 ? 3.649 17.44 -28.53 1.0 15.88 ? 209 A 1 +ATOM 3716 O O . ASP A1 1 219 ? 3.008 18.377 -28.061 1.0 15.52 ? 209 A 1 +ATOM 3717 C CB . ASP A1 1 219 ? 2.988 16.569 -30.727 1.0 17.01 ? 209 A 1 +ATOM 3718 C CG . ASP A1 1 219 ? 3.073 16.668 -32.248 1.0 18.02 ? 209 A 1 +ATOM 3719 O OD1 . ASP A1 1 219 ? 3.235 17.797 -32.796 1.0 18.82 ? 209 A 1 +ATOM 3720 O OD2 . ASP A1 1 219 ? 2.942 15.597 -32.893 1.0 20.38 ? 209 A 1 +ATOM 3721 H H . ASP A1 1 219 ? 5.391 16.17 -30.632 1.0 19.05 ? 209 A 1 +ATOM 3722 H HA . ASP A1 1 219 ? 3.981 18.331 -30.366 1.0 19.33 ? 209 A 1 +ATOM 3723 H HB2 . ASP A1 1 219 ? 3.131 15.642 -30.481 1.0 20.41 ? 209 A 1 +ATOM 3724 H HB3 . ASP A1 1 219 ? 2.098 16.849 -30.461 1.0 20.41 ? 209 A 1 +ATOM 3725 N N . LEU A1 1 220 ? 4.067 16.413 -27.767 1.0 14.86 ? 210 A 1 +ATOM 3726 C CA . LEU A1 1 220 ? 3.791 16.378 -26.327 1.0 14.57 ? 210 A 1 +ATOM 3727 C C . LEU A1 1 220 ? 4.491 17.523 -25.622 1.0 15.85 ? 210 A 1 +ATOM 3728 O O . LEU A1 1 220 ? 3.938 18.126 -24.712 1.0 15.36 ? 210 A 1 +ATOM 3729 C CB . LEU A1 1 220 ? 4.256 15.056 -25.735 1.0 16.21 ? 210 A 1 +ATOM 3730 C CG . LEU A1 1 220 ? 3.616 13.771 -26.256 1.0 25.88 ? 210 A 1 +ATOM 3731 C CD1 . LEU A1 1 220 ? 4.03 12.634 -25.333 1.0 24.9 ? 210 A 1 +ATOM 3732 C CD2 . LEU A1 1 220 ? 2.175 13.803 -26.438 1.0 29.39 ? 210 A 1 +ATOM 3733 H H . LEU A1 1 220 ? 4.507 15.734 -28.059 1.0 17.83 ? 210 A 1 +ATOM 3734 H HA . LEU A1 1 220 ? 2.834 16.457 -26.19 1.0 17.49 ? 210 A 1 +ATOM 3735 H HB2 . LEU A1 1 220 ? 5.209 14.979 -25.899 1.0 19.45 ? 210 A 1 +ATOM 3736 H HB3 . LEU A1 1 220 ? 4.085 15.084 -24.78 1.0 19.45 ? 210 A 1 +ATOM 3737 H HG . LEU A1 1 220 ? 3.941 13.634 -27.159 1.0 31.05 ? 210 A 1 +ATOM 3738 H HD11 . LEU A1 1 220 ? 3.618 11.812 -25.641 1.0 29.88 ? 210 A 1 +ATOM 3739 H HD12 . LEU A1 1 220 ? 4.996 12.548 -25.352 1.0 29.88 ? 210 A 1 +ATOM 3740 H HD13 . LEU A1 1 220 ? 3.734 12.835 -24.431 1.0 29.88 ? 210 A 1 +ATOM 3741 H HD21 . LEU A1 1 220 ? 1.878 12.937 -26.759 1.0 35.27 ? 210 A 1 +ATOM 3742 H HD22 . LEU A1 1 220 ? 1.753 14.003 -25.588 1.0 35.27 ? 210 A 1 +ATOM 3743 H HD23 . LEU A1 1 220 ? 1.954 14.489 -27.087 1.0 35.27 ? 210 A 1 +ATOM 3744 N N . VAL A1 1 221 ? 5.715 17.857 -26.049 1.0 15.18 ? 211 A 1 +ATOM 3745 C CA . VAL A1 1 221 ? 6.401 19.006 -25.5 1.0 15.63 ? 211 A 1 +ATOM 3746 C C . VAL A1 1 221 ? 5.625 20.286 -25.784 1.0 15.36 ? 211 A 1 +ATOM 3747 O O . VAL A1 1 221 ? 5.474 21.155 -24.909 1.0 16.51 ? 211 A 1 +ATOM 3748 C CB . VAL A1 1 221 ? 7.838 19.099 -26.046 1.0 18.02 ? 211 A 1 +ATOM 3749 C CG1 . VAL A1 1 221 ? 8.46 20.404 -25.59 1.0 19.99 ? 211 A 1 +ATOM 3750 C CG2 . VAL A1 1 221 ? 8.652 17.896 -25.589 1.0 18.07 ? 211 A 1 +ATOM 3751 H H . VAL A1 1 221 ? 6.158 17.431 -26.651 1.0 18.22 ? 211 A 1 +ATOM 3752 H HA . VAL A1 1 221 ? 6.45 18.887 -24.539 1.0 18.75 ? 211 A 1 +ATOM 3753 H HB . VAL A1 1 221 ? 7.834 19.089 -27.016 1.0 21.62 ? 211 A 1 +ATOM 3754 H HG11 . VAL A1 1 221 ? 9.426 20.329 -25.64 1.0 23.99 ? 211 A 1 +ATOM 3755 H HG12 . VAL A1 1 221 ? 8.153 21.119 -26.169 1.0 23.99 ? 211 A 1 +ATOM 3756 H HG13 . VAL A1 1 221 ? 8.189 20.581 -24.675 1.0 23.99 ? 211 A 1 +ATOM 3757 H HG21 . VAL A1 1 221 ? 9.558 17.981 -25.926 1.0 21.69 ? 211 A 1 +ATOM 3758 H HG22 . VAL A1 1 221 ? 8.661 17.87 -24.619 1.0 21.69 ? 211 A 1 +ATOM 3759 H HG23 . VAL A1 1 221 ? 8.244 17.088 -25.938 1.0 21.69 ? 211 A 1 +ATOM 3760 N N . ASP A1 1 222 ? 5.091 20.428 -27.008 1.0 15.65 ? 212 A 1 +ATOM 3761 C CA . ASP A1 1 222 ? 4.291 21.593 -27.323 1.0 15.52 ? 212 A 1 +ATOM 3762 C C . ASP A1 1 222 ? 3.033 21.633 -26.432 1.0 14.99 ? 212 A 1 +ATOM 3763 O O . ASP A1 1 222 ? 2.587 22.733 -26.065 1.0 15.71 ? 212 A 1 +ATOM 3764 C CB . ASP A1 1 222 ? 3.887 21.535 -28.81 1.0 15.72 ? 212 A 1 +ATOM 3765 C CG . ASP A1 1 222 ? 4.976 21.954 -29.763 1.0 19.01 ? 212 A 1 +ATOM 3766 O OD1 . ASP A1 1 222 ? 5.881 22.699 -29.347 1.0 21.66 ? 212 A 1 +ATOM 3767 O OD2 . ASP A1 1 222 ? 4.874 21.561 -30.959 1.0 19.04 ? 212 A 1 +ATOM 3768 H H . ASP A1 1 222 ? 5.183 19.869 -27.655 1.0 18.78 ? 212 A 1 +ATOM 3769 H HA . ASP A1 1 222 ? 4.804 22.402 -27.17 1.0 18.63 ? 212 A 1 +ATOM 3770 H HB2 . ASP A1 1 222 ? 3.64 20.624 -29.029 1.0 18.86 ? 212 A 1 +ATOM 3771 H HB3 . ASP A1 1 222 ? 3.131 22.127 -28.949 1.0 18.86 ? 212 A 1 +ATOM 3772 N N . ASP A1 1 223 ? 2.41 20.484 -26.148 1.0 15.39 ? 213 A 1 +ATOM 3773 C CA . ASP A1 1 223 ? 1.277 20.448 -25.201 1.0 14.05 ? 213 A 1 +ATOM 3774 C C . ASP A1 1 223 ? 1.682 20.997 -23.837 1.0 15.22 ? 213 A 1 +ATOM 3775 O O . ASP A1 1 223 ? 0.98 21.832 -23.271 1.0 15.47 ? 213 A 1 +ATOM 3776 C CB . ASP A1 1 223 ? 0.745 19.03 -25.051 1.0 14.44 ? 213 A 1 +ATOM 3777 C CG . ASP A1 1 223 ? -0.07 18.544 -26.238 1.0 15.38 ? 213 A 1 +ATOM 3778 O OD1 . ASP A1 1 223 ? -0.875 19.341 -26.781 1.0 15.21 ? 213 A 1 +ATOM 3779 O OD2 . ASP A1 1 223 ? 0.103 17.334 -26.595 1.0 16.66 ? 213 A 1 +ATOM 3780 H H . ASP A1 1 223 ? 2.617 19.719 -26.482 1.0 18.47 ? 213 A 1 +ATOM 3781 H HA . ASP A1 1 223 ? 0.567 21.001 -25.563 1.0 16.86 ? 213 A 1 +ATOM 3782 H HB2 . ASP A1 1 223 ? 1.496 18.426 -24.942 1.0 17.33 ? 213 A 1 +ATOM 3783 H HB3 . ASP A1 1 223 ? 0.174 18.994 -24.267 1.0 17.33 ? 213 A 1 +ATOM 3784 N N . LEU A1 1 224 ? 2.829 20.544 -23.318 1.0 15.0 ? 214 A 1 +ATOM 3785 C CA . LEU A1 1 224 ? 3.287 21.019 -22.007 1.0 14.61 ? 214 A 1 +ATOM 3786 C C . LEU A1 1 224 ? 3.508 22.518 -22.036 1.0 16.15 ? 214 A 1 +ATOM 3787 O O . LEU A1 1 224 ? 3.131 23.231 -21.104 1.0 16.08 ? 214 A 1 +ATOM 3788 C CB . LEU A1 1 224 ? 4.57 20.315 -21.589 1.0 16.27 ? 214 A 1 +ATOM 3789 C CG . LEU A1 1 224 ? 4.415 18.836 -21.284 1.0 15.0 ? 214 A 1 +ATOM 3790 C CD1 . LEU A1 1 224 ? 5.812 18.257 -21.004 1.0 17.45 ? 214 A 1 +ATOM 3791 C CD2 . LEU A1 1 224 ? 3.477 18.615 -20.072 1.0 16.27 ? 214 A 1 +ATOM 3792 H H . LEU A1 1 224 ? 3.35 19.974 -23.696 1.0 18.0 ? 214 A 1 +ATOM 3793 H HA . LEU A1 1 224 ? 2.606 20.806 -21.351 1.0 17.54 ? 214 A 1 +ATOM 3794 H HB2 . LEU A1 1 224 ? 5.215 20.399 -22.308 1.0 19.52 ? 214 A 1 +ATOM 3795 H HB3 . LEU A1 1 224 ? 4.909 20.745 -20.787 1.0 19.52 ? 214 A 1 +ATOM 3796 H HG . LEU A1 1 224 ? 4.013 18.377 -22.038 1.0 18.01 ? 214 A 1 +ATOM 3797 H HD11 . LEU A1 1 224 ? 5.727 17.313 -20.796 1.0 20.94 ? 214 A 1 +ATOM 3798 H HD12 . LEU A1 1 224 ? 6.366 18.373 -21.792 1.0 20.94 ? 214 A 1 +ATOM 3799 H HD13 . LEU A1 1 224 ? 6.204 18.727 -20.252 1.0 20.94 ? 214 A 1 +ATOM 3800 H HD21 . LEU A1 1 224 ? 3.501 17.678 -19.822 1.0 19.53 ? 214 A 1 +ATOM 3801 H HD22 . LEU A1 1 224 ? 3.783 19.162 -19.332 1.0 19.53 ? 214 A 1 +ATOM 3802 H HD23 . LEU A1 1 224 ? 2.575 18.868 -20.32 1.0 19.53 ? 214 A 1 +ATOM 3803 N N . LEU A1 1 225 ? 4.166 23.031 -23.08 1.0 15.41 ? 215 A 1 +ATOM 3804 C CA . LEU A1 1 225 ? 4.442 24.456 -23.145 1.0 17.79 ? 215 A 1 +ATOM 3805 C C . LEU A1 1 225 ? 3.184 25.271 -23.343 1.0 15.83 ? 215 A 1 +ATOM 3806 O O . LEU A1 1 225 ? 3.113 26.406 -22.848 1.0 18.32 ? 215 A 1 +ATOM 3807 C CB . LEU A1 1 225 ? 5.495 24.738 -24.221 1.0 17.91 ? 215 A 1 +ATOM 3808 C CG . LEU A1 1 225 ? 6.84 24.135 -23.881 1.0 21.55 ? 215 A 1 +ATOM 3809 C CD1 . LEU A1 1 225 ? 7.767 24.246 -25.09 1.0 28.55 ? 215 A 1 +ATOM 3810 C CD2 . LEU A1 1 225 ? 7.406 24.843 -22.665 1.0 27.88 ? 215 A 1 +ATOM 3811 H H . LEU A1 1 225 ? 4.457 22.578 -23.751 1.0 18.49 ? 215 A 1 +ATOM 3812 H HA . LEU A1 1 225 ? 4.821 24.746 -22.301 1.0 21.35 ? 215 A 1 +ATOM 3813 H HB2 . LEU A1 1 225 ? 5.197 24.359 -25.062 1.0 21.5 ? 215 A 1 +ATOM 3814 H HB3 . LEU A1 1 225 ? 5.607 25.697 -24.31 1.0 21.5 ? 215 A 1 +ATOM 3815 H HG . LEU A1 1 225 ? 6.758 23.192 -23.665 1.0 25.86 ? 215 A 1 +ATOM 3816 H HD11 . LEU A1 1 225 ? 8.629 23.864 -24.864 1.0 34.26 ? 215 A 1 +ATOM 3817 H HD12 . LEU A1 1 225 ? 7.375 23.762 -25.834 1.0 34.26 ? 215 A 1 +ATOM 3818 H HD13 . LEU A1 1 225 ? 7.871 25.182 -25.323 1.0 34.26 ? 215 A 1 +ATOM 3819 H HD21 . LEU A1 1 225 ? 8.362 24.684 -22.623 1.0 33.45 ? 215 A 1 +ATOM 3820 H HD22 . LEU A1 1 225 ? 7.232 25.794 -22.743 1.0 33.45 ? 215 A 1 +ATOM 3821 H HD23 . LEU A1 1 225 ? 6.978 24.493 -21.868 1.0 33.45 ? 215 A 1 +ATOM 3822 N N . PHE A1 1 226 ? 2.196 24.737 -24.053 1.0 15.59 ? 216 A 1 +ATOM 3823 C CA . PHE A1 1 226 ? 0.9 25.4 -24.185 1.0 16.73 ? 216 A 1 +ATOM 3824 C C . PHE A1 1 226 ? 0.239 25.532 -22.823 1.0 14.95 ? 216 A 1 +ATOM 3825 O O . PHE A1 1 226 ? -0.302 26.59 -22.47 1.0 17.25 ? 216 A 1 +ATOM 3826 C CB . PHE A1 1 226 ? 0.043 24.604 -25.174 1.0 16.29 ? 216 A 1 +ATOM 3827 C CG . PHE A1 1 226 ? -1.39 25.04 -25.223 1.0 15.08 ? 216 A 1 +ATOM 3828 C CD1 . PHE A1 1 226 ? -1.751 26.185 -25.884 1.0 16.88 ? 216 A 1 +ATOM 3829 C CD2 . PHE A1 1 226 ? -2.373 24.299 -24.606 1.0 17.78 ? 216 A 1 +ATOM 3830 C CE1 . PHE A1 1 226 ? -3.058 26.573 -25.904 1.0 19.06 ? 216 A 1 +ATOM 3831 C CE2 . PHE A1 1 226 ? -3.685 24.735 -24.647 1.0 16.46 ? 216 A 1 +ATOM 3832 C CZ . PHE A1 1 226 ? -3.997 25.822 -25.326 1.0 17.05 ? 216 A 1 +ATOM 3833 H H . PHE A1 1 226 ? 2.247 23.987 -24.471 1.0 18.71 ? 216 A 1 +ATOM 3834 H HA . PHE A1 1 226 ? 1.003 26.297 -24.541 1.0 20.07 ? 216 A 1 +ATOM 3835 H HB2 . PHE A1 1 226 ? 0.415 24.709 -26.064 1.0 19.55 ? 216 A 1 +ATOM 3836 H HB3 . PHE A1 1 226 ? 0.059 23.669 -24.917 1.0 19.55 ? 216 A 1 +ATOM 3837 H HD1 . PHE A1 1 226 ? -1.107 26.695 -26.319 1.0 20.25 ? 216 A 1 +ATOM 3838 H HD2 . PHE A1 1 226 ? -2.156 23.509 -24.165 1.0 21.33 ? 216 A 1 +ATOM 3839 H HE1 . PHE A1 1 226 ? -3.297 27.368 -26.323 1.0 22.88 ? 216 A 1 +ATOM 3840 H HE2 . PHE A1 1 226 ? -4.346 24.263 -24.196 1.0 19.75 ? 216 A 1 +ATOM 3841 H HZ . PHE A1 1 226 ? -4.89 26.07 -25.404 1.0 20.46 ? 216 A 1 +ATOM 3842 N N . LEU A1 1 227 ? 0.254 24.456 -22.062 1.0 14.8 ? 217 A 1 +ATOM 3843 C CA . LEU A1 1 227 ? -0.379 24.471 -20.727 1.0 14.58 ? 217 A 1 +ATOM 3844 C C . LEU A1 1 227 ? 0.306 25.491 -19.841 1.0 17.19 ? 217 A 1 +ATOM 3845 O O . LEU A1 1 227 ? -0.361 26.266 -19.15 1.0 17.77 ? 217 A 1 +ATOM 3846 C CB . LEU A1 1 227 ? -0.323 23.072 -20.118 1.0 15.88 ? 217 A 1 +ATOM 3847 C CG . LEU A1 1 227 ? -1.108 22.028 -20.813 1.0 16.17 ? 217 A 1 +ATOM 3848 C CD1 . LEU A1 1 227 ? -0.757 20.637 -20.385 1.0 21.35 ? 217 A 1 +ATOM 3849 C CD2 . LEU A1 1 227 ? -2.61 22.29 -20.735 1.0 15.96 ? 217 A 1 +ATOM 3850 H H . LEU A1 1 227 ? 0.616 23.706 -22.278 1.0 17.76 ? 217 A 1 +ATOM 3851 H HA . LEU A1 1 227 ? -1.315 24.715 -20.8 1.0 17.49 ? 217 A 1 +ATOM 3852 H HB2 . LEU A1 1 227 ? 0.603 22.781 -20.116 1.0 19.05 ? 217 A 1 +ATOM 3853 H HB3 . LEU A1 1 227 ? -0.656 23.125 -19.209 1.0 19.05 ? 217 A 1 +ATOM 3854 H HG . LEU A1 1 227 ? -0.862 22.079 -21.75 1.0 19.4 ? 217 A 1 +ATOM 3855 H HD11 . LEU A1 1 227 ? -1.404 20.018 -20.759 1.0 25.63 ? 217 A 1 +ATOM 3856 H HD12 . LEU A1 1 227 ? 0.132 20.422 -20.708 1.0 25.63 ? 217 A 1 +ATOM 3857 H HD13 . LEU A1 1 227 ? -0.777 20.59 -19.416 1.0 25.63 ? 217 A 1 +ATOM 3858 H HD21 . LEU A1 1 227 ? -3.083 21.534 -21.117 1.0 19.15 ? 217 A 1 +ATOM 3859 H HD22 . LEU A1 1 227 ? -2.863 22.402 -19.805 1.0 19.15 ? 217 A 1 +ATOM 3860 H HD23 . LEU A1 1 227 ? -2.817 23.096 -21.233 1.0 19.15 ? 217 A 1 +ATOM 3861 N N . LYS A1 1 228 ? 1.626 25.51 -19.862 1.0 16.4 ? 218 A 1 +ATOM 3862 C CA . LYS A1 1 228 ? 2.392 26.465 -19.065 1.0 19.33 ? 218 A 1 +ATOM 3863 C C . LYS A1 1 228 ? 2.084 27.894 -19.464 1.0 20.68 ? 218 A 1 +ATOM 3864 O O . LYS A1 1 228 ? 1.922 28.769 -18.599 1.0 21.61 ? 218 A 1 +ATOM 3865 C CB . LYS A1 1 228 ? 3.885 26.137 -19.23 1.0 22.02 ? 218 A 1 +ATOM 3866 C CG . LYS A1 1 228 ? 4.874 27.049 -18.506 1.0 23.39 ? 218 A 1 +ATOM 3867 C CD . LYS A1 1 228 ? 4.733 26.957 -17.06 1.0 27.01 ? 218 A 1 +ATOM 3868 C CE . LYS A1 1 228 ? 5.954 27.565 -16.354 0.85 30.79 ? 218 A 1 +ATOM 3869 N NZ . LYS A1 1 228 ? 5.612 27.692 -14.936 0.39 18.29 ? 218 A 1 +ATOM 3870 H H . LYS A1 1 228 ? 2.112 24.978 -20.331 1.0 19.68 ? 218 A 1 +ATOM 3871 H HA . LYS A1 1 228 ? 2.158 26.387 -18.127 1.0 23.19 ? 218 A 1 +ATOM 3872 H HB2 . LYS A1 1 228 ? 4.033 25.238 -18.898 1.0 26.42 ? 218 A 1 +ATOM 3873 H HB3 . LYS A1 1 228 ? 4.099 26.181 -20.175 1.0 26.42 ? 218 A 1 +ATOM 3874 H HG2 . LYS A1 1 228 ? 5.779 26.789 -18.74 1.0 28.07 ? 218 A 1 +ATOM 3875 H HG3 . LYS A1 1 228 ? 4.714 27.968 -18.769 1.0 28.07 ? 218 A 1 +ATOM 3876 H HD2 . LYS A1 1 228 ? 3.942 27.443 -16.781 1.0 32.42 ? 218 A 1 +ATOM 3877 H HD3 . LYS A1 1 228 ? 4.659 26.025 -16.8 1.0 32.42 ? 218 A 1 +ATOM 3878 H HE2 . LYS A1 1 228 ? 6.724 26.984 -16.45 0.78 36.95 ? 218 A 1 +ATOM 3879 H HE3 . LYS A1 1 228 ? 6.153 28.442 -16.718 0.79 36.95 ? 218 A 1 +ATOM 3880 H HZ1 . LYS A1 1 228 ? 6.326 27.515 -14.434 0.36 21.95 ? 218 A 1 +ATOM 3881 H HZ2 . LYS A1 1 228 ? 5.335 28.52 -14.762 0.42 21.95 ? 218 A 1 +ATOM 3882 H HZ3 . LYS A1 1 228 ? 4.963 27.12 -14.727 0.43 21.95 ? 218 A 1 +ATOM 3883 N N . GLU A1 1 229 ? 2.018 28.157 -20.773 1.0 19.05 ? 219 A 1 +ATOM 3884 C CA . GLU A1 1 229 ? 1.783 29.506 -21.276 1.0 20.33 ? 219 A 1 +ATOM 3885 C C . GLU A1 1 229 ? 0.503 30.1 -20.71 1.0 19.78 ? 219 A 1 +ATOM 3886 O O . GLU A1 1 229 ? 0.461 31.288 -20.374 1.0 22.07 ? 219 A 1 +ATOM 3887 C CB . GLU A1 1 229 ? 1.716 29.458 -22.821 1.0 21.67 ? 219 A 1 +ATOM 3888 C CG . GLU A1 1 229 ? 1.252 30.773 -23.506 1.0 26.0 ? 219 A 1 +ATOM 3889 C CD . GLU A1 1 229 ? 1.211 30.683 -25.037 1.0 43.85 ? 219 A 1 +ATOM 3890 O OE1 . GLU A1 1 229 ? 1.317 29.564 -25.601 1.0 35.1 ? 219 A 1 +ATOM 3891 O OE2 . GLU A1 1 229 ? 1.046 31.749 -25.663 1.0 55.7 ? 219 A 1 +ATOM 3892 H H . GLU A1 1 229 ? 2.107 27.567 -21.392 1.0 22.86 ? 219 A 1 +ATOM 3893 H HA . GLU A1 1 229 ? 2.516 30.082 -21.006 1.0 24.4 ? 219 A 1 +ATOM 3894 H HB2 . GLU A1 1 229 ? 2.602 29.252 -23.159 1.0 26.0 ? 219 A 1 +ATOM 3895 H HB3 . GLU A1 1 229 ? 1.093 28.761 -23.079 1.0 26.0 ? 219 A 1 +ATOM 3896 H HG2 . GLU A1 1 229 ? 0.357 30.988 -23.197 1.0 31.21 ? 219 A 1 +ATOM 3897 H HG3 . GLU A1 1 229 ? 1.865 31.485 -23.266 1.0 31.21 ? 219 A 1 +ATOM 3898 N N . HIS A1 1 230 ? -0.549 29.301 -20.603 1.0 17.82 ? 220 A 1 +ATOM 3899 C CA . HIS A1 1 230 ? -1.849 29.807 -20.213 1.0 19.87 ? 220 A 1 +ATOM 3900 C C . HIS A1 1 230 ? -2.186 29.605 -18.745 1.0 19.42 ? 220 A 1 +ATOM 3901 O O . HIS A1 1 230 ? -3.256 30.062 -18.311 1.0 21.77 ? 220 A 1 +ATOM 3902 C CB . HIS A1 1 230 ? -2.916 29.187 -21.1 1.0 21.62 ? 220 A 1 +ATOM 3903 C CG . HIS A1 1 230 ? -2.751 29.592 -22.529 1.0 22.23 ? 220 A 1 +ATOM 3904 N ND1 . HIS A1 1 230 ? -3.063 30.862 -23.003 1.0 27.57 ? 220 A 1 +ATOM 3905 C CD2 . HIS A1 1 230 ? -2.267 28.908 -23.586 1.0 20.79 ? 220 A 1 +ATOM 3906 C CE1 . HIS A1 1 230 ? -2.78 30.921 -24.287 1.0 24.01 ? 220 A 1 +ATOM 3907 N NE2 . HIS A1 1 230 ? -2.326 29.746 -24.676 1.0 24.01 ? 220 A 1 +ATOM 3908 H H . HIS A1 1 230 ? -0.532 28.454 -20.753 1.0 21.39 ? 220 A 1 +ATOM 3909 H HA . HIS A1 1 230 ? -1.859 30.767 -20.353 1.0 23.85 ? 220 A 1 +ATOM 3910 H HB2 . HIS A1 1 230 ? -2.854 28.221 -21.048 1.0 25.95 ? 220 A 1 +ATOM 3911 H HB3 . HIS A1 1 230 ? -3.791 29.48 -20.8 1.0 25.95 ? 220 A 1 +ATOM 3912 H HD1 . HIS A1 1 230 ? -3.388 31.505 -22.533 1.0 33.09 ? 220 A 1 +ATOM 3913 H HD2 . HIS A1 1 230 ? -1.952 28.033 -23.579 1.0 24.95 ? 220 A 1 +ATOM 3914 H HE1 . HIS A1 1 230 ? -2.884 31.668 -24.83 1.0 28.82 ? 220 A 1 +ATOM 3915 N N . ASP A1 1 231 ? -1.341 28.945 -17.996 1.0 17.38 ? 221 A 1 +ATOM 3916 C CA . ASP A1 1 231 ? -1.525 28.868 -16.531 1.0 19.27 ? 221 A 1 +ATOM 3917 C C . ASP A1 1 231 ? -2.908 28.323 -16.195 1.0 18.64 ? 221 A 1 +ATOM 3918 O O . ASP A1 1 231 ? -3.615 28.878 -15.348 1.0 18.64 ? 221 A 1 +ATOM 3919 C CB . ASP A1 1 231 ? -1.264 30.247 -15.906 1.0 21.99 ? 221 A 1 +ATOM 3920 C CG . ASP A1 1 231 ? -1.367 30.247 -14.398 1.0 24.55 ? 221 A 1 +ATOM 3921 O OD1 . ASP A1 1 231 ? -0.956 29.262 -13.784 1.0 23.23 ? 221 A 1 +ATOM 3922 O OD2 . ASP A1 1 231 ? -1.797 31.293 -13.835 1.0 29.47 ? 221 A 1 +ATOM 3923 H H . ASP A1 1 231 ? -0.65 28.528 -18.292 1.0 20.85 ? 221 A 1 +ATOM 3924 H HA . ASP A1 1 231 ? -0.889 28.247 -16.143 1.0 23.13 ? 221 A 1 +ATOM 3925 H HB2 . ASP A1 1 231 ? -0.37 30.536 -16.145 1.0 26.39 ? 221 A 1 +ATOM 3926 H HB3 . ASP A1 1 231 ? -1.918 30.876 -16.249 1.0 26.39 ? 221 A 1 +ATOM 3927 N N . PHE A1 1 232 ? -3.311 27.222 -16.853 1.0 16.9 ? 222 A 1 +ATOM 3928 C CA . PHE A1 1 232 ? -4.659 26.719 -16.665 1.0 15.74 ? 222 A 1 +ATOM 3929 C C . PHE A1 1 232 ? -4.893 26.294 -15.224 1.0 15.07 ? 222 A 1 +ATOM 3930 O O . PHE A1 1 232 ? -4.029 25.741 -14.547 1.0 16.16 ? 222 A 1 +ATOM 3931 C CB . PHE A1 1 232 ? -4.882 25.509 -17.591 1.0 16.41 ? 222 A 1 +ATOM 3932 C CG . PHE A1 1 232 ? -5.007 25.902 -19.05 1.0 15.39 ? 222 A 1 +ATOM 3933 C CD1 . PHE A1 1 232 ? -6.107 26.661 -19.493 1.0 15.06 ? 222 A 1 +ATOM 3934 C CD2 . PHE A1 1 232 ? -4.019 25.592 -19.965 1.0 16.37 ? 222 A 1 +ATOM 3935 C CE1 . PHE A1 1 232 ? -6.221 27.046 -20.825 1.0 16.53 ? 222 A 1 +ATOM 3936 C CE2 . PHE A1 1 232 ? -4.144 25.983 -21.292 1.0 16.07 ? 222 A 1 +ATOM 3937 C CZ . PHE A1 1 232 ? -5.189 26.693 -21.707 1.0 17.08 ? 222 A 1 +ATOM 3938 H H . PHE A1 1 232 ? -2.826 26.768 -17.399 1.0 20.28 ? 222 A 1 +ATOM 3939 H HA . PHE A1 1 232 ? -5.296 27.418 -16.879 1.0 18.89 ? 222 A 1 +ATOM 3940 H HB2 . PHE A1 1 232 ? -4.128 24.904 -17.506 1.0 19.69 ? 222 A 1 +ATOM 3941 H HB3 . PHE A1 1 232 ? -5.7 25.059 -17.329 1.0 19.69 ? 222 A 1 +ATOM 3942 H HD1 . PHE A1 1 232 ? -6.767 26.908 -18.886 1.0 18.07 ? 222 A 1 +ATOM 3943 H HD2 . PHE A1 1 232 ? -3.266 25.12 -19.691 1.0 19.64 ? 222 A 1 +ATOM 3944 H HE1 . PHE A1 1 232 ? -6.961 27.524 -21.122 1.0 19.84 ? 222 A 1 +ATOM 3945 H HE2 . PHE A1 1 232 ? -3.484 25.743 -21.902 1.0 19.28 ? 222 A 1 +ATOM 3946 H HZ . PHE A1 1 232 ? -5.236 26.961 -22.597 1.0 20.5 ? 222 A 1 +ATOM 3947 N N . ASP A1 1 233 ? -6.114 26.512 -14.803 1.0 14.07 ? 223 A 1 +ATOM 3948 C CA . ASP A1 1 233 ? -6.53 26.137 -13.451 1.0 14.74 ? 223 A 1 +ATOM 3949 C C . ASP A1 1 233 ? -6.606 24.656 -13.281 1.0 13.82 ? 223 A 1 +ATOM 3950 O O . ASP A1 1 233 ? -6.345 24.141 -12.17 1.0 15.96 ? 223 A 1 +ATOM 3951 C CB . ASP A1 1 233 ? -7.861 26.793 -13.101 1.0 14.56 ? 223 A 1 +ATOM 3952 C CG . ASP A1 1 233 ? -7.797 28.277 -13.256 1.0 18.1 ? 223 A 1 +ATOM 3953 O OD1 . ASP A1 1 233 ? -6.96 28.91 -12.558 1.0 18.24 ? 223 A 1 +ATOM 3954 O OD2 . ASP A1 1 233 ? -8.504 28.848 -14.127 1.0 19.28 ? 223 A 1 +ATOM 3955 H H . ASP A1 1 233 ? -6.735 26.877 -15.273 1.0 16.89 ? 223 A 1 +ATOM 3956 H HA . ASP A1 1 233 ? -5.864 26.468 -12.829 1.0 17.69 ? 223 A 1 +ATOM 3957 H HB2 . ASP A1 1 233 ? -8.551 26.454 -13.692 1.0 17.47 ? 223 A 1 +ATOM 3958 H HB3 . ASP A1 1 233 ? -8.085 26.592 -12.179 1.0 17.47 ? 223 A 1 +ATOM 3959 N N . MET A1 1 234 ? -7.01 23.943 -14.329 1.0 13.45 ? 224 A 1 +ATOM 3960 C CA A MET A1 1 234 ? -7.125 22.5 -14.307 0.61 14.69 ? 224 A 1 +ATOM 3961 C CA B MET A1 1 234 ? -7.126 22.502 -14.31 0.39 12.71 ? 224 A 1 +ATOM 3962 C C . MET A1 1 234 ? -6.48 21.961 -15.564 1.0 12.55 ? 224 A 1 +ATOM 3963 O O . MET A1 1 234 ? -6.535 22.6 -16.636 1.0 13.25 ? 224 A 1 +ATOM 3964 C CB A MET A1 1 234 ? -8.58 21.953 -14.247 0.61 18.43 ? 224 A 1 +ATOM 3965 C CB B MET A1 1 234 ? -8.587 22.049 -14.266 0.39 19.07 ? 224 A 1 +ATOM 3966 C CG A MET A1 1 234 ? -9.471 22.598 -13.228 0.61 53.62 ? 224 A 1 +ATOM 3967 C CG B MET A1 1 234 ? -9.343 22.617 -13.116 0.39 12.73 ? 224 A 1 +ATOM 3968 S SD A MET A1 1 234 ? -10.493 23.873 -13.961 0.61 16.31 ? 224 A 1 +ATOM 3969 S SD B MET A1 1 234 ? -11.129 22.466 -13.33 0.39 36.2 ? 224 A 1 +ATOM 3970 C CE A MET A1 1 234 ? -11.834 22.957 -14.771 0.61 14.91 ? 224 A 1 +ATOM 3971 C CE B MET A1 1 234 ? -11.422 23.695 -14.597 0.39 41.23 ? 224 A 1 +ATOM 3972 H H A MET A1 1 234 ? -7.229 24.289 -15.085 0.61 16.14 ? 224 A 1 +ATOM 3973 H H B MET A1 1 234 ? -7.229 24.29 -15.085 0.39 16.14 ? 224 A 1 +ATOM 3974 H HA A MET A1 1 234 ? -6.686 22.19 -13.5 0.61 17.63 ? 224 A 1 +ATOM 3975 H HA B MET A1 1 234 ? -6.685 22.15 -13.521 0.39 15.25 ? 224 A 1 +ATOM 3976 H HB2 A MET A1 1 234 ? -8.992 22.086 -15.115 0.61 22.11 ? 224 A 1 +ATOM 3977 H HB2 B MET A1 1 234 ? -9.028 22.331 -15.083 0.39 22.88 ? 224 A 1 +ATOM 3978 H HB3 A MET A1 1 234 ? -8.541 21.007 -14.039 0.61 22.11 ? 224 A 1 +ATOM 3979 H HB3 B MET A1 1 234 ? -8.613 21.082 -14.193 0.39 22.88 ? 224 A 1 +ATOM 3980 H HG2 A MET A1 1 234 ? -10.052 21.926 -12.839 0.61 64.35 ? 224 A 1 +ATOM 3981 H HG2 B MET A1 1 234 ? -9.094 22.144 -12.306 0.39 15.27 ? 224 A 1 +ATOM 3982 H HG3 A MET A1 1 234 ? -8.925 23.004 -12.536 0.61 64.35 ? 224 A 1 +ATOM 3983 H HG3 B MET A1 1 234 ? -9.128 23.559 -13.028 0.39 15.27 ? 224 A 1 +ATOM 3984 H HE1 A MET A1 1 234 ? -12.436 23.588 -15.197 0.61 17.89 ? 224 A 1 +ATOM 3985 H HE1 B MET A1 1 234 ? -12.371 23.727 -14.793 0.39 49.47 ? 224 A 1 +ATOM 3986 H HE2 A MET A1 1 234 ? -11.454 22.363 -15.436 0.61 17.89 ? 224 A 1 +ATOM 3987 H HE2 B MET A1 1 234 ? -11.121 24.559 -14.275 0.39 49.47 ? 224 A 1 +ATOM 3988 H HE3 A MET A1 1 234 ? -12.314 22.442 -14.103 0.61 17.89 ? 224 A 1 +ATOM 3989 H HE3 B MET A1 1 234 ? -10.928 23.449 -15.395 0.39 49.47 ? 224 A 1 +ATOM 3990 N N . VAL A1 1 235 ? -5.933 20.756 -15.477 1.0 12.33 ? 225 A 1 +ATOM 3991 C CA . VAL A1 1 235 ? -5.377 20.089 -16.647 1.0 12.22 ? 225 A 1 +ATOM 3992 C C . VAL A1 1 235 ? -5.762 18.628 -16.604 1.0 12.38 ? 225 A 1 +ATOM 3993 O O . VAL A1 1 235 ? -5.327 17.909 -15.688 1.0 13.45 ? 225 A 1 +ATOM 3994 C CB . VAL A1 1 235 ? -3.863 20.205 -16.693 1.0 13.28 ? 225 A 1 +ATOM 3995 C CG1 . VAL A1 1 235 ? -3.346 19.508 -17.986 1.0 14.18 ? 225 A 1 +ATOM 3996 C CG2 . VAL A1 1 235 ? -3.392 21.609 -16.661 1.0 14.96 ? 225 A 1 +ATOM 3997 H H . VAL A1 1 235 ? -5.872 20.303 -14.749 1.0 14.79 ? 225 A 1 +ATOM 3998 H HA . VAL A1 1 235 ? -5.761 20.484 -17.446 1.0 14.66 ? 225 A 1 +ATOM 3999 H HB . VAL A1 1 235 ? -3.503 19.775 -15.901 1.0 15.93 ? 225 A 1 +ATOM 4000 H HG11 . VAL A1 1 235 ? -2.411 19.733 -18.114 1.0 17.02 ? 225 A 1 +ATOM 4001 H HG12 . VAL A1 1 235 ? -3.445 18.548 -17.888 1.0 17.02 ? 225 A 1 +ATOM 4002 H HG13 . VAL A1 1 235 ? -3.868 19.819 -18.742 1.0 17.02 ? 225 A 1 +ATOM 4003 H HG21 . VAL A1 1 235 ? -2.424 21.619 -16.726 1.0 17.96 ? 225 A 1 +ATOM 4004 H HG22 . VAL A1 1 235 ? -3.779 22.089 -17.41 1.0 17.96 ? 225 A 1 +ATOM 4005 H HG23 . VAL A1 1 235 ? -3.671 22.017 -15.827 1.0 17.96 ? 225 A 1 +ATOM 4006 N N . GLY A1 1 236 ? -6.537 18.175 -17.576 1.0 12.51 ? 226 A 1 +ATOM 4007 C CA . GLY A1 1 236 ? -6.985 16.788 -17.72 1.0 12.35 ? 226 A 1 +ATOM 4008 C C . GLY A1 1 236 ? -6.183 16.068 -18.795 1.0 12.4 ? 226 A 1 +ATOM 4009 O O . GLY A1 1 236 ? -6.3 16.425 -19.985 1.0 13.17 ? 226 A 1 +ATOM 4010 H H . GLY A1 1 236 ? -6.839 18.676 -18.206 1.0 15.01 ? 226 A 1 +ATOM 4011 H HA2 . GLY A1 1 236 ? -6.871 16.319 -16.879 1.0 14.82 ? 226 A 1 +ATOM 4012 H HA3 . GLY A1 1 236 ? -7.923 16.772 -17.967 1.0 14.82 ? 226 A 1 +ATOM 4013 N N . ILE A1 1 237 ? -5.394 15.093 -18.403 1.0 12.64 ? 227 A 1 +ATOM 4014 C CA . ILE A1 1 237 ? -4.533 14.337 -19.297 1.0 12.52 ? 227 A 1 +ATOM 4015 C C . ILE A1 1 237 ? -4.847 12.871 -19.176 1.0 13.47 ? 227 A 1 +ATOM 4016 O O . ILE A1 1 237 ? -5.032 12.339 -18.069 1.0 13.69 ? 227 A 1 +ATOM 4017 C CB . ILE A1 1 237 ? -3.069 14.611 -18.951 1.0 14.42 ? 227 A 1 +ATOM 4018 C CG1 . ILE A1 1 237 ? -2.674 16.027 -19.382 1.0 20.34 ? 227 A 1 +ATOM 4019 C CG2 . ILE A1 1 237 ? -2.149 13.643 -19.613 1.0 17.71 ? 227 A 1 +ATOM 4020 C CD1 . ILE A1 1 237 ? -1.311 16.52 -18.803 1.0 23.12 ? 227 A 1 +ATOM 4021 H H . ILE A1 1 237 ? -5.334 14.834 -17.585 1.0 15.17 ? 227 A 1 +ATOM 4022 H HA . ILE A1 1 237 ? -4.707 14.588 -20.218 1.0 15.02 ? 227 A 1 +ATOM 4023 H HB . ILE A1 1 237 ? -2.988 14.516 -17.989 1.0 17.31 ? 227 A 1 +ATOM 4024 H HG12 . ILE A1 1 237 ? -2.607 16.049 -20.349 1.0 24.41 ? 227 A 1 +ATOM 4025 H HG13 . ILE A1 1 237 ? -3.36 16.644 -19.083 1.0 24.41 ? 227 A 1 +ATOM 4026 H HG21 . ILE A1 1 237 ? -1.239 13.971 -19.54 1.0 21.26 ? 227 A 1 +ATOM 4027 H HG22 . ILE A1 1 237 ? -2.227 12.782 -19.172 1.0 21.26 ? 227 A 1 +ATOM 4028 H HG23 . ILE A1 1 237 ? -2.397 13.559 -20.547 1.0 21.26 ? 227 A 1 +ATOM 4029 H HD11 . ILE A1 1 237 ? -1.241 17.479 -18.933 1.0 27.75 ? 227 A 1 +ATOM 4030 H HD12 . ILE A1 1 237 ? -1.275 16.31 -17.857 1.0 27.75 ? 227 A 1 +ATOM 4031 H HD13 . ILE A1 1 237 ? -0.589 16.07 -19.269 1.0 27.75 ? 227 A 1 +ATOM 4032 N N . GLY A1 1 238 ? -4.879 12.165 -20.287 1.0 12.73 ? 228 A 1 +ATOM 4033 C CA . GLY A1 1 238 ? -5.031 10.739 -20.271 1.0 12.89 ? 228 A 1 +ATOM 4034 C C . GLY A1 1 238 ? -4.557 10.167 -21.593 1.0 12.97 ? 228 A 1 +ATOM 4035 O O . GLY A1 1 238 ? -4.248 10.916 -22.543 1.0 13.75 ? 228 A 1 +ATOM 4036 H H . GLY A1 1 238 ? -4.812 12.501 -21.076 1.0 15.27 ? 228 A 1 +ATOM 4037 H HA2 . GLY A1 1 238 ? -4.505 10.356 -19.552 1.0 15.47 ? 228 A 1 +ATOM 4038 H HA3 . GLY A1 1 238 ? -5.963 10.506 -20.14 1.0 15.47 ? 228 A 1 +ATOM 4039 N N . PRO A1 1 239 ? -4.453 8.864 -21.675 1.0 13.0 ? 229 A 1 +ATOM 4040 C CA . PRO A1 1 239 ? -4.065 8.192 -22.921 1.0 13.13 ? 229 A 1 +ATOM 4041 C C . PRO A1 1 239 ? -5.226 8.189 -23.886 1.0 13.99 ? 229 A 1 +ATOM 4042 O O . PRO A1 1 239 ? -6.395 8.13 -23.519 1.0 14.19 ? 229 A 1 +ATOM 4043 C CB . PRO A1 1 239 ? -3.762 6.753 -22.464 1.0 15.51 ? 229 A 1 +ATOM 4044 C CG . PRO A1 1 239 ? -4.757 6.559 -21.306 1.0 14.96 ? 229 A 1 +ATOM 4045 C CD . PRO A1 1 239 ? -4.712 7.887 -20.59 1.0 13.24 ? 229 A 1 +ATOM 4046 H HA . PRO A1 1 239 ? -3.273 8.588 -23.316 1.0 15.76 ? 229 A 1 +ATOM 4047 H HB2 . PRO A1 1 239 ? -3.927 6.125 -23.184 1.0 18.61 ? 229 A 1 +ATOM 4048 H HB3 . PRO A1 1 239 ? -2.843 6.678 -22.161 1.0 18.61 ? 229 A 1 +ATOM 4049 H HG2 . PRO A1 1 239 ? -5.644 6.372 -21.65 1.0 17.95 ? 229 A 1 +ATOM 4050 H HG3 . PRO A1 1 239 ? -4.466 5.836 -20.728 1.0 17.95 ? 229 A 1 +ATOM 4051 H HD2 . PRO A1 1 239 ? -5.559 8.072 -20.156 1.0 15.89 ? 229 A 1 +ATOM 4052 H HD3 . PRO A1 1 239 ? -3.995 7.901 -19.937 1.0 15.89 ? 229 A 1 +ATOM 4053 N N . PHE A1 1 240 ? -4.878 8.238 -25.181 1.0 13.63 ? 230 A 1 +ATOM 4054 C CA . PHE A1 1 240 ? -5.826 7.907 -26.233 1.0 13.73 ? 230 A 1 +ATOM 4055 C C . PHE A1 1 240 ? -6.125 6.408 -26.157 1.0 13.94 ? 230 A 1 +ATOM 4056 O O . PHE A1 1 240 ? -5.215 5.574 -26.15 1.0 14.75 ? 230 A 1 +ATOM 4057 C CB . PHE A1 1 240 ? -5.205 8.236 -27.597 1.0 13.87 ? 230 A 1 +ATOM 4058 C CG . PHE A1 1 240 ? -5.924 7.579 -28.764 1.0 14.22 ? 230 A 1 +ATOM 4059 C CD1 . PHE A1 1 240 ? -7.254 7.842 -29.04 1.0 15.11 ? 230 A 1 +ATOM 4060 C CD2 . PHE A1 1 240 ? -5.228 6.74 -29.572 1.0 15.69 ? 230 A 1 +ATOM 4061 C CE1 . PHE A1 1 240 ? -7.913 7.21 -30.078 1.0 15.37 ? 230 A 1 +ATOM 4062 C CE2 . PHE A1 1 240 ? -5.877 6.098 -30.662 1.0 17.23 ? 230 A 1 +ATOM 4063 C CZ . PHE A1 1 240 ? -7.24 6.367 -30.891 1.0 15.77 ? 230 A 1 +ATOM 4064 H H . PHE A1 1 240 ? -4.098 8.461 -25.468 1.0 16.35 ? 230 A 1 +ATOM 4065 H HA . PHE A1 1 240 ? -6.647 8.413 -26.131 1.0 16.48 ? 230 A 1 +ATOM 4066 H HB2 . PHE A1 1 240 ? -5.236 9.196 -27.731 1.0 16.64 ? 230 A 1 +ATOM 4067 H HB3 . PHE A1 1 240 ? -4.285 7.929 -27.604 1.0 16.64 ? 230 A 1 +ATOM 4068 H HD1 . PHE A1 1 240 ? -7.714 8.458 -28.517 1.0 18.13 ? 230 A 1 +ATOM 4069 H HD2 . PHE A1 1 240 ? -4.325 6.584 -29.413 1.0 18.83 ? 230 A 1 +ATOM 4070 H HE1 . PHE A1 1 240 ? -8.82 7.364 -30.216 1.0 18.44 ? 230 A 1 +ATOM 4071 H HE2 . PHE A1 1 240 ? -5.411 5.513 -31.214 1.0 20.68 ? 230 A 1 +ATOM 4072 H HZ . PHE A1 1 240 ? -7.678 5.963 -31.604 1.0 18.93 ? 230 A 1 +ATOM 4073 N N . ILE A1 1 241 ? -7.404 6.059 -26.158 1.0 14.47 ? 231 A 1 +ATOM 4074 C CA . ILE A1 1 241 ? -7.813 4.649 -26.151 1.0 14.97 ? 231 A 1 +ATOM 4075 C C . ILE A1 1 241 ? -8.653 4.37 -27.39 1.0 15.02 ? 231 A 1 +ATOM 4076 O O . ILE A1 1 241 ? -9.773 4.912 -27.505 1.0 15.37 ? 231 A 1 +ATOM 4077 C CB . ILE A1 1 241 ? -8.597 4.307 -24.886 1.0 14.84 ? 231 A 1 +ATOM 4078 C CG1 . ILE A1 1 241 ? -7.698 4.521 -23.628 1.0 17.49 ? 231 A 1 +ATOM 4079 C CG2 . ILE A1 1 241 ? -9.049 2.875 -24.957 1.0 17.57 ? 231 A 1 +ATOM 4080 C CD1 . ILE A1 1 241 ? -8.393 4.382 -22.296 1.0 19.43 ? 231 A 1 +ATOM 4081 H H . ILE A1 1 241 ? -8.059 6.616 -26.162 1.0 17.36 ? 231 A 1 +ATOM 4082 H HA . ILE A1 1 241 ? -7.017 4.094 -26.184 1.0 17.96 ? 231 A 1 +ATOM 4083 H HB . ILE A1 1 241 ? -9.37 4.889 -24.82 1.0 17.81 ? 231 A 1 +ATOM 4084 H HG12 . ILE A1 1 241 ? -6.984 3.865 -23.65 1.0 20.99 ? 231 A 1 +ATOM 4085 H HG13 . ILE A1 1 241 ? -7.328 5.416 -23.668 1.0 20.99 ? 231 A 1 +ATOM 4086 H HG21 . ILE A1 1 241 ? -9.358 2.597 -24.08 1.0 21.09 ? 231 A 1 +ATOM 4087 H HG22 . ILE A1 1 241 ? -9.772 2.803 -25.6 1.0 21.09 ? 231 A 1 +ATOM 4088 H HG23 . ILE A1 1 241 ? -8.303 2.321 -25.235 1.0 21.09 ? 231 A 1 +ATOM 4089 H HD11 . ILE A1 1 241 ? -7.793 4.682 -21.594 1.0 23.32 ? 231 A 1 +ATOM 4090 H HD12 . ILE A1 1 241 ? -9.195 4.928 -22.3 1.0 23.32 ? 231 A 1 +ATOM 4091 H HD13 . ILE A1 1 241 ? -8.627 3.451 -22.156 1.0 23.32 ? 231 A 1 +ATOM 4092 N N . PRO A1 1 242 ? -8.156 3.593 -28.354 1.0 15.24 ? 232 A 1 +ATOM 4093 C CA . PRO A1 1 242 ? -8.876 3.44 -29.618 1.0 15.24 ? 232 A 1 +ATOM 4094 C C . PRO A1 1 242 ? -10.233 2.797 -29.394 1.0 18.0 ? 232 A 1 +ATOM 4095 O O . PRO A1 1 242 ? -10.397 1.848 -28.598 1.0 17.3 ? 232 A 1 +ATOM 4096 C CB . PRO A1 1 242 ? -7.983 2.515 -30.454 1.0 17.99 ? 232 A 1 +ATOM 4097 C CG . PRO A1 1 242 ? -6.614 2.638 -29.852 1.0 20.56 ? 232 A 1 +ATOM 4098 C CD . PRO A1 1 242 ? -6.808 2.983 -28.393 1.0 16.65 ? 232 A 1 +ATOM 4099 H HA . PRO A1 1 242 ? -8.965 4.301 -30.056 1.0 18.28 ? 232 A 1 +ATOM 4100 H HB2 . PRO A1 1 242 ? -8.307 1.603 -30.395 1.0 21.59 ? 232 A 1 +ATOM 4101 H HB3 . PRO A1 1 242 ? -7.982 2.807 -31.379 1.0 21.59 ? 232 A 1 +ATOM 4102 H HG2 . PRO A1 1 242 ? -6.144 1.794 -29.942 1.0 24.67 ? 232 A 1 +ATOM 4103 H HG3 . PRO A1 1 242 ? -6.122 3.34 -30.305 1.0 24.67 ? 232 A 1 +ATOM 4104 H HD2 . PRO A1 1 242 ? -6.777 2.184 -27.843 1.0 19.97 ? 232 A 1 +ATOM 4105 H HD3 . PRO A1 1 242 ? -6.136 3.616 -28.097 1.0 19.97 ? 232 A 1 +ATOM 4106 N N . HIS A1 1 243 ? -11.218 3.288 -30.151 1.0 18.03 ? 233 A 1 +ATOM 4107 C CA . HIS A1 1 243 ? -12.582 2.813 -30.066 1.0 15.88 ? 233 A 1 +ATOM 4108 C C . HIS A1 1 243 ? -12.948 2.056 -31.334 1.0 19.0 ? 233 A 1 +ATOM 4109 O O . HIS A1 1 243 ? -12.697 2.538 -32.452 1.0 18.08 ? 233 A 1 +ATOM 4110 C CB . HIS A1 1 243 ? -13.514 3.979 -29.882 1.0 16.39 ? 233 A 1 +ATOM 4111 C CG . HIS A1 1 243 ? -14.917 3.594 -29.603 1.0 16.16 ? 233 A 1 +ATOM 4112 N ND1 . HIS A1 1 243 ? -15.678 2.871 -30.499 1.0 18.51 ? 233 A 1 +ATOM 4113 C CD2 . HIS A1 1 243 ? -15.711 3.87 -28.553 1.0 16.48 ? 233 A 1 +ATOM 4114 C CE1 . HIS A1 1 243 ? -16.883 2.703 -29.982 1.0 18.47 ? 233 A 1 +ATOM 4115 N NE2 . HIS A1 1 243 ? -16.907 3.27 -28.793 1.0 18.01 ? 233 A 1 +ATOM 4116 H H . HIS A1 1 243 ? -11.109 3.912 -30.732 1.0 21.63 ? 233 A 1 +ATOM 4117 H HA . HIS A1 1 243 ? -12.678 2.211 -29.312 1.0 19.06 ? 233 A 1 +ATOM 4118 H HB2 . HIS A1 1 243 ? -13.2 4.512 -29.134 1.0 19.67 ? 233 A 1 +ATOM 4119 H HB3 . HIS A1 1 243 ? -13.51 4.511 -30.693 1.0 19.67 ? 233 A 1 +ATOM 4120 H HD2 . HIS A1 1 243 ? -15.484 4.376 -27.806 1.0 19.78 ? 233 A 1 +ATOM 4121 H HE1 . HIS A1 1 243 ? -17.593 2.261 -30.389 1.0 22.16 ? 233 A 1 +ATOM 4122 H HE2 . HIS A1 1 243 ? -17.575 3.261 -28.251 1.0 21.61 ? 233 A 1 +ATOM 4123 N N . PRO A1 1 244 ? -13.495 0.833 -31.243 1.0 18.66 ? 234 A 1 +ATOM 4124 C CA . PRO A1 1 244 ? -13.684 0.0 -32.434 1.0 19.82 ? 234 A 1 +ATOM 4125 C C . PRO A1 1 244 ? -14.649 0.547 -33.446 1.0 18.7 ? 234 A 1 +ATOM 4126 O O . PRO A1 1 244 ? -14.607 0.108 -34.587 1.0 20.9 ? 234 A 1 +ATOM 4127 C CB . PRO A1 1 244 ? -14.175 -1.326 -31.851 1.0 24.06 ? 234 A 1 +ATOM 4128 C CG . PRO A1 1 244 ? -14.721 -0.987 -30.51 1.0 27.14 ? 234 A 1 +ATOM 4129 C CD . PRO A1 1 244 ? -13.855 0.141 -29.988 1.0 18.39 ? 234 A 1 +ATOM 4130 H HA . PRO A1 1 244 ? -12.828 -0.129 -32.872 1.0 23.78 ? 234 A 1 +ATOM 4131 H HB2 . PRO A1 1 244 ? -14.865 -1.7 -32.421 1.0 28.88 ? 234 A 1 +ATOM 4132 H HB3 . PRO A1 1 244 ? -13.434 -1.947 -31.777 1.0 28.88 ? 234 A 1 +ATOM 4133 H HG2 . PRO A1 1 244 ? -15.645 -0.702 -30.594 1.0 32.57 ? 234 A 1 +ATOM 4134 H HG3 . PRO A1 1 244 ? -14.665 -1.761 -29.928 1.0 32.57 ? 234 A 1 +ATOM 4135 H HD2 . PRO A1 1 244 ? -14.355 0.724 -29.395 1.0 22.07 ? 234 A 1 +ATOM 4136 H HD3 . PRO A1 1 244 ? -13.068 -0.199 -29.534 1.0 22.07 ? 234 A 1 +ATOM 4137 N N . ASP A1 1 245 ? -15.549 1.44 -33.083 1.0 19.17 ? 235 A 1 +ATOM 4138 C CA . ASP A1 1 245 ? -16.542 1.964 -33.999 1.0 21.21 ? 235 A 1 +ATOM 4139 C C . ASP A1 1 245 ? -16.154 3.342 -34.487 1.0 20.76 ? 235 A 1 +ATOM 4140 O O . ASP A1 1 245 ? -17.042 4.16 -34.742 1.0 22.47 ? 235 A 1 +ATOM 4141 C CB . ASP A1 1 245 ? -17.913 1.963 -33.341 1.0 21.94 ? 235 A 1 +ATOM 4142 C CG . ASP A1 1 245 ? -18.372 0.562 -32.955 1.0 24.64 ? 235 A 1 +ATOM 4143 O OD1 . ASP A1 1 245 ? -18.132 -0.375 -33.757 1.0 31.79 ? 235 A 1 +ATOM 4144 O OD2 . ASP A1 1 245 ? -18.962 0.402 -31.892 1.0 29.64 ? 235 A 1 +ATOM 4145 H H . ASP A1 1 245 ? -15.606 1.767 -32.289 1.0 23.0 ? 235 A 1 +ATOM 4146 H HA . ASP A1 1 245 ? -16.608 1.389 -34.778 1.0 25.46 ? 235 A 1 +ATOM 4147 H HB2 . ASP A1 1 245 ? -17.878 2.501 -32.535 1.0 26.33 ? 235 A 1 +ATOM 4148 H HB3 . ASP A1 1 245 ? -18.562 2.333 -33.959 1.0 26.33 ? 235 A 1 +ATOM 4149 N N . THR A1 1 246 ? -14.858 3.585 -34.649 1.0 18.56 ? 236 A 1 +ATOM 4150 C CA . THR A1 1 246 ? -14.325 4.853 -35.125 1.0 17.21 ? 236 A 1 +ATOM 4151 C C . THR A1 1 246 ? -13.248 4.612 -36.156 1.0 17.7 ? 236 A 1 +ATOM 4152 O O . THR A1 1 246 ? -12.703 3.498 -36.215 1.0 18.86 ? 236 A 1 +ATOM 4153 C CB . THR A1 1 246 ? -13.697 5.685 -34.011 1.0 17.5 ? 236 A 1 +ATOM 4154 O OG1 . THR A1 1 246 ? -12.445 5.081 -33.589 1.0 17.49 ? 236 A 1 +ATOM 4155 C CG2 . THR A1 1 246 ? -14.633 5.876 -32.819 1.0 16.05 ? 236 A 1 +ATOM 4156 H H . THR A1 1 246 ? -14.243 3.008 -34.483 1.0 22.27 ? 236 A 1 +ATOM 4157 H HA . THR A1 1 246 ? -15.072 5.341 -35.505 1.0 20.65 ? 236 A 1 +ATOM 4158 H HB . THR A1 1 246 ? -13.52 6.574 -34.356 1.0 21.01 ? 236 A 1 +ATOM 4159 H HG1 . THR A1 1 246 ? -12.58 4.294 -33.327 1.0 20.99 ? 236 A 1 +ATOM 4160 H HG21 . THR A1 1 246 ? -14.192 6.398 -32.131 1.0 19.26 ? 236 A 1 +ATOM 4161 H HG22 . THR A1 1 246 ? -15.437 6.34 -33.1 1.0 19.26 ? 236 A 1 +ATOM 4162 H HG23 . THR A1 1 246 ? -14.88 5.013 -32.45 1.0 19.26 ? 236 A 1 +ATOM 4163 N N . PRO A1 1 247 ? -12.846 5.631 -36.924 1.0 17.76 ? 237 A 1 +ATOM 4164 C CA . PRO A1 1 247 ? -11.785 5.453 -37.897 1.0 18.52 ? 237 A 1 +ATOM 4165 C C . PRO A1 1 247 ? -10.441 5.123 -37.324 1.0 17.62 ? 237 A 1 +ATOM 4166 O O . PRO A1 1 247 ? -9.593 4.616 -38.052 1.0 18.86 ? 237 A 1 +ATOM 4167 C CB . PRO A1 1 247 ? -11.772 6.789 -38.65 1.0 20.65 ? 237 A 1 +ATOM 4168 C CG . PRO A1 1 247 ? -13.162 7.373 -38.462 1.0 19.0 ? 237 A 1 +ATOM 4169 C CD . PRO A1 1 247 ? -13.526 6.943 -37.089 1.0 18.59 ? 237 A 1 +ATOM 4170 H HA . PRO A1 1 247 ? -12.031 4.74 -38.507 1.0 22.22 ? 237 A 1 +ATOM 4171 H HB2 . PRO A1 1 247 ? -11.098 7.373 -38.269 1.0 24.78 ? 237 A 1 +ATOM 4172 H HB3 . PRO A1 1 247 ? -11.586 6.635 -39.589 1.0 24.78 ? 237 A 1 +ATOM 4173 H HG2 . PRO A1 1 247 ? -13.135 8.34 -38.534 1.0 22.79 ? 237 A 1 +ATOM 4174 H HG3 . PRO A1 1 247 ? -13.774 7.008 -39.121 1.0 22.79 ? 237 A 1 +ATOM 4175 H HD2 . PRO A1 1 247 ? -13.202 7.581 -36.434 1.0 22.3 ? 237 A 1 +ATOM 4176 H HD3 . PRO A1 1 247 ? -14.488 6.842 -37.006 1.0 22.3 ? 237 A 1 +ATOM 4177 N N . LEU A1 1 248 ? -10.246 5.364 -36.04 1.0 17.12 ? 238 A 1 +ATOM 4178 C CA . LEU A1 1 248 ? -8.978 5.094 -35.366 1.0 16.7 ? 238 A 1 +ATOM 4179 C C . LEU A1 1 248 ? -8.944 3.743 -34.654 1.0 17.55 ? 238 A 1 +ATOM 4180 O O . LEU A1 1 248 ? -8.006 3.485 -33.86 1.0 17.33 ? 238 A 1 +ATOM 4181 C CB . LEU A1 1 248 ? -8.631 6.225 -34.429 1.0 16.52 ? 238 A 1 +ATOM 4182 C CG . LEU A1 1 248 ? -8.634 7.625 -35.088 1.0 16.67 ? 238 A 1 +ATOM 4183 C CD1 . LEU A1 1 248 ? -8.211 8.644 -34.073 1.0 17.58 ? 238 A 1 +ATOM 4184 C CD2 . LEU A1 1 248 ? -7.797 7.677 -36.357 1.0 17.65 ? 238 A 1 +ATOM 4185 H H . LEU A1 1 248 ? -10.846 5.694 -35.52 1.0 20.55 ? 238 A 1 +ATOM 4186 H HA . LEU A1 1 248 ? -8.278 5.059 -36.037 1.0 20.04 ? 238 A 1 +ATOM 4187 H HB2 . LEU A1 1 248 ? -9.279 6.238 -33.708 1.0 19.83 ? 238 A 1 +ATOM 4188 H HB3 . LEU A1 1 248 ? -7.742 6.069 -34.074 1.0 19.83 ? 238 A 1 +ATOM 4189 H HG . LEU A1 1 248 ? -9.533 7.841 -35.382 1.0 20.01 ? 238 A 1 +ATOM 4190 H HD11 . LEU A1 1 248 ? -8.319 9.53 -34.452 1.0 21.09 ? 238 A 1 +ATOM 4191 H HD12 . LEU A1 1 248 ? -8.766 8.551 -33.283 1.0 21.09 ? 238 A 1 +ATOM 4192 H HD13 . LEU A1 1 248 ? -7.281 8.493 -33.844 1.0 21.09 ? 238 A 1 +ATOM 4193 H HD21 . LEU A1 1 248 ? -7.714 8.6 -36.643 1.0 21.18 ? 238 A 1 +ATOM 4194 H HD22 . LEU A1 1 248 ? -6.919 7.308 -36.172 1.0 21.18 ? 238 A 1 +ATOM 4195 H HD23 . LEU A1 1 248 ? -8.236 7.155 -37.047 1.0 21.18 ? 238 A 1 +ATOM 4196 N N . ALA A1 1 249 ? -9.899 2.868 -34.944 1.0 17.9 ? 239 A 1 +ATOM 4197 C CA . ALA A1 1 249 ? -10.007 1.581 -34.245 1.0 18.72 ? 239 A 1 +ATOM 4198 C C . ALA A1 1 249 ? -8.712 0.779 -34.179 1.0 18.96 ? 239 A 1 +ATOM 4199 O O . ALA A1 1 249 ? -8.478 0.118 -33.169 1.0 19.36 ? 239 A 1 +ATOM 4200 C CB . ALA A1 1 249 ? -11.066 0.713 -34.959 1.0 21.07 ? 239 A 1 +ATOM 4201 H H . ALA A1 1 249 ? -10.504 2.989 -35.543 1.0 21.48 ? 239 A 1 +ATOM 4202 H HA . ALA A1 1 249 ? -10.261 1.786 -33.332 1.0 22.47 ? 239 A 1 +ATOM 4203 H HB1 . ALA A1 1 249 ? -11.122 -0.147 -34.515 1.0 25.29 ? 239 A 1 +ATOM 4204 H HB2 . ALA A1 1 249 ? -11.925 1.163 -34.917 1.0 25.29 ? 239 A 1 +ATOM 4205 H HB3 . ALA A1 1 249 ? -10.803 0.59 -35.885 1.0 25.29 ? 239 A 1 +ATOM 4206 N N . ASN A1 1 250 ? -7.893 0.816 -35.201 1.0 19.63 ? 240 A 1 +ATOM 4207 C CA . ASN A1 1 250 ? -6.754 -0.072 -35.315 1.0 19.81 ? 240 A 1 +ATOM 4208 C C . ASN A1 1 250 ? -5.443 0.62 -34.967 1.0 18.45 ? 240 A 1 +ATOM 4209 O O . ASN A1 1 250 ? -4.376 0.029 -35.141 1.0 20.87 ? 240 A 1 +ATOM 4210 C CB . ASN A1 1 250 ? -6.724 -0.698 -36.7 1.0 21.13 ? 240 A 1 +ATOM 4211 C CG . ASN A1 1 250 ? -7.967 -1.496 -36.98 1.0 38.32 ? 240 A 1 +ATOM 4212 O OD1 . ASN A1 1 250 ? -8.429 -2.262 -36.131 1.0 38.14 ? 240 A 1 +ATOM 4213 N ND2 . ASN A1 1 250 ? -8.534 -1.32 -38.167 1.0 45.1 ? 240 A 1 +ATOM 4214 H H . ASN A1 1 250 ? -7.974 1.36 -35.862 1.0 23.55 ? 240 A 1 +ATOM 4215 H HA . ASN A1 1 250 ? -6.849 -0.805 -34.687 1.0 23.77 ? 240 A 1 +ATOM 4216 H HB2 . ASN A1 1 250 ? -6.657 0.004 -37.366 1.0 25.36 ? 240 A 1 +ATOM 4217 H HB3 . ASN A1 1 250 ? -5.96 -1.292 -36.766 1.0 25.36 ? 240 A 1 +ATOM 4218 H HD21 . ASN A1 1 250 ? -9.247 -1.754 -38.372 1.0 54.12 ? 240 A 1 +ATOM 4219 H HD22 . ASN A1 1 250 ? -8.188 -0.77 -38.731 1.0 54.12 ? 240 A 1 +ATOM 4220 N N . GLU A1 1 251 ? -5.508 1.844 -34.472 1.0 17.48 ? 241 A 1 +ATOM 4221 C CA . GLU A1 1 251 ? -4.313 2.597 -34.114 1.0 17.72 ? 241 A 1 +ATOM 4222 C C . GLU A1 1 251 ? -3.775 2.162 -32.745 1.0 16.8 ? 241 A 1 +ATOM 4223 O O . GLU A1 1 251 ? -4.451 1.498 -31.95 1.0 18.35 ? 241 A 1 +ATOM 4224 C CB . GLU A1 1 251 ? -4.607 4.108 -34.149 1.0 17.52 ? 241 A 1 +ATOM 4225 C CG . GLU A1 1 251 ? -5.101 4.568 -35.531 1.0 20.62 ? 241 A 1 +ATOM 4226 C CD . GLU A1 1 251 ? -4.025 4.5 -36.567 1.0 30.05 ? 241 A 1 +ATOM 4227 O OE1 . GLU A1 1 251 ? -2.863 4.825 -36.284 1.0 25.86 ? 241 A 1 +ATOM 4228 O OE2 . GLU A1 1 251 ? -4.354 4.143 -37.723 1.0 45.44 ? 241 A 1 +ATOM 4229 H H . GLU A1 1 251 ? -6.242 2.27 -34.33 1.0 20.98 ? 241 A 1 +ATOM 4230 H HA . GLU A1 1 251 ? -3.609 2.422 -34.758 1.0 21.26 ? 241 A 1 +ATOM 4231 H HB2 . GLU A1 1 251 ? -5.294 4.313 -33.496 1.0 21.02 ? 241 A 1 +ATOM 4232 H HB3 . GLU A1 1 251 ? -3.794 4.595 -33.939 1.0 21.02 ? 241 A 1 +ATOM 4233 H HG2 . GLU A1 1 251 ? -5.831 3.996 -35.815 1.0 24.74 ? 241 A 1 +ATOM 4234 H HG3 . GLU A1 1 251 ? -5.405 5.487 -35.471 1.0 24.74 ? 241 A 1 +ATOM 4235 N N . LYS A1 1 252 ? -2.524 2.544 -32.488 1.0 16.9 ? 242 A 1 +ATOM 4236 C CA . LYS A1 1 252 ? -1.917 2.232 -31.192 1.0 16.43 ? 242 A 1 +ATOM 4237 C C . LYS A1 1 252 ? -2.642 2.952 -30.059 1.0 16.79 ? 242 A 1 +ATOM 4238 O O . LYS A1 1 252 ? -3.082 4.098 -30.167 1.0 17.7 ? 242 A 1 +ATOM 4239 C CB . LYS A1 1 252 ? -0.478 2.702 -31.189 1.0 16.72 ? 242 A 1 +ATOM 4240 C CG . LYS A1 1 252 ? 0.429 1.903 -32.052 1.0 19.69 ? 242 A 1 +ATOM 4241 C CD . LYS A1 1 252 ? 1.806 2.537 -32.04 1.0 22.35 ? 242 A 1 +ATOM 4242 C CE . LYS A1 1 252 ? 2.862 1.655 -32.723 1.0 28.53 ? 242 A 1 +ATOM 4243 N NZ . LYS A1 1 252 ? 4.186 2.361 -32.767 1.0 34.97 ? 242 A 1 +ATOM 4244 H H . LYS A1 1 252 ? -2.017 2.975 -33.032 1.0 20.28 ? 242 A 1 +ATOM 4245 H HA . LYS A1 1 252 ? -1.965 1.275 -31.047 1.0 19.71 ? 242 A 1 +ATOM 4246 H HB2 . LYS A1 1 252 ? -0.45 3.618 -31.505 1.0 20.06 ? 242 A 1 +ATOM 4247 H HB3 . LYS A1 1 252 ? -0.138 2.653 -30.282 1.0 20.06 ? 242 A 1 +ATOM 4248 H HG2 . LYS A1 1 252 ? 0.496 0.996 -31.712 1.0 23.62 ? 242 A 1 +ATOM 4249 H HG3 . LYS A1 1 252 ? 0.094 1.891 -32.962 1.0 23.62 ? 242 A 1 +ATOM 4250 H HD2 . LYS A1 1 252 ? 1.77 3.384 -32.511 1.0 26.82 ? 242 A 1 +ATOM 4251 H HD3 . LYS A1 1 252 ? 2.082 2.68 -31.121 1.0 26.82 ? 242 A 1 +ATOM 4252 H HE2 . LYS A1 1 252 ? 2.968 0.829 -32.225 1.0 34.24 ? 242 A 1 +ATOM 4253 H HE3 . LYS A1 1 252 ? 2.585 1.461 -33.632 1.0 34.24 ? 242 A 1 +ATOM 4254 H HZ1 . LYS A1 1 252 ? 4.791 1.849 -33.172 1.0 41.96 ? 242 A 1 +ATOM 4255 H HZ2 . LYS A1 1 252 ? 4.109 3.126 -33.216 1.0 41.96 ? 242 A 1 +ATOM 4256 H HZ3 . LYS A1 1 252 ? 4.464 2.538 -31.941 1.0 41.96 ? 242 A 1 +ATOM 4257 N N . LYS A1 1 253 ? -2.772 2.235 -28.945 1.0 16.27 ? 243 A 1 +ATOM 4258 C CA . LYS A1 1 253 ? -3.218 2.835 -27.69 1.0 15.4 ? 243 A 1 +ATOM 4259 C C . LYS A1 1 253 ? -2.126 3.736 -27.115 1.0 15.11 ? 243 A 1 +ATOM 4260 O O . LYS A1 1 253 ? -0.943 3.455 -27.277 1.0 16.75 ? 243 A 1 +ATOM 4261 C CB . LYS A1 1 253 ? -3.553 1.691 -26.72 1.0 17.63 ? 243 A 1 +ATOM 4262 C CG . LYS A1 1 253 ? -4.25 2.125 -25.474 1.0 18.9 ? 243 A 1 +ATOM 4263 C CD . LYS A1 1 253 ? -4.553 0.913 -24.513 1.0 23.8 ? 243 A 1 +ATOM 4264 C CE . LYS A1 1 253 ? -5.422 -0.088 -25.169 1.0 25.12 ? 243 A 1 +ATOM 4265 N NZ . LYS A1 1 253 ? -5.796 -1.205 -24.195 1.0 23.31 ? 243 A 1 +ATOM 4266 H H . LYS A1 1 253 ? -2.607 1.393 -28.889 1.0 19.53 ? 243 A 1 +ATOM 4267 H HA . LYS A1 1 253 ? -4.005 3.388 -27.816 1.0 18.48 ? 243 A 1 +ATOM 4268 H HB2 . LYS A1 1 253 ? -4.131 1.059 -27.175 1.0 21.15 ? 243 A 1 +ATOM 4269 H HB3 . LYS A1 1 253 ? -2.727 1.256 -26.458 1.0 21.15 ? 243 A 1 +ATOM 4270 H HG2 . LYS A1 1 253 ? -3.688 2.756 -24.997 1.0 22.68 ? 243 A 1 +ATOM 4271 H HG3 . LYS A1 1 253 ? -5.093 2.544 -25.709 1.0 22.68 ? 243 A 1 +ATOM 4272 H HD2 . LYS A1 1 253 ? -3.72 0.481 -24.267 1.0 28.56 ? 243 A 1 +ATOM 4273 H HD3 . LYS A1 1 253 ? -5.005 1.237 -23.718 1.0 28.56 ? 243 A 1 +ATOM 4274 H HE2 . LYS A1 1 253 ? -6.237 0.341 -25.472 1.0 30.14 ? 243 A 1 +ATOM 4275 H HE3 . LYS A1 1 253 ? -4.953 -0.48 -25.922 1.0 30.14 ? 243 A 1 +ATOM 4276 H HZ1 . LYS A1 1 253 ? -6.328 -1.794 -24.597 1.0 27.98 ? 243 A 1 +ATOM 4277 H HZ2 . LYS A1 1 253 ? -5.061 -1.623 -23.915 1.0 27.98 ? 243 A 1 +ATOM 4278 H HZ3 . LYS A1 1 253 ? -6.221 -0.866 -23.49 1.0 27.98 ? 243 A 1 +ATOM 4279 N N . GLY A1 1 254 ? -2.512 4.79 -26.427 1.0 15.31 ? 244 A 1 +ATOM 4280 C CA . GLY A1 1 254 ? -1.524 5.622 -25.731 1.0 15.71 ? 244 A 1 +ATOM 4281 C C . GLY A1 1 254 ? -0.825 4.861 -24.622 1.0 14.49 ? 244 A 1 +ATOM 4282 O O . GLY A1 1 254 ? -1.372 3.906 -24.043 1.0 18.19 ? 244 A 1 +ATOM 4283 H H . GLY A1 1 254 ? -3.327 5.053 -26.343 1.0 18.37 ? 244 A 1 +ATOM 4284 H HA2 . GLY A1 1 254 ? -0.856 5.927 -26.364 1.0 18.85 ? 244 A 1 +ATOM 4285 H HA3 . GLY A1 1 254 ? -1.967 6.393 -25.343 1.0 18.85 ? 244 A 1 +ATOM 4286 N N . ASP A1 1 255 ? 0.398 5.252 -24.372 1.0 15.17 ? 245 A 1 +ATOM 4287 C CA . ASP A1 1 255 ? 1.233 4.543 -23.409 1.0 14.38 ? 245 A 1 +ATOM 4288 C C . ASP A1 1 255 ? 1.019 5.103 -22.0 1.0 16.17 ? 245 A 1 +ATOM 4289 O O . ASP A1 1 255 ? 1.125 6.307 -21.769 1.0 15.44 ? 245 A 1 +ATOM 4290 C CB . ASP A1 1 255 ? 2.679 4.727 -23.805 1.0 16.68 ? 245 A 1 +ATOM 4291 C CG . ASP A1 1 255 ? 3.634 3.93 -22.931 1.0 20.07 ? 245 A 1 +ATOM 4292 O OD1 . ASP A1 1 255 ? 3.683 2.674 -23.058 1.0 21.65 ? 245 A 1 +ATOM 4293 O OD2 . ASP A1 1 255 ? 4.324 4.589 -22.096 1.0 20.45 ? 245 A 1 +ATOM 4294 H H . ASP A1 1 255 ? 0.778 5.928 -24.744 1.0 18.2 ? 245 A 1 +ATOM 4295 H HA . ASP A1 1 255 ? 1.0 3.601 -23.395 1.0 17.26 ? 245 A 1 +ATOM 4296 H HB2 . ASP A1 1 255 ? 2.796 4.433 -24.722 1.0 20.01 ? 245 A 1 +ATOM 4297 H HB3 . ASP A1 1 255 ? 2.912 5.665 -23.725 1.0 20.01 ? 245 A 1 +ATOM 4298 N N . PHE A1 1 256 ? 0.753 4.218 -21.038 1.0 15.31 ? 246 A 1 +ATOM 4299 C CA . PHE A1 1 256 ? 0.506 4.644 -19.661 1.0 14.17 ? 246 A 1 +ATOM 4300 C C . PHE A1 1 256 ? 1.694 5.378 -19.055 1.0 14.67 ? 246 A 1 +ATOM 4301 O O . PHE A1 1 256 ? 1.531 6.459 -18.46 1.0 14.5 ? 246 A 1 +ATOM 4302 C CB . PHE A1 1 256 ? 0.12 3.437 -18.816 1.0 15.82 ? 246 A 1 +ATOM 4303 C CG . PHE A1 1 256 ? -0.117 3.779 -17.373 1.0 15.26 ? 246 A 1 +ATOM 4304 C CD1 . PHE A1 1 256 ? -1.219 4.459 -17.007 1.0 16.33 ? 246 A 1 +ATOM 4305 C CD2 . PHE A1 1 256 ? 0.787 3.434 -16.387 1.0 17.92 ? 246 A 1 +ATOM 4306 C CE1 . PHE A1 1 256 ? -1.493 4.733 -15.647 1.0 17.91 ? 246 A 1 +ATOM 4307 C CE2 . PHE A1 1 256 ? 0.547 3.681 -15.037 1.0 17.32 ? 246 A 1 +ATOM 4308 C CZ . PHE A1 1 256 ? -0.574 4.371 -14.682 1.0 17.21 ? 246 A 1 +ATOM 4309 H H . PHE A1 1 256 ? 0.71 3.368 -21.156 1.0 18.37 ? 246 A 1 +ATOM 4310 H HA . PHE A1 1 256 ? -0.234 5.271 -19.664 1.0 17.01 ? 246 A 1 +ATOM 4311 H HB2 . PHE A1 1 256 ? -0.697 3.053 -19.17 1.0 18.98 ? 246 A 1 +ATOM 4312 H HB3 . PHE A1 1 256 ? 0.837 2.784 -18.854 1.0 18.98 ? 246 A 1 +ATOM 4313 H HD1 . PHE A1 1 256 ? -1.812 4.754 -17.66 1.0 19.6 ? 246 A 1 +ATOM 4314 H HD2 . PHE A1 1 256 ? 1.584 3.022 -16.633 1.0 21.5 ? 246 A 1 +ATOM 4315 H HE1 . PHE A1 1 256 ? -2.286 5.154 -15.404 1.0 21.49 ? 246 A 1 +ATOM 4316 H HE2 . PHE A1 1 256 ? 1.142 3.381 -14.388 1.0 20.78 ? 246 A 1 +ATOM 4317 H HZ . PHE A1 1 256 ? -0.72 4.597 -13.792 1.0 20.65 ? 246 A 1 +ATOM 4318 N N . THR A1 1 257 ? 2.889 4.834 -19.183 1.0 15.69 ? 247 A 1 +ATOM 4319 C CA . THR A1 1 257 ? 4.035 5.488 -18.551 1.0 14.95 ? 247 A 1 +ATOM 4320 C C . THR A1 1 257 ? 4.276 6.867 -19.123 1.0 15.91 ? 247 A 1 +ATOM 4321 O O . THR A1 1 257 ? 4.545 7.821 -18.378 1.0 15.14 ? 247 A 1 +ATOM 4322 C CB . THR A1 1 257 ? 5.261 4.599 -18.665 1.0 16.91 ? 247 A 1 +ATOM 4323 O OG1 . THR A1 1 257 ? 4.986 3.369 -17.977 1.0 20.37 ? 247 A 1 +ATOM 4324 C CG2 . THR A1 1 257 ? 6.48 5.236 -18.01 1.0 20.05 ? 247 A 1 +ATOM 4325 H H . THR A1 1 257 ? 3.066 4.111 -19.614 1.0 18.83 ? 247 A 1 +ATOM 4326 H HA . THR A1 1 257 ? 3.85 5.608 -17.607 1.0 17.94 ? 247 A 1 +ATOM 4327 H HB . THR A1 1 257 ? 5.463 4.452 -19.603 1.0 20.3 ? 247 A 1 +ATOM 4328 H HG1 . THR A1 1 257 ? 4.304 3.003 -18.304 1.0 24.44 ? 247 A 1 +ATOM 4329 H HG21 . THR A1 1 257 ? 7.206 4.594 -17.965 1.0 24.06 ? 247 A 1 +ATOM 4330 H HG22 . THR A1 1 257 ? 6.771 6.004 -18.527 1.0 24.06 ? 247 A 1 +ATOM 4331 H HG23 . THR A1 1 257 ? 6.26 5.527 -17.111 1.0 24.06 ? 247 A 1 +ATOM 4332 N N . LEU A1 1 258 ? 4.24 6.997 -20.457 1.0 15.0 ? 248 A 1 +ATOM 4333 C CA . LEU A1 1 258 ? 4.396 8.313 -21.073 1.0 14.64 ? 248 A 1 +ATOM 4334 C C . LEU A1 1 258 ? 3.337 9.274 -20.57 1.0 14.41 ? 248 A 1 +ATOM 4335 O O . LEU A1 1 258 ? 3.629 10.455 -20.309 1.0 14.18 ? 248 A 1 +ATOM 4336 C CB . LEU A1 1 258 ? 4.36 8.147 -22.599 1.0 16.17 ? 248 A 1 +ATOM 4337 C CG . LEU A1 1 258 ? 4.684 9.407 -23.355 1.0 17.56 ? 248 A 1 +ATOM 4338 C CD1 . LEU A1 1 258 ? 6.05 9.908 -23.067 1.0 19.07 ? 248 A 1 +ATOM 4339 C CD2 . LEU A1 1 258 ? 4.542 9.074 -24.869 1.0 18.55 ? 248 A 1 +ATOM 4340 H H . LEU A1 1 258 ? 4.13 6.35 -21.013 1.0 18.0 ? 248 A 1 +ATOM 4341 H HA . LEU A1 1 258 ? 5.253 8.702 -20.839 1.0 17.57 ? 248 A 1 +ATOM 4342 H HB2 . LEU A1 1 258 ? 5.01 7.473 -22.853 1.0 19.41 ? 248 A 1 +ATOM 4343 H HB3 . LEU A1 1 258 ? 3.47 7.864 -22.86 1.0 19.41 ? 248 A 1 +ATOM 4344 H HG . LEU A1 1 258 ? 4.081 10.118 -23.089 1.0 21.07 ? 248 A 1 +ATOM 4345 H HD11 . LEU A1 1 258 ? 6.272 10.605 -23.704 1.0 22.89 ? 248 A 1 +ATOM 4346 H HD12 . LEU A1 1 258 ? 6.071 10.265 -22.165 1.0 22.89 ? 248 A 1 +ATOM 4347 H HD13 . LEU A1 1 258 ? 6.679 9.174 -23.147 1.0 22.89 ? 248 A 1 +ATOM 4348 H HD21 . LEU A1 1 258 ? 4.799 9.852 -25.388 1.0 22.25 ? 248 A 1 +ATOM 4349 H HD22 . LEU A1 1 258 ? 5.121 8.326 -25.083 1.0 22.25 ? 248 A 1 +ATOM 4350 H HD23 . LEU A1 1 258 ? 3.619 8.842 -25.056 1.0 22.25 ? 248 A 1 +ATOM 4351 N N . THR A1 1 259 ? 2.102 8.812 -20.442 1.0 13.96 ? 249 A 1 +ATOM 4352 C CA . THR A1 1 259 ? 1.031 9.684 -19.949 1.0 13.04 ? 249 A 1 +ATOM 4353 C C . THR A1 1 259 ? 1.303 10.106 -18.509 1.0 13.95 ? 249 A 1 +ATOM 4354 O O . THR A1 1 259 ? 1.063 11.266 -18.131 1.0 14.18 ? 249 A 1 +ATOM 4355 C CB . THR A1 1 259 ? -0.342 8.976 -20.088 1.0 13.73 ? 249 A 1 +ATOM 4356 O OG1 . THR A1 1 259 ? -0.531 8.523 -21.444 1.0 15.0 ? 249 A 1 +ATOM 4357 C CG2 . THR A1 1 259 ? -1.469 9.903 -19.759 1.0 14.37 ? 249 A 1 +ATOM 4358 H H . THR A1 1 259 ? 1.853 8.01 -20.63 1.0 16.76 ? 249 A 1 +ATOM 4359 H HA . THR A1 1 259 ? 0.992 10.487 -20.491 1.0 15.64 ? 249 A 1 +ATOM 4360 H HB . THR A1 1 259 ? -0.356 8.227 -19.473 1.0 16.48 ? 249 A 1 +ATOM 4361 H HG1 . THR A1 1 259 ? 0.049 7.948 -21.639 1.0 18.0 ? 249 A 1 +ATOM 4362 H HG21 . THR A1 1 259 ? -2.318 9.472 -19.944 1.0 17.25 ? 249 A 1 +ATOM 4363 H HG22 . THR A1 1 259 ? -1.436 10.145 -18.82 1.0 17.25 ? 249 A 1 +ATOM 4364 H HG23 . THR A1 1 259 ? -1.402 10.71 -20.294 1.0 17.25 ? 249 A 1 +ATOM 4365 N N . LEU A1 1 260 ? 1.734 9.169 -17.68 1.0 13.29 ? 250 A 1 +ATOM 4366 C CA A LEU A1 1 260 ? 2.094 9.497 -16.299 0.46 14.02 ? 250 A 1 +ATOM 4367 C CA B LEU A1 1 260 ? 2.076 9.497 -16.304 0.54 13.26 ? 250 A 1 +ATOM 4368 C C . LEU A1 1 260 ? 3.189 10.542 -16.251 1.0 13.6 ? 250 A 1 +ATOM 4369 O O . LEU A1 1 260 ? 3.176 11.455 -15.417 1.0 13.82 ? 250 A 1 +ATOM 4370 C CB A LEU A1 1 260 ? 2.632 8.28 -15.556 0.46 16.59 ? 250 A 1 +ATOM 4371 C CB B LEU A1 1 260 ? 2.458 8.188 -15.628 0.54 14.93 ? 250 A 1 +ATOM 4372 C CG A LEU A1 1 260 ? 1.723 7.31 -14.88 0.46 14.58 ? 250 A 1 +ATOM 4373 C CG B LEU A1 1 260 ? 2.6 8.152 -14.155 0.54 13.51 ? 250 A 1 +ATOM 4374 C CD1 A LEU A1 1 260 ? 2.632 6.372 -14.11 0.46 18.44 ? 250 A 1 +ATOM 4375 C CD1 B LEU A1 1 260 ? 1.315 8.519 -13.511 0.54 14.48 ? 250 A 1 +ATOM 4376 C CD2 A LEU A1 1 260 ? 0.774 7.976 -13.882 0.46 13.41 ? 250 A 1 +ATOM 4377 C CD2 B LEU A1 1 260 ? 3.002 6.735 -13.797 0.54 18.07 ? 250 A 1 +ATOM 4378 H H A LEU A1 1 260 ? 1.829 8.339 -17.884 0.46 15.94 ? 250 A 1 +ATOM 4379 H H B LEU A1 1 260 ? 1.837 8.34 -17.885 0.54 15.94 ? 250 A 1 +ATOM 4380 H HA A LEU A1 1 260 ? 1.282 9.813 -15.872 0.46 16.82 ? 250 A 1 +ATOM 4381 H HA B LEU A1 1 260 ? 1.33 9.889 -15.825 0.54 15.91 ? 250 A 1 +ATOM 4382 H HB2 A LEU A1 1 260 ? 3.138 7.76 -16.2 0.46 19.91 ? 250 A 1 +ATOM 4383 H HB2 B LEU A1 1 260 ? 1.777 7.536 -15.854 0.54 17.92 ? 250 A 1 +ATOM 4384 H HB3 A LEU A1 1 260 ? 3.222 8.614 -14.863 0.46 19.91 ? 250 A 1 +ATOM 4385 H HB3 B LEU A1 1 260 ? 3.314 7.913 -15.992 0.54 17.92 ? 250 A 1 +ATOM 4386 H HG A LEU A1 1 260 ? 1.166 6.865 -15.538 0.46 17.49 ? 250 A 1 +ATOM 4387 H HG B LEU A1 1 260 ? 3.264 8.783 -13.836 0.54 16.22 ? 250 A 1 +ATOM 4388 H HD11 A LEU A1 1 260 ? 2.09 5.697 -13.672 0.46 22.12 ? 250 A 1 +ATOM 4389 H HD11 B LEU A1 1 260 ? 1.368 8.318 -12.564 0.54 17.38 ? 250 A 1 +ATOM 4390 H HD12 A LEU A1 1 260 ? 3.248 5.951 -14.729 0.46 22.12 ? 250 A 1 +ATOM 4391 H HD12 B LEU A1 1 260 ? 1.157 9.467 -13.64 0.54 17.38 ? 250 A 1 +ATOM 4392 H HD13 A LEU A1 1 260 ? 3.124 6.882 -13.448 0.46 22.12 ? 250 A 1 +ATOM 4393 H HD13 B LEU A1 1 260 ? 0.6 8.006 -13.919 0.54 17.38 ? 250 A 1 +ATOM 4394 H HD21 A LEU A1 1 260 ? 0.243 7.292 -13.446 0.46 16.09 ? 250 A 1 +ATOM 4395 H HD21 B LEU A1 1 260 ? 2.955 6.627 -12.835 0.54 21.69 ? 250 A 1 +ATOM 4396 H HD22 A LEU A1 1 260 ? 1.297 8.459 -13.223 0.46 16.09 ? 250 A 1 +ATOM 4397 H HD22 B LEU A1 1 260 ? 2.393 6.116 -14.23 0.54 21.69 ? 250 A 1 +ATOM 4398 H HD23 A LEU A1 1 260 ? 0.195 8.591 -14.359 0.46 16.09 ? 250 A 1 +ATOM 4399 H HD23 B LEU A1 1 260 ? 3.908 6.577 -14.105 0.54 21.69 ? 250 A 1 +ATOM 4400 N N . LYS A1 1 261 ? 4.175 10.462 -17.161 1.0 13.56 ? 251 A 1 +ATOM 4401 C CA . LYS A1 1 261 ? 5.223 11.451 -17.199 1.0 14.31 ? 251 A 1 +ATOM 4402 C C . LYS A1 1 261 ? 4.682 12.817 -17.615 1.0 13.64 ? 251 A 1 +ATOM 4403 O O . LYS A1 1 261 ? 5.168 13.86 -17.144 1.0 15.12 ? 251 A 1 +ATOM 4404 C CB . LYS A1 1 261 ? 6.342 10.959 -18.133 1.0 15.02 ? 251 A 1 +ATOM 4405 C CG . LYS A1 1 261 ? 7.073 9.762 -17.552 1.0 15.81 ? 251 A 1 +ATOM 4406 C CD . LYS A1 1 261 ? 8.047 9.12 -18.498 1.0 20.88 ? 251 A 1 +ATOM 4407 C CE . LYS A1 1 261 ? 9.182 10.024 -18.769 1.0 20.88 ? 251 A 1 +ATOM 4408 N NZ . LYS A1 1 261 ? 10.314 9.281 -19.448 1.0 19.32 ? 251 A 1 +ATOM 4409 H H . LYS A1 1 261 ? 4.247 9.844 -17.755 1.0 16.27 ? 251 A 1 +ATOM 4410 H HA . LYS A1 1 261 ? 5.611 11.565 -16.318 1.0 17.18 ? 251 A 1 +ATOM 4411 H HB2 . LYS A1 1 261 ? 5.956 10.698 -18.983 1.0 18.03 ? 251 A 1 +ATOM 4412 H HB3 . LYS A1 1 261 ? 6.984 11.674 -18.265 1.0 18.03 ? 251 A 1 +ATOM 4413 H HG2 . LYS A1 1 261 ? 7.569 10.05 -16.77 1.0 18.98 ? 251 A 1 +ATOM 4414 H HG3 . LYS A1 1 261 ? 6.42 9.09 -17.302 1.0 18.98 ? 251 A 1 +ATOM 4415 H HD2 . LYS A1 1 261 ? 8.391 8.303 -18.106 1.0 25.06 ? 251 A 1 +ATOM 4416 H HD3 . LYS A1 1 261 ? 7.602 8.924 -19.338 1.0 25.06 ? 251 A 1 +ATOM 4417 H HE2 . LYS A1 1 261 ? 8.892 10.742 -19.353 1.0 25.06 ? 251 A 1 +ATOM 4418 H HE3 . LYS A1 1 261 ? 9.511 10.389 -17.933 1.0 25.06 ? 251 A 1 +ATOM 4419 H HZ1 . LYS A1 1 261 ? 10.987 9.839 -19.616 1.0 23.19 ? 251 A 1 +ATOM 4420 H HZ2 . LYS A1 1 261 ? 10.606 8.625 -18.922 1.0 23.19 ? 251 A 1 +ATOM 4421 H HZ3 . LYS A1 1 261 ? 10.031 8.931 -20.216 1.0 23.19 ? 251 A 1 +ATOM 4422 N N . MET A1 1 262 ? 3.683 12.837 -18.483 1.0 13.93 ? 252 A 1 +ATOM 4423 C CA . MET A1 1 262 ? 3.015 14.096 -18.825 1.0 13.87 ? 252 A 1 +ATOM 4424 C C . MET A1 1 262 ? 2.304 14.695 -17.617 1.0 14.71 ? 252 A 1 +ATOM 4425 O O . MET A1 1 262 ? 2.336 15.924 -17.432 1.0 14.43 ? 252 A 1 +ATOM 4426 C CB . MET A1 1 262 ? 2.059 13.849 -20.0 1.0 13.79 ? 252 A 1 +ATOM 4427 C CG . MET A1 1 262 ? 2.76 13.679 -21.33 1.0 14.53 ? 252 A 1 +ATOM 4428 S SD . MET A1 1 262 ? 3.473 15.192 -21.987 1.0 15.0 ? 252 A 1 +ATOM 4429 C CE . MET A1 1 262 ? 2.023 16.098 -22.437 1.0 16.03 ? 252 A 1 +ATOM 4430 H H . MET A1 1 262 ? 3.37 12.146 -18.888 1.0 16.72 ? 252 A 1 +ATOM 4431 H HA . MET A1 1 262 ? 3.672 14.747 -19.117 1.0 16.65 ? 252 A 1 +ATOM 4432 H HB2 . MET A1 1 262 ? 1.553 13.04 -19.827 1.0 16.55 ? 252 A 1 +ATOM 4433 H HB3 . MET A1 1 262 ? 1.457 14.606 -20.078 1.0 16.55 ? 252 A 1 +ATOM 4434 H HG2 . MET A1 1 262 ? 3.48 13.038 -21.222 1.0 17.43 ? 252 A 1 +ATOM 4435 H HG3 . MET A1 1 262 ? 2.119 13.351 -21.979 1.0 17.43 ? 252 A 1 +ATOM 4436 H HE1 . MET A1 1 262 ? 2.288 16.919 -22.88 1.0 19.23 ? 252 A 1 +ATOM 4437 H HE2 . MET A1 1 262 ? 1.485 15.557 -23.036 1.0 19.23 ? 252 A 1 +ATOM 4438 H HE3 . MET A1 1 262 ? 1.518 16.304 -21.635 1.0 19.23 ? 252 A 1 +ATOM 4439 N N . VAL A1 1 263 ? 1.604 13.87 -16.821 1.0 13.26 ? 253 A 1 +ATOM 4440 C CA . VAL A1 1 263 ? 0.985 14.375 -15.58 1.0 13.81 ? 253 A 1 +ATOM 4441 C C . VAL A1 1 263 ? 2.043 14.928 -14.643 1.0 13.49 ? 253 A 1 +ATOM 4442 O O . VAL A1 1 263 ? 1.894 16.024 -14.087 1.0 13.56 ? 253 A 1 +ATOM 4443 C CB . VAL A1 1 263 ? 0.188 13.242 -14.914 1.0 14.09 ? 253 A 1 +ATOM 4444 C CG1 . VAL A1 1 263 ? -0.233 13.639 -13.49 1.0 14.35 ? 253 A 1 +ATOM 4445 C CG2 . VAL A1 1 263 ? -1.034 12.875 -15.759 1.0 14.68 ? 253 A 1 +ATOM 4446 H H . VAL A1 1 263 ? 1.475 13.033 -16.971 1.0 15.91 ? 253 A 1 +ATOM 4447 H HA . VAL A1 1 263 ? 0.38 15.101 -15.799 1.0 16.57 ? 253 A 1 +ATOM 4448 H HB . VAL A1 1 263 ? 0.755 12.458 -14.85 1.0 16.91 ? 253 A 1 +ATOM 4449 H HG11 . VAL A1 1 263 ? -0.955 13.059 -13.201 1.0 17.21 ? 253 A 1 +ATOM 4450 H HG12 . VAL A1 1 263 ? 0.528 13.541 -12.897 1.0 17.21 ? 253 A 1 +ATOM 4451 H HG13 . VAL A1 1 263 ? -0.532 14.562 -13.495 1.0 17.21 ? 253 A 1 +ATOM 4452 H HG21 . VAL A1 1 263 ? -1.513 12.152 -15.324 1.0 17.61 ? 253 A 1 +ATOM 4453 H HG22 . VAL A1 1 263 ? -1.608 13.652 -15.839 1.0 17.61 ? 253 A 1 +ATOM 4454 H HG23 . VAL A1 1 263 ? -0.736 12.592 -16.638 1.0 17.61 ? 253 A 1 +ATOM 4455 N N . ALA A1 1 264 ? 3.128 14.189 -14.478 1.0 13.24 ? 254 A 1 +ATOM 4456 C CA . ALA A1 1 264 ? 4.172 14.632 -13.558 1.0 13.89 ? 254 A 1 +ATOM 4457 C C . ALA A1 1 264 ? 4.764 15.96 -14.026 1.0 14.5 ? 254 A 1 +ATOM 4458 O O . ALA A1 1 264 ? 4.978 16.892 -13.219 1.0 14.29 ? 254 A 1 +ATOM 4459 C CB . ALA A1 1 264 ? 5.255 13.573 -13.458 1.0 15.04 ? 254 A 1 +ATOM 4460 H H . ALA A1 1 264 ? 3.285 13.442 -14.875 1.0 15.89 ? 254 A 1 +ATOM 4461 H HA . ALA A1 1 264 ? 3.79 14.757 -12.675 1.0 16.67 ? 254 A 1 +ATOM 4462 H HB1 . ALA A1 1 264 ? 5.94 13.878 -12.843 1.0 18.05 ? 254 A 1 +ATOM 4463 H HB2 . ALA A1 1 264 ? 4.861 12.748 -13.132 1.0 18.05 ? 254 A 1 +ATOM 4464 H HB3 . ALA A1 1 264 ? 5.639 13.431 -14.338 1.0 18.05 ? 254 A 1 +ATOM 4465 N N . LEU A1 1 265 ? 5.112 16.062 -15.325 1.0 14.35 ? 255 A 1 +ATOM 4466 C CA . LEU A1 1 265 ? 5.688 17.313 -15.832 1.0 14.21 ? 255 A 1 +ATOM 4467 C C . LEU A1 1 265 ? 4.687 18.453 -15.748 1.0 14.12 ? 255 A 1 +ATOM 4468 O O . LEU A1 1 265 ? 5.082 19.588 -15.47 1.0 15.27 ? 255 A 1 +ATOM 4469 C CB . LEU A1 1 265 ? 6.222 17.101 -17.248 1.0 15.48 ? 255 A 1 +ATOM 4470 C CG . LEU A1 1 265 ? 7.49 16.254 -17.29 1.0 15.3 ? 255 A 1 +ATOM 4471 C CD1 . LEU A1 1 265 ? 7.711 15.739 -18.719 1.0 17.88 ? 255 A 1 +ATOM 4472 C CD2 . LEU A1 1 265 ? 8.697 17.088 -16.824 1.0 16.75 ? 255 A 1 +ATOM 4473 H H . LEU A1 1 265 ? 5.026 15.439 -15.911 1.0 17.23 ? 255 A 1 +ATOM 4474 H HA . LEU A1 1 265 ? 6.449 17.574 -15.289 1.0 17.05 ? 255 A 1 +ATOM 4475 H HB2 . LEU A1 1 265 ? 5.543 16.649 -17.774 1.0 18.57 ? 255 A 1 +ATOM 4476 H HB3 . LEU A1 1 265 ? 6.425 17.964 -17.64 1.0 18.57 ? 255 A 1 +ATOM 4477 H HG . LEU A1 1 265 ? 7.403 15.494 -16.694 1.0 18.36 ? 255 A 1 +ATOM 4478 H HD11 . LEU A1 1 265 ? 8.523 15.209 -18.741 1.0 21.45 ? 255 A 1 +ATOM 4479 H HD12 . LEU A1 1 265 ? 6.952 15.194 -18.978 1.0 21.45 ? 255 A 1 +ATOM 4480 H HD13 . LEU A1 1 265 ? 7.793 16.497 -19.318 1.0 21.45 ? 255 A 1 +ATOM 4481 H HD21 . LEU A1 1 265 ? 9.503 16.558 -16.921 1.0 20.1 ? 255 A 1 +ATOM 4482 H HD22 . LEU A1 1 265 ? 8.758 17.887 -17.37 1.0 20.1 ? 255 A 1 +ATOM 4483 H HD23 . LEU A1 1 265 ? 8.572 17.332 -15.893 1.0 20.1 ? 255 A 1 +ATOM 4484 N N . THR A1 1 266 ? 3.412 18.175 -15.922 1.0 14.04 ? 256 A 1 +ATOM 4485 C CA . THR A1 1 266 ? 2.374 19.211 -15.77 1.0 13.62 ? 256 A 1 +ATOM 4486 C C . THR A1 1 266 ? 2.366 19.751 -14.346 1.0 14.93 ? 256 A 1 +ATOM 4487 O O . THR A1 1 266 ? 2.328 20.959 -14.133 1.0 14.95 ? 256 A 1 +ATOM 4488 C CB . THR A1 1 266 ? 0.998 18.698 -16.168 1.0 13.62 ? 256 A 1 +ATOM 4489 O OG1 . THR A1 1 266 ? 1.018 18.419 -17.578 1.0 14.42 ? 256 A 1 +ATOM 4490 C CG2 . THR A1 1 266 ? -0.05 19.773 -15.984 1.0 15.92 ? 256 A 1 +ATOM 4491 H H . THR A1 1 266 ? 3.105 17.398 -16.128 1.0 16.85 ? 256 A 1 +ATOM 4492 H HA . THR A1 1 266 ? 2.58 19.936 -16.38 1.0 16.34 ? 256 A 1 +ATOM 4493 H HB . THR A1 1 266 ? 0.781 17.921 -15.629 1.0 16.34 ? 256 A 1 +ATOM 4494 H HG1 . THR A1 1 266 ? 1.557 17.796 -17.74 1.0 17.31 ? 256 A 1 +ATOM 4495 H HG21 . THR A1 1 266 ? -0.883 19.499 -16.4 1.0 19.11 ? 256 A 1 +ATOM 4496 H HG22 . THR A1 1 266 ? -0.206 19.927 -15.039 1.0 19.11 ? 256 A 1 +ATOM 4497 H HG23 . THR A1 1 266 ? 0.248 20.601 -16.393 1.0 19.11 ? 256 A 1 +ATOM 4498 N N . ARG A1 1 267 ? 2.428 18.855 -13.343 1.0 13.97 ? 257 A 1 +ATOM 4499 C CA . ARG A1 1 267 ? 2.498 19.321 -11.961 1.0 13.87 ? 257 A 1 +ATOM 4500 C C . ARG A1 1 267 ? 3.753 20.138 -11.734 1.0 14.8 ? 257 A 1 +ATOM 4501 O O . ARG A1 1 267 ? 3.712 21.161 -11.035 1.0 15.04 ? 257 A 1 +ATOM 4502 C CB . ARG A1 1 267 ? 2.489 18.12 -11.028 1.0 14.28 ? 257 A 1 +ATOM 4503 C CG . ARG A1 1 267 ? 2.825 18.442 -9.536 1.0 15.31 ? 257 A 1 +ATOM 4504 C CD . ARG A1 1 267 ? 1.832 19.429 -8.87 1.0 14.48 ? 257 A 1 +ATOM 4505 N NE . ARG A1 1 267 ? 0.525 18.827 -8.778 1.0 13.76 ? 257 A 1 +ATOM 4506 C CZ . ARG A1 1 267 ? -0.638 19.473 -8.787 1.0 13.65 ? 257 A 1 +ATOM 4507 N NH1 . ARG A1 1 267 ? -0.639 20.806 -8.699 1.0 14.84 ? 257 A 1 +ATOM 4508 N NH2 . ARG A1 1 267 ? -1.791 18.808 -8.821 1.0 13.98 ? 257 A 1 +ATOM 4509 H H . ARG A1 1 267 ? 2.431 18.0 -13.44 1.0 16.77 ? 257 A 1 +ATOM 4510 H HA . ARG A1 1 267 ? 1.726 19.876 -11.767 1.0 16.64 ? 257 A 1 +ATOM 4511 H HB2 . ARG A1 1 267 ? 1.604 17.723 -11.048 1.0 17.14 ? 257 A 1 +ATOM 4512 H HB3 . ARG A1 1 267 ? 3.147 17.481 -11.343 1.0 17.14 ? 257 A 1 +ATOM 4513 H HG2 . ARG A1 1 267 ? 2.807 17.617 -9.027 1.0 18.37 ? 257 A 1 +ATOM 4514 H HG3 . ARG A1 1 267 ? 3.709 18.84 -9.494 1.0 18.37 ? 257 A 1 +ATOM 4515 H HD2 . ARG A1 1 267 ? 2.138 19.647 -7.976 1.0 17.38 ? 257 A 1 +ATOM 4516 H HD3 . ARG A1 1 267 ? 1.766 20.236 -9.404 1.0 17.38 ? 257 A 1 +ATOM 4517 H HE . ARG A1 1 267 ? 0.494 17.97 -8.711 1.0 16.51 ? 257 A 1 +ATOM 4518 H HH11 . ARG A1 1 267 ? 0.105 21.234 -8.638 1.0 17.81 ? 257 A 1 +ATOM 4519 H HH12 . ARG A1 1 267 ? -1.383 21.237 -8.704 1.0 17.81 ? 257 A 1 +ATOM 4520 H HH21 . ARG A1 1 267 ? -1.792 17.948 -8.838 1.0 16.78 ? 257 A 1 +ATOM 4521 H HH22 . ARG A1 1 267 ? -2.536 19.239 -8.826 1.0 16.78 ? 257 A 1 +ATOM 4522 N N . ILE A1 1 268 ? 4.902 19.687 -12.232 1.0 15.13 ? 258 A 1 +ATOM 4523 C CA . ILE A1 1 268 ? 6.131 20.463 -12.053 1.0 16.24 ? 258 A 1 +ATOM 4524 C C . ILE A1 1 268 ? 5.997 21.854 -12.673 1.0 17.21 ? 258 A 1 +ATOM 4525 O O . ILE A1 1 268 ? 6.405 22.869 -12.077 1.0 17.81 ? 258 A 1 +ATOM 4526 C CB . ILE A1 1 268 ? 7.312 19.658 -12.636 1.0 16.03 ? 258 A 1 +ATOM 4527 C CG1 . ILE A1 1 268 ? 7.561 18.431 -11.768 1.0 17.52 ? 258 A 1 +ATOM 4528 C CG2 . ILE A1 1 268 ? 8.602 20.509 -12.711 1.0 18.79 ? 258 A 1 +ATOM 4529 C CD1 . ILE A1 1 268 ? 8.348 17.322 -12.435 1.0 18.43 ? 258 A 1 +ATOM 4530 H H . ILE A1 1 268 ? 4.998 18.952 -12.667 1.0 18.15 ? 258 A 1 +ATOM 4531 H HA . ILE A1 1 268 ? 6.294 20.605 -11.108 1.0 19.49 ? 258 A 1 +ATOM 4532 H HB . ILE A1 1 268 ? 7.076 19.391 -13.538 1.0 19.24 ? 258 A 1 +ATOM 4533 H HG12 . ILE A1 1 268 ? 8.057 18.707 -10.982 1.0 21.02 ? 258 A 1 +ATOM 4534 H HG13 . ILE A1 1 268 ? 6.703 18.061 -11.506 1.0 21.02 ? 258 A 1 +ATOM 4535 H HG21 . ILE A1 1 268 ? 9.355 19.926 -12.892 1.0 22.54 ? 258 A 1 +ATOM 4536 H HG22 . ILE A1 1 268 ? 8.509 21.161 -13.424 1.0 22.54 ? 258 A 1 +ATOM 4537 H HG23 . ILE A1 1 268 ? 8.731 20.963 -11.864 1.0 22.54 ? 258 A 1 +ATOM 4538 H HD11 . ILE A1 1 268 ? 8.408 16.568 -11.827 1.0 22.12 ? 258 A 1 +ATOM 4539 H HD12 . ILE A1 1 268 ? 7.892 17.056 -13.248 1.0 22.12 ? 258 A 1 +ATOM 4540 H HD13 . ILE A1 1 268 ? 9.237 17.648 -12.646 1.0 22.12 ? 258 A 1 +ATOM 4541 N N . LEU A1 1 269 ? 5.433 21.932 -13.886 1.0 16.05 ? 259 A 1 +ATOM 4542 C CA . LEU A1 1 269 ? 5.29 23.21 -14.589 1.0 16.32 ? 259 A 1 +ATOM 4543 C C . LEU A1 1 269 ? 4.254 24.122 -13.943 1.0 17.65 ? 259 A 1 +ATOM 4544 O O . LEU A1 1 269 ? 4.425 25.359 -13.955 1.0 18.64 ? 259 A 1 +ATOM 4545 C CB . LEU A1 1 269 ? 4.925 22.948 -16.04 1.0 17.71 ? 259 A 1 +ATOM 4546 C CG . LEU A1 1 269 ? 6.033 22.365 -16.923 1.0 17.72 ? 259 A 1 +ATOM 4547 C CD1 . LEU A1 1 269 ? 5.445 21.846 -18.221 1.0 21.07 ? 259 A 1 +ATOM 4548 C CD2 . LEU A1 1 269 ? 7.041 23.408 -17.207 1.0 22.51 ? 259 A 1 +ATOM 4549 H H . LEU A1 1 269 ? 5.126 21.258 -14.323 1.0 19.26 ? 259 A 1 +ATOM 4550 H HA . LEU A1 1 269 ? 6.14 23.676 -14.557 1.0 19.58 ? 259 A 1 +ATOM 4551 H HB2 . LEU A1 1 269 ? 4.186 22.32 -16.057 1.0 21.25 ? 259 A 1 +ATOM 4552 H HB3 . LEU A1 1 269 ? 4.654 23.789 -16.44 1.0 21.25 ? 259 A 1 +ATOM 4553 H HG . LEU A1 1 269 ? 6.464 21.627 -16.464 1.0 21.27 ? 259 A 1 +ATOM 4554 H HD11 . LEU A1 1 269 ? 6.16 21.493 -18.773 1.0 25.28 ? 259 A 1 +ATOM 4555 H HD12 . LEU A1 1 269 ? 4.806 21.145 -18.02 1.0 25.28 ? 259 A 1 +ATOM 4556 H HD13 . LEU A1 1 269 ? 5.002 22.576 -18.681 1.0 25.28 ? 259 A 1 +ATOM 4557 H HD21 . LEU A1 1 269 ? 7.708 23.047 -17.812 1.0 27.02 ? 259 A 1 +ATOM 4558 H HD22 . LEU A1 1 269 ? 6.601 24.17 -17.616 1.0 27.02 ? 259 A 1 +ATOM 4559 H HD23 . LEU A1 1 269 ? 7.46 23.677 -16.374 1.0 27.02 ? 259 A 1 +ATOM 4560 N N . LEU A1 1 270 ? 3.195 23.54 -13.377 1.0 16.52 ? 260 A 1 +ATOM 4561 C CA . LEU A1 1 270 ? 2.019 24.28 -12.871 1.0 17.56 ? 260 A 1 +ATOM 4562 C C . LEU A1 1 270 ? 1.754 23.779 -11.456 1.0 15.42 ? 260 A 1 +ATOM 4563 O O . LEU A1 1 270 ? 0.823 23.03 -11.205 1.0 15.49 ? 260 A 1 +ATOM 4564 C CB . LEU A1 1 270 ? 0.792 24.032 -13.77 1.0 15.52 ? 260 A 1 +ATOM 4565 C CG . LEU A1 1 270 ? 0.903 24.625 -15.181 1.0 17.5 ? 260 A 1 +ATOM 4566 C CD1 . LEU A1 1 270 ? -0.326 24.214 -15.98 1.0 20.15 ? 260 A 1 +ATOM 4567 C CD2 . LEU A1 1 270 ? 1.095 26.14 -15.168 1.0 20.99 ? 260 A 1 +ATOM 4568 H H . LEU A1 1 270 ? 3.125 22.69 -13.267 1.0 19.82 ? 260 A 1 +ATOM 4569 H HA . LEU A1 1 270 ? 2.203 25.233 -12.851 1.0 21.07 ? 260 A 1 +ATOM 4570 H HB2 . LEU A1 1 270 ? 0.667 23.075 -13.863 1.0 18.62 ? 260 A 1 +ATOM 4571 H HB3 . LEU A1 1 270 ? 0.015 24.428 -13.346 1.0 18.62 ? 260 A 1 +ATOM 4572 H HG . LEU A1 1 270 ? 1.697 24.275 -15.615 1.0 21.0 ? 260 A 1 +ATOM 4573 H HD11 . LEU A1 1 270 ? -0.261 24.586 -16.873 1.0 24.18 ? 260 A 1 +ATOM 4574 H HD12 . LEU A1 1 270 ? -0.363 23.246 -16.027 1.0 24.18 ? 260 A 1 +ATOM 4575 H HD13 . LEU A1 1 270 ? -1.119 24.554 -15.537 1.0 24.18 ? 260 A 1 +ATOM 4576 H HD21 . LEU A1 1 270 ? 1.0 26.478 -16.072 1.0 25.19 ? 260 A 1 +ATOM 4577 H HD22 . LEU A1 1 270 ? 0.423 26.539 -14.594 1.0 25.19 ? 260 A 1 +ATOM 4578 H HD23 . LEU A1 1 270 ? 1.981 26.344 -14.83 1.0 25.19 ? 260 A 1 +ATOM 4579 N N . PRO A1 1 271 ? 2.549 24.241 -10.494 1.0 15.88 ? 261 A 1 +ATOM 4580 C CA . PRO A1 1 271 ? 2.541 23.61 -9.162 1.0 16.75 ? 261 A 1 +ATOM 4581 C C . PRO A1 1 271 ? 1.273 23.665 -8.382 1.0 15.59 ? 261 A 1 +ATOM 4582 O O . PRO A1 1 271 ? 1.025 22.774 -7.554 1.0 16.71 ? 261 A 1 +ATOM 4583 C CB . PRO A1 1 271 ? 3.66 24.344 -8.405 1.0 16.95 ? 261 A 1 +ATOM 4584 C CG . PRO A1 1 271 ? 4.611 24.736 -9.481 1.0 19.49 ? 261 A 1 +ATOM 4585 C CD . PRO A1 1 271 ? 3.702 25.144 -10.626 1.0 18.06 ? 261 A 1 +ATOM 4586 H HA . PRO A1 1 271 ? 2.761 22.676 -9.305 1.0 20.1 ? 261 A 1 +ATOM 4587 H HB2 . PRO A1 1 271 ? 3.302 25.123 -7.95 1.0 20.34 ? 261 A 1 +ATOM 4588 H HB3 . PRO A1 1 271 ? 4.078 23.748 -7.764 1.0 20.34 ? 261 A 1 +ATOM 4589 H HG2 . PRO A1 1 271 ? 5.163 25.477 -9.188 1.0 23.39 ? 261 A 1 +ATOM 4590 H HG3 . PRO A1 1 271 ? 5.17 23.982 -9.727 1.0 23.39 ? 261 A 1 +ATOM 4591 H HD2 . PRO A1 1 271 ? 3.427 26.069 -10.532 1.0 21.67 ? 261 A 1 +ATOM 4592 H HD3 . PRO A1 1 271 ? 4.145 25.014 -11.479 1.0 21.67 ? 261 A 1 +ATOM 4593 N N . ASP A1 1 272 ? 0.449 24.68 -8.574 1.0 17.36 ? 262 A 1 +ATOM 4594 C CA . ASP A1 1 272 ? -0.782 24.784 -7.796 1.0 17.2 ? 262 A 1 +ATOM 4595 C C . ASP A1 1 272 ? -2.019 24.507 -8.639 1.0 18.55 ? 262 A 1 +ATOM 4596 O O . ASP A1 1 272 ? -3.138 24.774 -8.223 1.0 16.96 ? 262 A 1 +ATOM 4597 C CB . ASP A1 1 272 ? -0.827 26.066 -6.951 1.0 19.97 ? 262 A 1 +ATOM 4598 C CG . ASP A1 1 272 ? -0.625 27.299 -7.75 1.0 21.56 ? 262 A 1 +ATOM 4599 O OD1 . ASP A1 1 272 ? -0.97 27.272 -8.956 1.0 20.83 ? 262 A 1 +ATOM 4600 O OD2 . ASP A1 1 272 ? -0.14 28.268 -7.168 1.0 21.98 ? 262 A 1 +ATOM 4601 H H . ASP A1 1 272 ? 0.576 25.314 -9.141 1.0 20.83 ? 262 A 1 +ATOM 4602 H HA . ASP A1 1 272 ? -0.792 24.091 -7.117 1.0 20.64 ? 262 A 1 +ATOM 4603 H HB2 . ASP A1 1 272 ? -1.694 26.129 -6.52 1.0 23.97 ? 262 A 1 +ATOM 4604 H HB3 . ASP A1 1 272 ? -0.126 26.027 -6.281 1.0 23.97 ? 262 A 1 +ATOM 4605 N N . SER A1 1 273 ? -1.862 23.908 -9.817 1.0 15.44 ? 263 A 1 +ATOM 4606 C CA . SER A1 1 273 ? -3.03 23.541 -10.638 1.0 15.24 ? 263 A 1 +ATOM 4607 C C . SER A1 1 273 ? -3.768 22.331 -10.08 1.0 14.61 ? 263 A 1 +ATOM 4608 O O . SER A1 1 273 ? -3.241 21.541 -9.285 1.0 15.13 ? 263 A 1 +ATOM 4609 C CB . SER A1 1 273 ? -2.596 23.224 -12.068 1.0 15.9 ? 263 A 1 +ATOM 4610 O OG . SER A1 1 273 ? -1.669 22.113 -12.132 1.0 18.77 ? 263 A 1 +ATOM 4611 H H . SER A1 1 273 ? -1.103 23.704 -10.166 1.0 18.52 ? 263 A 1 +ATOM 4612 H HA . SER A1 1 273 ? -3.642 24.294 -10.639 1.0 18.29 ? 263 A 1 +ATOM 4613 H HB2 . SER A1 1 273 ? -3.384 22.999 -12.587 1.0 19.08 ? 263 A 1 +ATOM 4614 H HB3 . SER A1 1 273 ? -2.165 24.009 -12.442 1.0 19.08 ? 263 A 1 +ATOM 4615 H HG . SER A1 1 273 ? -0.968 22.3 -11.708 1.0 22.53 ? 263 A 1 +ATOM 4616 N N . ASN A1 1 274 ? -5.001 22.185 -10.493 1.0 13.48 ? 264 A 1 +ATOM 4617 C CA . ASN A1 1 274 ? -5.797 21.014 -10.194 1.0 13.35 ? 264 A 1 +ATOM 4618 C C . ASN A1 1 274 ? -5.662 20.005 -11.318 1.0 13.33 ? 264 A 1 +ATOM 4619 O O . ASN A1 1 274 ? -5.957 20.312 -12.478 1.0 14.59 ? 264 A 1 +ATOM 4620 C CB . ASN A1 1 274 ? -7.253 21.39 -9.955 1.0 13.83 ? 264 A 1 +ATOM 4621 C CG . ASN A1 1 274 ? -7.478 21.941 -8.583 1.0 14.04 ? 264 A 1 +ATOM 4622 O OD1 . ASN A1 1 274 ? -6.833 21.52 -7.615 1.0 15.23 ? 264 A 1 +ATOM 4623 N ND2 . ASN A1 1 274 ? -8.408 22.881 -8.473 1.0 16.21 ? 264 A 1 +ATOM 4624 H H . ASN A1 1 274 ? -5.419 22.769 -10.966 1.0 16.18 ? 264 A 1 +ATOM 4625 H HA . ASN A1 1 274 ? -5.464 20.599 -9.383 1.0 16.02 ? 264 A 1 +ATOM 4626 H HB2 . ASN A1 1 274 ? -7.517 22.065 -10.599 1.0 16.59 ? 264 A 1 +ATOM 4627 H HB3 . ASN A1 1 274 ? -7.807 20.6 -10.057 1.0 16.59 ? 264 A 1 +ATOM 4628 H HD21 . ASN A1 1 274 ? -8.576 23.232 -7.705 1.0 19.46 ? 264 A 1 +ATOM 4629 H HD22 . ASN A1 1 274 ? -8.842 23.14 -9.168 1.0 19.46 ? 264 A 1 +ATOM 4630 N N . ILE A1 1 275 ? -5.185 18.819 -11.03 1.0 12.42 ? 265 A 1 +ATOM 4631 C CA . ILE A1 1 275 ? -4.823 17.802 -12.017 1.0 12.2 ? 265 A 1 +ATOM 4632 C C . ILE A1 1 275 ? -5.546 16.51 -11.678 1.0 12.56 ? 265 A 1 +ATOM 4633 O O . ILE A1 1 275 ? -5.169 15.833 -10.706 1.0 13.06 ? 265 A 1 +ATOM 4634 C CB . ILE A1 1 275 ? -3.33 17.593 -12.048 1.0 12.96 ? 265 A 1 +ATOM 4635 C CG1 . ILE A1 1 275 ? -2.592 18.86 -12.41 1.0 14.75 ? 265 A 1 +ATOM 4636 C CG2 . ILE A1 1 275 ? -2.972 16.505 -13.067 1.0 15.01 ? 265 A 1 +ATOM 4637 C CD1 . ILE A1 1 275 ? -1.072 18.794 -12.379 1.0 15.24 ? 265 A 1 +ATOM 4638 H H . ILE A1 1 275 ? -5.048 18.552 -10.225 1.0 14.91 ? 265 A 1 +ATOM 4639 H HA . ILE A1 1 275 ? -5.115 18.092 -12.895 1.0 14.64 ? 265 A 1 +ATOM 4640 H HB . ILE A1 1 275 ? -3.062 17.324 -11.156 1.0 15.55 ? 265 A 1 +ATOM 4641 H HG12 . ILE A1 1 275 ? -2.848 19.11 -13.312 1.0 17.7 ? 265 A 1 +ATOM 4642 H HG13 . ILE A1 1 275 ? -2.859 19.553 -11.786 1.0 17.7 ? 265 A 1 +ATOM 4643 H HG21 . ILE A1 1 275 ? -2.006 16.449 -13.143 1.0 18.01 ? 265 A 1 +ATOM 4644 H HG22 . ILE A1 1 275 ? -3.329 15.657 -12.762 1.0 18.01 ? 265 A 1 +ATOM 4645 H HG23 . ILE A1 1 275 ? -3.359 16.737 -13.926 1.0 18.01 ? 265 A 1 +ATOM 4646 H HD11 . ILE A1 1 275 ? -0.715 19.696 -12.406 1.0 18.28 ? 265 A 1 +ATOM 4647 H HD12 . ILE A1 1 275 ? -0.791 18.352 -11.563 1.0 18.28 ? 265 A 1 +ATOM 4648 H HD13 . ILE A1 1 275 ? -0.762 18.293 -13.15 1.0 18.28 ? 265 A 1 +ATOM 4649 N N . PRO A1 1 276 ? -6.57 16.092 -12.409 1.0 12.3 ? 266 A 1 +ATOM 4650 C CA . PRO A1 1 276 ? -7.219 14.814 -12.132 1.0 13.02 ? 266 A 1 +ATOM 4651 C C . PRO A1 1 276 ? -6.368 13.626 -12.5 1.0 13.21 ? 266 A 1 +ATOM 4652 O O . PRO A1 1 276 ? -5.577 13.651 -13.441 1.0 13.49 ? 266 A 1 +ATOM 4653 C CB . PRO A1 1 276 ? -8.5 14.838 -12.954 1.0 14.14 ? 266 A 1 +ATOM 4654 C CG . PRO A1 1 276 ? -8.188 15.795 -14.025 1.0 16.17 ? 266 A 1 +ATOM 4655 C CD . PRO A1 1 276 ? -7.327 16.894 -13.375 1.0 13.75 ? 266 A 1 +ATOM 4656 H HA . PRO A1 1 276 ? -7.44 14.774 -11.188 1.0 15.62 ? 266 A 1 +ATOM 4657 H HB2 . PRO A1 1 276 ? -8.689 13.956 -13.311 1.0 16.96 ? 266 A 1 +ATOM 4658 H HB3 . PRO A1 1 276 ? -9.244 15.143 -12.411 1.0 16.96 ? 266 A 1 +ATOM 4659 H HG2 . PRO A1 1 276 ? -7.696 15.347 -14.73 1.0 19.41 ? 266 A 1 +ATOM 4660 H HG3 . PRO A1 1 276 ? -9.01 16.168 -14.379 1.0 19.41 ? 266 A 1 +ATOM 4661 H HD2 . PRO A1 1 276 ? -6.742 17.319 -14.022 1.0 16.5 ? 266 A 1 +ATOM 4662 H HD3 . PRO A1 1 276 ? -7.874 17.562 -12.933 1.0 16.5 ? 266 A 1 +ATOM 4663 N N . ALA A1 1 277 ? -6.585 12.539 -11.795 1.0 12.69 ? 267 A 1 +ATOM 4664 C CA . ALA A1 1 277 ? -6.215 11.204 -12.226 1.0 11.97 ? 267 A 1 +ATOM 4665 C C . ALA A1 1 277 ? -7.419 10.72 -13.015 1.0 12.43 ? 267 A 1 +ATOM 4666 O O . ALA A1 1 277 ? -8.467 10.375 -12.44 1.0 13.7 ? 267 A 1 +ATOM 4667 C CB . ALA A1 1 277 ? -5.963 10.325 -10.998 1.0 13.65 ? 267 A 1 +ATOM 4668 H H . ALA A1 1 277 ? -6.964 12.544 -11.023 1.0 15.23 ? 267 A 1 +ATOM 4669 H HA . ALA A1 1 277 ? -5.415 11.192 -12.774 1.0 14.37 ? 267 A 1 +ATOM 4670 H HB1 . ALA A1 1 277 ? -5.711 9.436 -11.292 1.0 16.38 ? 267 A 1 +ATOM 4671 H HB2 . ALA A1 1 277 ? -5.247 10.715 -10.472 1.0 16.38 ? 267 A 1 +ATOM 4672 H HB3 . ALA A1 1 277 ? -6.775 10.281 -10.469 1.0 16.38 ? 267 A 1 +ATOM 4673 N N . THR A1 1 278 ? -7.32 10.784 -14.353 1.0 12.91 ? 268 A 1 +ATOM 4674 C CA . THR A1 1 278 ? -8.499 10.678 -15.205 1.0 12.95 ? 268 A 1 +ATOM 4675 C C . THR A1 1 278 ? -9.029 9.252 -15.281 1.0 13.14 ? 268 A 1 +ATOM 4676 O O . THR A1 1 278 ? -8.33 8.261 -15.088 1.0 13.18 ? 268 A 1 +ATOM 4677 C CB . THR A1 1 278 ? -8.23 11.27 -16.591 1.0 13.72 ? 268 A 1 +ATOM 4678 O OG1 . THR A1 1 278 ? -7.208 10.503 -17.195 1.0 14.72 ? 268 A 1 +ATOM 4679 C CG2 A THR A1 1 278 ? -7.936 12.732 -16.527 1.0 14.33 ? 268 A 1 +ATOM 4680 H H . THR A1 1 278 ? -6.582 10.888 -14.783 1.0 15.49 ? 268 A 1 +ATOM 4681 H HA . THR A1 1 278 ? -9.214 11.202 -14.812 1.0 15.54 ? 268 A 1 +ATOM 4682 H HB A THR A1 1 278 ? -9.017 11.224 -17.157 1.0 16.47 ? 268 A 1 +ATOM 4683 H HG1 . THR A1 1 278 ? -6.983 10.85 -17.926 1.0 17.66 ? 268 A 1 +ATOM 4684 H HG21 A THR A1 1 278 ? -8.334 13.184 -17.286 1.0 17.19 ? 268 A 1 +ATOM 4685 H HG22 A THR A1 1 278 ? -8.3 13.108 -15.71 1.0 17.19 ? 268 A 1 +ATOM 4686 H HG23 A THR A1 1 278 ? -6.977 12.878 -16.54 1.0 17.19 ? 268 A 1 +ATOM 4687 N N . THR A1 1 279 ? -10.306 9.189 -15.712 1.0 13.77 ? 269 A 1 +ATOM 4688 C CA . THR A1 1 279 ? -10.97 7.892 -15.956 1.0 14.71 ? 269 A 1 +ATOM 4689 C C . THR A1 1 279 ? -10.146 7.031 -16.892 1.0 15.36 ? 269 A 1 +ATOM 4690 O O . THR A1 1 279 ? -10.026 5.835 -16.695 1.0 15.99 ? 269 A 1 +ATOM 4691 C CB . THR A1 1 279 ? -12.325 8.141 -16.621 1.0 16.27 ? 269 A 1 +ATOM 4692 O OG1 . THR A1 1 279 ? -12.985 9.243 -16.025 1.0 16.63 ? 269 A 1 +ATOM 4693 C CG2 . THR A1 1 279 ? -13.195 6.909 -16.56 1.0 18.38 ? 269 A 1 +ATOM 4694 H H . THR A1 1 279 ? -10.803 9.874 -15.868 1.0 16.53 ? 269 A 1 +ATOM 4695 H HA . THR A1 1 279 ? -11.088 7.436 -15.108 1.0 17.65 ? 269 A 1 +ATOM 4696 H HB . THR A1 1 279 ? -12.176 8.351 -17.557 1.0 19.53 ? 269 A 1 +ATOM 4697 H HG1 . THR A1 1 279 ? -13.782 9.278 -16.29 1.0 19.95 ? 269 A 1 +ATOM 4698 H HG21 . THR A1 1 279 ? -14.063 7.095 -16.952 1.0 22.05 ? 269 A 1 +ATOM 4699 H HG22 . THR A1 1 279 ? -12.778 6.183 -17.05 1.0 22.05 ? 269 A 1 +ATOM 4700 H HG23 . THR A1 1 279 ? -13.319 6.635 -15.638 1.0 22.05 ? 269 A 1 +ATOM 4701 N N . ALA A1 1 280 ? -9.55 7.633 -17.928 1.0 14.55 ? 270 A 1 +ATOM 4702 C CA . ALA A1 1 280 ? -8.787 6.849 -18.891 1.0 15.65 ? 270 A 1 +ATOM 4703 C C . ALA A1 1 280 ? -7.552 6.229 -18.275 1.0 16.81 ? 270 A 1 +ATOM 4704 O O . ALA A1 1 280 ? -7.164 5.137 -18.647 1.0 16.53 ? 270 A 1 +ATOM 4705 C CB . ALA A1 1 280 ? -8.468 7.765 -20.079 1.0 15.62 ? 270 A 1 +ATOM 4706 H H . ALA A1 1 280 ? -9.574 8.477 -18.089 1.0 17.47 ? 270 A 1 +ATOM 4707 H HA . ALA A1 1 280 ? -9.306 6.097 -19.217 1.0 18.78 ? 270 A 1 +ATOM 4708 H HB1 . ALA A1 1 280 ? -7.966 7.262 -20.74 1.0 18.74 ? 270 A 1 +ATOM 4709 H HB2 . ALA A1 1 280 ? -9.299 8.082 -20.466 1.0 18.74 ? 270 A 1 +ATOM 4710 H HB3 . ALA A1 1 280 ? -7.941 8.517 -19.766 1.0 18.74 ? 270 A 1 +ATOM 4711 N N . MET A1 1 281 ? -6.944 6.887 -17.29 1.0 15.76 ? 271 A 1 +ATOM 4712 C CA . MET A1 1 281 ? -5.834 6.261 -16.569 1.0 15.39 ? 271 A 1 +ATOM 4713 C C . MET A1 1 281 ? -6.272 5.049 -15.769 1.0 15.97 ? 271 A 1 +ATOM 4714 O O . MET A1 1 281 ? -5.547 4.048 -15.692 1.0 18.64 ? 271 A 1 +ATOM 4715 C CB . MET A1 1 281 ? -5.153 7.28 -15.638 1.0 15.63 ? 271 A 1 +ATOM 4716 C CG . MET A1 1 281 ? -4.448 8.412 -16.331 1.0 17.55 ? 271 A 1 +ATOM 4717 S SD . MET A1 1 281 ? -3.069 7.807 -17.359 1.0 16.67 ? 271 A 1 +ATOM 4718 C CE . MET A1 1 281 ? -1.645 8.216 -16.337 1.0 16.3 ? 271 A 1 +ATOM 4719 H H . MET A1 1 281 ? -7.149 7.679 -17.024 1.0 18.91 ? 271 A 1 +ATOM 4720 H HA . MET A1 1 281 ? -5.189 5.974 -17.234 1.0 18.47 ? 271 A 1 +ATOM 4721 H HB2 . MET A1 1 281 ? -5.831 7.67 -15.063 1.0 18.75 ? 271 A 1 +ATOM 4722 H HB3 . MET A1 1 281 ? -4.493 6.813 -15.103 1.0 18.75 ? 271 A 1 +ATOM 4723 H HG2 . MET A1 1 281 ? -5.076 8.878 -16.905 1.0 21.07 ? 271 A 1 +ATOM 4724 H HG3 . MET A1 1 281 ? -4.09 9.022 -15.667 1.0 21.07 ? 271 A 1 +ATOM 4725 H HE1 . MET A1 1 281 ? -0.838 7.918 -16.785 1.0 19.56 ? 271 A 1 +ATOM 4726 H HE2 . MET A1 1 281 ? -1.616 9.176 -16.206 1.0 19.56 ? 271 A 1 +ATOM 4727 H HE3 . MET A1 1 281 ? -1.733 7.768 -15.48 1.0 19.56 ? 271 A 1 +ATOM 4728 N N . GLY A1 1 282 ? -7.483 5.109 -15.224 1.0 16.45 ? 272 A 1 +ATOM 4729 C CA . GLY A1 1 282 ? -8.024 3.945 -14.527 1.0 17.01 ? 272 A 1 +ATOM 4730 C C . GLY A1 1 282 ? -8.476 2.835 -15.436 1.0 18.4 ? 272 A 1 +ATOM 4731 O O . GLY A1 1 282 ? -8.555 1.675 -15.03 1.0 20.56 ? 272 A 1 +ATOM 4732 H H . GLY A1 1 282 ? -8.001 5.795 -15.242 1.0 19.75 ? 272 A 1 +ATOM 4733 H HA2 . GLY A1 1 282 ? -7.342 3.588 -13.937 1.0 20.41 ? 272 A 1 +ATOM 4734 H HA3 . GLY A1 1 282 ? -8.787 4.224 -13.996 1.0 20.41 ? 272 A 1 +ATOM 4735 N N . THR A1 1 283 ? -8.795 3.183 -16.676 1.0 17.17 ? 273 A 1 +ATOM 4736 C CA . THR A1 1 283 ? -9.219 2.19 -17.66 1.0 16.82 ? 273 A 1 +ATOM 4737 C C . THR A1 1 283 ? -8.025 1.422 -18.183 1.0 19.02 ? 273 A 1 +ATOM 4738 O O . THR A1 1 283 ? -8.078 0.201 -18.341 1.0 21.4 ? 273 A 1 +ATOM 4739 C CB . THR A1 1 283 ? -9.925 2.91 -18.803 1.0 16.62 ? 273 A 1 +ATOM 4740 O OG1 . THR A1 1 283 ? -11.087 3.569 -18.318 1.0 18.85 ? 273 A 1 +ATOM 4741 C CG2 . THR A1 1 283 ? -10.329 1.963 -19.891 1.0 18.97 ? 273 A 1 +ATOM 4742 H H . THR A1 1 283 ? -8.776 3.989 -16.976 1.0 20.61 ? 273 A 1 +ATOM 4743 H HA . THR A1 1 283 ? -9.837 1.558 -17.26 1.0 20.19 ? 273 A 1 +ATOM 4744 H HB . THR A1 1 283 ? -9.308 3.557 -19.179 1.0 19.94 ? 273 A 1 +ATOM 4745 H HG1 . THR A1 1 283 ? -10.872 4.148 -17.75 1.0 22.62 ? 273 A 1 +ATOM 4746 H HG21 . THR A1 1 283 ? -10.953 2.397 -20.494 1.0 22.76 ? 273 A 1 +ATOM 4747 H HG22 . THR A1 1 283 ? -9.549 1.683 -20.394 1.0 22.76 ? 273 A 1 +ATOM 4748 H HG23 . THR A1 1 283 ? -10.754 1.18 -19.508 1.0 22.76 ? 273 A 1 +ATOM 4749 N N . ILE A1 1 284 ? -6.925 2.108 -18.44 1.0 18.39 ? 274 A 1 +ATOM 4750 C CA . ILE A1 1 284 ? -5.809 1.475 -19.127 1.0 19.59 ? 274 A 1 +ATOM 4751 C C . ILE A1 1 284 ? -5.02 0.531 -18.257 1.0 18.37 ? 274 A 1 +ATOM 4752 O O . ILE A1 1 284 ? -4.469 -0.461 -18.754 1.0 21.77 ? 274 A 1 +ATOM 4753 C CB . ILE A1 1 284 ? -4.92 2.544 -19.81 1.0 19.92 ? 274 A 1 +ATOM 4754 C CG1 . ILE A1 1 284 ? -3.993 1.922 -20.824 1.0 21.16 ? 274 A 1 +ATOM 4755 C CG2 . ILE A1 1 284 ? -4.126 3.351 -18.818 1.0 19.22 ? 274 A 1 +ATOM 4756 C CD1 . ILE A1 1 284 ? -3.238 2.961 -21.651 1.0 24.07 ? 274 A 1 +ATOM 4757 H H . ILE A1 1 284 ? -6.797 2.932 -18.23 1.0 22.06 ? 274 A 1 +ATOM 4758 H HA . ILE A1 1 284 ? -6.186 0.914 -19.822 1.0 23.51 ? 274 A 1 +ATOM 4759 H HB . ILE A1 1 284 ? -5.528 3.146 -20.266 1.0 23.91 ? 274 A 1 +ATOM 4760 H HG12 . ILE A1 1 284 ? -3.339 1.375 -20.36 1.0 25.4 ? 274 A 1 +ATOM 4761 H HG13 . ILE A1 1 284 ? -4.512 1.374 -21.432 1.0 25.4 ? 274 A 1 +ATOM 4762 H HG21 . ILE A1 1 284 ? -3.789 4.147 -19.257 1.0 23.06 ? 274 A 1 +ATOM 4763 H HG22 . ILE A1 1 284 ? -4.703 3.599 -18.079 1.0 23.06 ? 274 A 1 +ATOM 4764 H HG23 . ILE A1 1 284 ? -3.386 2.814 -18.494 1.0 23.06 ? 274 A 1 +ATOM 4765 H HD11 . ILE A1 1 284 ? -2.759 2.511 -22.365 1.0 28.88 ? 274 A 1 +ATOM 4766 H HD12 . ILE A1 1 284 ? -3.874 3.59 -22.026 1.0 28.88 ? 274 A 1 +ATOM 4767 H HD13 . ILE A1 1 284 ? -2.611 3.428 -21.076 1.0 28.88 ? 274 A 1 +ATOM 4768 N N . VAL A1 1 285 ? -4.88 0.779 -16.956 1.0 17.22 ? 275 A 1 +ATOM 4769 C CA . VAL A1 1 285 ? -4.087 -0.03 -16.051 1.0 17.72 ? 275 A 1 +ATOM 4770 C C . VAL A1 1 285 ? -4.913 -0.22 -14.789 1.0 17.65 ? 275 A 1 +ATOM 4771 O O . VAL A1 1 285 ? -5.488 0.773 -14.277 1.0 17.53 ? 275 A 1 +ATOM 4772 C CB . VAL A1 1 285 ? -2.771 0.685 -15.701 1.0 18.41 ? 275 A 1 +ATOM 4773 C CG1 . VAL A1 1 285 ? -2.102 0.093 -14.477 1.0 25.1 ? 275 A 1 +ATOM 4774 C CG2 . VAL A1 1 285 ? -1.83 0.615 -16.913 1.0 22.38 ? 275 A 1 +ATOM 4775 H H . VAL A1 1 285 ? -5.255 1.444 -16.561 1.0 20.66 ? 275 A 1 +ATOM 4776 H HA . VAL A1 1 285 ? -3.886 -0.888 -16.457 1.0 21.26 ? 275 A 1 +ATOM 4777 H HB . VAL A1 1 285 ? -2.969 1.61 -15.485 1.0 22.09 ? 275 A 1 +ATOM 4778 H HG11 . VAL A1 1 285 ? -1.174 0.374 -14.458 1.0 30.12 ? 275 A 1 +ATOM 4779 H HG12 . VAL A1 1 285 ? -2.56 0.409 -13.682 1.0 30.12 ? 275 A 1 +ATOM 4780 H HG13 . VAL A1 1 285 ? -2.153 -0.874 -14.526 1.0 30.12 ? 275 A 1 +ATOM 4781 H HG21 . VAL A1 1 285 ? -1.016 1.101 -16.71 1.0 26.86 ? 275 A 1 +ATOM 4782 H HG22 . VAL A1 1 285 ? -1.622 -0.314 -17.099 1.0 26.86 ? 275 A 1 +ATOM 4783 H HG23 . VAL A1 1 285 ? -2.271 1.014 -17.679 1.0 26.86 ? 275 A 1 +ATOM 4784 N N . PRO A1 1 286 ? -4.981 -1.429 -14.225 1.0 16.97 ? 276 A 1 +ATOM 4785 C CA . PRO A1 1 286 ? -5.651 -1.585 -12.928 1.0 18.17 ? 276 A 1 +ATOM 4786 C C . PRO A1 1 286 ? -4.927 -0.816 -11.844 1.0 19.02 ? 276 A 1 +ATOM 4787 O O . PRO A1 1 286 ? -3.734 -0.981 -11.665 1.0 23.02 ? 276 A 1 +ATOM 4788 C CB . PRO A1 1 286 ? -5.608 -3.107 -12.683 1.0 21.38 ? 276 A 1 +ATOM 4789 C CG . PRO A1 1 286 ? -5.284 -3.711 -13.989 1.0 24.09 ? 276 A 1 +ATOM 4790 C CD . PRO A1 1 286 ? -4.459 -2.724 -14.731 1.0 18.15 ? 276 A 1 +ATOM 4791 H HA . PRO A1 1 286 ? -6.573 -1.29 -12.98 1.0 21.8 ? 276 A 1 +ATOM 4792 H HB2 . PRO A1 1 286 ? -4.923 -3.314 -12.028 1.0 25.66 ? 276 A 1 +ATOM 4793 H HB3 . PRO A1 1 286 ? -6.472 -3.412 -12.366 1.0 25.66 ? 276 A 1 +ATOM 4794 H HG2 . PRO A1 1 286 ? -4.788 -4.533 -13.85 1.0 28.91 ? 276 A 1 +ATOM 4795 H HG3 . PRO A1 1 286 ? -6.105 -3.897 -14.471 1.0 28.91 ? 276 A 1 +ATOM 4796 H HD2 . PRO A1 1 286 ? -3.518 -2.827 -14.519 1.0 21.78 ? 276 A 1 +ATOM 4797 H HD3 . PRO A1 1 286 ? -4.595 -2.805 -15.688 1.0 21.78 ? 276 A 1 +ATOM 4798 N N . GLY A1 1 287 ? -5.652 0.048 -11.162 1.0 17.95 ? 277 A 1 +ATOM 4799 C CA . GLY A1 1 287 ? -5.012 0.923 -10.206 1.0 18.93 ? 277 A 1 +ATOM 4800 C C . GLY A1 1 287 ? -4.386 2.16 -10.8 1.0 15.41 ? 277 A 1 +ATOM 4801 O O . GLY A1 1 287 ? -3.592 2.852 -10.158 1.0 17.62 ? 277 A 1 +ATOM 4802 H H . GLY A1 1 287 ? -6.504 0.145 -11.233 1.0 21.54 ? 277 A 1 +ATOM 4803 H HA2 . GLY A1 1 287 ? -5.673 1.209 -9.556 1.0 22.72 ? 277 A 1 +ATOM 4804 H HA3 . GLY A1 1 287 ? -4.314 0.428 -9.751 1.0 22.72 ? 277 A 1 +ATOM 4805 N N . GLY A1 1 288 ? -4.659 2.458 -12.065 1.0 15.63 ? 278 A 1 +ATOM 4806 C CA . GLY A1 1 288 ? -4.02 3.559 -12.74 1.0 16.22 ? 278 A 1 +ATOM 4807 C C . GLY A1 1 288 ? -4.262 4.906 -12.096 1.0 14.21 ? 278 A 1 +ATOM 4808 O O . GLY A1 1 288 ? -3.377 5.749 -12.11 1.0 13.68 ? 278 A 1 +ATOM 4809 H H . GLY A1 1 288 ? -5.219 2.029 -12.556 1.0 18.76 ? 278 A 1 +ATOM 4810 H HA2 . GLY A1 1 288 ? -3.062 3.405 -12.756 1.0 19.46 ? 278 A 1 +ATOM 4811 H HA3 . GLY A1 1 288 ? -4.348 3.602 -13.652 1.0 19.46 ? 278 A 1 +ATOM 4812 N N . ARG A1 1 289 ? -5.482 5.131 -11.585 1.0 14.48 ? 279 A 1 +ATOM 4813 C CA A ARG A1 1 289 ? -5.746 6.421 -10.943 0.57 14.11 ? 279 A 1 +ATOM 4814 C CA B ARG A1 1 289 ? -5.74 6.42 -10.944 0.43 14.27 ? 279 A 1 +ATOM 4815 C C . ARG A1 1 289 ? -4.972 6.562 -9.641 1.0 14.43 ? 279 A 1 +ATOM 4816 O O . ARG A1 1 289 ? -4.432 7.636 -9.374 1.0 15.23 ? 279 A 1 +ATOM 4817 C CB A ARG A1 1 289 ? -7.232 6.643 -10.706 0.57 14.24 ? 279 A 1 +ATOM 4818 C CB B ARG A1 1 289 ? -7.223 6.63 -10.715 0.43 14.34 ? 279 A 1 +ATOM 4819 C CG A ARG A1 1 289 ? -8.029 6.699 -12.008 0.57 16.03 ? 279 A 1 +ATOM 4820 C CG B ARG A1 1 289 ? -7.964 6.825 -12.021 0.43 16.28 ? 279 A 1 +ATOM 4821 C CD A ARG A1 1 289 ? -9.373 7.418 -11.878 0.57 23.42 ? 279 A 1 +ATOM 4822 C CD B ARG A1 1 289 ? -9.471 6.736 -11.847 0.43 15.1 ? 279 A 1 +ATOM 4823 N NE A ARG A1 1 289 ? -10.31 6.602 -11.128 0.57 23.58 ? 279 A 1 +ATOM 4824 N NE B ARG A1 1 289 ? -9.882 5.459 -11.288 0.43 18.37 ? 279 A 1 +ATOM 4825 C CZ A ARG A1 1 289 ? -11.62 6.844 -11.048 0.57 44.84 ? 279 A 1 +ATOM 4826 C CZ B ARG A1 1 289 ? -11.122 5.174 -10.918 0.43 45.85 ? 279 A 1 +ATOM 4827 N NH1 A ARG A1 1 289 ? -12.198 7.892 -11.688 0.57 20.62 ? 279 A 1 +ATOM 4828 N NH1 B ARG A1 1 289 ? -12.067 6.097 -11.035 0.43 43.16 ? 279 A 1 +ATOM 4829 N NH2 A ARG A1 1 289 ? -12.345 6.003 -10.326 0.57 26.12 ? 279 A 1 +ATOM 4830 N NH2 B ARG A1 1 289 ? -11.403 3.974 -10.421 0.43 44.27 ? 279 A 1 +ATOM 4831 H H A ARG A1 1 289 ? -6.141 4.579 -11.598 0.57 17.38 ? 279 A 1 +ATOM 4832 H H B ARG A1 1 289 ? -6.142 4.58 -11.597 0.43 17.38 ? 279 A 1 +ATOM 4833 H HA A ARG A1 1 289 ? -5.454 7.115 -11.554 0.57 16.93 ? 279 A 1 +ATOM 4834 H HA B ARG A1 1 289 ? -5.44 7.117 -11.548 0.43 17.12 ? 279 A 1 +ATOM 4835 H HB2 A ARG A1 1 289 ? -7.58 5.912 -10.171 0.57 17.09 ? 279 A 1 +ATOM 4836 H HB2 B ARG A1 1 289 ? -7.591 5.853 -10.268 0.43 17.21 ? 279 A 1 +ATOM 4837 H HB3 A ARG A1 1 289 ? -7.357 7.484 -10.24 0.57 17.09 ? 279 A 1 +ATOM 4838 H HB3 B ARG A1 1 289 ? -7.354 7.421 -10.169 0.43 17.21 ? 279 A 1 +ATOM 4839 H HG2 A ARG A1 1 289 ? -7.506 7.17 -12.675 0.57 19.23 ? 279 A 1 +ATOM 4840 H HG2 B ARG A1 1 289 ? -7.754 7.702 -12.379 0.43 19.54 ? 279 A 1 +ATOM 4841 H HG3 A ARG A1 1 289 ? -8.207 5.793 -12.305 0.57 19.23 ? 279 A 1 +ATOM 4842 H HG3 B ARG A1 1 289 ? -7.692 6.137 -12.648 0.43 19.54 ? 279 A 1 +ATOM 4843 H HD2 A ARG A1 1 289 ? -9.249 8.258 -11.409 0.57 28.1 ? 279 A 1 +ATOM 4844 H HD2 B ARG A1 1 289 ? -9.764 7.438 -11.245 0.43 18.12 ? 279 A 1 +ATOM 4845 H HD3 A ARG A1 1 289 ? -9.741 7.582 -12.76 0.57 28.1 ? 279 A 1 +ATOM 4846 H HD3 B ARG A1 1 289 ? -9.898 6.84 -12.711 0.43 18.12 ? 279 A 1 +ATOM 4847 H HE A ARG A1 1 289 ? -10.001 5.917 -10.708 0.57 28.3 ? 279 A 1 +ATOM 4848 H HE B ARG A1 1 289 ? -9.283 4.85 -11.193 0.43 22.05 ? 279 A 1 +ATOM 4849 H HH11 A ARG A1 1 289 ? -11.718 8.423 -12.163 0.57 24.74 ? 279 A 1 +ATOM 4850 H HH11 B ARG A1 1 289 ? -11.874 6.873 -11.35 0.43 51.79 ? 279 A 1 +ATOM 4851 H HH12 A ARG A1 1 289 ? -13.045 8.024 -11.618 0.57 24.74 ? 279 A 1 +ATOM 4852 H HH12 B ARG A1 1 289 ? -12.874 5.918 -10.796 0.43 51.79 ? 279 A 1 +ATOM 4853 H HH21 A ARG A1 1 289 ? -11.967 5.337 -9.935 0.57 31.34 ? 279 A 1 +ATOM 4854 H HH21 B ARG A1 1 289 ? -10.782 3.384 -10.342 0.43 53.12 ? 279 A 1 +ATOM 4855 H HH22 A ARG A1 1 289 ? -13.193 6.123 -10.248 0.57 31.34 ? 279 A 1 +ATOM 4856 H HH22 B ARG A1 1 289 ? -12.207 3.786 -10.18 0.43 53.12 ? 279 A 1 +ATOM 4857 N N . GLU A1 1 290 ? -4.871 5.486 -8.856 1.0 14.78 ? 280 A 1 +ATOM 4858 C CA . GLU A1 1 290 ? -4.111 5.522 -7.613 1.0 14.08 ? 280 A 1 +ATOM 4859 C C . GLU A1 1 290 ? -2.667 5.828 -7.892 1.0 15.54 ? 280 A 1 +ATOM 4860 O O . GLU A1 1 290 ? -2.045 6.616 -7.184 1.0 16.11 ? 280 A 1 +ATOM 4861 C CB . GLU A1 1 290 ? -4.247 4.158 -6.967 1.0 16.99 ? 280 A 1 +ATOM 4862 C CG . GLU A1 1 290 ? -5.625 3.863 -6.447 1.0 20.6 ? 280 A 1 +ATOM 4863 C CD . GLU A1 1 290 ? -6.556 3.107 -7.415 1.0 31.79 ? 280 A 1 +ATOM 4864 O OE1 . GLU A1 1 290 ? -6.497 3.265 -8.668 1.0 21.47 ? 280 A 1 +ATOM 4865 O OE2 . GLU A1 1 290 ? -7.387 2.336 -6.898 1.0 25.41 ? 280 A 1 +ATOM 4866 H H . GLU A1 1 290 ? -5.234 4.724 -9.023 1.0 17.74 ? 280 A 1 +ATOM 4867 H HA . GLU A1 1 290 ? -4.448 6.206 -7.014 1.0 16.89 ? 280 A 1 +ATOM 4868 H HB2 . GLU A1 1 290 ? -4.029 3.479 -7.625 1.0 20.39 ? 280 A 1 +ATOM 4869 H HB3 . GLU A1 1 290 ? -3.632 4.105 -6.22 1.0 20.39 ? 280 A 1 +ATOM 4870 H HG2 . GLU A1 1 290 ? -5.539 3.321 -5.647 1.0 24.72 ? 280 A 1 +ATOM 4871 H HG3 . GLU A1 1 290 ? -6.056 4.705 -6.232 1.0 24.72 ? 280 A 1 +ATOM 4872 N N . ILE A1 1 291 ? -2.093 5.211 -8.931 1.0 15.11 ? 281 A 1 +ATOM 4873 C CA . ILE A1 1 291 ? -0.709 5.482 -9.299 1.0 15.53 ? 281 A 1 +ATOM 4874 C C . ILE A1 1 291 ? -0.566 6.951 -9.68 1.0 15.29 ? 281 A 1 +ATOM 4875 O O . ILE A1 1 291 ? 0.371 7.64 -9.284 1.0 15.04 ? 281 A 1 +ATOM 4876 C CB . ILE A1 1 291 ? -0.285 4.547 -10.457 1.0 15.51 ? 281 A 1 +ATOM 4877 C CG1 . ILE A1 1 291 ? -0.239 3.087 -10.016 1.0 17.95 ? 281 A 1 +ATOM 4878 C CG2 . ILE A1 1 291 ? 1.082 4.937 -10.971 1.0 17.98 ? 281 A 1 +ATOM 4879 C CD1 . ILE A1 1 291 ? -0.096 2.099 -11.199 1.0 21.35 ? 281 A 1 +ATOM 4880 H H . ILE A1 1 291 ? -2.486 4.634 -9.434 1.0 18.14 ? 281 A 1 +ATOM 4881 H HA . ILE A1 1 291 ? -0.128 5.306 -8.542 1.0 18.64 ? 281 A 1 +ATOM 4882 H HB . ILE A1 1 291 ? -0.951 4.644 -11.155 1.0 18.61 ? 281 A 1 +ATOM 4883 H HG12 . ILE A1 1 291 ? 0.521 2.96 -9.427 1.0 21.54 ? 281 A 1 +ATOM 4884 H HG13 . ILE A1 1 291 ? -1.061 2.874 -9.548 1.0 21.54 ? 281 A 1 +ATOM 4885 H HG21 . ILE A1 1 291 ? 1.393 4.256 -11.588 1.0 21.57 ? 281 A 1 +ATOM 4886 H HG22 . ILE A1 1 291 ? 1.017 5.791 -11.426 1.0 21.57 ? 281 A 1 +ATOM 4887 H HG23 . ILE A1 1 291 ? 1.694 5.007 -10.221 1.0 21.57 ? 281 A 1 +ATOM 4888 H HD11 . ILE A1 1 291 ? -0.294 1.202 -10.887 1.0 25.63 ? 281 A 1 +ATOM 4889 H HD12 . ILE A1 1 291 ? -0.719 2.351 -11.898 1.0 25.63 ? 281 A 1 +ATOM 4890 H HD13 . ILE A1 1 291 ? 0.813 2.139 -11.536 1.0 25.63 ? 281 A 1 +ATOM 4891 N N . THR A1 1 292 ? -1.505 7.456 -10.483 1.0 13.87 ? 282 A 1 +ATOM 4892 C CA . THR A1 1 292 ? -1.405 8.824 -10.976 1.0 14.02 ? 282 A 1 +ATOM 4893 C C . THR A1 1 292 ? -1.496 9.821 -9.828 1.0 13.45 ? 282 A 1 +ATOM 4894 O O . THR A1 1 292 ? -0.802 10.85 -9.833 1.0 14.58 ? 282 A 1 +ATOM 4895 C CB . THR A1 1 292 ? -2.516 9.076 -12.0 1.0 12.56 ? 282 A 1 +ATOM 4896 O OG1 . THR A1 1 292 ? -2.394 8.11 -13.079 1.0 13.87 ? 282 A 1 +ATOM 4897 C CG2 . THR A1 1 292 ? -2.366 10.401 -12.662 1.0 13.54 ? 282 A 1 +ATOM 4898 H H . THR A1 1 292 ? -2.201 7.03 -10.753 1.0 16.65 ? 282 A 1 +ATOM 4899 H HA . THR A1 1 292 ? -0.553 8.954 -11.421 1.0 16.82 ? 282 A 1 +ATOM 4900 H HB . THR A1 1 292 ? -3.364 9.023 -11.532 1.0 15.07 ? 282 A 1 +ATOM 4901 H HG1 . THR A1 1 292 ? -2.497 7.331 -12.78 1.0 16.64 ? 282 A 1 +ATOM 4902 H HG21 . THR A1 1 292 ? -3.024 10.495 -13.369 1.0 16.25 ? 282 A 1 +ATOM 4903 H HG22 . THR A1 1 292 ? -2.494 11.112 -12.015 1.0 16.25 ? 282 A 1 +ATOM 4904 H HG23 . THR A1 1 292 ? -1.478 10.481 -13.046 1.0 16.25 ? 282 A 1 +ATOM 4905 N N . LEU A1 1 293 ? -2.291 9.51 -8.797 1.0 13.85 ? 283 A 1 +ATOM 4906 C CA . LEU A1 1 293 ? -2.374 10.374 -7.605 1.0 13.32 ? 283 A 1 +ATOM 4907 C C . LEU A1 1 293 ? -1.068 10.396 -6.82 1.0 14.7 ? 283 A 1 +ATOM 4908 O O . LEU A1 1 293 ? -0.886 11.301 -6.004 1.0 14.77 ? 283 A 1 +ATOM 4909 C CB . LEU A1 1 293 ? -3.53 9.902 -6.729 1.0 14.68 ? 283 A 1 +ATOM 4910 C CG . LEU A1 1 293 ? -4.913 10.237 -7.259 1.0 14.0 ? 283 A 1 +ATOM 4911 C CD1 . LEU A1 1 293 ? -5.984 9.473 -6.494 1.0 16.11 ? 283 A 1 +ATOM 4912 C CD2 . LEU A1 1 293 ? -5.183 11.727 -7.197 1.0 15.45 ? 283 A 1 +ATOM 4913 H H . LEU A1 1 293 ? -2.791 8.812 -8.76 1.0 16.62 ? 283 A 1 +ATOM 4914 H HA . LEU A1 1 293 ? -2.556 11.289 -7.873 1.0 15.99 ? 283 A 1 +ATOM 4915 H HB2 . LEU A1 1 293 ? -3.476 8.937 -6.645 1.0 17.62 ? 283 A 1 +ATOM 4916 H HB3 . LEU A1 1 293 ? -3.443 10.317 -5.857 1.0 17.62 ? 283 A 1 +ATOM 4917 H HG . LEU A1 1 293 ? -4.953 9.97 -8.19 1.0 16.81 ? 283 A 1 +ATOM 4918 H HD11 . LEU A1 1 293 ? -6.855 9.704 -6.854 1.0 19.34 ? 283 A 1 +ATOM 4919 H HD12 . LEU A1 1 293 ? -5.826 8.521 -6.597 1.0 19.34 ? 283 A 1 +ATOM 4920 H HD13 . LEU A1 1 293 ? -5.938 9.717 -5.557 1.0 19.34 ? 283 A 1 +ATOM 4921 H HD21 . LEU A1 1 293 ? -6.116 11.888 -7.41 1.0 18.54 ? 283 A 1 +ATOM 4922 H HD22 . LEU A1 1 293 ? -4.989 12.046 -6.301 1.0 18.54 ? 283 A 1 +ATOM 4923 H HD23 . LEU A1 1 293 ? -4.614 12.178 -7.839 1.0 18.54 ? 283 A 1 +ATOM 4924 N N . ARG A1 1 294 ? -0.166 9.476 -7.048 1.0 15.13 ? 284 A 1 +ATOM 4925 C CA . ARG A1 1 294 ? 1.154 9.482 -6.425 1.0 15.84 ? 284 A 1 +ATOM 4926 C C . ARG A1 1 294 ? 2.211 10.103 -7.322 1.0 16.52 ? 284 A 1 +ATOM 4927 O O . ARG A1 1 294 ? 3.374 10.2 -6.929 1.0 17.84 ? 284 A 1 +ATOM 4928 C CB . ARG A1 1 294 ? 1.574 8.049 -6.068 1.0 17.48 ? 284 A 1 +ATOM 4929 C CG . ARG A1 1 294 ? 0.662 7.414 -4.986 1.0 19.14 ? 284 A 1 +ATOM 4930 C CD . ARG A1 1 294 ? 1.307 6.078 -4.463 1.0 30.02 ? 284 A 1 +ATOM 4931 N NE . ARG A1 1 294 ? 2.318 6.354 -3.438 1.0 73.18 ? 284 A 1 +ATOM 4932 C CZ . ARG A1 1 294 ? 3.384 5.599 -3.175 1.0 89.92 ? 284 A 1 +ATOM 4933 N NH1 . ARG A1 1 294 ? 3.628 4.485 -3.855 1.0 51.61 ? 284 A 1 +ATOM 4934 N NH2 . ARG A1 1 294 ? 4.225 5.971 -2.219 1.0 100.72 ? 284 A 1 +ATOM 4935 H H . ARG A1 1 294 ? -0.289 8.81 -7.578 1.0 18.15 ? 284 A 1 +ATOM 4936 H HA . ARG A1 1 294 ? 1.11 9.995 -5.603 1.0 19.0 ? 284 A 1 +ATOM 4937 H HB2 . ARG A1 1 294 ? 1.526 7.498 -6.865 1.0 20.98 ? 284 A 1 +ATOM 4938 H HB3 . ARG A1 1 294 ? 2.482 8.062 -5.728 1.0 20.98 ? 284 A 1 +ATOM 4939 H HG2 . ARG A1 1 294 ? 0.564 8.026 -4.24 1.0 22.97 ? 284 A 1 +ATOM 4940 H HG3 . ARG A1 1 294 ? -0.207 7.213 -5.367 1.0 22.97 ? 284 A 1 +ATOM 4941 H HD2 . ARG A1 1 294 ? 0.619 5.517 -4.073 1.0 36.02 ? 284 A 1 +ATOM 4942 H HD3 . ARG A1 1 294 ? 1.735 5.614 -5.2 1.0 36.02 ? 284 A 1 +ATOM 4943 H HE . ARG A1 1 294 ? 2.214 7.066 -2.966 1.0 87.81 ? 284 A 1 +ATOM 4944 H HH11 . ARG A1 1 294 ? 3.093 4.238 -4.481 1.0 61.93 ? 284 A 1 +ATOM 4945 H HH12 . ARG A1 1 294 ? 4.321 4.011 -3.67 1.0 61.93 ? 284 A 1 +ATOM 4946 H HH21 . ARG A1 1 294 ? 4.081 6.694 -1.776 1.0 120.86 ? 284 A 1 +ATOM 4947 H HH22 . ARG A1 1 294 ? 4.916 5.489 -2.042 1.0 120.86 ? 284 A 1 +ATOM 4948 N N . CYS A1 1 295 ? 1.828 10.621 -8.483 1.0 15.32 ? 285 A 1 +ATOM 4949 C CA . CYS A1 1 295 ? 2.774 11.147 -9.477 1.0 16.0 ? 285 A 1 +ATOM 4950 C C . CYS A1 1 295 ? 2.398 12.565 -9.853 1.0 15.85 ? 285 A 1 +ATOM 4951 O O . CYS A1 1 295 ? 2.79 13.06 -10.916 1.0 16.11 ? 285 A 1 +ATOM 4952 C CB . CYS A1 1 295 ? 2.801 10.294 -10.732 1.0 16.46 ? 285 A 1 +ATOM 4953 S SG . CYS A1 1 295 ? 3.377 8.621 -10.485 1.0 18.77 ? 285 A 1 +ATOM 4954 H H . CYS A1 1 295 ? 1.007 10.685 -8.73 1.0 18.39 ? 285 A 1 +ATOM 4955 H HA . CYS A1 1 295 ? 3.666 11.13 -9.095 1.0 19.2 ? 285 A 1 +ATOM 4956 H HB2 . CYS A1 1 295 ? 1.901 10.244 -11.09 1.0 19.75 ? 285 A 1 +ATOM 4957 H HB3 . CYS A1 1 295 ? 3.391 10.715 -11.377 1.0 19.75 ? 285 A 1 +ATOM 4958 H HG . CYS A1 1 295 ? 3.561 8.109 -11.554 1.0 22.52 ? 285 A 1 +ATOM 4959 N N . GLY A1 1 296 ? 1.626 13.246 -9.021 1.0 15.1 ? 286 A 1 +ATOM 4960 C CA . GLY A1 1 296 ? 1.323 14.655 -9.189 1.0 15.63 ? 286 A 1 +ATOM 4961 C C . GLY A1 1 296 ? -0.133 15.012 -9.244 1.0 14.19 ? 286 A 1 +ATOM 4962 O O . GLY A1 1 296 ? -0.457 16.189 -9.111 1.0 14.12 ? 286 A 1 +ATOM 4963 H H . GLY A1 1 296 ? 1.254 12.9 -8.327 1.0 18.12 ? 286 A 1 +ATOM 4964 H HA2 . GLY A1 1 296 ? 1.714 15.142 -8.447 1.0 18.76 ? 286 A 1 +ATOM 4965 H HA3 . GLY A1 1 296 ? 1.729 14.959 -10.016 1.0 18.76 ? 286 A 1 +ATOM 4966 N N . ALA A1 1 297 ? -1.062 14.073 -9.445 1.0 13.32 ? 287 A 1 +ATOM 4967 C CA . ALA A1 1 297 ? -2.472 14.42 -9.489 1.0 13.4 ? 287 A 1 +ATOM 4968 C C . ALA A1 1 297 ? -3.037 14.62 -8.084 1.0 13.87 ? 287 A 1 +ATOM 4969 O O . ALA A1 1 297 ? -2.491 14.12 -7.09 1.0 14.37 ? 287 A 1 +ATOM 4970 C CB . ALA A1 1 297 ? -3.264 13.333 -10.202 1.0 13.44 ? 287 A 1 +ATOM 4971 H H . ALA A1 1 297 ? -0.897 13.237 -9.557 1.0 15.98 ? 287 A 1 +ATOM 4972 H HA . ALA A1 1 297 ? -2.573 15.253 -9.977 1.0 16.08 ? 287 A 1 +ATOM 4973 H HB1 . ALA A1 1 297 ? -4.204 13.572 -10.197 1.0 16.12 ? 287 A 1 +ATOM 4974 H HB2 . ALA A1 1 297 ? -2.946 13.258 -11.116 1.0 16.12 ? 287 A 1 +ATOM 4975 H HB3 . ALA A1 1 297 ? -3.134 12.491 -9.737 1.0 16.12 ? 287 A 1 +ATOM 4976 N N . ASN A1 1 298 ? -4.139 15.383 -8.017 1.0 12.67 ? 288 A 1 +ATOM 4977 C CA . ASN A1 1 298 ? -4.753 15.739 -6.733 1.0 13.15 ? 288 A 1 +ATOM 4978 C C . ASN A1 1 298 ? -6.263 15.775 -6.81 1.0 13.06 ? 288 A 1 +ATOM 4979 O O . ASN A1 1 298 ? -6.9 16.275 -5.851 1.0 14.08 ? 288 A 1 +ATOM 4980 C CB . ASN A1 1 298 ? -4.226 17.094 -6.213 1.0 13.47 ? 288 A 1 +ATOM 4981 C CG . ASN A1 1 298 ? -4.728 18.271 -7.012 1.0 13.36 ? 288 A 1 +ATOM 4982 O OD1 . ASN A1 1 298 ? -4.674 18.228 -8.265 1.0 13.42 ? 288 A 1 +ATOM 4983 N ND2 . ASN A1 1 298 ? -5.238 19.314 -6.39 1.0 14.77 ? 288 A 1 +ATOM 4984 H H . ASN A1 1 298 ? -4.548 15.706 -8.701 1.0 15.2 ? 288 A 1 +ATOM 4985 H HA . ASN A1 1 298 ? -4.503 15.067 -6.08 1.0 15.78 ? 288 A 1 +ATOM 4986 H HB2 . ASN A1 1 298 ? -4.514 17.213 -5.294 1.0 16.16 ? 288 A 1 +ATOM 4987 H HB3 . ASN A1 1 298 ? -3.257 17.094 -6.259 1.0 16.16 ? 288 A 1 +ATOM 4988 H HD21 . ASN A1 1 298 ? -5.525 19.987 -6.842 1.0 17.73 ? 288 A 1 +ATOM 4989 H HD22 . ASN A1 1 298 ? -5.283 19.322 -5.531 1.0 17.73 ? 288 A 1 +ATOM 4990 N N . VAL A1 1 299 ? -6.871 15.274 -7.876 1.0 12.86 ? 289 A 1 +ATOM 4991 C CA . VAL A1 1 299 ? -8.31 15.317 -8.095 1.0 13.08 ? 289 A 1 +ATOM 4992 C C . VAL A1 1 299 ? -8.74 13.965 -8.621 1.0 13.06 ? 289 A 1 +ATOM 4993 O O . VAL A1 1 299 ? -7.991 13.3 -9.349 1.0 13.05 ? 289 A 1 +ATOM 4994 C CB . VAL A1 1 299 ? -8.661 16.443 -9.112 1.0 13.88 ? 289 A 1 +ATOM 4995 C CG1 . VAL A1 1 299 ? -10.117 16.369 -9.581 1.0 15.36 ? 289 A 1 +ATOM 4996 C CG2 . VAL A1 1 299 ? -8.3 17.794 -8.545 1.0 16.01 ? 289 A 1 +ATOM 4997 H H . VAL A1 1 299 ? -6.452 14.885 -8.518 1.0 15.44 ? 289 A 1 +ATOM 4998 H HA . VAL A1 1 299 ? -8.784 15.482 -7.264 1.0 15.7 ? 289 A 1 +ATOM 4999 H HB . VAL A1 1 299 ? -8.128 16.312 -9.912 1.0 16.65 ? 289 A 1 +ATOM 5000 H HG11 . VAL A1 1 299 ? -10.338 17.187 -10.053 1.0 18.43 ? 289 A 1 +ATOM 5001 H HG12 . VAL A1 1 299 ? -10.221 15.607 -10.172 1.0 18.43 ? 289 A 1 +ATOM 5002 H HG13 . VAL A1 1 299 ? -10.693 16.268 -8.807 1.0 18.43 ? 289 A 1 +ATOM 5003 H HG21 . VAL A1 1 299 ? -8.548 18.481 -9.183 1.0 19.21 ? 289 A 1 +ATOM 5004 H HG22 . VAL A1 1 299 ? -8.782 17.926 -7.713 1.0 19.21 ? 289 A 1 +ATOM 5005 H HG23 . VAL A1 1 299 ? -7.345 17.823 -8.382 1.0 19.21 ? 289 A 1 +ATOM 5006 N N . ILE A1 1 300 ? -9.931 13.535 -8.267 1.0 12.89 ? 290 A 1 +ATOM 5007 C CA . ILE A1 1 300 ? -10.54 12.318 -8.827 1.0 14.42 ? 290 A 1 +ATOM 5008 C C . ILE A1 1 300 ? -11.982 12.641 -9.162 1.0 13.75 ? 290 A 1 +ATOM 5009 O O . ILE A1 1 300 ? -12.645 13.441 -8.492 1.0 14.5 ? 290 A 1 +ATOM 5010 C CB . ILE A1 1 300 ? -10.38 11.118 -7.871 1.0 16.13 ? 290 A 1 +ATOM 5011 C CG1 . ILE A1 1 300 ? -10.709 9.835 -8.632 1.0 21.15 ? 290 A 1 +ATOM 5012 C CG2 . ILE A1 1 300 ? -11.193 11.294 -6.621 1.0 17.59 ? 290 A 1 +ATOM 5013 C CD1 . ILE A1 1 300 ? -9.943 8.656 -8.217 1.0 27.33 ? 290 A 1 +ATOM 5014 H H . ILE A1 1 300 ? -10.43 13.932 -7.69 1.0 15.47 ? 290 A 1 +ATOM 5015 H HA . ILE A1 1 300 ? -10.108 12.061 -9.656 1.0 17.3 ? 290 A 1 +ATOM 5016 H HB . ILE A1 1 300 ? -9.46 11.06 -7.569 1.0 19.36 ? 290 A 1 +ATOM 5017 H HG12 . ILE A1 1 300 ? -11.649 9.632 -8.501 1.0 25.38 ? 290 A 1 +ATOM 5018 H HG13 . ILE A1 1 300 ? -10.53 9.982 -9.574 1.0 25.38 ? 290 A 1 +ATOM 5019 H HG21 . ILE A1 1 300 ? -10.957 10.595 -5.99 1.0 21.1 ? 290 A 1 +ATOM 5020 H HG22 . ILE A1 1 300 ? -10.999 12.164 -6.239 1.0 21.1 ? 290 A 1 +ATOM 5021 H HG23 . ILE A1 1 300 ? -12.134 11.233 -6.846 1.0 21.1 ? 290 A 1 +ATOM 5022 H HD11 . ILE A1 1 300 ? -10.082 7.946 -8.863 1.0 32.79 ? 290 A 1 +ATOM 5023 H HD12 . ILE A1 1 300 ? -9.002 8.889 -8.179 1.0 32.79 ? 290 A 1 +ATOM 5024 H HD13 . ILE A1 1 300 ? -10.25 8.372 -7.342 1.0 32.79 ? 290 A 1 +ATOM 5025 N N . MET A1 1 301 ? -12.454 12.078 -10.267 1.0 13.34 ? 291 A 1 +ATOM 5026 C CA A MET A1 1 301 ? -13.744 12.428 -10.854 0.79 14.28 ? 291 A 1 +ATOM 5027 C CA B MET A1 1 301 ? -13.761 12.428 -10.81 0.21 16.11 ? 291 A 1 +ATOM 5028 C C . MET A1 1 301 ? -14.576 11.17 -11.0 1.0 14.17 ? 291 A 1 +ATOM 5029 O O . MET A1 1 301 ? -14.69 10.632 -12.128 1.0 17.03 ? 291 A 1 +ATOM 5030 C CB A MET A1 1 301 ? -13.575 13.266 -12.141 0.79 13.76 ? 291 A 1 +ATOM 5031 C CB B MET A1 1 301 ? -13.637 13.174 -12.132 0.21 15.72 ? 291 A 1 +ATOM 5032 C CG A MET A1 1 301 ? -12.496 14.398 -12.056 0.79 12.48 ? 291 A 1 +ATOM 5033 C CG B MET A1 1 301 ? -12.942 14.508 -12.074 0.21 28.52 ? 291 A 1 +ATOM 5034 S SD A MET A1 1 301 ? -12.217 15.406 -13.589 0.79 16.62 ? 291 A 1 +ATOM 5035 S SD B MET A1 1 301 ? -13.546 15.49 -13.424 0.21 16.35 ? 291 A 1 +ATOM 5036 C CE A MET A1 1 301 ? -13.684 16.485 -13.493 0.79 20.22 ? 291 A 1 +ATOM 5037 C CE B MET A1 1 301 ? -12.146 16.559 -13.809 0.21 26.81 ? 291 A 1 +ATOM 5038 H H A MET A1 1 301 ? -12.032 11.473 -10.709 0.79 16.01 ? 291 A 1 +ATOM 5039 H H B MET A1 1 301 ? -12.031 11.485 -10.725 0.21 16.01 ? 291 A 1 +ATOM 5040 H HA A MET A1 1 301 ? -14.242 12.996 -10.246 0.79 17.13 ? 291 A 1 +ATOM 5041 H HA B MET A1 1 301 ? -14.203 13.001 -10.164 0.21 19.33 ? 291 A 1 +ATOM 5042 H HB2 A MET A1 1 301 ? -13.317 12.672 -12.863 0.79 16.52 ? 291 A 1 +ATOM 5043 H HB2 B MET A1 1 301 ? -13.136 12.617 -12.749 0.21 18.86 ? 291 A 1 +ATOM 5044 H HB3 A MET A1 1 301 ? -14.424 13.688 -12.345 0.79 16.52 ? 291 A 1 +ATOM 5045 H HB3 B MET A1 1 301 ? -14.53 13.331 -12.477 0.21 18.86 ? 291 A 1 +ATOM 5046 H HG2 A MET A1 1 301 ? -12.763 15.016 -11.357 0.79 14.97 ? 291 A 1 +ATOM 5047 H HG2 B MET A1 1 301 ? -13.143 14.955 -11.236 0.21 34.23 ? 291 A 1 +ATOM 5048 H HG3 A MET A1 1 301 ? -11.647 13.988 -11.83 0.79 14.97 ? 291 A 1 +ATOM 5049 H HG3 B MET A1 1 301 ? -11.983 14.391 -12.165 0.21 34.23 ? 291 A 1 +ATOM 5050 H HE1 A MET A1 1 301 ? -13.599 17.192 -14.152 0.79 24.27 ? 291 A 1 +ATOM 5051 H HE1 B MET A1 1 301 ? -12.322 17.022 -14.643 0.21 32.17 ? 291 A 1 +ATOM 5052 H HE2 A MET A1 1 301 ? -14.477 15.957 -13.674 0.79 24.27 ? 291 A 1 +ATOM 5053 H HE2 B MET A1 1 301 ? -12.032 17.201 -13.091 0.21 32.17 ? 291 A 1 +ATOM 5054 H HE3 A MET A1 1 301 ? -13.737 16.867 -12.603 0.79 24.27 ? 291 A 1 +ATOM 5055 H HE3 B MET A1 1 301 ? -11.347 16.015 -13.895 0.21 32.17 ? 291 A 1 +ATOM 5056 N N . PRO A1 1 302 ? -15.185 10.667 -9.944 1.0 15.01 ? 292 A 1 +ATOM 5057 C CA . PRO A1 1 302 ? -15.982 9.456 -10.073 1.0 15.86 ? 292 A 1 +ATOM 5058 C C . PRO A1 1 302 ? -17.159 9.667 -11.004 1.0 14.73 ? 292 A 1 +ATOM 5059 O O . PRO A1 1 302 ? -17.784 10.729 -11.032 1.0 16.22 ? 292 A 1 +ATOM 5060 C CB . PRO A1 1 302 ? -16.44 9.184 -8.646 1.0 18.01 ? 292 A 1 +ATOM 5061 C CG . PRO A1 1 302 ? -16.474 10.512 -7.996 1.0 15.66 ? 292 A 1 +ATOM 5062 C CD . PRO A1 1 302 ? -15.295 11.231 -8.58 1.0 14.11 ? 292 A 1 +ATOM 5063 H HA . PRO A1 1 302 ? -15.44 8.717 -10.391 1.0 19.04 ? 292 A 1 +ATOM 5064 H HB2 . PRO A1 1 302 ? -17.321 8.778 -8.653 1.0 21.61 ? 292 A 1 +ATOM 5065 H HB3 . PRO A1 1 302 ? -15.808 8.596 -8.203 1.0 21.61 ? 292 A 1 +ATOM 5066 H HG2 . PRO A1 1 302 ? -17.303 10.967 -8.209 1.0 18.79 ? 292 A 1 +ATOM 5067 H HG3 . PRO A1 1 302 ? -16.385 10.416 -7.035 1.0 18.79 ? 292 A 1 +ATOM 5068 H HD2 . PRO A1 1 302 ? -15.457 12.186 -8.614 1.0 16.93 ? 292 A 1 +ATOM 5069 H HD3 . PRO A1 1 302 ? -14.492 11.049 -8.067 1.0 16.93 ? 292 A 1 +ATOM 5070 N N A ASN A1 1 303 ? -17.502 8.602 -11.731 0.56 16.61 ? 293 A 1 +ATOM 5071 N N B ASN A1 1 303 ? -17.426 8.629 -11.778 0.44 13.76 ? 293 A 1 +ATOM 5072 C CA A ASN A1 1 303 ? -18.61 8.647 -12.684 0.56 14.88 ? 293 A 1 +ATOM 5073 C CA B ASN A1 1 303 ? -18.596 8.635 -12.625 0.44 13.56 ? 293 A 1 +ATOM 5074 C C A ASN A1 1 303 ? -19.93 8.386 -11.967 0.56 13.98 ? 293 A 1 +ATOM 5075 C C B ASN A1 1 303 ? -19.851 8.484 -11.779 0.44 13.59 ? 293 A 1 +ATOM 5076 O O A ASN A1 1 303 ? -20.182 7.278 -11.461 0.56 14.74 ? 293 A 1 +ATOM 5077 O O B ASN A1 1 303 ? -19.958 7.566 -10.962 0.44 14.63 ? 293 A 1 +ATOM 5078 C CB A ASN A1 1 303 ? -18.372 7.607 -13.776 0.56 14.3 ? 293 A 1 +ATOM 5079 C CB B ASN A1 1 303 ? -18.508 7.482 -13.616 0.44 20.63 ? 293 A 1 +ATOM 5080 C CG A ASN A1 1 303 ? -19.485 7.557 -14.805 0.56 30.06 ? 293 A 1 +ATOM 5081 C CG B ASN A1 1 303 ? -19.538 7.596 -14.689 0.44 13.54 ? 293 A 1 +ATOM 5082 O OD1 A ASN A1 1 303 ? -20.399 8.396 -14.799 0.56 16.49 ? 293 A 1 +ATOM 5083 O OD1 B ASN A1 1 303 ? -20.67 7.361 -14.457 0.44 14.55 ? 293 A 1 +ATOM 5084 N ND2 A ASN A1 1 303 ? -19.394 6.572 -15.725 0.56 17.46 ? 293 A 1 +ATOM 5085 N ND2 B ASN A1 1 303 ? -19.123 8.029 -15.851 0.44 23.14 ? 293 A 1 +ATOM 5086 H H A ASN A1 1 303 ? -17.106 7.84 -11.69 0.56 19.93 ? 293 A 1 +ATOM 5087 H H B ASN A1 1 303 ? -16.948 7.916 -11.828 0.44 16.51 ? 293 A 1 +ATOM 5088 H HA A ASN A1 1 303 ? -18.661 9.532 -13.078 0.56 17.86 ? 293 A 1 +ATOM 5089 H HA B ASN A1 1 303 ? -18.648 9.472 -13.112 0.44 16.27 ? 293 A 1 +ATOM 5090 H HB2 A ASN A1 1 303 ? -17.547 7.821 -14.239 0.56 17.16 ? 293 A 1 +ATOM 5091 H HB2 B ASN A1 1 303 ? -17.632 7.485 -14.033 0.44 24.76 ? 293 A 1 +ATOM 5092 H HB3 A ASN A1 1 303 ? -18.305 6.731 -13.366 0.56 17.16 ? 293 A 1 +ATOM 5093 H HB3 B ASN A1 1 303 ? -18.648 6.645 -13.147 0.44 24.76 ? 293 A 1 +ATOM 5094 H HD21 A ASN A1 1 303 ? -19.996 6.494 -16.333 0.56 20.96 ? 293 A 1 +ATOM 5095 H HD21 B ASN A1 1 303 ? -19.678 8.113 -16.502 0.44 27.77 ? 293 A 1 +ATOM 5096 H HD22 A ASN A1 1 303 ? -18.733 6.022 -15.702 0.56 20.96 ? 293 A 1 +ATOM 5097 H HD22 B ASN A1 1 303 ? -18.294 8.23 -15.963 0.44 27.77 ? 293 A 1 +ATOM 5098 N N . TRP A1 1 304 ? -20.783 9.394 -11.958 1.0 14.13 ? 294 A 1 +ATOM 5099 C CA . TRP A1 1 304 ? -22.063 9.365 -11.289 1.0 14.25 ? 294 A 1 +ATOM 5100 C C . TRP A1 1 304 ? -23.214 9.284 -12.274 1.0 15.21 ? 294 A 1 +ATOM 5101 O O . TRP A1 1 304 ? -24.363 9.541 -11.928 1.0 18.27 ? 294 A 1 +ATOM 5102 C CB . TRP A1 1 304 ? -22.13 10.597 -10.354 1.0 14.6 ? 294 A 1 +ATOM 5103 C CG . TRP A1 1 304 ? -23.199 10.535 -9.304 1.0 15.25 ? 294 A 1 +ATOM 5104 C CD1 . TRP A1 1 304 ? -24.3 11.274 -9.209 1.0 15.45 ? 294 A 1 +ATOM 5105 C CD2 . TRP A1 1 304 ? -23.216 9.624 -8.195 1.0 15.55 ? 294 A 1 +ATOM 5106 N NE1 . TRP A1 1 304 ? -25.027 10.897 -8.077 1.0 17.37 ? 294 A 1 +ATOM 5107 C CE2 . TRP A1 1 304 ? -24.352 9.906 -7.431 1.0 17.12 ? 294 A 1 +ATOM 5108 C CE3 . TRP A1 1 304 ? -22.337 8.633 -7.764 1.0 15.77 ? 294 A 1 +ATOM 5109 C CZ2 . TRP A1 1 304 ? -24.627 9.227 -6.252 1.0 18.83 ? 294 A 1 +ATOM 5110 C CZ3 . TRP A1 1 304 ? -22.636 7.956 -6.586 1.0 18.62 ? 294 A 1 +ATOM 5111 C CH2 . TRP A1 1 304 ? -23.747 8.279 -5.848 1.0 18.31 ? 294 A 1 +ATOM 5112 H H A TRP A1 1 304 ? -20.633 10.142 -12.354 0.56 16.95 ? 294 A 1 +ATOM 5113 H H B TRP A1 1 304 ? -20.695 10.067 -12.486 0.44 16.95 ? 294 A 1 +ATOM 5114 H HA . TRP A1 1 304 ? -22.162 8.574 -10.735 1.0 17.1 ? 294 A 1 +ATOM 5115 H HB2 . TRP A1 1 304 ? -21.278 10.684 -9.897 1.0 17.52 ? 294 A 1 +ATOM 5116 H HB3 . TRP A1 1 304 ? -22.298 11.385 -10.895 1.0 17.52 ? 294 A 1 +ATOM 5117 H HD1 . TRP A1 1 304 ? -24.549 11.941 -9.806 1.0 18.54 ? 294 A 1 +ATOM 5118 H HE1 . TRP A1 1 304 ? -25.778 11.236 -7.829 1.0 20.85 ? 294 A 1 +ATOM 5119 H HE3 . TRP A1 1 304 ? -21.57 8.431 -8.25 1.0 18.93 ? 294 A 1 +ATOM 5120 H HZ2 . TRP A1 1 304 ? -25.391 9.417 -5.756 1.0 22.6 ? 294 A 1 +ATOM 5121 H HZ3 . TRP A1 1 304 ? -22.075 7.273 -6.295 1.0 22.34 ? 294 A 1 +ATOM 5122 H HH2 . TRP A1 1 304 ? -23.9 7.834 -5.046 1.0 21.97 ? 294 A 1 +ATOM 5123 N N . THR A1 1 305 ? -22.96 8.942 -13.511 1.0 14.82 ? 295 A 1 +ATOM 5124 C CA . THR A1 1 305 ? -24.058 8.792 -14.462 1.0 14.69 ? 295 A 1 +ATOM 5125 C C . THR A1 1 305 ? -24.893 7.553 -14.085 1.0 15.2 ? 295 A 1 +ATOM 5126 O O . THR A1 1 305 ? -24.325 6.484 -13.817 1.0 15.53 ? 295 A 1 +ATOM 5127 C CB . THR A1 1 305 ? -23.483 8.584 -15.862 1.0 14.54 ? 295 A 1 +ATOM 5128 O OG1 . THR A1 1 305 ? -22.582 9.663 -16.143 1.0 14.23 ? 295 A 1 +ATOM 5129 C CG2 . THR A1 1 305 ? -24.555 8.544 -16.912 1.0 15.29 ? 295 A 1 +ATOM 5130 H H . THR A1 1 305 ? -22.177 8.791 -13.833 1.0 17.78 ? 295 A 1 +ATOM 5131 H HA . THR A1 1 305 ? -24.621 9.582 -14.449 1.0 17.63 ? 295 A 1 +ATOM 5132 H HB . THR A1 1 305 ? -23.022 7.731 -15.896 1.0 17.45 ? 295 A 1 +ATOM 5133 H HG1 . THR A1 1 305 ? -21.926 9.633 -15.62 1.0 17.08 ? 295 A 1 +ATOM 5134 H HG21 . THR A1 1 305 ? -24.153 8.503 -17.794 1.0 18.35 ? 295 A 1 +ATOM 5135 H HG22 . THR A1 1 305 ? -25.115 7.763 -16.785 1.0 18.35 ? 295 A 1 +ATOM 5136 H HG23 . THR A1 1 305 ? -25.106 9.34 -16.854 1.0 18.35 ? 295 A 1 +ATOM 5137 N N . PRO A1 1 306 ? -26.197 7.649 -14.022 1.0 15.67 ? 296 A 1 +ATOM 5138 C CA . PRO A1 1 306 ? -26.985 6.502 -13.567 1.0 16.3 ? 296 A 1 +ATOM 5139 C C . PRO A1 1 306 ? -27.216 5.476 -14.674 1.0 16.68 ? 296 A 1 +ATOM 5140 O O . PRO A1 1 306 ? -27.173 5.79 -15.898 1.0 16.87 ? 296 A 1 +ATOM 5141 C CB . PRO A1 1 306 ? -28.307 7.143 -13.109 1.0 18.73 ? 296 A 1 +ATOM 5142 C CG . PRO A1 1 306 ? -28.434 8.37 -14.04 1.0 18.72 ? 296 A 1 +ATOM 5143 C CD . PRO A1 1 306 ? -27.01 8.859 -14.196 1.0 15.94 ? 296 A 1 +ATOM 5144 H HA . PRO A1 1 306 ? -26.554 6.065 -12.815 1.0 19.56 ? 296 A 1 +ATOM 5145 H HB2 . PRO A1 1 306 ? -29.044 6.524 -13.234 1.0 22.47 ? 296 A 1 +ATOM 5146 H HB3 . PRO A1 1 306 ? -28.251 7.408 -12.178 1.0 22.47 ? 296 A 1 +ATOM 5147 H HG2 . PRO A1 1 306 ? -28.809 8.104 -14.895 1.0 22.46 ? 296 A 1 +ATOM 5148 H HG3 . PRO A1 1 306 ? -28.994 9.046 -13.628 1.0 22.46 ? 296 A 1 +ATOM 5149 H HD2 . PRO A1 1 306 ? -26.873 9.24 -15.077 1.0 19.12 ? 296 A 1 +ATOM 5150 H HD3 . PRO A1 1 306 ? -26.797 9.515 -13.514 1.0 19.12 ? 296 A 1 +ATOM 5151 N N . SER A1 1 307 ? -27.491 4.242 -14.263 1.0 17.22 ? 297 A 1 +ATOM 5152 C CA . SER A1 1 307 ? -28.104 3.269 -15.135 1.0 17.84 ? 297 A 1 +ATOM 5153 C C . SER A1 1 307 ? -29.438 3.83 -15.586 1.0 18.48 ? 297 A 1 +ATOM 5154 O O . SER A1 1 307 ? -30.138 4.481 -14.798 1.0 20.74 ? 297 A 1 +ATOM 5155 C CB . SER A1 1 307 ? -28.398 1.987 -14.352 1.0 21.77 ? 297 A 1 +ATOM 5156 O OG . SER A1 1 307 ? -27.22 1.477 -13.82 1.0 26.42 ? 297 A 1 +ATOM 5157 H H . SER A1 1 307 ? -27.328 3.946 -13.473 1.0 20.66 ? 297 A 1 +ATOM 5158 H HA . SER A1 1 307 ? -27.526 3.072 -15.888 1.0 21.41 ? 297 A 1 +ATOM 5159 H HB2 . SER A1 1 307 ? -29.014 2.187 -13.63 1.0 26.12 ? 297 A 1 +ATOM 5160 H HB3 . SER A1 1 307 ? -28.789 1.33 -14.949 1.0 26.12 ? 297 A 1 +ATOM 5161 H HG . SER A1 1 307 ? -26.669 1.326 -14.435 1.0 31.7 ? 297 A 1 +ATOM 5162 N N . PRO A1 1 308 ? -29.875 3.548 -16.803 1.0 18.81 ? 298 A 1 +ATOM 5163 C CA . PRO A1 1 308 ? -29.287 2.691 -17.843 1.0 19.51 ? 298 A 1 +ATOM 5164 C C . PRO A1 1 308 ? -28.384 3.456 -18.794 1.0 19.19 ? 298 A 1 +ATOM 5165 O O . PRO A1 1 308 ? -27.996 2.926 -19.874 1.0 21.47 ? 298 A 1 +ATOM 5166 C CB . PRO A1 1 308 ? -30.524 2.185 -18.561 1.0 22.74 ? 298 A 1 +ATOM 5167 C CG . PRO A1 1 308 ? -31.385 3.414 -18.625 1.0 21.38 ? 298 A 1 +ATOM 5168 C CD . PRO A1 1 308 ? -31.225 4.003 -17.202 1.0 20.72 ? 298 A 1 +ATOM 5169 H HA . PRO A1 1 308 ? -28.787 1.953 -17.461 1.0 23.41 ? 298 A 1 +ATOM 5170 H HB2 . PRO A1 1 308 ? -30.296 1.863 -19.447 1.0 27.28 ? 298 A 1 +ATOM 5171 H HB3 . PRO A1 1 308 ? -30.949 1.479 -18.05 1.0 27.28 ? 298 A 1 +ATOM 5172 H HG2 . PRO A1 1 308 ? -31.057 4.025 -19.303 1.0 25.65 ? 298 A 1 +ATOM 5173 H HG3 . PRO A1 1 308 ? -32.307 3.176 -18.81 1.0 25.65 ? 298 A 1 +ATOM 5174 H HD2 . PRO A1 1 308 ? -31.272 4.972 -17.221 1.0 24.86 ? 298 A 1 +ATOM 5175 H HD3 . PRO A1 1 308 ? -31.901 3.65 -16.603 1.0 24.86 ? 298 A 1 +ATOM 5176 N N . TYR A1 1 309 ? -28.048 4.695 -18.476 1.0 17.4 ? 299 A 1 +ATOM 5177 C CA . TYR A1 1 309 ? -27.313 5.569 -19.376 1.0 17.41 ? 299 A 1 +ATOM 5178 C C . TYR A1 1 309 ? -25.84 5.37 -19.284 1.0 17.3 ? 299 A 1 +ATOM 5179 O O . TYR A1 1 309 ? -25.127 5.583 -20.297 1.0 17.71 ? 299 A 1 +ATOM 5180 C CB . TYR A1 1 309 ? -27.624 7.062 -19.091 1.0 16.55 ? 299 A 1 +ATOM 5181 C CG . TYR A1 1 309 ? -29.097 7.333 -18.949 1.0 17.95 ? 299 A 1 +ATOM 5182 C CD1 . TYR A1 1 309 ? -29.976 7.055 -19.948 1.0 19.37 ? 299 A 1 +ATOM 5183 C CD2 . TYR A1 1 309 ? -29.591 7.86 -17.755 1.0 19.64 ? 299 A 1 +ATOM 5184 C CE1 . TYR A1 1 309 ? -31.362 7.307 -19.788 1.0 20.15 ? 299 A 1 +ATOM 5185 C CE2 . TYR A1 1 309 ? -30.955 8.118 -17.6 1.0 20.31 ? 299 A 1 +ATOM 5186 C CZ . TYR A1 1 309 ? -31.798 7.858 -18.612 1.0 20.09 ? 299 A 1 +ATOM 5187 O OH . TYR A1 1 309 ? -33.136 8.094 -18.468 1.0 25.16 ? 299 A 1 +ATOM 5188 H H . TYR A1 1 309 ? -28.237 5.066 -17.723 1.0 20.88 ? 299 A 1 +ATOM 5189 H HA . TYR A1 1 309 ? -27.608 5.362 -20.277 1.0 20.89 ? 299 A 1 +ATOM 5190 H HB2 . TYR A1 1 309 ? -27.189 7.322 -18.264 1.0 19.86 ? 299 A 1 +ATOM 5191 H HB3 . TYR A1 1 309 ? -27.289 7.6 -19.826 1.0 19.86 ? 299 A 1 +ATOM 5192 H HD1 . TYR A1 1 309 ? -29.664 6.695 -20.747 1.0 23.24 ? 299 A 1 +ATOM 5193 H HD2 . TYR A1 1 309 ? -29.005 8.042 -17.056 1.0 23.56 ? 299 A 1 +ATOM 5194 H HE1 . TYR A1 1 309 ? -31.963 7.102 -20.467 1.0 24.18 ? 299 A 1 +ATOM 5195 H HE2 . TYR A1 1 309 ? -31.277 8.468 -16.8 1.0 24.37 ? 299 A 1 +ATOM 5196 H HH . TYR A1 1 309 ? -33.288 8.436 -17.716 1.0 30.2 ? 299 A 1 +ATOM 5197 N N . ARG A1 1 310 ? -25.307 5.006 -18.114 1.0 16.47 ? 300 A 1 +ATOM 5198 C CA . ARG A1 1 310 ? -23.862 5.016 -17.918 1.0 17.46 ? 300 A 1 +ATOM 5199 C C . ARG A1 1 310 ? -23.14 4.226 -18.985 1.0 16.92 ? 300 A 1 +ATOM 5200 O O . ARG A1 1 310 ? -22.094 4.662 -19.47 1.0 17.43 ? 300 A 1 +ATOM 5201 C CB . ARG A1 1 310 ? -23.461 4.58 -16.489 1.0 18.08 ? 300 A 1 +ATOM 5202 C CG . ARG A1 1 310 ? -23.861 3.226 -16.118 1.0 19.9 ? 300 A 1 +ATOM 5203 C CD . ARG A1 1 310 ? -23.384 2.855 -14.689 1.0 22.89 ? 300 A 1 +ATOM 5204 N NE . ARG A1 1 310 ? -23.852 1.494 -14.415 1.0 26.31 ? 300 A 1 +ATOM 5205 C CZ . ARG A1 1 310 ? -23.528 0.76 -13.349 1.0 69.15 ? 300 A 1 +ATOM 5206 N NH1 . ARG A1 1 310 ? -22.671 1.216 -12.48 1.0 30.14 ? 300 A 1 +ATOM 5207 N NH2 . ARG A1 1 310 ? -24.04 -0.446 -13.169 1.0 34.75 ? 300 A 1 +ATOM 5208 H H . ARG A1 1 310 ? -25.757 4.751 -17.427 1.0 19.77 ? 300 A 1 +ATOM 5209 H HA . ARG A1 1 310 ? -23.569 5.937 -17.998 1.0 20.95 ? 300 A 1 +ATOM 5210 H HB2 . ARG A1 1 310 ? -22.495 4.627 -16.415 1.0 21.7 ? 300 A 1 +ATOM 5211 H HB3 . ARG A1 1 310 ? -23.873 5.188 -15.856 1.0 21.7 ? 300 A 1 +ATOM 5212 H HG2 . ARG A1 1 310 ? -24.829 3.161 -16.142 1.0 23.88 ? 300 A 1 +ATOM 5213 H HG3 . ARG A1 1 310 ? -23.471 2.594 -16.742 1.0 23.88 ? 300 A 1 +ATOM 5214 H HD2 . ARG A1 1 310 ? -22.415 2.879 -14.641 1.0 27.47 ? 300 A 1 +ATOM 5215 H HD3 . ARG A1 1 310 ? -23.764 3.465 -14.038 1.0 27.47 ? 300 A 1 +ATOM 5216 H HE . ARG A1 1 310 ? -24.381 1.137 -14.991 1.0 31.58 ? 300 A 1 +ATOM 5217 H HH11 . ARG A1 1 310 ? -22.314 1.99 -12.593 1.0 36.17 ? 300 A 1 +ATOM 5218 H HH12 . ARG A1 1 310 ? -22.462 0.744 -11.792 1.0 36.17 ? 300 A 1 +ATOM 5219 H HH21 . ARG A1 1 310 ? -24.591 -0.768 -13.745 1.0 41.69 ? 300 A 1 +ATOM 5220 H HH22 . ARG A1 1 310 ? -23.822 -0.907 -12.477 1.0 41.69 ? 300 A 1 +ATOM 5221 N N . GLN A1 1 311 ? -23.622 3.035 -19.295 1.0 17.02 ? 301 A 1 +ATOM 5222 C CA . GLN A1 1 311 ? -22.952 2.165 -20.232 1.0 18.4 ? 301 A 1 +ATOM 5223 C C . GLN A1 1 311 ? -22.954 2.708 -21.637 1.0 18.92 ? 301 A 1 +ATOM 5224 O O . GLN A1 1 311 ? -22.175 2.216 -22.48 1.0 20.56 ? 301 A 1 +ATOM 5225 C CB . GLN A1 1 311 ? -23.554 0.763 -20.219 1.0 20.57 ? 301 A 1 +ATOM 5226 C CG . GLN A1 1 311 ? -24.981 0.661 -20.525 1.0 24.2 ? 301 A 1 +ATOM 5227 C CD . GLN A1 1 311 ? -25.849 0.582 -19.299 1.0 63.45 ? 301 A 1 +ATOM 5228 O OE1 . GLN A1 1 311 ? -25.677 1.347 -18.358 1.0 25.71 ? 301 A 1 +ATOM 5229 N NE2 . GLN A1 1 311 ? -26.802 -0.349 -19.31 1.0 33.54 ? 301 A 1 +ATOM 5230 H H . GLN A1 1 311 ? -24.347 2.705 -18.97 1.0 20.42 ? 301 A 1 +ATOM 5231 H HA . GLN A1 1 311 ? -22.03 2.084 -19.942 1.0 22.08 ? 301 A 1 +ATOM 5232 H HB2 . GLN A1 1 311 ? -23.083 0.227 -20.877 1.0 24.69 ? 301 A 1 +ATOM 5233 H HB3 . GLN A1 1 311 ? -23.426 0.388 -19.334 1.0 24.69 ? 301 A 1 +ATOM 5234 H HG2 . GLN A1 1 311 ? -25.25 1.445 -21.03 1.0 29.04 ? 301 A 1 +ATOM 5235 H HG3 . GLN A1 1 311 ? -25.134 -0.14 -21.05 1.0 29.04 ? 301 A 1 +ATOM 5236 H HE21 . GLN A1 1 311 ? -26.894 -0.863 -19.993 1.0 40.24 ? 301 A 1 +ATOM 5237 H HE22 . GLN A1 1 311 ? -27.326 -0.435 -18.633 1.0 40.24 ? 301 A 1 +ATOM 5238 N N . LEU A1 1 312 ? -23.787 3.697 -21.933 1.0 16.42 ? 302 A 1 +ATOM 5239 C CA . LEU A1 1 312 ? -23.895 4.255 -23.284 1.0 16.46 ? 302 A 1 +ATOM 5240 C C . LEU A1 1 312 ? -22.96 5.443 -23.5 1.0 15.77 ? 302 A 1 +ATOM 5241 O O . LEU A1 1 312 ? -22.83 5.89 -24.672 1.0 15.8 ? 302 A 1 +ATOM 5242 C CB . LEU A1 1 312 ? -25.346 4.678 -23.576 1.0 16.9 ? 302 A 1 +ATOM 5243 C CG . LEU A1 1 312 ? -26.331 3.569 -23.443 1.0 17.68 ? 302 A 1 +ATOM 5244 C CD1 . LEU A1 1 312 ? -27.744 4.09 -23.676 1.0 19.23 ? 302 A 1 +ATOM 5245 C CD2 . LEU A1 1 312 ? -26.021 2.488 -24.407 1.0 20.07 ? 302 A 1 +ATOM 5246 H H . LEU A1 1 312 ? -24.311 4.072 -21.363 1.0 19.7 ? 302 A 1 +ATOM 5247 H HA . LEU A1 1 312 ? -23.662 3.567 -23.927 1.0 19.75 ? 302 A 1 +ATOM 5248 H HB2 . LEU A1 1 312 ? -25.599 5.376 -22.951 1.0 20.28 ? 302 A 1 +ATOM 5249 H HB3 . LEU A1 1 312 ? -25.396 5.013 -24.485 1.0 20.28 ? 302 A 1 +ATOM 5250 H HG . LEU A1 1 312 ? -26.28 3.204 -22.546 1.0 21.22 ? 302 A 1 +ATOM 5251 H HD11 . LEU A1 1 312 ? -28.371 3.356 -23.578 1.0 23.07 ? 302 A 1 +ATOM 5252 H HD12 . LEU A1 1 312 ? -27.939 4.78 -23.023 1.0 23.07 ? 302 A 1 +ATOM 5253 H HD13 . LEU A1 1 312 ? -27.802 4.457 -24.572 1.0 23.07 ? 302 A 1 +ATOM 5254 H HD21 . LEU A1 1 312 ? -26.784 1.892 -24.469 1.0 24.08 ? 302 A 1 +ATOM 5255 H HD22 . LEU A1 1 312 ? -25.836 2.881 -25.274 1.0 24.08 ? 302 A 1 +ATOM 5256 H HD23 . LEU A1 1 312 ? -25.244 1.998 -24.093 1.0 24.08 ? 302 A 1 +ATOM 5257 N N . TYR A1 1 313 ? -22.289 5.956 -22.488 1.0 15.68 ? 303 A 1 +ATOM 5258 C CA . TYR A1 1 313 ? -21.38 7.093 -22.681 1.0 14.66 ? 303 A 1 +ATOM 5259 C C . TYR A1 1 313 ? -20.004 6.561 -23.031 1.0 14.47 ? 303 A 1 +ATOM 5260 O O . TYR A1 1 313 ? -19.031 6.683 -22.3 1.0 15.1 ? 303 A 1 +ATOM 5261 C CB . TYR A1 1 313 ? -21.397 8.018 -21.48 1.0 15.6 ? 303 A 1 +ATOM 5262 C CG . TYR A1 1 313 ? -20.821 9.362 -21.745 1.0 13.97 ? 303 A 1 +ATOM 5263 C CD1 . TYR A1 1 313 ? -21.552 10.386 -22.332 1.0 13.97 ? 303 A 1 +ATOM 5264 C CD2 . TYR A1 1 313 ? -19.541 9.635 -21.317 1.0 15.45 ? 303 A 1 +ATOM 5265 C CE1 . TYR A1 1 313 ? -21.018 11.64 -22.503 1.0 13.67 ? 303 A 1 +ATOM 5266 C CE2 . TYR A1 1 313 ? -19.02 10.894 -21.476 1.0 16.97 ? 303 A 1 +ATOM 5267 C CZ . TYR A1 1 313 ? -19.748 11.872 -22.017 1.0 16.39 ? 303 A 1 +ATOM 5268 O OH . TYR A1 1 313 ? -19.292 13.169 -22.168 1.0 19.86 ? 303 A 1 +ATOM 5269 H H . TYR A1 1 313 ? -22.337 5.672 -21.678 1.0 18.82 ? 303 A 1 +ATOM 5270 H HA . TYR A1 1 313 ? -21.682 7.629 -23.431 1.0 17.6 ? 303 A 1 +ATOM 5271 H HB2 . TYR A1 1 313 ? -22.316 8.142 -21.196 1.0 18.72 ? 303 A 1 +ATOM 5272 H HB3 . TYR A1 1 313 ? -20.881 7.611 -20.766 1.0 18.72 ? 303 A 1 +ATOM 5273 H HD1 . TYR A1 1 313 ? -22.422 10.219 -22.615 1.0 16.76 ? 303 A 1 +ATOM 5274 H HD2 . TYR A1 1 313 ? -19.03 8.966 -20.922 1.0 18.54 ? 303 A 1 +ATOM 5275 H HE1 . TYR A1 1 313 ? -21.498 12.311 -22.932 1.0 16.4 ? 303 A 1 +ATOM 5276 H HE2 . TYR A1 1 313 ? -18.149 11.068 -21.202 1.0 20.36 ? 303 A 1 +ATOM 5277 H HH . TYR A1 1 313 ? -18.545 13.256 -21.794 1.0 23.84 ? 303 A 1 +ATOM 5278 N N . GLN A1 1 314 ? -19.969 5.96 -24.216 1.0 14.85 ? 304 A 1 +ATOM 5279 C CA . GLN A1 1 314 ? -18.878 5.075 -24.626 1.0 17.33 ? 304 A 1 +ATOM 5280 C C . GLN A1 1 314 ? -17.781 5.827 -25.386 1.0 15.71 ? 304 A 1 +ATOM 5281 O O . GLN A1 1 314 ? -17.565 5.592 -26.577 1.0 16.47 ? 304 A 1 +ATOM 5282 C CB A GLN A1 1 314 ? -19.4 3.855 -25.415 0.79 17.21 ? 304 A 1 +ATOM 5283 C CG A GLN A1 1 314 ? -20.194 2.877 -24.616 0.79 24.87 ? 304 A 1 +ATOM 5284 C CD A GLN A1 1 314 ? -20.661 1.688 -25.458 0.79 73.53 ? 304 A 1 +ATOM 5285 O OE1 A GLN A1 1 314 ? -20.007 1.285 -26.416 0.79 32.47 ? 304 A 1 +ATOM 5286 N NE2 A GLN A1 1 314 ? -21.806 1.131 -25.1 0.79 31.79 ? 304 A 1 +ATOM 5287 H H . GLN A1 1 314 ? -20.579 6.05 -24.816 1.0 17.81 ? 304 A 1 +ATOM 5288 H HA . GLN A1 1 314 ? -18.475 4.736 -23.812 1.0 20.79 ? 304 A 1 +ATOM 5289 H HB2 A GLN A1 1 314 ? -19.97 4.174 -26.132 0.79 20.65 ? 304 A 1 +ATOM 5290 H HB3 A GLN A1 1 314 ? -18.639 3.379 -25.782 0.79 20.65 ? 304 A 1 +ATOM 5291 H HG2 A GLN A1 1 314 ? -19.646 2.538 -23.891 0.79 29.84 ? 304 A 1 +ATOM 5292 H HG3 A GLN A1 1 314 ? -20.979 3.321 -24.258 0.79 29.84 ? 304 A 1 +ATOM 5293 H HE21 A GLN A1 1 314 ? -22.243 1.441 -24.427 0.79 38.15 ? 304 A 1 +ATOM 5294 H HE22 A GLN A1 1 314 ? -22.113 0.46 -25.54 0.79 38.15 ? 304 A 1 +ATOM 5295 N N . LEU A1 1 315 ? -17.1 6.765 -24.716 1.0 15.71 ? 305 A 1 +ATOM 5296 C CA . LEU A1 1 315 ? -16.03 7.542 -25.374 1.0 15.41 ? 305 A 1 +ATOM 5297 C C . LEU A1 1 315 ? -14.989 6.586 -25.921 1.0 16.25 ? 305 A 1 +ATOM 5298 O O . LEU A1 1 315 ? -14.458 6.787 -27.031 1.0 15.31 ? 305 A 1 +ATOM 5299 C CB . LEU A1 1 315 ? -15.346 8.461 -24.376 1.0 15.3 ? 305 A 1 +ATOM 5300 C CG . LEU A1 1 315 ? -16.209 9.51 -23.675 1.0 15.67 ? 305 A 1 +ATOM 5301 C CD1 . LEU A1 1 315 ? -15.35 10.234 -22.596 1.0 16.07 ? 305 A 1 +ATOM 5302 C CD2 . LEU A1 1 315 ? -16.79 10.509 -24.636 1.0 16.96 ? 305 A 1 +ATOM 5303 H H . LEU A1 1 315 ? -17.232 6.972 -23.892 1.0 18.86 ? 305 A 1 +ATOM 5304 H HA . LEU A1 1 315 ? -16.42 8.083 -26.078 1.0 18.49 ? 305 A 1 +ATOM 5305 H HB2 . LEU A1 1 315 ? -14.958 7.907 -23.681 1.0 18.36 ? 305 A 1 +ATOM 5306 H HB3 . LEU A1 1 315 ? -14.647 8.941 -24.847 1.0 18.36 ? 305 A 1 +ATOM 5307 H HG . LEU A1 1 315 ? -16.961 9.063 -23.256 1.0 18.8 ? 305 A 1 +ATOM 5308 H HD11 . LEU A1 1 315 ? -15.9 10.894 -22.145 1.0 19.28 ? 305 A 1 +ATOM 5309 H HD12 . LEU A1 1 315 ? -15.028 9.579 -21.957 1.0 19.28 ? 305 A 1 +ATOM 5310 H HD13 . LEU A1 1 315 ? -14.599 10.669 -23.03 1.0 19.28 ? 305 A 1 +ATOM 5311 H HD21 . LEU A1 1 315 ? -17.342 11.136 -24.144 1.0 20.35 ? 305 A 1 +ATOM 5312 H HD22 . LEU A1 1 315 ? -16.066 10.982 -25.076 1.0 20.35 ? 305 A 1 +ATOM 5313 H HD23 . LEU A1 1 315 ? -17.327 10.04 -25.293 1.0 20.35 ? 305 A 1 +ATOM 5314 N N . TYR A1 1 316 ? -14.673 5.548 -25.152 1.0 14.82 ? 306 A 1 +ATOM 5315 C CA . TYR A1 1 316 ? -13.669 4.543 -25.473 1.0 16.82 ? 306 A 1 +ATOM 5316 C C . TYR A1 1 316 ? -14.016 3.255 -24.754 1.0 15.9 ? 306 A 1 +ATOM 5317 O O . TYR A1 1 316 ? -14.711 3.276 -23.721 1.0 17.33 ? 306 A 1 +ATOM 5318 C CB . TYR A1 1 316 ? -12.248 5.01 -25.07 1.0 16.15 ? 306 A 1 +ATOM 5319 C CG . TYR A1 1 316 ? -12.156 5.626 -23.698 1.0 14.71 ? 306 A 1 +ATOM 5320 C CD1 . TYR A1 1 316 ? -12.046 4.836 -22.566 1.0 16.48 ? 306 A 1 +ATOM 5321 C CD2 . TYR A1 1 316 ? -12.173 6.982 -23.535 1.0 14.18 ? 306 A 1 +ATOM 5322 C CE1 . TYR A1 1 316 ? -11.97 5.433 -21.302 1.0 15.72 ? 306 A 1 +ATOM 5323 C CE2 . TYR A1 1 316 ? -12.12 7.56 -22.279 1.0 15.35 ? 306 A 1 +ATOM 5324 C CZ . TYR A1 1 316 ? -12.041 6.764 -21.184 1.0 13.22 ? 306 A 1 +ATOM 5325 O OH . TYR A1 1 316 ? -11.957 7.319 -19.915 1.0 16.85 ? 306 A 1 +ATOM 5326 H H . TYR A1 1 316 ? -15.05 5.395 -24.394 1.0 17.78 ? 306 A 1 +ATOM 5327 H HA . TYR A1 1 316 ? -13.683 4.374 -26.428 1.0 20.18 ? 306 A 1 +ATOM 5328 H HB2 . TYR A1 1 316 ? -11.655 4.242 -25.086 1.0 19.38 ? 306 A 1 +ATOM 5329 H HB3 . TYR A1 1 316 ? -11.948 5.675 -25.71 1.0 19.38 ? 306 A 1 +ATOM 5330 H HD1 . TYR A1 1 316 ? -12.022 3.909 -22.646 1.0 19.77 ? 306 A 1 +ATOM 5331 H HD2 . TYR A1 1 316 ? -12.223 7.529 -24.286 1.0 17.01 ? 306 A 1 +ATOM 5332 H HE1 . TYR A1 1 316 ? -11.87 4.904 -20.543 1.0 18.87 ? 306 A 1 +ATOM 5333 H HE2 . TYR A1 1 316 ? -12.138 8.485 -22.187 1.0 18.42 ? 306 A 1 +ATOM 5334 H HH . TYR A1 1 316 ? -12.029 8.154 -19.961 1.0 20.21 ? 306 A 1 +ATOM 5335 N N . PRO A1 1 317 ? -13.536 2.128 -25.241 1.0 17.12 ? 307 A 1 +ATOM 5336 C CA . PRO A1 1 317 ? -13.842 0.847 -24.607 1.0 18.02 ? 307 A 1 +ATOM 5337 C C . PRO A1 1 317 ? -13.255 0.758 -23.21 1.0 18.07 ? 307 A 1 +ATOM 5338 O O . PRO A1 1 317 ? -12.182 1.317 -22.92 1.0 19.39 ? 307 A 1 +ATOM 5339 C CB . PRO A1 1 317 ? -13.237 -0.198 -25.558 1.0 20.8 ? 307 A 1 +ATOM 5340 C CG . PRO A1 1 317 ? -12.238 0.542 -26.322 1.0 23.69 ? 307 A 1 +ATOM 5341 C CD . PRO A1 1 317 ? -12.718 1.944 -26.454 1.0 18.49 ? 307 A 1 +ATOM 5342 H HA . PRO A1 1 317 ? -14.801 0.708 -24.563 1.0 21.62 ? 307 A 1 +ATOM 5343 H HB2 . PRO A1 1 317 ? -12.827 -0.914 -25.048 1.0 24.96 ? 307 A 1 +ATOM 5344 H HB3 . PRO A1 1 317 ? -13.926 -0.558 -26.139 1.0 24.96 ? 307 A 1 +ATOM 5345 H HG2 . PRO A1 1 317 ? -11.392 0.519 -25.848 1.0 28.42 ? 307 A 1 +ATOM 5346 H HG3 . PRO A1 1 317 ? -12.139 0.135 -27.197 1.0 28.42 ? 307 A 1 +ATOM 5347 H HD2 . PRO A1 1 317 ? -11.974 2.566 -26.468 1.0 22.19 ? 307 A 1 +ATOM 5348 H HD3 . PRO A1 1 317 ? -13.256 2.052 -27.254 1.0 22.19 ? 307 A 1 +ATOM 5349 N N . GLY A1 1 318 ? -13.971 0.031 -22.367 1.0 19.52 ? 308 A 1 +ATOM 5350 C CA . GLY A1 1 318 ? -13.543 -0.183 -20.986 1.0 19.47 ? 308 A 1 +ATOM 5351 C C . GLY A1 1 318 ? -13.8 0.961 -20.06 1.0 19.42 ? 308 A 1 +ATOM 5352 O O . GLY A1 1 318 ? -13.447 0.854 -18.878 1.0 19.58 ? 308 A 1 +ATOM 5353 H H . GLY A1 1 318 ? -14.714 -0.353 -22.567 1.0 23.43 ? 308 A 1 +ATOM 5354 H HA2 . GLY A1 1 318 ? -14.007 -0.958 -20.634 1.0 23.37 ? 308 A 1 +ATOM 5355 H HA3 . GLY A1 1 318 ? -12.589 -0.358 -20.981 1.0 23.37 ? 308 A 1 +ATOM 5356 N N . LYS A1 1 319 ? -14.383 2.061 -20.539 1.0 20.14 ? 309 A 1 +ATOM 5357 C CA . LYS A1 1 319 ? -14.572 3.242 -19.69 1.0 18.89 ? 309 A 1 +ATOM 5358 C C . LYS A1 1 319 ? -15.468 2.964 -18.5 1.0 21.67 ? 309 A 1 +ATOM 5359 O O . LYS A1 1 319 ? -15.23 3.451 -17.389 1.0 20.12 ? 309 A 1 +ATOM 5360 C CB . LYS A1 1 319 ? -15.172 4.345 -20.494 1.0 17.63 ? 309 A 1 +ATOM 5361 C CG . LYS A1 1 319 ? -15.379 5.642 -19.676 1.0 18.42 ? 309 A 1 +ATOM 5362 C CD . LYS A1 1 319 ? -15.923 6.751 -20.479 1.0 20.1 ? 309 A 1 +ATOM 5363 C CE . LYS A1 1 319 ? -16.266 7.969 -19.631 1.0 19.54 ? 309 A 1 +ATOM 5364 N NZ . LYS A1 1 319 ? -17.229 7.634 -18.517 1.0 22.39 ? 309 A 1 +ATOM 5365 H H . LYS A1 1 319 ? -14.676 2.151 -21.343 1.0 24.17 ? 309 A 1 +ATOM 5366 H HA . LYS A1 1 319 ? -13.701 3.508 -19.358 1.0 22.67 ? 309 A 1 +ATOM 5367 H HB2 . LYS A1 1 319 ? -14.583 4.55 -21.237 1.0 21.16 ? 309 A 1 +ATOM 5368 H HB3 . LYS A1 1 319 ? -16.037 4.059 -20.826 1.0 21.16 ? 309 A 1 +ATOM 5369 H HG2 . LYS A1 1 319 ? -16.001 5.464 -18.954 1.0 22.1 ? 309 A 1 +ATOM 5370 H HG3 . LYS A1 1 319 ? -14.525 5.927 -19.315 1.0 22.1 ? 309 A 1 +ATOM 5371 H HD2 . LYS A1 1 319 ? -15.264 7.02 -21.139 1.0 24.12 ? 309 A 1 +ATOM 5372 H HD3 . LYS A1 1 319 ? -16.734 6.455 -20.922 1.0 24.12 ? 309 A 1 +ATOM 5373 H HE2 . LYS A1 1 319 ? -15.453 8.319 -19.233 1.0 23.45 ? 309 A 1 +ATOM 5374 H HE3 . LYS A1 1 319 ? -16.677 8.644 -20.194 1.0 23.45 ? 309 A 1 +ATOM 5375 H HZ1 . LYS A1 1 319 ? -17.493 8.379 -18.109 1.0 26.86 ? 309 A 1 +ATOM 5376 H HZ2 . LYS A1 1 319 ? -17.942 7.217 -18.847 1.0 26.86 ? 309 A 1 +ATOM 5377 H HZ3 . LYS A1 1 319 ? -16.833 7.103 -17.922 1.0 26.86 ? 309 A 1 +ATOM 5378 N N . ILE A1 1 320 ? -16.517 2.178 -18.712 1.0 24.59 ? 310 A 1 +ATOM 5379 C CA . ILE A1 1 320 ? -17.585 1.995 -17.76 1.0 22.85 ? 310 A 1 +ATOM 5380 C C . ILE A1 1 320 ? -17.492 0.581 -17.212 1.0 24.84 ? 310 A 1 +ATOM 5381 O O . ILE A1 1 320 ? -17.293 -0.355 -17.989 1.0 29.21 ? 310 A 1 +ATOM 5382 C CB . ILE A1 1 320 ? -18.937 2.218 -18.478 1.0 24.18 ? 310 A 1 +ATOM 5383 C CG1 . ILE A1 1 320 ? -18.993 3.639 -19.055 1.0 32.19 ? 310 A 1 +ATOM 5384 C CG2 . ILE A1 1 320 ? -20.087 2.001 -17.498 1.0 26.48 ? 310 A 1 +ATOM 5385 C CD1 . ILE A1 1 320 ? -19.09 3.684 -20.578 1.0 31.92 ? 310 A 1 +ATOM 5386 H H . ILE A1 1 320 ? -16.629 1.723 -19.434 1.0 29.51 ? 310 A 1 +ATOM 5387 H HA . ILE A1 1 320 ? -17.497 2.609 -17.014 1.0 27.42 ? 310 A 1 +ATOM 5388 H HB . ILE A1 1 320 ? -19.018 1.581 -19.205 1.0 29.02 ? 310 A 1 +ATOM 5389 H HG12 . ILE A1 1 320 ? -19.772 4.091 -18.696 1.0 38.62 ? 310 A 1 +ATOM 5390 H HG13 . ILE A1 1 320 ? -18.186 4.112 -18.797 1.0 38.62 ? 310 A 1 +ATOM 5391 H HG21 . ILE A1 1 320 ? -20.915 2.29 -17.914 1.0 31.77 ? 310 A 1 +ATOM 5392 H HG22 . ILE A1 1 320 ? -20.14 1.058 -17.277 1.0 31.77 ? 310 A 1 +ATOM 5393 H HG23 . ILE A1 1 320 ? -19.921 2.52 -16.696 1.0 31.77 ? 310 A 1 +ATOM 5394 H HD11 . ILE A1 1 320 ? -19.127 4.61 -20.865 1.0 38.3 ? 310 A 1 +ATOM 5395 H HD12 . ILE A1 1 320 ? -18.31 3.251 -20.958 1.0 38.3 ? 310 A 1 +ATOM 5396 H HD13 . ILE A1 1 320 ? -19.895 3.219 -20.857 1.0 38.3 ? 310 A 1 +ATOM 5397 N N . SER A1 1 321 ? -17.602 0.404 -15.902 1.0 22.11 ? 311 A 1 +ATOM 5398 C CA . SER A1 1 321 ? -17.868 -0.902 -15.328 1.0 26.14 ? 311 A 1 +ATOM 5399 C C . SER A1 1 321 ? -19.333 -0.976 -14.938 1.0 20.64 ? 311 A 1 +ATOM 5400 O O . SER A1 1 321 ? -19.854 -0.039 -14.314 1.0 27.49 ? 311 A 1 +ATOM 5401 C CB . SER A1 1 321 ? -17.051 -1.185 -14.068 1.0 24.66 ? 311 A 1 +ATOM 5402 O OG . SER A1 1 321 ? -17.387 -2.461 -13.589 1.0 26.64 ? 311 A 1 +ATOM 5403 H H . SER A1 1 321 ? -17.524 1.033 -15.321 1.0 26.53 ? 311 A 1 +ATOM 5404 H HA . SER A1 1 321 ? -17.636 -1.569 -15.993 1.0 31.37 ? 311 A 1 +ATOM 5405 H HB2 . SER A1 1 321 ? -16.105 -1.157 -14.282 1.0 29.59 ? 311 A 1 +ATOM 5406 H HB3 . SER A1 1 321 ? -17.257 -0.52 -13.392 1.0 29.59 ? 311 A 1 +ATOM 5407 H HG . SER A1 1 321 ? -16.962 -2.624 -12.883 1.0 31.97 ? 311 A 1 +ATOM 5408 N N . VAL A1 1 322 ? -19.937 -2.097 -15.243 1.0 23.31 ? 312 A 1 +ATOM 5409 C CA . VAL A1 1 322 ? -21.317 -2.34 -14.845 1.0 24.23 ? 312 A 1 +ATOM 5410 C C . VAL A1 1 322 ? -21.434 -3.435 -13.791 1.0 22.2 ? 312 A 1 +ATOM 5411 O O . VAL A1 1 322 ? -22.501 -3.895 -13.508 1.0 23.1 ? 312 A 1 +ATOM 5412 C CB . VAL A1 1 322 ? -22.224 -2.624 -16.05 1.0 40.4 ? 312 A 1 +ATOM 5413 C CG1 . VAL A1 1 322 ? -22.41 -1.349 -16.863 1.0 38.25 ? 312 A 1 +ATOM 5414 C CG2 . VAL A1 1 322 ? -21.653 -3.767 -16.876 1.0 27.49 ? 312 A 1 +ATOM 5415 H H . VAL A1 1 322 ? -19.574 -2.741 -15.682 1.0 27.98 ? 312 A 1 +ATOM 5416 H HA . VAL A1 1 322 ? -21.632 -1.522 -14.43 1.0 29.07 ? 312 A 1 +ATOM 5417 H HB . VAL A1 1 322 ? -23.103 -2.905 -15.753 1.0 48.47 ? 312 A 1 +ATOM 5418 H HG11 . VAL A1 1 322 ? -22.988 -1.537 -17.618 1.0 45.91 ? 312 A 1 +ATOM 5419 H HG12 . VAL A1 1 322 ? -22.814 -0.671 -16.299 1.0 45.91 ? 312 A 1 +ATOM 5420 H HG13 . VAL A1 1 322 ? -21.544 -1.045 -17.176 1.0 45.91 ? 312 A 1 +ATOM 5421 H HG21 . VAL A1 1 322 ? -22.284 -3.995 -17.577 1.0 32.99 ? 312 A 1 +ATOM 5422 H HG22 . VAL A1 1 322 ? -20.811 -3.485 -17.266 1.0 32.99 ? 312 A 1 +ATOM 5423 H HG23 . VAL A1 1 322 ? -21.51 -4.533 -16.298 1.0 32.99 ? 312 A 1 +ATOM 5424 N N . PHE A1 1 323 ? -20.31 -3.785 -13.16 1.0 23.98 ? 313 A 1 +ATOM 5425 C CA . PHE A1 1 323 ? -20.31 -4.833 -12.176 1.0 25.04 ? 313 A 1 +ATOM 5426 C C . PHE A1 1 323 ? -20.889 -4.409 -10.834 1.0 25.55 ? 313 A 1 +ATOM 5427 O O . PHE A1 1 323 ? -21.292 -5.278 -10.057 1.0 31.7 ? 313 A 1 +ATOM 5428 C CB . PHE A1 1 323 ? -18.858 -5.33 -11.995 1.0 31.16 ? 313 A 1 +ATOM 5429 C CG . PHE A1 1 323 ? -18.69 -6.807 -12.186 1.0 29.22 ? 313 A 1 +ATOM 5430 C CD1 . PHE A1 1 323 ? -19.032 -7.409 -13.373 1.0 33.8 ? 313 A 1 +ATOM 5431 C CD2 . PHE A1 1 323 ? -18.142 -7.577 -11.188 1.0 32.48 ? 313 A 1 +ATOM 5432 C CE1 . PHE A1 1 323 ? -18.87 -8.785 -13.528 1.0 36.76 ? 313 A 1 +ATOM 5433 C CE2 . PHE A1 1 323 ? -17.981 -8.924 -11.345 1.0 40.01 ? 313 A 1 +ATOM 5434 C CZ . PHE A1 1 323 ? -18.351 -9.517 -12.532 1.0 43.86 ? 313 A 1 +ATOM 5435 H H . PHE A1 1 323 ? -19.542 -3.422 -13.294 1.0 28.78 ? 313 A 1 +ATOM 5436 H HA . PHE A1 1 323 ? -20.861 -5.567 -12.489 1.0 30.04 ? 313 A 1 +ATOM 5437 H HB2 . PHE A1 1 323 ? -18.293 -4.883 -12.644 1.0 37.39 ? 313 A 1 +ATOM 5438 H HB3 . PHE A1 1 323 ? -18.565 -5.114 -11.096 1.0 37.39 ? 313 A 1 +ATOM 5439 H HD1 . PHE A1 1 323 ? -19.372 -6.899 -14.073 1.0 40.56 ? 313 A 1 +ATOM 5440 H HD2 . PHE A1 1 323 ? -17.877 -7.175 -10.393 1.0 38.97 ? 313 A 1 +ATOM 5441 H HE1 . PHE A1 1 323 ? -19.121 -9.195 -14.323 1.0 44.11 ? 313 A 1 +ATOM 5442 H HE2 . PHE A1 1 323 ? -17.624 -9.437 -10.656 1.0 48.01 ? 313 A 1 +ATOM 5443 H HZ . PHE A1 1 323 ? -18.241 -10.434 -12.643 1.0 52.63 ? 313 A 1 +ATOM 5444 N N . GLU A1 1 324 ? -20.959 -3.11 -10.558 1.0 24.69 ? 314 A 1 +ATOM 5445 C CA . GLU A1 1 324 ? -21.51 -2.624 -9.29 1.0 24.5 ? 314 A 1 +ATOM 5446 C C . GLU A1 1 324 ? -22.658 -1.64 -9.554 1.0 25.68 ? 314 A 1 +ATOM 5447 O O . GLU A1 1 324 ? -22.822 -1.103 -10.658 1.0 24.92 ? 314 A 1 +ATOM 5448 C CB . GLU A1 1 324 ? -20.437 -1.928 -8.438 1.0 27.86 ? 314 A 1 +ATOM 5449 C CG . GLU A1 1 324 ? -19.16 -2.751 -8.139 1.0 52.87 ? 314 A 1 +ATOM 5450 C CD . GLU A1 1 324 ? -19.422 -3.945 -7.245 1.0 83.51 ? 314 A 1 +ATOM 5451 O OE1 . GLU A1 1 324 ? -20.33 -3.856 -6.393 1.0 102.39 ? 314 A 1 +ATOM 5452 O OE2 . GLU A1 1 324 ? -18.723 -4.974 -7.392 1.0 83.86 ? 314 A 1 +ATOM 5453 H H . GLU A1 1 324 ? -20.694 -2.487 -11.088 1.0 29.63 ? 314 A 1 +ATOM 5454 H HA . GLU A1 1 324 ? -21.859 -3.381 -8.793 1.0 29.4 ? 314 A 1 +ATOM 5455 H HB2 . GLU A1 1 324 ? -20.156 -1.124 -8.903 1.0 33.43 ? 314 A 1 +ATOM 5456 H HB3 . GLU A1 1 324 ? -20.833 -1.695 -7.584 1.0 33.43 ? 314 A 1 +ATOM 5457 H HG2 . GLU A1 1 324 ? -18.794 -3.079 -8.975 1.0 63.44 ? 314 A 1 +ATOM 5458 H HG3 . GLU A1 1 324 ? -18.514 -2.18 -7.695 1.0 63.44 ? 314 A 1 +ATOM 5459 N N . LYS A1 1 325 ? -23.476 -1.436 -8.531 1.0 25.65 ? 315 A 1 +ATOM 5460 C CA . LYS A1 1 325 ? -24.557 -0.449 -8.595 1.0 25.72 ? 315 A 1 +ATOM 5461 C C . LYS A1 1 325 ? -24.026 0.953 -8.89 1.0 21.53 ? 315 A 1 +ATOM 5462 O O . LYS A1 1 325 ? -22.887 1.295 -8.589 1.0 21.86 ? 315 A 1 +ATOM 5463 C CB . LYS A1 1 325 ? -25.325 -0.44 -7.254 1.0 31.43 ? 315 A 1 +ATOM 5464 C CG . LYS A1 1 325 ? -24.549 0.06 -6.041 1.0 73.12 ? 315 A 1 +ATOM 5465 C CD . LYS A1 1 325 ? -25.355 -0.162 -4.756 1.0 65.48 ? 315 A 1 +ATOM 5466 H H . LYS A1 1 325 ? -23.431 -1.855 -7.781 1.0 30.78 ? 315 A 1 +ATOM 5467 H HA . LYS A1 1 325 ? -25.163 -0.689 -9.313 1.0 30.86 ? 315 A 1 +ATOM 5468 H HB2 . LYS A1 1 325 ? -26.101 0.132 -7.353 1.0 37.72 ? 315 A 1 +ATOM 5469 H HB3 . LYS A1 1 325 ? -25.605 -1.349 -7.059 1.0 37.72 ? 315 A 1 +ATOM 5470 H HG2 . LYS A1 1 325 ? -23.712 -0.424 -5.969 1.0 87.74 ? 315 A 1 +ATOM 5471 H HG3 . LYS A1 1 325 ? -24.376 1.01 -6.137 1.0 87.74 ? 315 A 1 +ATOM 5472 N N . ASP A1 1 326 ? -24.868 1.794 -9.538 1.0 19.92 ? 316 A 1 +ATOM 5473 C CA . ASP A1 1 326 ? -24.454 3.09 -10.013 1.0 18.3 ? 316 A 1 +ATOM 5474 C C . ASP A1 1 326 ? -24.228 4.137 -8.931 1.0 19.27 ? 316 A 1 +ATOM 5475 O O . ASP A1 1 326 ? -23.816 5.241 -9.24 1.0 20.65 ? 316 A 1 +ATOM 5476 C CB . ASP A1 1 326 ? -25.371 3.597 -11.129 1.0 17.69 ? 316 A 1 +ATOM 5477 C CG . ASP A1 1 326 ? -26.736 3.983 -10.663 1.0 18.65 ? 316 A 1 +ATOM 5478 O OD1 . ASP A1 1 326 ? -26.908 4.285 -9.447 1.0 21.16 ? 316 A 1 +ATOM 5479 O OD2 . ASP A1 1 326 ? -27.682 4.022 -11.449 1.0 19.7 ? 316 A 1 +ATOM 5480 H H . ASP A1 1 326 ? -25.692 1.615 -9.707 1.0 23.91 ? 316 A 1 +ATOM 5481 H HA . ASP A1 1 326 ? -23.583 2.973 -10.423 1.0 21.96 ? 316 A 1 +ATOM 5482 H HB2 . ASP A1 1 326 ? -24.966 4.379 -11.535 1.0 21.23 ? 316 A 1 +ATOM 5483 H HB3 . ASP A1 1 326 ? -25.473 2.895 -11.791 1.0 21.23 ? 316 A 1 +ATOM 5484 N N . THR A1 1 327 ? -24.415 3.789 -7.668 1.0 20.47 ? 317 A 1 +ATOM 5485 C CA . THR A1 1 327 ? -24.059 4.685 -6.564 1.0 21.89 ? 317 A 1 +ATOM 5486 C C . THR A1 1 327 ? -22.764 4.293 -5.893 1.0 24.01 ? 317 A 1 +ATOM 5487 O O . THR A1 1 327 ? -22.422 4.87 -4.856 1.0 23.85 ? 317 A 1 +ATOM 5488 C CB . THR A1 1 327 ? -25.153 4.702 -5.506 1.0 24.67 ? 317 A 1 +ATOM 5489 O OG1 . THR A1 1 327 ? -25.482 3.363 -5.172 1.0 27.53 ? 317 A 1 +ATOM 5490 C CG2 . THR A1 1 327 ? -26.396 5.4 -6.009 1.0 25.25 ? 317 A 1 +ATOM 5491 H H . THR A1 1 327 ? -24.749 3.036 -7.417 1.0 24.57 ? 317 A 1 +ATOM 5492 H HA . THR A1 1 327 ? -23.971 5.576 -6.935 1.0 26.27 ? 317 A 1 +ATOM 5493 H HB . THR A1 1 327 ? -24.837 5.183 -4.726 1.0 29.61 ? 317 A 1 +ATOM 5494 H HG1 . THR A1 1 327 ? -26.102 3.352 -4.605 1.0 33.03 ? 317 A 1 +ATOM 5495 H HG21 . THR A1 1 327 ? -27.08 5.395 -5.322 1.0 30.3 ? 317 A 1 +ATOM 5496 H HG22 . THR A1 1 327 ? -26.19 6.319 -6.241 1.0 30.3 ? 317 A 1 +ATOM 5497 H HG23 . THR A1 1 327 ? -26.737 4.945 -6.796 1.0 30.3 ? 317 A 1 +ATOM 5498 N N . ALA A1 1 328 ? -22.009 3.37 -6.455 1.0 18.76 ? 318 A 1 +ATOM 5499 C CA . ALA A1 1 328 ? -20.843 2.86 -5.758 1.0 19.62 ? 318 A 1 +ATOM 5500 C C . ALA A1 1 328 ? -19.644 3.769 -5.899 1.0 18.27 ? 318 A 1 +ATOM 5501 O O . ALA A1 1 328 ? -18.714 3.686 -5.088 1.0 19.65 ? 318 A 1 +ATOM 5502 C CB . ALA A1 1 328 ? -20.469 1.477 -6.311 1.0 26.21 ? 318 A 1 +ATOM 5503 H H . ALA A1 1 328 ? -22.148 3.024 -7.23 1.0 22.51 ? 318 A 1 +ATOM 5504 H HA . ALA A1 1 328 ? -21.059 2.774 -4.817 1.0 23.55 ? 318 A 1 +ATOM 5505 H HB1 . ALA A1 1 328 ? -19.69 1.147 -5.836 1.0 31.46 ? 318 A 1 +ATOM 5506 H HB2 . ALA A1 1 328 ? -21.216 0.872 -6.182 1.0 31.46 ? 318 A 1 +ATOM 5507 H HB3 . ALA A1 1 328 ? -20.269 1.558 -7.257 1.0 31.46 ? 318 A 1 +ATOM 5508 N N . SER A1 1 329 ? -19.561 4.622 -6.929 1.0 18.3 ? 319 A 1 +ATOM 5509 C CA . SER A1 1 329 ? -18.293 5.27 -7.242 1.0 17.23 ? 319 A 1 +ATOM 5510 C C . SER A1 1 329 ? -17.842 6.284 -6.188 1.0 17.17 ? 319 A 1 +ATOM 5511 O O . SER A1 1 329 ? -16.639 6.365 -5.917 1.0 17.99 ? 319 A 1 +ATOM 5512 C CB . SER A1 1 329 ? -18.312 5.978 -8.581 1.0 16.69 ? 319 A 1 +ATOM 5513 O OG . SER A1 1 329 ? -19.32 6.988 -8.53 1.0 19.34 ? 319 A 1 +ATOM 5514 H H . SER A1 1 329 ? -20.214 4.836 -7.447 1.0 21.96 ? 319 A 1 +ATOM 5515 H HA . SER A1 1 329 ? -17.657 4.539 -7.279 1.0 20.67 ? 319 A 1 +ATOM 5516 H HB2 . SER A1 1 329 ? -17.448 6.387 -8.747 1.0 20.03 ? 319 A 1 +ATOM 5517 H HB3 . SER A1 1 329 ? -18.519 5.344 -9.284 1.0 20.03 ? 319 A 1 +ATOM 5518 H HG . SER A1 1 329 ? -19.361 7.39 -9.267 1.0 23.2 ? 319 A 1 +ATOM 5519 N N . ILE A1 1 330 ? -18.751 7.058 -5.601 1.0 17.95 ? 320 A 1 +ATOM 5520 C CA . ILE A1 1 330 ? -18.299 8.056 -4.626 1.0 16.79 ? 320 A 1 +ATOM 5521 C C . ILE A1 1 330 ? -17.751 7.36 -3.392 1.0 18.68 ? 320 A 1 +ATOM 5522 O O . ILE A1 1 330 ? -16.625 7.67 -2.977 1.0 17.76 ? 320 A 1 +ATOM 5523 C CB . ILE A1 1 330 ? -19.393 9.109 -4.365 1.0 17.5 ? 320 A 1 +ATOM 5524 C CG1 . ILE A1 1 330 ? -19.606 9.965 -5.622 1.0 17.26 ? 320 A 1 +ATOM 5525 C CG2 . ILE A1 1 330 ? -18.974 10.004 -3.216 1.0 19.47 ? 320 A 1 +ATOM 5526 C CD1 . ILE A1 1 330 ? -20.823 10.857 -5.525 1.0 18.92 ? 320 A 1 +ATOM 5527 H H . ILE A1 1 330 ? -19.599 7.028 -5.743 1.0 21.54 ? 320 A 1 +ATOM 5528 H HA . ILE A1 1 330 ? -17.541 8.549 -4.978 1.0 20.15 ? 320 A 1 +ATOM 5529 H HB . ILE A1 1 330 ? -20.219 8.653 -4.142 1.0 21.0 ? 320 A 1 +ATOM 5530 H HG12 . ILE A1 1 330 ? -18.829 10.531 -5.754 1.0 20.71 ? 320 A 1 +ATOM 5531 H HG13 . ILE A1 1 330 ? -19.723 9.38 -6.386 1.0 20.71 ? 320 A 1 +ATOM 5532 H HG21 . ILE A1 1 330 ? -19.58 10.759 -3.166 1.0 23.37 ? 320 A 1 +ATOM 5533 H HG22 . ILE A1 1 330 ? -19.011 9.496 -2.39 1.0 23.37 ? 320 A 1 +ATOM 5534 H HG23 . ILE A1 1 330 ? -18.069 10.316 -3.372 1.0 23.37 ? 320 A 1 +ATOM 5535 H HD11 . ILE A1 1 330 ? -21.021 11.218 -6.404 1.0 22.71 ? 320 A 1 +ATOM 5536 H HD12 . ILE A1 1 330 ? -21.575 10.333 -5.206 1.0 22.71 ? 320 A 1 +ATOM 5537 H HD13 . ILE A1 1 330 ? -20.637 11.58 -4.905 1.0 22.71 ? 320 A 1 +ATOM 5538 N N . PRO A1 1 331 ? -18.468 6.397 -2.778 1.0 18.49 ? 321 A 1 +ATOM 5539 C CA . PRO A1 1 331 ? -17.845 5.67 -1.65 1.0 18.55 ? 321 A 1 +ATOM 5540 C C . PRO A1 1 331 ? -16.558 4.984 -2.046 1.0 20.0 ? 321 A 1 +ATOM 5541 O O . PRO A1 1 331 ? -15.611 4.912 -1.243 1.0 21.27 ? 321 A 1 +ATOM 5542 C CB . PRO A1 1 331 ? -18.927 4.668 -1.24 1.0 23.13 ? 321 A 1 +ATOM 5543 C CG . PRO A1 1 331 ? -20.183 5.237 -1.751 1.0 24.74 ? 321 A 1 +ATOM 5544 C CD . PRO A1 1 331 ? -19.89 6.048 -2.958 1.0 18.85 ? 321 A 1 +ATOM 5545 H HA . PRO A1 1 331 ? -17.679 6.27 -0.906 1.0 22.26 ? 321 A 1 +ATOM 5546 H HB2 . PRO A1 1 331 ? -18.747 3.805 -1.643 1.0 27.76 ? 321 A 1 +ATOM 5547 H HB3 . PRO A1 1 331 ? -18.951 4.585 -0.274 1.0 27.76 ? 321 A 1 +ATOM 5548 H HG2 . PRO A1 1 331 ? -20.787 4.512 -1.977 1.0 29.69 ? 321 A 1 +ATOM 5549 H HG3 . PRO A1 1 331 ? -20.578 5.796 -1.063 1.0 29.69 ? 321 A 1 +ATOM 5550 H HD2 . PRO A1 1 331 ? -20.02 5.527 -3.766 1.0 22.62 ? 321 A 1 +ATOM 5551 H HD3 . PRO A1 1 331 ? -20.443 6.845 -2.984 1.0 22.62 ? 321 A 1 +ATOM 5552 N N A SER A1 1 332 ? -16.507 4.448 -3.256 0.56 19.79 ? 322 A 1 +ATOM 5553 N N B SER A1 1 332 ? -16.441 4.496 -3.281 0.44 20.37 ? 322 A 1 +ATOM 5554 C CA A SER A1 1 332 ? -15.303 3.768 -3.692 0.56 20.98 ? 322 A 1 +ATOM 5555 C CA B SER A1 1 332 ? -15.237 3.759 -3.674 0.44 19.27 ? 322 A 1 +ATOM 5556 C C A SER A1 1 332 ? -14.123 4.718 -3.647 0.56 23.17 ? 322 A 1 +ATOM 5557 C C B SER A1 1 332 ? -14.028 4.68 -3.83 0.44 16.26 ? 322 A 1 +ATOM 5558 O O A SER A1 1 332 ? -13.097 4.395 -3.022 0.56 20.9 ? 322 A 1 +ATOM 5559 O O B SER A1 1 332 ? -12.874 4.295 -3.549 0.44 15.88 ? 322 A 1 +ATOM 5560 C CB A SER A1 1 332 ? -15.463 3.204 -5.099 0.56 24.07 ? 322 A 1 +ATOM 5561 C CB B SER A1 1 332 ? -15.483 3.03 -4.989 0.44 21.2 ? 322 A 1 +ATOM 5562 O OG A SER A1 1 332 ? -14.279 2.531 -5.479 0.56 23.29 ? 322 A 1 +ATOM 5563 O OG B SER A1 1 332 ? -16.397 1.978 -4.789 0.44 28.67 ? 322 A 1 +ATOM 5564 H H A SER A1 1 332 ? -17.146 4.463 -3.832 0.56 23.75 ? 322 A 1 +ATOM 5565 H H B SER A1 1 332 ? -17.033 4.574 -3.9 0.44 24.44 ? 322 A 1 +ATOM 5566 H HA A SER A1 1 332 ? -15.144 3.02 -3.096 0.56 25.17 ? 322 A 1 +ATOM 5567 H HA B SER A1 1 332 ? -15.041 3.113 -2.977 0.44 23.12 ? 322 A 1 +ATOM 5568 H HB2 A SER A1 1 332 ? -16.205 2.58 -5.112 0.56 28.88 ? 322 A 1 +ATOM 5569 H HB2 B SER A1 1 332 ? -15.85 3.653 -5.636 0.44 25.44 ? 322 A 1 +ATOM 5570 H HB3 A SER A1 1 332 ? -15.631 3.932 -5.719 0.56 28.88 ? 322 A 1 +ATOM 5571 H HB3 B SER A1 1 332 ? -14.645 2.667 -5.315 0.44 25.44 ? 322 A 1 +ATOM 5572 H HG A SER A1 1 332 ? -14.361 2.221 -6.255 0.56 27.94 ? 322 A 1 +ATOM 5573 H HG B SER A1 1 332 ? -17.134 2.283 -4.525 0.44 34.4 ? 322 A 1 +ATOM 5574 N N . VAL A1 1 333 ? -14.249 5.892 -4.303 1.0 18.49 ? 323 A 1 +ATOM 5575 C CA . VAL A1 1 333 ? -13.124 6.833 -4.349 1.0 18.01 ? 323 A 1 +ATOM 5576 C C . VAL A1 1 333 ? -12.791 7.329 -2.952 1.0 18.58 ? 323 A 1 +ATOM 5577 O O . VAL A1 1 333 ? -11.62 7.585 -2.675 1.0 18.77 ? 323 A 1 +ATOM 5578 C CB . VAL A1 1 333 ? -13.245 7.971 -5.382 1.0 17.37 ? 323 A 1 +ATOM 5579 C CG1 . VAL A1 1 333 ? -13.41 7.427 -6.784 1.0 19.45 ? 323 A 1 +ATOM 5580 C CG2 . VAL A1 1 333 ? -14.297 8.915 -5.053 1.0 19.52 ? 323 A 1 +ATOM 5581 H H A VAL A1 1 333 ? -14.957 6.154 -4.715 0.56 22.18 ? 323 A 1 +ATOM 5582 H H B VAL A1 1 333 ? -15.002 6.19 -4.592 0.44 22.18 ? 323 A 1 +ATOM 5583 H HA . VAL A1 1 333 ? -12.375 6.32 -4.692 1.0 21.61 ? 323 A 1 +ATOM 5584 H HB . VAL A1 1 333 ? -12.413 8.469 -5.354 1.0 20.84 ? 323 A 1 +ATOM 5585 H HG11 . VAL A1 1 333 ? -13.461 8.169 -7.407 1.0 23.34 ? 323 A 1 +ATOM 5586 H HG12 . VAL A1 1 333 ? -12.647 6.868 -6.998 1.0 23.34 ? 323 A 1 +ATOM 5587 H HG13 . VAL A1 1 333 ? -14.226 6.904 -6.826 1.0 23.34 ? 323 A 1 +ATOM 5588 H HG21 . VAL A1 1 333 ? -14.403 9.539 -5.788 1.0 23.42 ? 323 A 1 +ATOM 5589 H HG22 . VAL A1 1 333 ? -15.124 8.429 -4.909 1.0 23.42 ? 323 A 1 +ATOM 5590 H HG23 . VAL A1 1 333 ? -14.05 9.394 -4.246 1.0 23.42 ? 323 A 1 +ATOM 5591 N N . MET A1 1 334 ? -13.763 7.47 -2.07 1.0 18.53 ? 324 A 1 +ATOM 5592 C CA A MET A1 1 334 ? -13.414 7.85 -0.705 0.69 21.48 ? 324 A 1 +ATOM 5593 C CA B MET A1 1 334 ? -13.446 7.833 -0.687 0.31 14.97 ? 324 A 1 +ATOM 5594 C C . MET A1 1 334 ? -12.542 6.794 -0.038 1.0 20.99 ? 324 A 1 +ATOM 5595 O O . MET A1 1 334 ? -11.567 7.134 0.663 1.0 20.29 ? 324 A 1 +ATOM 5596 C CB A MET A1 1 334 ? -14.684 8.131 0.089 0.69 25.64 ? 324 A 1 +ATOM 5597 C CB B MET A1 1 334 ? -14.738 7.951 0.121 0.31 15.87 ? 324 A 1 +ATOM 5598 C CG A MET A1 1 334 ? -15.387 9.377 -0.412 0.69 20.52 ? 324 A 1 +ATOM 5599 C CG B MET A1 1 334 ? -15.628 9.09 -0.286 0.31 23.18 ? 324 A 1 +ATOM 5600 S SD A MET A1 1 334 ? -16.93 9.689 0.457 0.69 25.19 ? 324 A 1 +ATOM 5601 S SD B MET A1 1 334 ? -15.039 10.637 0.414 0.31 29.02 ? 324 A 1 +ATOM 5602 C CE A MET A1 1 334 ? -17.375 11.339 -0.101 0.69 27.29 ? 324 A 1 +ATOM 5603 C CE B MET A1 1 334 ? -16.506 11.662 0.169 0.31 28.71 ? 324 A 1 +ATOM 5604 H H A MET A1 1 334 ? -14.602 7.358 -2.224 0.69 22.23 ? 324 A 1 +ATOM 5605 H H B MET A1 1 334 ? -14.601 7.366 -2.234 0.31 22.23 ? 324 A 1 +ATOM 5606 H HA A MET A1 1 334 ? -12.903 8.675 -0.724 0.69 25.78 ? 324 A 1 +ATOM 5607 H HA B MET A1 1 334 ? -12.996 8.693 -0.693 0.31 17.97 ? 324 A 1 +ATOM 5608 H HB2 A MET A1 1 334 ? -15.291 7.38 -0.001 0.69 30.77 ? 324 A 1 +ATOM 5609 H HB2 B MET A1 1 334 ? -15.244 7.131 0.014 0.31 19.05 ? 324 A 1 +ATOM 5610 H HB3 A MET A1 1 334 ? -14.456 8.262 1.023 0.69 30.77 ? 324 A 1 +ATOM 5611 H HB3 B MET A1 1 334 ? -14.507 8.08 1.054 0.31 19.05 ? 324 A 1 +ATOM 5612 H HG2 A MET A1 1 334 ? -14.807 10.143 -0.28 0.69 24.62 ? 324 A 1 +ATOM 5613 H HG2 B MET A1 1 334 ? -15.631 9.17 -1.253 0.31 27.81 ? 324 A 1 +ATOM 5614 H HG3 A MET A1 1 334 ? -15.587 9.271 -1.355 0.69 24.62 ? 324 A 1 +ATOM 5615 H HG3 B MET A1 1 334 ? -16.528 8.929 0.036 0.31 27.81 ? 324 A 1 +ATOM 5616 H HE1 A MET A1 1 334 ? -18.197 11.61 0.339 0.69 32.75 ? 324 A 1 +ATOM 5617 H HE1 B MET A1 1 334 ? -16.331 12.551 0.514 0.31 34.45 ? 324 A 1 +ATOM 5618 H HE2 A MET A1 1 334 ? -16.66 11.953 0.128 0.69 32.75 ? 324 A 1 +ATOM 5619 H HE2 B MET A1 1 334 ? -16.705 11.708 -0.779 0.31 34.45 ? 324 A 1 +ATOM 5620 H HE3 A MET A1 1 334 ? -17.504 11.324 -1.062 0.69 32.75 ? 324 A 1 +ATOM 5621 H HE3 B MET A1 1 334 ? -17.252 11.264 0.645 0.31 34.45 ? 324 A 1 +ATOM 5622 N N . LYS A1 1 335 ? -12.847 5.511 -0.254 1.0 20.22 ? 325 A 1 +ATOM 5623 C CA . LYS A1 1 335 ? -12.03 4.446 0.314 1.0 22.9 ? 325 A 1 +ATOM 5624 C C . LYS A1 1 335 ? -10.635 4.482 -0.285 1.0 22.31 ? 325 A 1 +ATOM 5625 O O . LYS A1 1 335 ? -9.636 4.319 0.438 1.0 22.09 ? 325 A 1 +ATOM 5626 C CB . LYS A1 1 335 ? -12.7 3.096 0.034 1.0 25.33 ? 325 A 1 +ATOM 5627 C CG . LYS A1 1 335 ? -11.947 1.889 0.528 1.0 32.77 ? 325 A 1 +ATOM 5628 H H . LYS A1 1 335 ? -13.515 5.236 -0.721 1.0 24.27 ? 325 A 1 +ATOM 5629 H HA . LYS A1 1 335 ? -11.956 4.558 1.275 1.0 27.48 ? 325 A 1 +ATOM 5630 H HB2 . LYS A1 1 335 ? -13.57 3.091 0.464 1.0 30.39 ? 325 A 1 +ATOM 5631 H HB3 . LYS A1 1 335 ? -12.804 3.0 -0.926 1.0 30.39 ? 325 A 1 +ATOM 5632 N N . MET A1 1 336 ? -10.546 4.692 -1.601 1.0 20.03 ? 326 A 1 +ATOM 5633 C CA A MET A1 1 336 ? -9.263 4.79 -2.283 0.62 20.74 ? 326 A 1 +ATOM 5634 C CA B MET A1 1 336 ? -9.25 4.753 -2.241 0.38 20.43 ? 326 A 1 +ATOM 5635 C C . MET A1 1 336 ? -8.407 5.883 -1.669 1.0 20.03 ? 326 A 1 +ATOM 5636 O O . MET A1 1 336 ? -7.208 5.697 -1.41 1.0 19.47 ? 326 A 1 +ATOM 5637 C CB A MET A1 1 336 ? -9.502 5.092 -3.768 0.62 25.45 ? 326 A 1 +ATOM 5638 C CB B MET A1 1 336 ? -9.451 4.905 -3.737 0.38 18.49 ? 326 A 1 +ATOM 5639 C CG A MET A1 1 336 ? -8.246 5.553 -4.552 0.62 19.96 ? 326 A 1 +ATOM 5640 C CG B MET A1 1 336 ? -8.176 4.822 -4.524 0.38 20.42 ? 326 A 1 +ATOM 5641 S SD A MET A1 1 336 ? -8.43 6.191 -6.23 0.62 21.73 ? 326 A 1 +ATOM 5642 S SD B MET A1 1 336 ? -7.444 6.436 -4.523 0.38 23.72 ? 326 A 1 +ATOM 5643 C CE A MET A1 1 336 ? -9.641 5.062 -6.936 0.62 20.91 ? 326 A 1 +ATOM 5644 C CE B MET A1 1 336 ? -8.37 7.271 -5.805 0.38 37.75 ? 326 A 1 +ATOM 5645 H H A MET A1 1 336 ? -11.223 4.782 -2.124 0.62 24.03 ? 326 A 1 +ATOM 5646 H H B MET A1 1 336 ? -11.215 4.8 -2.13 0.38 24.03 ? 326 A 1 +ATOM 5647 H HA A MET A1 1 336 ? -8.801 3.941 -2.206 0.62 24.89 ? 326 A 1 +ATOM 5648 H HA B MET A1 1 336 ? -8.768 3.925 -2.089 0.38 24.51 ? 326 A 1 +ATOM 5649 H HB2 A MET A1 1 336 ? -9.833 4.287 -4.196 0.62 30.53 ? 326 A 1 +ATOM 5650 H HB2 B MET A1 1 336 ? -10.038 4.198 -4.047 0.38 22.19 ? 326 A 1 +ATOM 5651 H HB3 A MET A1 1 336 ? -10.163 5.8 -3.835 0.62 30.53 ? 326 A 1 +ATOM 5652 H HB3 B MET A1 1 336 ? -9.852 5.77 -3.912 0.38 22.19 ? 326 A 1 +ATOM 5653 H HG2 A MET A1 1 336 ? -7.827 6.261 -4.037 0.62 23.95 ? 326 A 1 +ATOM 5654 H HG2 B MET A1 1 336 ? -7.566 4.191 -4.11 0.38 24.5 ? 326 A 1 +ATOM 5655 H HG3 A MET A1 1 336 ? -7.649 4.791 -4.615 0.62 23.95 ? 326 A 1 +ATOM 5656 H HG3 B MET A1 1 336 ? -8.362 4.553 -5.437 0.38 24.5 ? 326 A 1 +ATOM 5657 H HE1 A MET A1 1 336 ? -9.786 5.295 -7.866 0.62 25.09 ? 326 A 1 +ATOM 5658 H HE1 B MET A1 1 336 ? -8.287 8.23 -5.682 0.38 45.3 ? 326 A 1 +ATOM 5659 H HE2 A MET A1 1 336 ? -9.303 4.155 -6.872 0.62 25.09 ? 326 A 1 +ATOM 5660 H HE2 B MET A1 1 336 ? -8.012 7.017 -6.67 0.38 45.3 ? 326 A 1 +ATOM 5661 H HE3 A MET A1 1 336 ? -10.472 5.14 -6.442 0.62 25.09 ? 326 A 1 +ATOM 5662 H HE3 B MET A1 1 336 ? -9.302 7.009 -5.743 0.38 45.3 ? 326 A 1 +ATOM 5663 N N . ILE A1 1 337 ? -9.008 7.045 -1.456 1.0 19.3 ? 327 A 1 +ATOM 5664 C CA . ILE A1 1 337 ? -8.285 8.185 -0.919 1.0 18.29 ? 327 A 1 +ATOM 5665 C C . ILE A1 1 337 ? -7.766 7.862 0.474 1.0 19.67 ? 327 A 1 +ATOM 5666 O O . ILE A1 1 337 ? -6.63 8.168 0.795 1.0 18.65 ? 327 A 1 +ATOM 5667 C CB . ILE A1 1 337 ? -9.208 9.411 -0.94 1.0 17.99 ? 327 A 1 +ATOM 5668 C CG1 . ILE A1 1 337 ? -9.442 9.865 -2.396 1.0 17.99 ? 327 A 1 +ATOM 5669 C CG2 . ILE A1 1 337 ? -8.632 10.553 -0.081 1.0 19.21 ? 327 A 1 +ATOM 5670 C CD1 . ILE A1 1 337 ? -10.619 10.882 -2.515 1.0 20.05 ? 327 A 1 +ATOM 5671 H H . ILE A1 1 337 ? -9.839 7.201 -1.615 1.0 23.17 ? 327 A 1 +ATOM 5672 H HA . ILE A1 1 337 ? -7.511 8.381 -1.47 1.0 21.95 ? 327 A 1 +ATOM 5673 H HB . ILE A1 1 337 ? -10.063 9.163 -0.555 1.0 21.58 ? 327 A 1 +ATOM 5674 H HG12 . ILE A1 1 337 ? -8.638 10.293 -2.729 1.0 21.59 ? 327 A 1 +ATOM 5675 H HG13 . ILE A1 1 337 ? -9.656 9.091 -2.94 1.0 21.59 ? 327 A 1 +ATOM 5676 H HG21 . ILE A1 1 337 ? -9.14 11.362 -0.248 1.0 23.05 ? 327 A 1 +ATOM 5677 H HG22 . ILE A1 1 337 ? -8.699 10.308 0.856 1.0 23.05 ? 327 A 1 +ATOM 5678 H HG23 . ILE A1 1 337 ? -7.702 10.691 -0.321 1.0 23.05 ? 327 A 1 +ATOM 5679 H HD11 . ILE A1 1 337 ? -10.795 11.052 -3.453 1.0 24.05 ? 327 A 1 +ATOM 5680 H HD12 . ILE A1 1 337 ? -11.407 10.504 -2.094 1.0 24.05 ? 327 A 1 +ATOM 5681 H HD13 . ILE A1 1 337 ? -10.369 11.707 -2.07 1.0 24.05 ? 327 A 1 +ATOM 5682 N N . GLU A1 1 338 ? -8.599 7.222 1.29 1.0 18.09 ? 328 A 1 +ATOM 5683 C CA A GLU A1 1 338 ? -8.161 6.822 2.623 0.49 18.56 ? 328 A 1 +ATOM 5684 C CA B GLU A1 1 338 ? -8.173 6.811 2.624 0.51 21.87 ? 328 A 1 +ATOM 5685 C C . GLU A1 1 338 ? -7.008 5.837 2.553 1.0 20.24 ? 328 A 1 +ATOM 5686 O O . GLU A1 1 338 ? -6.016 5.979 3.281 1.0 22.46 ? 328 A 1 +ATOM 5687 C CB A GLU A1 1 338 ? -9.353 6.201 3.355 0.49 22.8 ? 328 A 1 +ATOM 5688 C CB B GLU A1 1 338 ? -9.38 6.172 3.317 0.51 19.89 ? 328 A 1 +ATOM 5689 C CG A GLU A1 1 338 ? -9.003 5.668 4.756 0.49 25.23 ? 328 A 1 +ATOM 5690 C CG B GLU A1 1 338 ? -9.169 5.913 4.809 0.51 49.54 ? 328 A 1 +ATOM 5691 C CD A GLU A1 1 338 ? -8.568 6.758 5.711 0.49 58.17 ? 328 A 1 +ATOM 5692 C CD B GLU A1 1 338 ? -10.416 5.351 5.486 0.51 43.61 ? 328 A 1 +ATOM 5693 O OE1 A GLU A1 1 338 ? -9.03 7.909 5.557 0.49 48.71 ? 328 A 1 +ATOM 5694 O OE1 B GLU A1 1 338 ? -10.936 4.302 5.047 0.51 38.63 ? 328 A 1 +ATOM 5695 O OE2 A GLU A1 1 338 ? -7.769 6.464 6.628 0.49 62.69 ? 328 A 1 +ATOM 5696 O OE2 B GLU A1 1 338 ? -10.891 5.979 6.445 0.51 47.8 ? 328 A 1 +ATOM 5697 H H A GLU A1 1 338 ? -9.411 7.011 1.101 0.49 21.7 ? 328 A 1 +ATOM 5698 H H B GLU A1 1 338 ? -9.411 7.015 1.098 0.51 21.7 ? 328 A 1 +ATOM 5699 H HA A GLU A1 1 338 ? -7.85 7.598 3.114 0.49 22.27 ? 328 A 1 +ATOM 5700 H HA B GLU A1 1 338 ? -7.872 7.578 3.136 0.51 26.24 ? 328 A 1 +ATOM 5701 H HB2 A GLU A1 1 338 ? -10.042 6.876 3.458 0.49 27.36 ? 328 A 1 +ATOM 5702 H HB2 B GLU A1 1 338 ? -10.142 6.764 3.224 0.51 23.87 ? 328 A 1 +ATOM 5703 H HB3 A GLU A1 1 338 ? -9.69 5.459 2.83 0.49 27.36 ? 328 A 1 +ATOM 5704 H HB3 B GLU A1 1 338 ? -9.567 5.32 2.892 0.51 23.87 ? 328 A 1 +ATOM 5705 H HG2 A GLU A1 1 338 ? -9.784 5.234 5.132 0.49 30.27 ? 328 A 1 +ATOM 5706 H HG2 B GLU A1 1 338 ? -8.45 5.271 4.922 0.51 59.45 ? 328 A 1 +ATOM 5707 H HG3 A GLU A1 1 338 ? -8.275 5.031 4.678 0.49 30.27 ? 328 A 1 +ATOM 5708 H HG3 B GLU A1 1 338 ? -8.939 6.748 5.247 0.51 59.45 ? 328 A 1 +ATOM 5709 N N . LEU A1 1 339 ? -7.1 4.842 1.668 1.0 22.68 ? 329 A 1 +ATOM 5710 C CA . LEU A1 1 339 ? -6.038 3.845 1.535 1.0 24.7 ? 329 A 1 +ATOM 5711 C C . LEU A1 1 339 ? -4.731 4.46 1.075 1.0 24.0 ? 329 A 1 +ATOM 5712 O O . LEU A1 1 339 ? -3.659 3.939 1.408 1.0 25.64 ? 329 A 1 +ATOM 5713 C CB . LEU A1 1 339 ? -6.485 2.778 0.533 1.0 32.43 ? 329 A 1 +ATOM 5714 C CG . LEU A1 1 339 ? -7.118 1.491 1.054 1.0 44.48 ? 329 A 1 +ATOM 5715 C CD1 . LEU A1 1 339 ? -8.08 1.722 2.179 1.0 74.73 ? 329 A 1 +ATOM 5716 C CD2 . LEU A1 1 339 ? -7.807 0.758 -0.095 1.0 66.42 ? 329 A 1 +ATOM 5717 H H . LEU A1 1 339 ? -7.765 4.721 1.135 1.0 27.22 ? 329 A 1 +ATOM 5718 H HA . LEU A1 1 339 ? -5.882 3.434 2.399 1.0 29.64 ? 329 A 1 +ATOM 5719 H HB2 . LEU A1 1 339 ? -7.141 3.187 -0.054 1.0 38.92 ? 329 A 1 +ATOM 5720 H HB3 . LEU A1 1 339 ? -5.704 2.512 0.024 1.0 38.92 ? 329 A 1 +ATOM 5721 H HG . LEU A1 1 339 ? -6.409 0.937 1.418 1.0 53.37 ? 329 A 1 +ATOM 5722 H HD11 . LEU A1 1 339 ? -8.542 0.893 2.375 1.0 89.68 ? 329 A 1 +ATOM 5723 H HD12 . LEU A1 1 339 ? -7.586 2.018 2.96 1.0 89.68 ? 329 A 1 +ATOM 5724 H HD13 . LEU A1 1 339 ? -8.718 2.403 1.913 1.0 89.68 ? 329 A 1 +ATOM 5725 H HD21 . LEU A1 1 339 ? -8.174 -0.076 0.237 1.0 79.7 ? 329 A 1 +ATOM 5726 H HD22 . LEU A1 1 339 ? -8.518 1.317 -0.444 1.0 79.7 ? 329 A 1 +ATOM 5727 H HD23 . LEU A1 1 339 ? -7.155 0.579 -0.791 1.0 79.7 ? 329 A 1 +ATOM 5728 N N . LEU A1 1 340 ? -4.766 5.52 0.275 1.0 20.26 ? 330 A 1 +ATOM 5729 C CA . LEU A1 1 340 ? -3.58 6.235 -0.118 1.0 20.09 ? 330 A 1 +ATOM 5730 C C . LEU A1 1 340 ? -2.964 7.045 0.997 1.0 23.93 ? 330 A 1 +ATOM 5731 O O . LEU A1 1 340 ? -1.873 7.597 0.806 1.0 25.33 ? 330 A 1 +ATOM 5732 C CB . LEU A1 1 340 ? -3.881 7.178 -1.287 1.0 21.81 ? 330 A 1 +ATOM 5733 C CG . LEU A1 1 340 ? -4.106 6.543 -2.65 1.0 23.45 ? 330 A 1 +ATOM 5734 C CD1 . LEU A1 1 340 ? -4.53 7.631 -3.6 1.0 26.12 ? 330 A 1 +ATOM 5735 C CD2 . LEU A1 1 340 ? -2.864 5.84 -3.148 1.0 33.15 ? 330 A 1 +ATOM 5736 H H . LEU A1 1 340 ? -5.488 5.847 -0.058 1.0 24.31 ? 330 A 1 +ATOM 5737 H HA . LEU A1 1 340 ? -2.934 5.573 -0.409 1.0 24.11 ? 330 A 1 +ATOM 5738 H HB2 . LEU A1 1 340 ? -4.686 7.675 -1.07 1.0 26.18 ? 330 A 1 +ATOM 5739 H HB3 . LEU A1 1 340 ? -3.131 7.787 -1.379 1.0 26.18 ? 330 A 1 +ATOM 5740 H HG . LEU A1 1 340 ? -4.796 5.864 -2.594 1.0 28.14 ? 330 A 1 +ATOM 5741 H HD11 . LEU A1 1 340 ? -4.661 7.247 -4.481 1.0 31.35 ? 330 A 1 +ATOM 5742 H HD12 . LEU A1 1 340 ? -5.359 8.023 -3.283 1.0 31.35 ? 330 A 1 +ATOM 5743 H HD13 . LEU A1 1 340 ? -3.836 8.308 -3.634 1.0 31.35 ? 330 A 1 +ATOM 5744 H HD21 . LEU A1 1 340 ? -3.001 5.571 -4.07 1.0 39.78 ? 330 A 1 +ATOM 5745 H HD22 . LEU A1 1 340 ? -2.111 6.449 -3.09 1.0 39.78 ? 330 A 1 +ATOM 5746 H HD23 . LEU A1 1 340 ? -2.7 5.059 -2.597 1.0 39.78 ? 330 A 1 +ATOM 5747 N N . GLY A1 1 341 ? -3.664 7.173 2.104 1.0 20.69 ? 331 A 1 +ATOM 5748 C CA . GLY A1 1 341 ? -3.216 8.058 3.153 1.0 24.01 ? 331 A 1 +ATOM 5749 C C . GLY A1 1 341 ? -3.469 9.524 2.886 1.0 24.24 ? 331 A 1 +ATOM 5750 O O . GLY A1 1 341 ? -2.822 10.375 3.503 1.0 24.99 ? 331 A 1 +ATOM 5751 H H . GLY A1 1 341 ? -4.4 6.761 2.271 1.0 24.83 ? 331 A 1 +ATOM 5752 H HA2 . GLY A1 1 341 ? -3.673 7.822 3.976 1.0 28.81 ? 331 A 1 +ATOM 5753 H HA3 . GLY A1 1 341 ? -2.262 7.938 3.276 1.0 28.81 ? 331 A 1 +ATOM 5754 N N . ARG A1 1 342 ? -4.407 9.849 1.986 1.0 18.06 ? 332 A 1 +ATOM 5755 C CA . ARG A1 1 342 ? -4.792 11.208 1.636 1.0 17.23 ? 332 A 1 +ATOM 5756 C C . ARG A1 1 342 ? -6.087 11.56 2.356 1.0 18.87 ? 332 A 1 +ATOM 5757 O O . ARG A1 1 342 ? -6.624 10.763 3.128 1.0 19.51 ? 332 A 1 +ATOM 5758 C CB . ARG A1 1 342 ? -4.869 11.271 0.104 1.0 17.03 ? 332 A 1 +ATOM 5759 C CG . ARG A1 1 342 ? -3.544 10.963 -0.586 1.0 17.71 ? 332 A 1 +ATOM 5760 C CD . ARG A1 1 342 ? -2.668 12.154 -0.711 1.0 16.95 ? 332 A 1 +ATOM 5761 N NE . ARG A1 1 342 ? -2.902 12.984 -1.895 1.0 16.64 ? 332 A 1 +ATOM 5762 C CZ . ARG A1 1 342 ? -2.532 12.64 -3.12 1.0 17.28 ? 332 A 1 +ATOM 5763 N NH1 . ARG A1 1 342 ? -1.889 11.534 -3.32 1.0 17.22 ? 332 A 1 +ATOM 5764 N NH2 . ARG A1 1 342 ? -2.798 13.506 -4.118 1.0 17.44 ? 332 A 1 +ATOM 5765 H H . ARG A1 1 342 ? -4.856 9.262 1.546 1.0 21.68 ? 332 A 1 +ATOM 5766 H HA . ARG A1 1 342 ? -4.149 11.874 1.927 1.0 20.67 ? 332 A 1 +ATOM 5767 H HB2 . ARG A1 1 342 ? -5.522 10.622 -0.203 1.0 20.43 ? 332 A 1 +ATOM 5768 H HB3 . ARG A1 1 342 ? -5.14 12.164 -0.159 1.0 20.43 ? 332 A 1 +ATOM 5769 H HG2 . ARG A1 1 342 ? -3.068 10.293 -0.071 1.0 21.25 ? 332 A 1 +ATOM 5770 H HG3 . ARG A1 1 342 ? -3.723 10.628 -1.479 1.0 21.25 ? 332 A 1 +ATOM 5771 H HD2 . ARG A1 1 342 ? -2.804 12.716 0.068 1.0 20.34 ? 332 A 1 +ATOM 5772 H HD3 . ARG A1 1 342 ? -1.747 11.853 -0.747 1.0 20.34 ? 332 A 1 +ATOM 5773 H HE . ARG A1 1 342 ? -3.302 13.738 -1.788 1.0 19.97 ? 332 A 1 +ATOM 5774 H HH11 . ARG A1 1 342 ? -1.7 11.02 -2.656 1.0 20.67 ? 332 A 1 +ATOM 5775 H HH12 . ARG A1 1 342 ? -1.65 11.312 -4.116 1.0 20.67 ? 332 A 1 +ATOM 5776 H HH21 . ARG A1 1 342 ? -3.193 14.25 -3.947 1.0 20.93 ? 332 A 1 +ATOM 5777 H HH22 . ARG A1 1 342 ? -2.572 13.314 -4.925 1.0 20.93 ? 332 A 1 +ATOM 5778 N N . LYS A1 1 343 ? -6.618 12.73 2.101 1.0 18.8 ? 333 A 1 +ATOM 5779 C CA . LYS A1 1 343 ? -7.861 13.173 2.701 1.0 23.52 ? 333 A 1 +ATOM 5780 C C . LYS A1 1 343 ? -8.813 13.649 1.629 1.0 22.82 ? 333 A 1 +ATOM 5781 O O . LYS A1 1 343 ? -8.36 14.161 0.663 1.0 19.37 ? 333 A 1 +ATOM 5782 C CB . LYS A1 1 343 ? -7.581 14.386 3.606 1.0 26.21 ? 333 A 1 +ATOM 5783 C CG . LYS A1 1 343 ? -6.142 14.74 3.737 1.0 64.7 ? 333 A 1 +ATOM 5784 H H . LYS A1 1 343 ? -6.27 13.307 1.567 1.0 22.56 ? 333 A 1 +ATOM 5785 H HA . LYS A1 1 343 ? -8.266 12.444 3.196 1.0 28.23 ? 333 A 1 +ATOM 5786 H HB2 . LYS A1 1 343 ? -8.04 15.158 3.239 1.0 31.45 ? 333 A 1 +ATOM 5787 H HB3 . LYS A1 1 343 ? -7.917 14.193 4.495 1.0 31.45 ? 333 A 1 +ATOM 5788 N N . PRO A1 1 344 ? -10.135 13.519 1.759 1.0 28.23 ? 334 A 1 +ATOM 5789 C CA . PRO A1 1 344 ? -11.027 14.184 0.805 1.0 24.36 ? 334 A 1 +ATOM 5790 C C . PRO A1 1 344 ? -11.001 15.696 1.042 1.0 26.79 ? 334 A 1 +ATOM 5791 O O . PRO A1 1 344 ? -10.615 16.187 2.095 1.0 24.35 ? 334 A 1 +ATOM 5792 C CB B PRO A1 1 344 ? -12.4 13.599 1.168 1.0 42.97 ? 334 A 1 +ATOM 5793 C CG . PRO A1 1 344 ? -12.278 13.385 2.68 1.0 35.51 ? 334 A 1 +ATOM 5794 C CD . PRO A1 1 344 ? -10.863 12.861 2.855 1.0 34.1 ? 334 A 1 +ATOM 5795 H HA . PRO A1 1 344 ? -10.81 13.975 -0.117 1.0 29.23 ? 334 A 1 +ATOM 5796 H HB2 B PRO A1 1 344 ? -13.106 14.229 0.954 1.0 51.57 ? 334 A 1 +ATOM 5797 H HB3 B PRO A1 1 344 ? -12.548 12.762 0.701 1.0 51.57 ? 334 A 1 +ATOM 5798 H HG2 B PRO A1 1 344 ? -12.403 14.224 3.15 1.0 42.61 ? 334 A 1 +ATOM 5799 H HG3 B PRO A1 1 344 ? -12.933 12.735 2.982 1.0 42.61 ? 334 A 1 +ATOM 5800 H HD2 . PRO A1 1 344 ? -10.501 13.119 3.717 1.0 40.92 ? 334 A 1 +ATOM 5801 H HD3 . PRO A1 1 344 ? -10.835 11.896 2.759 1.0 40.92 ? 334 A 1 +ATOM 5802 N N . GLY A1 1 345 ? -11.355 16.429 -0.002 1.0 25.83 ? 335 A 1 +ATOM 5803 C CA . GLY A1 1 345 ? -11.361 17.874 0.091 1.0 22.33 ? 335 A 1 +ATOM 5804 C C . GLY A1 1 345 ? -12.356 18.368 1.123 1.0 23.94 ? 335 A 1 +ATOM 5805 O O . GLY A1 1 345 ? -13.428 17.792 1.302 1.0 30.08 ? 335 A 1 +ATOM 5806 H H . GLY A1 1 345 ? -11.593 16.116 -0.767 1.0 30.99 ? 335 A 1 +ATOM 5807 H HA2 . GLY A1 1 345 ? -10.478 18.187 0.341 1.0 26.8 ? 335 A 1 +ATOM 5808 H HA3 . GLY A1 1 345 ? -11.598 18.253 -0.77 1.0 26.8 ? 335 A 1 +ATOM 5809 N N . ARG A1 1 346 ? -11.985 19.446 1.794 1.0 22.35 ? 336 A 1 +ATOM 5810 C CA . ARG A1 1 346 ? -12.792 20.042 2.854 1.0 27.0 ? 336 A 1 +ATOM 5811 C C . ARG A1 1 346 ? -13.672 21.17 2.368 1.0 26.75 ? 336 A 1 +ATOM 5812 O O . ARG A1 1 346 ? -14.623 21.56 3.054 1.0 33.91 ? 336 A 1 +ATOM 5813 C CB . ARG A1 1 346 ? -11.872 20.603 3.949 1.0 31.48 ? 336 A 1 +ATOM 5814 C CG . ARG A1 1 346 ? -11.069 19.514 4.696 1.0 39.58 ? 336 A 1 +ATOM 5815 H H . ARG A1 1 346 ? -11.248 19.866 1.654 1.0 26.82 ? 336 A 1 +ATOM 5816 H HA . ARG A1 1 346 ? -13.359 19.352 3.232 1.0 32.41 ? 336 A 1 +ATOM 5817 H HB2 . ARG A1 1 346 ? -11.237 21.214 3.542 1.0 37.78 ? 336 A 1 +ATOM 5818 H HB3 . ARG A1 1 346 ? -12.413 21.074 4.602 1.0 37.78 ? 336 A 1 +ATOM 5819 N N . ASP A1 1 347 ? -13.339 21.757 1.233 1.0 20.8 ? 337 A 1 +ATOM 5820 C CA . ASP A1 1 347 ? -14.09 22.841 0.627 1.0 19.86 ? 337 A 1 +ATOM 5821 C C . ASP A1 1 347 ? -14.278 22.465 -0.841 1.0 18.72 ? 337 A 1 +ATOM 5822 O O . ASP A1 1 347 ? -14.22 21.294 -1.214 1.0 18.03 ? 337 A 1 +ATOM 5823 C CB . ASP A1 1 347 ? -13.302 24.131 0.89 1.0 21.04 ? 337 A 1 +ATOM 5824 C CG . ASP A1 1 347 ? -11.913 24.146 0.241 1.0 27.38 ? 337 A 1 +ATOM 5825 O OD1 . ASP A1 1 347 ? -11.564 23.243 -0.536 1.0 21.1 ? 337 A 1 +ATOM 5826 O OD2 . ASP A1 1 347 ? -11.105 25.056 0.549 1.0 28.42 ? 337 A 1 +ATOM 5827 H H . ASP A1 1 347 ? -12.649 21.535 0.771 1.0 24.96 ? 337 A 1 +ATOM 5828 H HA . ASP A1 1 347 ? -14.979 22.949 1.0 1.0 23.84 ? 337 A 1 +ATOM 5829 H HB2 . ASP A1 1 347 ? -13.803 24.882 0.535 1.0 25.25 ? 337 A 1 +ATOM 5830 H HB3 . ASP A1 1 347 ? -13.182 24.234 1.847 1.0 25.25 ? 337 A 1 +ATOM 5831 N N . TRP A1 1 348 ? -14.547 23.446 -1.699 1.0 17.5 ? 338 A 1 +ATOM 5832 C CA . TRP A1 1 348 ? -14.799 23.144 -3.108 1.0 16.26 ? 338 A 1 +ATOM 5833 C C . TRP A1 1 348 ? -13.532 22.82 -3.88 1.0 16.8 ? 338 A 1 +ATOM 5834 O O . TRP A1 1 348 ? -13.627 22.4 -5.046 1.0 15.66 ? 338 A 1 +ATOM 5835 C CB . TRP A1 1 348 ? -15.488 24.324 -3.826 1.0 18.19 ? 338 A 1 +ATOM 5836 C CG . TRP A1 1 348 ? -16.865 24.647 -3.332 1.0 18.02 ? 338 A 1 +ATOM 5837 C CD1 . TRP A1 1 348 ? -17.564 23.979 -2.41 1.0 20.13 ? 338 A 1 +ATOM 5838 C CD2 . TRP A1 1 348 ? -17.706 25.719 -3.789 1.0 17.71 ? 338 A 1 +ATOM 5839 N NE1 . TRP A1 1 348 ? -18.828 24.574 -2.258 1.0 20.22 ? 338 A 1 +ATOM 5840 C CE2 . TRP A1 1 348 ? -18.912 25.648 -3.093 1.0 19.06 ? 338 A 1 +ATOM 5841 C CE3 . TRP A1 1 348 ? -17.534 26.736 -4.723 1.0 19.69 ? 338 A 1 +ATOM 5842 C CZ2 . TRP A1 1 348 ? -19.957 26.568 -3.292 1.0 20.5 ? 338 A 1 +ATOM 5843 C CZ3 . TRP A1 1 348 ? -18.577 27.605 -4.958 1.0 22.66 ? 338 A 1 +ATOM 5844 C CH2 . TRP A1 1 348 ? -19.758 27.532 -4.235 1.0 21.76 ? 338 A 1 +ATOM 5845 H H . TRP A1 1 348 ? -14.589 24.281 -1.495 1.0 21.0 ? 338 A 1 +ATOM 5846 H HA . TRP A1 1 348 ? -15.399 22.382 -3.13 1.0 19.51 ? 338 A 1 +ATOM 5847 H HB2 . TRP A1 1 348 ? -14.943 25.118 -3.706 1.0 21.83 ? 338 A 1 +ATOM 5848 H HB3 . TRP A1 1 348 ? -15.56 24.111 -4.769 1.0 21.83 ? 338 A 1 +ATOM 5849 H HD1 . TRP A1 1 348 ? -17.26 23.236 -1.941 1.0 24.16 ? 338 A 1 +ATOM 5850 H HE1 . TRP A1 1 348 ? -19.447 24.304 -1.725 1.0 24.27 ? 338 A 1 +ATOM 5851 H HE3 . TRP A1 1 348 ? -16.729 26.827 -5.181 1.0 23.62 ? 338 A 1 +ATOM 5852 H HZ2 . TRP A1 1 348 ? -20.747 26.522 -2.803 1.0 24.59 ? 338 A 1 +ATOM 5853 H HZ3 . TRP A1 1 348 ? -18.486 28.256 -5.617 1.0 27.19 ? 338 A 1 +ATOM 5854 H HH2 . TRP A1 1 348 ? -20.429 28.154 -4.397 1.0 26.11 ? 338 A 1 +ATOM 5855 N N . GLY A1 1 349 ? -12.349 23.01 -3.324 1.0 16.33 ? 339 A 1 +ATOM 5856 C CA . GLY A1 1 349 ? -11.125 22.661 -4.016 1.0 16.3 ? 339 A 1 +ATOM 5857 C C . GLY A1 1 349 ? -10.878 23.538 -5.228 1.0 15.57 ? 339 A 1 +ATOM 5858 O O . GLY A1 1 349 ? -10.31 23.049 -6.207 1.0 16.35 ? 339 A 1 +ATOM 5859 H H . GLY A1 1 349 ? -12.227 23.342 -2.541 1.0 19.6 ? 339 A 1 +ATOM 5860 H HA2 . GLY A1 1 349 ? -10.375 22.758 -3.409 1.0 19.56 ? 339 A 1 +ATOM 5861 H HA3 . GLY A1 1 349 ? -11.175 21.738 -4.31 1.0 19.56 ? 339 A 1 +ATOM 5862 N N . GLY A1 1 350 ? -11.224 24.811 -5.19 1.0 16.17 ? 340 A 1 +ATOM 5863 C CA . GLY A1 1 350 ? -10.895 25.701 -6.288 1.0 16.6 ? 340 A 1 +ATOM 5864 C C . GLY A1 1 350 ? -9.412 25.94 -6.386 1.0 17.37 ? 340 A 1 +ATOM 5865 O O . GLY A1 1 350 ? -8.683 25.847 -5.407 1.0 18.4 ? 340 A 1 +ATOM 5866 H H . GLY A1 1 350 ? -11.649 25.186 -4.543 1.0 19.41 ? 340 A 1 +ATOM 5867 H HA2 . GLY A1 1 350 ? -11.201 25.312 -7.122 1.0 19.92 ? 340 A 1 +ATOM 5868 H HA3 . GLY A1 1 350 ? -11.337 26.554 -6.156 1.0 19.92 ? 340 A 1 +ATOM 5869 N N . ARG A1 1 351 ? -8.916 26.219 -7.59 1.0 16.61 ? 341 A 1 +ATOM 5870 C CA . ARG A1 1 351 ? -7.501 26.471 -7.749 1.0 15.79 ? 341 A 1 +ATOM 5871 C C . ARG A1 1 351 ? -7.104 27.719 -6.988 1.0 18.81 ? 341 A 1 +ATOM 5872 O O . ARG A1 1 351 ? -7.771 28.758 -7.064 1.0 19.38 ? 341 A 1 +ATOM 5873 C CB . ARG A1 1 351 ? -7.194 26.651 -9.239 1.0 17.79 ? 341 A 1 +ATOM 5874 C CG . ARG A1 1 351 ? -5.725 26.815 -9.597 1.0 17.39 ? 341 A 1 +ATOM 5875 C CD . ARG A1 1 351 ? -5.36 28.264 -9.656 1.0 19.51 ? 341 A 1 +ATOM 5876 N NE . ARG A1 1 351 ? -3.928 28.494 -9.888 1.0 21.36 ? 341 A 1 +ATOM 5877 C CZ . ARG A1 1 351 ? -3.368 28.79 -11.053 1.0 21.27 ? 341 A 1 +ATOM 5878 N NH1 . ARG A1 1 351 ? -4.1 28.912 -12.16 1.0 18.97 ? 341 A 1 +ATOM 5879 N NH2 . ARG A1 1 351 ? -2.065 28.998 -11.098 1.0 21.39 ? 341 A 1 +ATOM 5880 H H . ARG A1 1 351 ? -9.376 26.265 -8.315 1.0 19.93 ? 341 A 1 +ATOM 5881 H HA . ARG A1 1 351 ? -6.986 25.725 -7.404 1.0 18.95 ? 341 A 1 +ATOM 5882 H HB2 . ARG A1 1 351 ? -7.52 25.869 -9.713 1.0 21.35 ? 341 A 1 +ATOM 5883 H HB3 . ARG A1 1 351 ? -7.657 27.444 -9.551 1.0 21.35 ? 341 A 1 +ATOM 5884 H HG2 . ARG A1 1 351 ? -5.176 26.385 -8.923 1.0 20.87 ? 341 A 1 +ATOM 5885 H HG3 . ARG A1 1 351 ? -5.555 26.418 -10.465 1.0 20.87 ? 341 A 1 +ATOM 5886 H HD2 . ARG A1 1 351 ? -5.849 28.682 -10.382 1.0 23.41 ? 341 A 1 +ATOM 5887 H HD3 . ARG A1 1 351 ? -5.596 28.682 -8.814 1.0 23.41 ? 341 A 1 +ATOM 5888 H HE . ARG A1 1 351 ? -3.406 28.432 -9.207 1.0 25.63 ? 341 A 1 +ATOM 5889 H HH11 . ARG A1 1 351 ? -4.952 28.798 -12.127 1.0 22.76 ? 341 A 1 +ATOM 5890 H HH12 . ARG A1 1 351 ? -3.72 29.105 -12.907 1.0 22.76 ? 341 A 1 +ATOM 5891 H HH21 . ARG A1 1 351 ? -1.595 28.94 -10.38 1.0 25.67 ? 341 A 1 +ATOM 5892 H HH22 . ARG A1 1 351 ? -1.686 29.191 -11.845 1.0 25.67 ? 341 A 1 +ATOM 5893 N N . LYS A1 1 352 ? -5.991 27.612 -6.266 1.0 18.03 ? 342 A 1 +ATOM 5894 C CA . LYS A1 1 352 ? -5.428 28.727 -5.512 1.0 19.05 ? 342 A 1 +ATOM 5895 C C . LYS A1 1 352 ? -4.082 29.117 -6.111 1.0 20.75 ? 342 A 1 +ATOM 5896 O O . LYS A1 1 352 ? -3.468 28.375 -6.882 1.0 19.79 ? 342 A 1 +ATOM 5897 C CB . LYS A1 1 352 ? -5.279 28.338 -4.033 1.0 20.36 ? 342 A 1 +ATOM 5898 C CG . LYS A1 1 352 ? -6.576 28.007 -3.371 1.0 23.77 ? 342 A 1 +ATOM 5899 C CD . LYS A1 1 352 ? -7.514 29.222 -3.359 1.0 38.16 ? 342 A 1 +ATOM 5900 C CE . LYS A1 1 352 ? -8.722 29.056 -2.425 1.0 57.78 ? 342 A 1 +ATOM 5901 N NZ . LYS A1 1 352 ? -9.727 28.09 -2.937 1.0 77.35 ? 342 A 1 +ATOM 5902 H H . LYS A1 1 352 ? -5.534 26.887 -6.197 1.0 21.63 ? 342 A 1 +ATOM 5903 H HA . LYS A1 1 352 ? -6.008 29.503 -5.559 1.0 22.86 ? 342 A 1 +ATOM 5904 H HB2 . LYS A1 1 352 ? -4.706 27.558 -3.971 1.0 24.43 ? 342 A 1 +ATOM 5905 H HB3 . LYS A1 1 352 ? -4.881 29.081 -3.553 1.0 24.43 ? 342 A 1 +ATOM 5906 H HG2 . LYS A1 1 352 ? -7.011 27.288 -3.855 1.0 28.53 ? 342 A 1 +ATOM 5907 H HG3 . LYS A1 1 352 ? -6.411 27.738 -2.454 1.0 28.53 ? 342 A 1 +ATOM 5908 H HD2 . LYS A1 1 352 ? -7.016 30.0 -3.063 1.0 45.79 ? 342 A 1 +ATOM 5909 H HD3 . LYS A1 1 352 ? -7.851 29.366 -4.257 1.0 45.79 ? 342 A 1 +ATOM 5910 H HE2 . LYS A1 1 352 ? -8.413 28.736 -1.564 1.0 69.34 ? 342 A 1 +ATOM 5911 H HE3 . LYS A1 1 352 ? -9.161 29.915 -2.322 1.0 69.34 ? 342 A 1 +ATOM 5912 H HZ1 . LYS A1 1 352 ? -9.355 27.287 -3.034 1.0 92.82 ? 342 A 1 +ATOM 5913 H HZ2 . LYS A1 1 352 ? -10.407 28.027 -2.367 1.0 92.82 ? 342 A 1 +ATOM 5914 H HZ3 . LYS A1 1 352 ? -10.036 28.362 -3.727 1.0 92.82 ? 342 A 1 +ATOM 5915 N N . ARG A1 1 353 ? -3.6 30.298 -5.738 1.0 23.02 ? 343 A 1 +ATOM 5916 C CA . ARG A1 1 353 ? -2.322 30.8 -6.211 1.0 26.32 ? 343 A 1 +ATOM 5917 C C . ARG A1 1 353 ? -1.39 30.885 -5.019 1.0 25.14 ? 343 A 1 +ATOM 5918 O O . ARG A1 1 353 ? -1.378 31.886 -4.297 1.0 30.35 ? 343 A 1 +ATOM 5919 C CB . ARG A1 1 353 ? -2.527 32.122 -6.889 1.0 26.82 ? 343 A 1 +ATOM 5920 C CG . ARG A1 1 353 ? -3.344 31.953 -8.156 1.0 27.3 ? 343 A 1 +ATOM 5921 C CD . ARG A1 1 353 ? -3.506 33.258 -8.883 1.0 32.49 ? 343 A 1 +ATOM 5922 N NE . ARG A1 1 353 ? -4.397 33.042 -10.009 1.0 35.42 ? 343 A 1 +ATOM 5923 C CZ . ARG A1 1 353 ? -3.98 32.604 -11.185 1.0 32.18 ? 343 A 1 +ATOM 5924 N NH1 . ARG A1 1 353 ? -2.689 32.361 -11.378 1.0 32.28 ? 343 A 1 +ATOM 5925 N NH2 . ARG A1 1 353 ? -4.855 32.419 -12.152 1.0 31.11 ? 343 A 1 +ATOM 5926 H H . ARG A1 1 353 ? -4.006 30.833 -5.201 1.0 27.62 ? 343 A 1 +ATOM 5927 H HA . ARG A1 1 353 ? -1.921 30.184 -6.844 1.0 31.58 ? 343 A 1 +ATOM 5928 H HB2 . ARG A1 1 353 ? -3.002 32.722 -6.292 1.0 32.19 ? 343 A 1 +ATOM 5929 H HB3 . ARG A1 1 353 ? -1.666 32.502 -7.124 1.0 32.19 ? 343 A 1 +ATOM 5930 H HG2 . ARG A1 1 353 ? -2.895 31.328 -8.746 1.0 32.76 ? 343 A 1 +ATOM 5931 H HG3 . ARG A1 1 353 ? -4.225 31.62 -7.927 1.0 32.76 ? 343 A 1 +ATOM 5932 H HD2 . ARG A1 1 353 ? -3.893 33.923 -8.293 1.0 38.99 ? 343 A 1 +ATOM 5933 H HD3 . ARG A1 1 353 ? -2.646 33.566 -9.211 1.0 38.99 ? 343 A 1 +ATOM 5934 H HE . ARG A1 1 353 ? -5.235 33.205 -9.906 1.0 42.5 ? 343 A 1 +ATOM 5935 H HH11 . ARG A1 1 353 ? -2.128 32.488 -10.739 1.0 38.74 ? 343 A 1 +ATOM 5936 H HH12 . ARG A1 1 353 ? -2.415 32.077 -12.142 1.0 38.74 ? 343 A 1 +ATOM 5937 H HH21 . ARG A1 1 353 ? -5.689 32.581 -12.015 1.0 37.33 ? 343 A 1 +ATOM 5938 H HH22 . ARG A1 1 353 ? -4.593 32.135 -12.92 1.0 37.33 ? 343 A 1 +ATOM 5939 N N . VAL A1 1 354 ? -0.654 29.81 -4.768 1.0 25.61 ? 344 A 1 +ATOM 5940 C CA . VAL A1 1 354 ? 0.275 29.726 -3.65 1.0 23.4 ? 344 A 1 +ATOM 5941 C C . VAL A1 1 354 ? 1.711 29.529 -4.085 1.0 24.89 ? 344 A 1 +ATOM 5942 O O . VAL A1 1 354 ? 2.629 29.652 -3.223 1.0 28.28 ? 344 A 1 +ATOM 5943 C CB . VAL A1 1 354 ? -0.108 28.655 -2.609 1.0 30.78 ? 344 A 1 +ATOM 5944 C CG1 . VAL A1 1 354 ? -1.375 29.054 -1.881 1.0 29.3 ? 344 A 1 +ATOM 5945 C CG2 . VAL A1 1 354 ? -0.254 27.279 -3.262 1.0 26.59 ? 344 A 1 +ATOM 5946 H H . VAL A1 1 354 ? -0.676 29.094 -5.245 1.0 30.73 ? 344 A 1 +ATOM 5947 H HA . VAL A1 1 354 ? 0.222 30.577 -3.187 1.0 28.08 ? 344 A 1 +ATOM 5948 H HB . VAL A1 1 354 ? 0.605 28.588 -1.955 1.0 36.94 ? 344 A 1 +ATOM 5949 H HG11 . VAL A1 1 354 ? -1.596 28.368 -1.232 1.0 35.16 ? 344 A 1 +ATOM 5950 H HG12 . VAL A1 1 354 ? -1.227 29.9 -1.43 1.0 35.16 ? 344 A 1 +ATOM 5951 H HG13 . VAL A1 1 354 ? -2.095 29.144 -2.525 1.0 35.16 ? 344 A 1 +ATOM 5952 H HG21 . VAL A1 1 354 ? -0.497 26.631 -2.582 1.0 31.91 ? 344 A 1 +ATOM 5953 H HG22 . VAL A1 1 354 ? -0.948 27.323 -3.939 1.0 31.91 ? 344 A 1 +ATOM 5954 H HG23 . VAL A1 1 354 ? 0.59 27.031 -3.669 1.0 31.91 ? 344 A 1 +ATOM 5955 N N . PHE A1 1 355 ? 1.948 29.279 -5.377 1.0 24.53 ? 345 A 1 +ATOM 5956 C CA . PHE A1 1 355 ? 3.293 29.144 -5.916 1.0 26.25 ? 345 A 1 +ATOM 5957 C C . PHE A1 1 355 ? 3.764 30.49 -6.468 1.0 41.98 ? 345 A 1 +ATOM 5958 O O . PHE A1 1 355 ? 3.087 31.103 -7.307 1.0 34.57 ? 345 A 1 +ATOM 5959 C CB . PHE A1 1 355 ? 3.341 28.113 -7.037 1.0 24.84 ? 345 A 1 +ATOM 5960 C CG . PHE A1 1 355 ? 4.725 27.856 -7.53 1.0 27.27 ? 345 A 1 +ATOM 5961 C CD1 . PHE A1 1 355 ? 5.574 27.017 -6.837 1.0 24.6 ? 345 A 1 +ATOM 5962 C CD2 . PHE A1 1 355 ? 5.183 28.44 -8.693 1.0 31.65 ? 345 A 1 +ATOM 5963 C CE1 . PHE A1 1 355 ? 6.874 26.821 -7.251 1.0 31.19 ? 345 A 1 +ATOM 5964 C CE2 . PHE A1 1 355 ? 6.479 28.23 -9.106 1.0 31.65 ? 345 A 1 +ATOM 5965 C CZ . PHE A1 1 355 ? 7.318 27.419 -8.403 1.0 28.6 ? 345 A 1 +ATOM 5966 H H . PHE A1 1 355 ? 1.331 29.181 -5.968 1.0 29.43 ? 345 A 1 +ATOM 5967 H HA . PHE A1 1 355 ? 3.883 28.858 -5.202 1.0 31.5 ? 345 A 1 +ATOM 5968 H HB2 . PHE A1 1 355 ? 2.979 27.275 -6.71 1.0 29.8 ? 345 A 1 +ATOM 5969 H HB3 . PHE A1 1 355 ? 2.812 28.434 -7.784 1.0 29.8 ? 345 A 1 +ATOM 5970 H HD1 . PHE A1 1 355 ? 5.265 26.577 -6.079 1.0 29.52 ? 345 A 1 +ATOM 5971 H HD2 . PHE A1 1 355 ? 4.615 28.976 -9.199 1.0 37.98 ? 345 A 1 +ATOM 5972 H HE1 . PHE A1 1 355 ? 7.447 26.286 -6.751 1.0 37.43 ? 345 A 1 +ATOM 5973 H HE2 . PHE A1 1 355 ? 6.787 28.648 -9.877 1.0 37.98 ? 345 A 1 +ATOM 5974 H HZ . PHE A1 1 355 ? 8.187 27.273 -8.701 1.0 34.33 ? 345 A 1 +ATOM 5975 N N . THR A1 1 356 ? 4.951 30.904 -6.041 1.0 36.21 ? 346 A 1 +ATOM 5976 C CA . THR A1 1 356 ? 5.494 32.241 -6.349 1.0 95.29 ? 346 A 1 +ATOM 5977 C C . THR A1 1 356 ? 4.423 33.337 -6.326 1.0 77.1 ? 346 A 1 +ATOM 5978 O O . THR A1 1 356 ? 3.764 33.562 -5.308 1.0 69.13 ? 346 A 1 +ATOM 5979 C CB . THR A1 1 356 ? 6.216 32.271 -7.723 1.0 45.92 ? 346 A 1 +ATOM 5980 H H . THR A1 1 356 ? 5.48 30.426 -5.56 1.0 43.45 ? 346 A 1 +ATOM 5981 H HA . THR A1 1 356 ? 6.139 32.46 -5.658 1.0 114.34 ? 346 A 1 +HETATM 5982 N N . CYS B2 2 357 ? -13.62 11.653 -17.753 1.0 15.5 ? 401 A 1 +HETATM 5983 C CA . CYS B2 2 357 ? -13.258 11.104 -19.086 1.0 14.53 ? 401 A 1 +HETATM 5984 C C . CYS B2 2 357 ? -11.777 10.907 -18.976 1.0 19.5 ? 401 A 1 +HETATM 5985 O O . CYS B2 2 357 ? -11.206 9.988 -19.577 1.0 21.3 ? 401 A 1 +HETATM 5986 C CB . CYS B2 2 357 ? -13.549 12.161 -20.146 1.0 15.72 ? 401 A 1 +HETATM 5987 S SG . CYS B2 2 357 ? -12.837 13.793 -19.661 1.0 14.51 ? 401 A 1 +HETATM 5988 O OXT . CYS B2 2 357 ? -11.137 11.77 -18.293 1.0 18.79 ? 401 A 1 +HETATM 5989 H HA . CYS B2 2 357 ? -13.734 10.298 -19.339 1.0 17.44 ? 401 A 1 +HETATM 5990 H HB2 . CYS B2 2 357 ? -13.154 11.89 -20.989 1.0 18.87 ? 401 A 1 +HETATM 5991 H HB3 . CYS B2 2 357 ? -14.509 12.261 -20.246 1.0 18.87 ? 401 A 1 +HETATM 5992 FE FE . FE2 C3 3 358 ? -12.387 13.254 -17.469 1.0 14.79 ? 402 A 1 +HETATM 5993 C C C CMO D4 4 359 ? -13.654 14.394 -16.878 0.93 15.47 ? 403 A 1 +HETATM 5994 O O C CMO D4 4 359 ? -14.462 15.123 -16.5 0.93 17.1 ? 403 A 1 +HETATM 5995 C C C CMO E4 5 360 ? -11.117 14.498 -17.376 0.96 14.1 ? 404 A 1 +HETATM 5996 O O C CMO E4 5 360 ? -10.282 15.318 -17.308 0.96 15.65 ? 404 A 1 +HETATM 5997 C C . CYN F5 6 361 ? -11.936 12.582 -15.952 1.0 16.12 ? 405 A 1 +HETATM 5998 N N . CYN F5 6 361 ? -11.615 12.105 -14.879 1.0 14.92 ? 405 A 1 +HETATM 5999 C C . PYR G6 7 362 ? -6.947 7.429 -40.8 1.0 56.9 ? 406 A 1 +HETATM 6000 O O . PYR G6 7 362 ? -6.283 6.301 -40.895 1.0 57.5 ? 406 A 1 +HETATM 6001 O OXT . PYR G6 7 362 ? -8.258 7.366 -40.833 1.0 56.71 ? 406 A 1 +HETATM 6002 C CA . PYR G6 7 362 ? -6.295 8.664 -40.657 1.0 57.62 ? 406 A 1 +HETATM 6003 O O3 . PYR G6 7 362 ? -6.927 9.794 -40.892 1.0 60.52 ? 406 A 1 +HETATM 6004 C CB . PYR G6 7 362 ? -4.859 8.74 -40.223 1.0 55.28 ? 406 A 1 +HETATM 6005 H HB1 . PYR G6 7 362 ? -4.21 8.649 -41.094 1.0 66.34 ? 406 A 1 +HETATM 6006 H HB2 . PYR G6 7 362 ? -4.677 9.697 -39.734 1.0 66.34 ? 406 A 1 +HETATM 6007 H HB3 . PYR G6 7 362 ? -4.647 7.93 -39.526 1.0 66.34 ? 406 A 1 +HETATM 6008 C C1 A GOL H7 8 363 ? -13.852 26.587 -1.22 0.82 40.6 ? 407 A 1 +HETATM 6009 O O1 A GOL H7 8 363 ? -13.272 27.014 -2.397 0.82 38.97 ? 407 A 1 +HETATM 6010 C C2 A GOL H7 8 363 ? -14.767 27.657 -0.692 0.82 38.62 ? 407 A 1 +HETATM 6011 O O2 A GOL H7 8 363 ? -15.368 27.265 0.544 0.82 44.83 ? 407 A 1 +HETATM 6012 C C3 A GOL H7 8 363 ? -15.845 27.845 -1.778 0.82 42.1 ? 407 A 1 +HETATM 6013 O O3 A GOL H7 8 363 ? -16.99 28.225 -1.083 0.82 46.84 ? 407 A 1 +HETATM 6014 H H11 A GOL H7 8 363 ? -13.19 26.384 -0.541 0.82 48.72 ? 407 A 1 +HETATM 6015 H H12 A GOL H7 8 363 ? -14.366 25.774 -1.342 0.82 48.72 ? 407 A 1 +HETATM 6016 H H2 A GOL H7 8 363 ? -14.269 28.474 -0.533 0.82 46.35 ? 407 A 1 +HETATM 6017 H HO2 A GOL H7 8 363 ? -16.146 27.605 0.57 0.82 53.8 ? 407 A 1 +HETATM 6018 H H31 A GOL H7 8 363 ? -15.946 27.021 -2.28 0.82 50.52 ? 407 A 1 +HETATM 6019 H H32 A GOL H7 8 363 ? -15.542 28.503 -2.423 0.82 50.52 ? 407 A 1 +HETATM 6020 N N . SAH I8 9 364 ? -17.865 17.003 -26.042 1.0 15.52 ? 408 A 1 +HETATM 6021 C CA . SAH I8 9 364 ? -17.075 17.569 -24.928 1.0 13.98 ? 408 A 1 +HETATM 6022 C CB . SAH I8 9 364 ? -17.07 16.718 -23.687 1.0 16.79 ? 408 A 1 +HETATM 6023 C CG . SAH I8 9 364 ? -17.189 15.242 -23.847 1.0 18.34 ? 408 A 1 +HETATM 6024 S SD . SAH I8 9 364 ? -15.779 14.412 -24.57 1.0 19.12 ? 408 A 1 +HETATM 6025 C C . SAH I8 9 364 ? -15.673 17.89 -25.432 1.0 15.58 ? 408 A 1 +HETATM 6026 O O . SAH I8 9 364 ? -14.983 18.683 -24.861 1.0 15.41 ? 408 A 1 +HETATM 6027 O OXT . SAH I8 9 364 ? -15.354 17.308 -26.538 1.0 16.89 ? 408 A 1 +HETATM 6028 C "C5'" . SAH I8 9 364 ? -14.672 14.417 -23.123 1.0 19.7 ? 408 A 1 +HETATM 6029 C "C4'" . SAH I8 9 364 ? -13.223 14.058 -23.438 1.0 16.19 ? 408 A 1 +HETATM 6030 O "O4'" . SAH I8 9 364 ? -13.1 12.691 -23.698 1.0 17.08 ? 408 A 1 +HETATM 6031 C "C3'" . SAH I8 9 364 ? -12.552 14.719 -24.616 1.0 14.58 ? 408 A 1 +HETATM 6032 O "O3'" . SAH I8 9 364 ? -12.114 16.019 -24.243 1.0 16.83 ? 408 A 1 +HETATM 6033 C "C2'" . SAH I8 9 364 ? -11.375 13.766 -24.892 1.0 14.5 ? 408 A 1 +HETATM 6034 O "O2'" . SAH I8 9 364 ? -10.169 14.207 -24.323 1.0 16.84 ? 408 A 1 +HETATM 6035 C "C1'" . SAH I8 9 364 ? -11.815 12.456 -24.215 1.0 14.78 ? 408 A 1 +HETATM 6036 N N9 . SAH I8 9 364 ? -11.906 11.313 -25.151 1.0 13.49 ? 408 A 1 +HETATM 6037 C C8 . SAH I8 9 364 ? -12.756 11.213 -26.252 1.0 15.31 ? 408 A 1 +HETATM 6038 N N7 . SAH I8 9 364 ? -12.456 10.119 -26.909 1.0 14.76 ? 408 A 1 +HETATM 6039 C C5 . SAH I8 9 364 ? -11.389 9.515 -26.298 1.0 14.68 ? 408 A 1 +HETATM 6040 C C6 . SAH I8 9 364 ? -10.636 8.377 -26.563 1.0 14.06 ? 408 A 1 +HETATM 6041 N N6 . SAH I8 9 364 ? -10.879 7.568 -27.608 1.0 14.29 ? 408 A 1 +HETATM 6042 N N1 . SAH I8 9 364 ? -9.616 8.087 -25.732 1.0 14.25 ? 408 A 1 +HETATM 6043 C C2 . SAH I8 9 364 ? -9.355 8.843 -24.658 1.0 14.58 ? 408 A 1 +HETATM 6044 N N3 . SAH I8 9 364 ? -10.058 9.951 -24.351 1.0 14.39 ? 408 A 1 +HETATM 6045 C C4 . SAH I8 9 364 ? -11.056 10.289 -25.186 1.0 13.52 ? 408 A 1 +HETATM 6046 H H2 . SAH I8 9 364 ? -8.536 8.548 -24.001 1.0 17.5 ? 408 A 1 +HETATM 6047 H HN1 . SAH I8 9 364 ? -18.702 16.964 -25.862 1.0 18.63 ? 408 A 1 +HETATM 6048 H HN2 . SAH I8 9 364 ? -17.937 17.52 -26.725 1.0 18.63 ? 408 A 1 +HETATM 6049 H HA . SAH I8 9 364 ? -17.499 18.396 -24.617 1.0 16.78 ? 408 A 1 +HETATM 6050 H HB1 . SAH I8 9 364 ? -17.894 17.054 -23.058 1.0 20.14 ? 408 A 1 +HETATM 6051 H HB2 . SAH I8 9 364 ? -16.139 16.922 -23.156 1.0 20.14 ? 408 A 1 +HETATM 6052 H HG1 . SAH I8 9 364 ? -18.06 15.038 -24.47 1.0 22.01 ? 408 A 1 +HETATM 6053 H HG2 . SAH I8 9 364 ? -17.371 14.808 -22.864 1.0 22.01 ? 408 A 1 +HETATM 6054 H "H5'1" . SAH I8 9 364 ? -15.055 13.708 -22.39 1.0 23.64 ? 408 A 1 +HETATM 6055 H "H5'2" . SAH I8 9 364 ? -14.694 15.41 -22.673 1.0 23.64 ? 408 A 1 +HETATM 6056 H "H4'" . SAH I8 9 364 ? -12.727 14.413 -22.535 1.0 19.42 ? 408 A 1 +HETATM 6057 H "H3'" . SAH I8 9 364 ? -13.187 14.869 -25.489 1.0 17.5 ? 408 A 1 +HETATM 6058 H "HO3'" . SAH I8 9 364 ? -11.135 16.058 -24.286 1.0 20.2 ? 408 A 1 +HETATM 6059 H "H2'" . SAH I8 9 364 ? -11.171 13.682 -25.96 1.0 17.4 ? 408 A 1 +HETATM 6060 H "HO2'" . SAH I8 9 364 ? -9.811 13.509 -23.735 1.0 20.21 ? 408 A 1 +HETATM 6061 H "H1'" . SAH I8 9 364 ? -11.067 12.204 -23.464 1.0 17.74 ? 408 A 1 +HETATM 6062 H H8 . SAH I8 9 364 ? -13.537 11.924 -26.52 1.0 18.37 ? 408 A 1 +HETATM 6063 H HN61 . SAH I8 9 364 ? -11.64 7.777 -28.246 1.0 17.15 ? 408 A 1 +HETATM 6064 H HN62 . SAH I8 9 364 ? -10.3 6.747 -27.76 1.0 17.15 ? 408 A 1 +HETATM 6065 P P . PO4 J9 10 365 ? 8.003 28.971 -13.083 1.0 78.39 ? 409 A 1 +HETATM 6066 O O1 . PO4 J9 10 365 ? 8.416 28.801 -14.525 1.0 78.44 ? 409 A 1 +HETATM 6067 O O2 . PO4 J9 10 365 ? 6.834 28.065 -12.775 1.0 77.58 ? 409 A 1 +HETATM 6068 O O3 . PO4 J9 10 365 ? 7.594 30.403 -12.845 1.0 80.67 ? 409 A 1 +HETATM 6069 O O4 . PO4 J9 10 365 ? 9.166 28.635 -12.171 1.0 79.12 ? 409 A 1 +HETATM 6070 P P . PO4 K9 11 366 ? -15.521 5.422 -12.462 0.96 29.98 ? 410 A 1 +HETATM 6071 O O1 . PO4 K9 11 366 ? -15.041 6.241 -13.574 0.96 34.04 ? 410 A 1 +HETATM 6072 O O2 . PO4 K9 11 366 ? -14.487 4.409 -12.015 0.96 34.36 ? 410 A 1 +HETATM 6073 O O3 . PO4 K9 11 366 ? -16.639 4.543 -13.013 0.96 40.68 ? 410 A 1 +HETATM 6074 O O4 . PO4 K9 11 366 ? -16.024 6.091 -11.297 0.96 30.35 ? 410 A 1 +HETATM 6075 P P A PO4 L9 12 367 ? 4.639 4.645 -8.181 0.46 42.84 ? 411 A 1 +HETATM 6076 P P B PO4 L9 12 367 ? 6.483 6.365 -6.973 0.54 48.42 ? 411 A 1 +HETATM 6077 O O1 A PO4 L9 12 367 ? 5.005 3.882 -9.445 0.46 41.03 ? 411 A 1 +HETATM 6078 O O1 B PO4 L9 12 367 ? 6.594 4.861 -7.019 0.54 49.69 ? 411 A 1 +HETATM 6079 O O2 A PO4 L9 12 367 ? 3.153 4.486 -7.791 0.46 36.41 ? 411 A 1 +HETATM 6080 O O2 B PO4 L9 12 367 ? 5.039 6.73 -7.266 0.54 44.99 ? 411 A 1 +HETATM 6081 O O3 A PO4 L9 12 367 ? 5.458 4.2 -7.004 0.46 41.84 ? 411 A 1 +HETATM 6082 O O3 B PO4 L9 12 367 ? 6.801 6.865 -5.574 0.54 41.11 ? 411 A 1 +HETATM 6083 O O4 A PO4 L9 12 367 ? 4.939 6.108 -8.399 0.46 43.47 ? 411 A 1 +HETATM 6084 O O4 B PO4 L9 12 367 ? 7.424 6.948 -7.999 0.54 50.62 ? 411 A 1 +HETATM 6085 P P . PO4 M9 13 368 ? -16.748 -1.865 -23.51 0.66 49.03 ? 412 A 1 +HETATM 6086 O O1 . PO4 M9 13 368 ? -15.705 -1.77 -24.582 0.66 50.1 ? 412 A 1 +HETATM 6087 O O2 . PO4 M9 13 368 ? -17.149 -3.323 -23.348 0.66 51.67 ? 412 A 1 +HETATM 6088 O O3 . PO4 M9 13 368 ? -17.957 -1.021 -23.834 0.66 43.93 ? 412 A 1 +HETATM 6089 O O4 . PO4 M9 13 368 ? -16.196 -1.448 -22.192 0.66 45.55 ? 412 A 1 +HETATM 6090 P P . PO4 N9 14 369 ? 12.855 26.598 -26.938 0.64 42.51 ? 413 A 1 +HETATM 6091 O O1 . PO4 N9 14 369 ? 11.669 26.549 -27.867 0.64 41.15 ? 413 A 1 +HETATM 6092 O O2 . PO4 N9 14 369 ? 14.012 25.826 -27.549 0.64 41.85 ? 413 A 1 +HETATM 6093 O O3 . PO4 N9 14 369 ? 12.564 26.065 -25.53 0.64 40.27 ? 413 A 1 +HETATM 6094 O O4 . PO4 N9 14 369 ? 13.258 28.03 -26.75 0.64 41.72 ? 413 A 1 +HETATM 6095 CL CL . CL O10 15 370 ? -13.656 20.424 -11.485 1.0 18.89 ? 414 A 1 +HETATM 6096 FE FE1 . SF4 P11 16 371 ? -16.704 13.168 -28.652 1.0 14.51 3 415 A 1 +HETATM 6097 FE FE2 . SF4 P11 16 371 ? -18.415 15.035 -29.544 1.0 14.51 3 415 A 1 +HETATM 6098 FE FE3 . SF4 P11 16 371 ? -15.796 15.239 -30.166 1.0 14.69 3 415 A 1 +HETATM 6099 FE FE4 . SF4 P11 16 371 ? -16.618 15.773 -27.438 1.0 16.4 3 415 A 1 +HETATM 6100 S S1 . SF4 P11 16 371 ? -17.092 16.926 -29.468 1.0 15.42 ? 415 A 1 +HETATM 6101 S S2 . SF4 P11 16 371 ? -14.845 14.451 -28.213 1.0 14.86 ? 415 A 1 +HETATM 6102 S S3 . SF4 P11 16 371 ? -18.333 14.121 -27.454 1.0 14.72 ? 415 A 1 +HETATM 6103 S S4 . SF4 P11 16 371 ? -17.281 13.593 -30.861 1.0 14.95 ? 415 A 1 +HETATM 6104 O O . HOH Q12 17 372 ? -19.612 -2.124 -23.261 1.0 49.98 ? 501 A 1 +HETATM 6105 O O . HOH Q12 17 373 ? -19.483 2.481 -28.077 1.0 42.55 ? 502 A 1 +HETATM 6106 O O . HOH Q12 17 374 ? -3.58 12.739 4.824 1.0 33.48 ? 503 A 1 +HETATM 6107 O O . HOH Q12 17 375 ? 9.623 16.996 -34.751 1.0 58.83 ? 504 A 1 +HETATM 6108 O O . HOH Q12 17 376 ? -0.212 11.671 3.131 1.0 43.13 ? 505 A 1 +HETATM 6109 O O . HOH Q12 17 377 ? -17.845 2.97 -14.13 1.0 50.92 ? 506 A 1 +HETATM 6110 O O . HOH Q12 17 378 ? -9.806 24.224 -10.622 1.0 21.54 ? 507 A 1 +HETATM 6111 O O . HOH Q12 17 379 ? -3.109 18.95 3.117 1.0 34.26 ? 508 A 1 +HETATM 6112 O O . HOH Q12 17 380 ? 28.212 14.334 -26.678 1.0 43.38 ? 509 A 1 +HETATM 6113 O O . HOH Q12 17 381 ? 15.689 14.1 -26.332 1.0 34.64 ? 510 A 1 +HETATM 6114 O O . HOH Q12 17 382 ? -16.465 -1.949 -19.827 1.0 53.36 ? 511 A 1 +HETATM 6115 O O . HOH Q12 17 383 ? -23.392 12.083 -32.002 0.4 13.83 ? 512 A 1 +HETATM 6116 O O . HOH Q12 17 384 ? 10.315 15.426 -0.555 1.0 40.07 ? 513 A 1 +HETATM 6117 O O . HOH Q12 17 385 ? 31.507 8.327 -31.33 1.0 60.62 ? 514 A 1 +HETATM 6118 O O . HOH Q12 17 386 ? 10.588 19.241 -28.95 1.0 50.03 ? 515 A 1 +HETATM 6119 O O . HOH Q12 17 387 ? -14.021 2.041 -11.512 1.0 43.52 ? 516 A 1 +HETATM 6120 O O . HOH Q12 17 388 ? 6.188 2.144 -5.839 1.0 56.79 ? 517 A 1 +HETATM 6121 O O . HOH Q12 17 389 ? -11.118 16.128 4.522 1.0 58.42 ? 518 A 1 +HETATM 6122 O O . HOH Q12 17 390 ? -38.708 14.79 -9.112 1.0 50.04 ? 519 A 1 +HETATM 6123 O O . HOH Q12 17 391 ? -31.457 32.688 -23.397 1.0 52.45 ? 520 A 1 +HETATM 6124 O O . HOH Q12 17 392 ? -20.175 6.486 -18.436 1.0 31.42 ? 521 A 1 +HETATM 6125 O O . HOH Q12 17 393 ? -14.726 8.734 -13.977 1.0 22.71 ? 522 A 1 +HETATM 6126 O O . HOH Q12 17 394 ? 31.785 16.068 -31.64 1.0 31.0 ? 523 A 1 +HETATM 6127 O O . HOH Q12 17 395 ? 25.322 3.519 -18.036 1.0 52.13 ? 524 A 1 +HETATM 6128 O O . HOH Q12 17 396 ? 0.189 33.909 -24.603 1.0 58.6 ? 525 A 1 +HETATM 6129 O O . HOH Q12 17 397 ? -13.917 30.075 -8.921 1.0 50.11 ? 526 A 1 +HETATM 6130 O O . HOH Q12 17 398 ? -19.447 20.271 -38.644 1.0 48.16 ? 527 A 1 +HETATM 6131 O O . HOH Q12 17 399 ? -10.654 32.843 -15.288 1.0 42.06 ? 528 A 1 +HETATM 6132 O O . HOH Q12 17 400 ? 31.954 12.64 -36.06 1.0 52.7 ? 529 A 1 +HETATM 6133 O O . HOH Q12 17 401 ? -1.366 29.858 -27.073 1.0 47.88 ? 530 A 1 +HETATM 6134 O O . HOH Q12 17 402 ? 5.458 9.082 -5.49 1.0 41.01 ? 531 A 1 +HETATM 6135 O O . HOH Q12 17 403 ? -20.468 1.896 -30.399 1.0 26.77 ? 532 A 1 +HETATM 6136 O O . HOH Q12 17 404 ? -0.226 9.577 1.206 1.0 37.49 ? 533 A 1 +HETATM 6137 O O . HOH Q12 17 405 ? -36.118 19.555 -21.132 1.0 39.3 ? 534 A 1 +HETATM 6138 O O . HOH Q12 17 406 ? -19.441 11.13 -42.836 1.0 38.58 ? 535 A 1 +HETATM 6139 O O . HOH Q12 17 407 ? 6.778 3.634 -21.949 1.0 35.27 ? 536 A 1 +HETATM 6140 O O . HOH Q12 17 408 ? -0.34 15.133 -24.996 1.0 20.48 ? 537 A 1 +HETATM 6141 O O . HOH Q12 17 409 ? 2.721 20.302 -31.818 1.0 18.51 ? 538 A 1 +HETATM 6142 O O . HOH Q12 17 410 ? -8.531 29.134 -20.631 1.0 43.03 ? 539 A 1 +HETATM 6143 O O . HOH Q12 17 411 ? -25.693 6.323 -32.73 1.0 23.27 ? 540 A 1 +HETATM 6144 O O . HOH Q12 17 412 ? -25.982 0.363 -15.925 1.0 29.45 ? 541 A 1 +HETATM 6145 O O . HOH Q12 17 413 ? -11.256 26.782 2.544 1.0 53.51 ? 542 A 1 +HETATM 6146 O O . HOH Q12 17 414 ? -21.51 12.913 -40.833 1.0 37.73 ? 543 A 1 +HETATM 6147 O O . HOH Q12 17 415 ? 11.126 28.822 -14.667 1.0 48.6 ? 544 A 1 +HETATM 6148 O O . HOH Q12 17 416 ? -17.772 -2.993 -33.537 1.0 62.34 ? 545 A 1 +HETATM 6149 O O . HOH Q12 17 417 ? 2.113 3.162 -5.742 1.0 51.65 ? 546 A 1 +HETATM 6150 O O . HOH Q12 17 418 ? 0.693 12.372 0.245 1.0 35.31 ? 547 A 1 +HETATM 6151 O O . HOH Q12 17 419 ? -18.51 1.467 -3.267 1.0 30.52 ? 548 A 1 +HETATM 6152 O O . HOH Q12 17 420 ? -17.018 8.559 -40.349 1.0 28.83 ? 549 A 1 +HETATM 6153 O O . HOH Q12 17 421 ? -0.182 17.076 -29.242 1.0 16.38 ? 550 A 1 +HETATM 6154 O O . HOH Q12 17 422 ? 6.877 20.656 -32.458 1.0 39.93 ? 551 A 1 +HETATM 6155 O O . HOH Q12 17 423 ? 3.03 15.199 -35.539 1.0 29.99 ? 552 A 1 +HETATM 6156 O O . HOH Q12 17 424 ? -28.86 1.206 -21.715 1.0 26.9 ? 553 A 1 +HETATM 6157 O O . HOH Q12 17 425 ? -9.241 9.834 3.728 1.0 25.41 ? 554 A 1 +HETATM 6158 O O . HOH Q12 17 426 ? 13.514 18.197 -31.714 1.0 54.28 ? 555 A 1 +HETATM 6159 O O . HOH Q12 17 427 ? -22.724 -2.7 -6.157 1.0 52.79 ? 556 A 1 +HETATM 6160 O O . HOH Q12 17 428 ? -12.712 30.897 -33.308 1.0 34.61 ? 557 A 1 +HETATM 6161 O O . HOH Q12 17 429 ? -6.255 -0.469 -31.81 1.0 21.66 ? 558 A 1 +HETATM 6162 O O . HOH Q12 17 430 ? -11.128 10.607 -12.365 1.0 15.66 ? 559 A 1 +HETATM 6163 O O . HOH Q12 17 431 ? -12.335 28.638 -4.301 1.0 56.55 ? 560 A 1 +HETATM 6164 O O . HOH Q12 17 432 ? -29.615 30.734 -20.548 1.0 27.89 ? 561 A 1 +HETATM 6165 O O . HOH Q12 17 433 ? -17.301 0.829 -21.328 1.0 39.78 ? 562 A 1 +HETATM 6166 O O . HOH Q12 17 434 ? -12.795 16.926 -28.272 1.0 20.96 ? 563 A 1 +HETATM 6167 O O . HOH Q12 17 435 ? -9.845 14.156 -41.102 1.0 28.62 ? 564 A 1 +HETATM 6168 O O . HOH Q12 17 436 ? 0.752 1.438 -26.803 1.0 33.71 ? 565 A 1 +HETATM 6169 O O . HOH Q12 17 437 ? 1.141 13.216 -6.111 1.0 16.78 ? 566 A 1 +HETATM 6170 O O . HOH Q12 17 438 ? -16.987 24.327 -32.882 1.0 19.77 ? 567 A 1 +HETATM 6171 O O . HOH Q12 17 439 ? -30.31 4.488 -11.682 1.0 36.66 ? 568 A 1 +HETATM 6172 O O . HOH Q12 17 440 ? -26.742 37.552 -24.904 1.0 50.63 ? 569 A 1 +HETATM 6173 O O . HOH Q12 17 441 ? -2.417 6.043 -31.888 1.0 18.29 ? 570 A 1 +HETATM 6174 O O . HOH Q12 17 442 ? -23.553 17.835 -37.216 1.0 40.95 ? 571 A 1 +HETATM 6175 O O . HOH Q12 17 443 ? -8.686 0.039 -27.591 1.0 24.52 ? 572 A 1 +HETATM 6176 O O . HOH Q12 17 444 ? -7.797 3.391 -11.015 1.0 19.69 ? 573 A 1 +HETATM 6177 O O . HOH Q12 17 445 ? 10.253 26.996 -22.16 1.0 54.81 ? 574 A 1 +HETATM 6178 O O . HOH Q12 17 446 ? -21.472 17.411 -0.642 1.0 21.96 ? 575 A 1 +HETATM 6179 O O . HOH Q12 17 447 ? -11.962 1.768 -3.357 1.0 41.6 ? 576 A 1 +HETATM 6180 O O . HOH Q12 17 448 ? -24.868 -4.658 -14.546 1.0 44.85 ? 577 A 1 +HETATM 6181 O O . HOH Q12 17 449 ? 26.05 19.386 -14.204 1.0 51.92 ? 578 A 1 +HETATM 6182 O O . HOH Q12 17 450 ? -34.361 10.487 -20.191 1.0 21.21 ? 579 A 1 +HETATM 6183 O O . HOH Q12 17 451 ? -16.476 11.722 -18.34 1.0 17.96 ? 580 A 1 +HETATM 6184 O O . HOH Q12 17 452 ? -26.814 30.465 -9.422 1.0 26.1 ? 581 A 1 +HETATM 6185 O O . HOH Q12 17 453 ? 0.067 26.345 -11.271 1.0 20.13 ? 582 A 1 +HETATM 6186 O O . HOH Q12 17 454 ? 12.712 11.654 -28.585 1.0 40.25 ? 583 A 1 +HETATM 6187 O O . HOH Q12 17 455 ? -9.223 25.826 -1.229 1.0 41.55 ? 584 A 1 +HETATM 6188 O O . HOH Q12 17 456 ? -15.663 33.121 -27.991 1.0 48.41 ? 585 A 1 +HETATM 6189 O O . HOH Q12 17 457 ? -7.832 31.258 -11.54 1.0 43.88 ? 586 A 1 +HETATM 6190 O O . HOH Q12 17 458 ? -21.152 4.792 -9.353 1.0 36.32 ? 587 A 1 +HETATM 6191 O O . HOH Q12 17 459 ? -29.187 10.623 0.352 1.0 31.03 ? 588 A 1 +HETATM 6192 O O . HOH Q12 17 460 ? -1.003 3.755 -34.636 1.0 26.3 ? 589 A 1 +HETATM 6193 O O . HOH Q12 17 461 ? -22.139 5.673 -12.441 1.0 31.43 ? 590 A 1 +HETATM 6194 O O . HOH Q12 17 462 ? -13.384 19.307 -2.852 1.0 16.77 ? 591 A 1 +HETATM 6195 O O . HOH Q12 17 463 ? -27.292 26.14 -30.276 1.0 38.7 ? 592 A 1 +HETATM 6196 O O . HOH Q12 17 464 ? -15.977 19.745 -28.188 1.0 18.33 ? 593 A 1 +HETATM 6197 O O . HOH Q12 17 465 ? 19.736 10.036 -22.273 1.0 65.24 ? 594 A 1 +HETATM 6198 O O . HOH Q12 17 466 ? 26.343 12.134 -30.096 1.0 57.68 ? 595 A 1 +HETATM 6199 O O . HOH Q12 17 467 ? -22.053 6.331 -40.313 1.0 36.31 ? 596 A 1 +HETATM 6200 O O . HOH Q12 17 468 ? -0.839 25.488 -31.136 1.0 30.64 ? 597 A 1 +HETATM 6201 O O . HOH Q12 17 469 ? -14.636 17.588 -34.81 1.0 19.3 ? 598 A 1 +HETATM 6202 O O . HOH Q12 17 470 ? -32.304 6.511 -25.025 1.0 29.85 ? 599 A 1 +HETATM 6203 O O . HOH Q12 17 471 ? -4.58 25.139 -5.949 1.0 17.49 ? 600 A 1 +HETATM 6204 O O . HOH Q12 17 472 ? -15.146 30.748 -11.198 1.0 26.87 ? 601 A 1 +HETATM 6205 O O . HOH Q12 17 473 ? -1.538 33.659 -15.155 1.0 58.65 ? 602 A 1 +HETATM 6206 O O . HOH Q12 17 474 ? -17.973 -2.923 -18.582 1.0 69.52 ? 603 A 1 +HETATM 6207 O O . HOH Q12 17 475 ? -32.419 8.709 -14.195 1.0 46.94 ? 604 A 1 +HETATM 6208 O O . HOH Q12 17 476 ? -28.792 29.221 -8.03 1.0 24.15 ? 605 A 1 +HETATM 6209 O O . HOH Q12 17 477 ? -3.21 25.173 -3.46 1.0 23.18 ? 606 A 1 +HETATM 6210 O O . HOH Q12 17 478 ? -7.604 31.165 -15.243 1.0 54.73 ? 607 A 1 +HETATM 6211 O O . HOH Q12 17 479 ? 7.045 16.165 -34.574 1.0 35.82 ? 608 A 1 +HETATM 6212 O O . HOH Q12 17 480 ? -20.241 30.578 -9.228 1.0 37.21 ? 609 A 1 +HETATM 6213 O O . HOH Q12 17 481 ? -20.442 31.912 -11.92 1.0 25.05 ? 610 A 1 +HETATM 6214 O O . HOH Q12 17 482 ? -6.46 23.379 -36.316 1.0 17.84 ? 611 A 1 +HETATM 6215 O O . HOH Q12 17 483 ? 1.342 8.83 -30.807 1.0 23.32 ? 612 A 1 +HETATM 6216 O O . HOH Q12 17 484 ? -3.633 15.85 -2.853 1.0 17.86 ? 613 A 1 +HETATM 6217 O O . HOH Q12 17 485 ? -3.689 33.216 -21.746 1.0 44.06 ? 614 A 1 +HETATM 6218 O O . HOH Q12 17 486 ? 14.805 3.627 -24.971 1.0 53.15 ? 615 A 1 +HETATM 6219 O O . HOH Q12 17 487 ? -31.949 12.507 -2.458 1.0 31.25 ? 616 A 1 +HETATM 6220 O O . HOH Q12 17 488 ? -5.378 19.266 -3.422 1.0 17.1 ? 617 A 1 +HETATM 6221 O O . HOH Q12 17 489 ? -8.136 24.302 -3.206 1.0 24.99 ? 618 A 1 +HETATM 6222 O O . HOH Q12 17 490 ? -4.919 19.956 0.309 1.0 22.53 ? 619 A 1 +HETATM 6223 O O . HOH Q12 17 491 ? -1.748 26.645 -13.316 1.0 23.41 ? 620 A 1 +HETATM 6224 O O . HOH Q12 17 492 ? 0.903 21.902 1.34 1.0 28.97 ? 621 A 1 +HETATM 6225 O O . HOH Q12 17 493 ? 5.606 18.376 -34.061 1.0 31.05 ? 622 A 1 +HETATM 6226 O O . HOH Q12 17 494 ? -6.979 28.918 -16.427 1.0 41.11 ? 623 A 1 +HETATM 6227 O O . HOH Q12 17 495 ? -18.365 36.907 -16.324 1.0 44.64 ? 624 A 1 +HETATM 6228 O O . HOH Q12 17 496 ? -18.195 -1.15 -29.755 1.0 40.07 ? 625 A 1 +HETATM 6229 O O . HOH Q12 17 497 ? -17.176 2.107 -23.368 1.0 34.92 ? 626 A 1 +HETATM 6230 O O . HOH Q12 17 498 ? -8.252 0.935 -12.397 1.0 22.03 ? 627 A 1 +HETATM 6231 O O . HOH Q12 17 499 ? -8.503 35.168 -21.734 1.0 25.55 ? 628 A 1 +HETATM 6232 O O . HOH Q12 17 500 ? -2.242 12.676 -42.388 1.0 52.46 ? 629 A 1 +HETATM 6233 O O . HOH Q12 17 501 ? -9.902 -0.228 -22.822 1.0 22.17 ? 630 A 1 +HETATM 6234 O O . HOH Q12 17 502 ? -29.247 3.527 -8.201 1.0 31.81 ? 631 A 1 +HETATM 6235 O O . HOH Q12 17 503 ? -32.086 22.862 -6.282 1.0 27.72 ? 632 A 1 +HETATM 6236 O O . HOH Q12 17 504 ? -32.091 12.932 -5.277 1.0 29.53 ? 633 A 1 +HETATM 6237 O O . HOH Q12 17 505 ? -17.133 16.883 -40.054 1.0 22.38 ? 634 A 1 +HETATM 6238 O O . HOH Q12 17 506 ? -32.26 11.25 -11.032 1.0 26.68 ? 635 A 1 +HETATM 6239 O O . HOH Q12 17 507 ? 15.019 6.819 -8.788 1.0 35.56 ? 636 A 1 +HETATM 6240 O O . HOH Q12 17 508 ? -10.544 -0.933 -31.663 1.0 28.29 ? 637 A 1 +HETATM 6241 O O . HOH Q12 17 509 ? -7.685 1.76 -4.21 1.0 45.41 ? 638 A 1 +HETATM 6242 O O . HOH Q12 17 510 ? -13.602 3.326 -8.04 1.0 50.79 ? 639 A 1 +HETATM 6243 O O . HOH Q12 17 511 ? -4.828 15.152 -15.64 1.0 14.27 ? 640 A 1 +HETATM 6244 O O . HOH Q12 17 512 ? -28.05 33.039 -17.27 1.0 32.39 ? 641 A 1 +HETATM 6245 O O . HOH Q12 17 513 ? -8.864 22.7 -0.28 1.0 40.91 ? 642 A 1 +HETATM 6246 O O . HOH Q12 17 514 ? -5.71 9.248 5.254 1.0 38.34 ? 643 A 1 +HETATM 6247 O O . HOH Q12 17 515 ? 9.687 24.796 -3.342 1.0 53.73 ? 644 A 1 +HETATM 6248 O O . HOH Q12 17 516 ? -35.243 23.488 -18.137 1.0 44.9 ? 645 A 1 +HETATM 6249 O O . HOH Q12 17 517 ? 2.192 10.063 -2.942 1.0 24.78 ? 646 A 1 +HETATM 6250 O O . HOH Q12 17 518 ? 1.145 7.531 -34.973 1.0 37.64 ? 647 A 1 +HETATM 6251 O O . HOH Q12 17 519 ? 0.496 1.527 -21.655 1.0 36.85 ? 648 A 1 +HETATM 6252 O O . HOH Q12 17 520 ? -17.804 6.144 -36.523 1.0 20.08 ? 649 A 1 +HETATM 6253 O O . HOH Q12 17 521 ? -16.357 9.074 -16.311 1.0 30.66 ? 650 A 1 +HETATM 6254 O O . HOH Q12 17 522 ? -23.168 26.702 -4.626 1.0 21.69 ? 651 A 1 +HETATM 6255 O O . HOH Q12 17 523 ? 13.345 13.218 -7.443 1.0 35.81 ? 652 A 1 +HETATM 6256 O O . HOH Q12 17 524 ? -14.018 26.975 -7.123 1.0 26.23 ? 653 A 1 +HETATM 6257 O O . HOH Q12 17 525 ? -6.34 23.173 -5.437 1.0 21.76 ? 654 A 1 +HETATM 6258 O O . HOH Q12 17 526 ? 14.632 1.002 -16.969 1.0 28.18 ? 655 A 1 +HETATM 6259 O O . HOH Q12 17 527 ? -13.254 -2.191 -35.389 1.0 37.62 ? 656 A 1 +HETATM 6260 O O . HOH Q12 17 528 ? 1.036 19.486 -29.691 1.0 16.72 ? 657 A 1 +HETATM 6261 O O . HOH Q12 17 529 ? -20.599 1.92 -10.056 1.0 40.11 ? 658 A 1 +HETATM 6262 O O . HOH Q12 17 530 ? -9.17 1.404 -8.831 1.0 53.84 ? 659 A 1 +HETATM 6263 O O . HOH Q12 17 531 ? -10.468 29.153 -6.468 1.0 30.38 ? 660 A 1 +HETATM 6264 O O . HOH Q12 17 532 ? 4.266 6.633 0.492 1.0 61.51 ? 661 A 1 +HETATM 6265 O O . HOH Q12 17 533 ? -9.545 10.755 -21.713 1.0 26.42 ? 662 A 1 +HETATM 6266 O O . HOH Q12 17 534 ? -9.873 17.192 -41.315 1.0 27.72 ? 663 A 1 +HETATM 6267 O O . HOH Q12 17 535 ? -11.505 9.538 2.085 1.0 26.38 ? 664 A 1 +HETATM 6268 O O . HOH Q12 17 536 ? 0.74 30.266 -8.913 1.0 33.42 ? 665 A 1 +HETATM 6269 O O . HOH Q12 17 537 ? -7.011 32.906 -9.025 1.0 56.44 ? 666 A 1 +HETATM 6270 O O . HOH Q12 17 538 ? -15.99 20.424 -22.917 1.0 15.54 ? 667 A 1 +HETATM 6271 O O . HOH Q12 17 539 ? 25.734 17.226 -20.381 1.0 60.23 ? 668 A 1 +HETATM 6272 O O . HOH Q12 17 540 ? 0.911 5.162 -28.498 1.0 36.69 ? 669 A 1 +HETATM 6273 O O . HOH Q12 17 541 ? -23.484 -0.343 -26.798 1.0 58.56 ? 670 A 1 +HETATM 6274 O O . HOH Q12 17 542 ? 3.134 2.065 -20.374 1.0 21.34 ? 671 A 1 +HETATM 6275 O O . HOH Q12 17 543 ? -10.789 5.844 -31.455 1.0 16.41 ? 672 A 1 +HETATM 6276 O O . HOH Q12 17 544 ? -13.052 18.224 -22.779 1.0 15.54 ? 673 A 1 +HETATM 6277 O O . HOH Q12 17 545 ? -14.773 18.967 -5.213 1.0 15.99 ? 674 A 1 +HETATM 6278 O O . HOH Q12 17 546 ? -18.701 33.421 -29.805 1.0 36.43 ? 675 A 1 +HETATM 6279 O O . HOH Q12 17 547 ? 5.884 25.231 -28.131 1.0 47.66 ? 676 A 1 +HETATM 6280 O O . HOH Q12 17 548 ? -15.871 28.936 -7.432 1.0 29.6 ? 677 A 1 +HETATM 6281 O O . HOH Q12 17 549 ? -16.338 5.019 1.47 1.0 37.39 ? 678 A 1 +HETATM 6282 O O . HOH Q12 17 550 ? -0.612 6.078 -37.417 1.0 49.99 ? 679 A 1 +HETATM 6283 O O . HOH Q12 17 551 ? -34.747 22.701 -25.676 1.0 37.99 ? 680 A 1 +HETATM 6284 O O . HOH Q12 17 552 ? -7.814 2.49 -37.55 1.0 26.85 ? 681 A 1 +HETATM 6285 O O . HOH Q12 17 553 ? 5.368 28.02 -22.349 1.0 29.29 ? 682 A 1 +HETATM 6286 O O . HOH Q12 17 554 ? -30.178 7.866 -8.675 1.0 26.35 ? 683 A 1 +HETATM 6287 O O . HOH Q12 17 555 ? -5.06 31.275 -14.721 1.0 39.37 ? 684 A 1 +HETATM 6288 O O . HOH Q12 17 556 ? 0.775 17.058 1.601 1.0 34.29 ? 685 A 1 +HETATM 6289 O O . HOH Q12 17 557 ? -25.509 9.939 -34.44 1.0 30.14 ? 686 A 1 +HETATM 6290 O O . HOH Q12 17 558 ? -31.898 24.591 -26.855 1.0 28.58 ? 687 A 1 +HETATM 6291 O O . HOH Q12 17 559 ? 18.506 23.044 -22.294 1.0 49.45 ? 688 A 1 +HETATM 6292 O O . HOH Q12 17 560 ? -32.53 5.962 -14.513 1.0 35.63 ? 689 A 1 +HETATM 6293 O O . HOH Q12 17 561 ? -20.143 8.587 0.362 1.0 39.53 ? 690 A 1 +HETATM 6294 O O . HOH Q12 17 562 ? 25.284 6.462 -12.432 1.0 50.85 ? 691 A 1 +HETATM 6295 O O . HOH Q12 17 563 ? 1.938 1.226 -24.754 1.0 50.75 ? 692 A 1 +HETATM 6296 O O . HOH Q12 17 564 ? -1.141 32.938 -18.717 1.0 42.62 ? 693 A 1 +HETATM 6297 O O . HOH Q12 17 565 ? -19.795 -0.664 -11.393 1.0 48.2 ? 694 A 1 +HETATM 6298 O O . HOH Q12 17 566 ? 24.414 12.678 -25.466 1.0 43.99 ? 695 A 1 +HETATM 6299 O O . HOH Q12 17 567 ? -21.596 -8.099 -10.207 1.0 42.07 ? 696 A 1 +HETATM 6300 O O . HOH Q12 17 568 ? -19.904 21.542 -34.874 1.0 26.79 ? 697 A 1 +HETATM 6301 O O . HOH Q12 17 569 ? -20.143 0.344 -21.809 1.0 29.31 ? 698 A 1 +HETATM 6302 O O . HOH Q12 17 570 ? 2.966 25.149 -27.523 1.0 28.52 ? 699 A 1 +HETATM 6303 O O . HOH Q12 17 571 ? -1.013 15.665 -38.748 1.0 53.53 ? 700 A 1 +HETATM 6304 O O B HOH Q12 17 572 ? -12.068 26.462 -3.019 1.0 26.67 ? 701 A 1 +HETATM 6305 O O . HOH Q12 17 573 ? 7.672 12.617 -3.223 1.0 26.42 ? 702 A 1 +HETATM 6306 O O . HOH Q12 17 574 ? -9.627 20.239 -43.323 1.0 42.32 ? 703 A 1 +HETATM 6307 O O . HOH Q12 17 575 ? 10.638 22.14 -9.993 1.0 31.74 ? 704 A 1 +HETATM 6308 O O . HOH Q12 17 576 ? -5.343 32.149 -4.426 1.0 46.74 ? 705 A 1 +HETATM 6309 O O . HOH Q12 17 577 ? 4.302 8.834 -2.263 1.0 52.75 ? 706 A 1 +HETATM 6310 O O . HOH Q12 17 578 ? -29.736 24.583 -30.018 1.0 37.65 ? 707 A 1 +HETATM 6311 O O . HOH Q12 17 579 ? -22.072 34.809 -28.756 1.0 28.03 ? 708 A 1 +HETATM 6312 O O . HOH Q12 17 580 ? -14.858 10.348 -40.557 1.0 28.45 ? 709 A 1 +HETATM 6313 O O . HOH Q12 17 581 ? -36.551 22.234 -24.06 1.0 52.21 ? 710 A 1 +HETATM 6314 O O . HOH Q12 17 582 ? -7.352 0.018 -22.114 1.0 25.32 ? 711 A 1 +HETATM 6315 O O . HOH Q12 17 583 ? -4.642 11.652 -15.306 1.0 13.41 ? 712 A 1 +HETATM 6316 O O . HOH Q12 17 584 ? -0.36 9.713 -1.704 1.0 25.43 ? 713 A 1 +HETATM 6317 O O . HOH Q12 17 585 ? -0.269 32.452 -9.823 1.0 48.54 ? 714 A 1 +HETATM 6318 O O . HOH Q12 17 586 ? 28.466 7.388 -27.828 1.0 46.89 ? 715 A 1 +HETATM 6319 O O B HOH Q12 17 587 ? -14.398 26.31 -1.395 0.6 20.49 ? 716 A 1 +HETATM 6320 O O . HOH Q12 17 588 ? 22.433 10.661 -23.068 1.0 47.35 ? 717 A 1 +HETATM 6321 O O . HOH Q12 17 589 ? -31.178 27.866 -28.289 1.0 46.68 ? 718 A 1 +HETATM 6322 O O . HOH Q12 17 590 ? 15.642 23.879 -26.165 1.0 36.5 ? 719 A 1 +HETATM 6323 O O . HOH Q12 17 591 ? -35.829 8.124 -14.759 1.0 47.12 ? 720 A 1 +HETATM 6324 O O . HOH Q12 17 592 ? -25.519 0.822 -27.765 1.0 29.38 ? 721 A 1 +HETATM 6325 O O . HOH Q12 17 593 ? -30.003 5.827 -30.667 1.0 31.31 ? 722 A 1 +HETATM 6326 O O . HOH Q12 17 594 ? -16.55 5.782 -16.288 1.0 21.93 ? 723 A 1 +HETATM 6327 O O . HOH Q12 17 595 ? -1.954 -0.542 -29.046 1.0 27.84 ? 724 A 1 +HETATM 6328 O O . HOH Q12 17 596 ? -19.328 4.495 -11.932 1.0 56.59 ? 725 A 1 +HETATM 6329 O O . HOH Q12 17 597 ? 16.408 5.965 -22.586 1.0 30.76 ? 726 A 1 +HETATM 6330 O O . HOH Q12 17 598 ? -27.081 0.612 -11.051 1.0 27.59 ? 727 A 1 +HETATM 6331 O O . HOH Q12 17 599 ? -13.814 16.643 -2.356 1.0 22.88 ? 728 A 1 +HETATM 6332 O O . HOH Q12 17 600 ? -7.258 27.603 -37.934 1.0 30.23 ? 729 A 1 +HETATM 6333 O O . HOH Q12 17 601 ? -6.887 22.102 -1.669 1.0 43.84 ? 730 A 1 +HETATM 6334 O O . HOH Q12 17 602 ? -29.266 -1.051 -17.918 1.0 28.59 ? 731 A 1 +HETATM 6335 O O . HOH Q12 17 603 ? -19.944 21.837 -0.611 1.0 31.92 ? 732 A 1 +HETATM 6336 O O . HOH Q12 17 604 ? -12.553 18.551 -42.22 1.0 37.19 ? 733 A 1 +HETATM 6337 O O . HOH Q12 17 605 ? -21.84 3.151 -37.694 1.0 31.83 ? 734 A 1 +HETATM 6338 O O . HOH Q12 17 606 ? -33.586 26.757 -12.382 1.0 34.68 ? 735 A 1 +HETATM 6339 O O . HOH Q12 17 607 ? -6.125 26.117 -35.9 1.0 20.37 ? 736 A 1 +HETATM 6340 O O . HOH Q12 17 608 ? 24.541 5.329 -21.294 1.0 38.72 ? 737 A 1 +HETATM 6341 O O . HOH Q12 17 609 ? -11.297 39.238 -17.751 1.0 52.71 ? 738 A 1 +HETATM 6342 O O . HOH Q12 17 610 ? -17.114 28.14 -30.833 1.0 38.4 ? 739 A 1 +HETATM 6343 O O . HOH Q12 17 611 ? -12.111 32.325 -11.202 1.0 53.93 ? 740 A 1 +HETATM 6344 O O . HOH Q12 17 612 ? 7.141 1.924 -16.591 1.0 36.16 ? 741 A 1 +HETATM 6345 O O . HOH Q12 17 613 ? -4.745 19.673 -41.065 1.0 24.2 ? 742 A 1 +HETATM 6346 O O . HOH Q12 17 614 ? -20.896 30.256 -6.034 1.0 29.16 ? 743 A 1 +HETATM 6347 O O . HOH Q12 17 615 ? -23.132 3.181 -2.552 1.0 47.02 ? 744 A 1 +HETATM 6348 O O . HOH Q12 17 616 ? 1.803 6.783 -26.46 1.0 21.95 ? 745 A 1 +HETATM 6349 O O . HOH Q12 17 617 ? -16.562 30.805 -27.879 1.0 39.08 ? 746 A 1 +HETATM 6350 O O . HOH Q12 17 618 ? 9.469 3.865 -12.653 1.0 32.45 ? 747 A 1 +HETATM 6351 O O . HOH Q12 17 619 ? 3.498 27.591 -25.876 1.0 37.66 ? 748 A 1 +HETATM 6352 O O . HOH Q12 17 620 ? -32.191 26.488 -24.797 1.0 32.65 ? 749 A 1 +HETATM 6353 O O . HOH Q12 17 621 ? -8.568 33.914 -33.661 1.0 50.92 ? 750 A 1 +HETATM 6354 O O . HOH Q12 17 622 ? 3.362 9.156 -34.154 1.0 51.36 ? 751 A 1 +HETATM 6355 O O . HOH Q12 17 623 ? 8.232 10.79 -31.156 1.0 34.75 ? 752 A 1 +HETATM 6356 O O . HOH Q12 17 624 ? -16.54 14.36 -40.701 1.0 21.37 ? 753 A 1 +HETATM 6357 O O . HOH Q12 17 625 ? -14.842 1.053 -37.385 1.0 48.31 ? 754 A 1 +HETATM 6358 O O . HOH Q12 17 626 ? 2.395 11.104 3.379 1.0 35.26 ? 755 A 1 +HETATM 6359 O O . HOH Q12 17 627 ? -29.836 30.194 -28.736 1.0 50.7 ? 756 A 1 +HETATM 6360 O O . HOH Q12 17 628 ? 2.36 17.1 -37.476 1.0 38.4 ? 757 A 1 +HETATM 6361 O O . HOH Q12 17 629 ? 16.141 16.724 -26.109 1.0 31.49 ? 758 A 1 +HETATM 6362 O O . HOH Q12 17 630 ? -16.429 0.173 -7.169 1.0 55.3 ? 759 A 1 +HETATM 6363 O O . HOH Q12 17 631 ? -34.169 5.82 -16.821 1.0 56.98 ? 760 A 1 +HETATM 6364 O O . HOH Q12 17 632 ? -16.484 24.722 -35.544 1.0 40.79 ? 761 A 1 +HETATM 6365 O O . HOH Q12 17 633 ? 9.732 5.816 -20.112 1.0 42.57 ? 762 A 1 +HETATM 6366 O O . HOH Q12 17 634 ? -7.438 10.582 -22.143 1.0 24.6 ? 763 A 1 +HETATM 6367 O O . HOH Q12 17 635 ? -19.074 36.279 -13.295 1.0 42.16 ? 764 A 1 +HETATM 6368 O O . HOH Q12 17 636 ? 8.917 3.686 -15.427 1.0 30.05 ? 765 A 1 +HETATM 6369 O O . HOH Q12 17 637 ? -15.076 -2.736 -27.357 1.0 43.42 ? 766 A 1 +HETATM 6370 O O . HOH Q12 17 638 ? 9.471 13.967 -31.689 1.0 27.79 ? 767 A 1 +HETATM 6371 O O . HOH Q12 17 639 ? -18.846 26.043 -31.775 1.0 47.28 ? 768 A 1 +HETATM 6372 O O . HOH Q12 17 640 ? -23.468 34.307 -11.183 1.0 51.35 ? 769 A 1 +HETATM 6373 O O . HOH Q12 17 641 ? -15.363 34.28 -11.231 1.0 59.62 ? 770 A 1 +HETATM 6374 O O A HOH Q12 17 642 ? 8.484 25.589 -27.922 0.52 41.93 ? 771 A 1 +HETATM 6375 O O B HOH Q12 17 642 ? 8.526 20.471 -29.446 0.48 21.2 ? 771 A 1 +HETATM 6376 O O . HOH Q12 17 643 ? -11.408 34.62 -27.299 1.0 64.24 ? 772 A 1 +HETATM 6377 O O . HOH Q12 17 644 ? -0.849 9.681 5.724 1.0 56.55 ? 773 A 1 +HETATM 6378 O O . HOH Q12 17 645 ? -32.992 9.039 -23.74 1.0 22.71 ? 774 A 1 +HETATM 6379 O O . HOH Q12 17 646 ? 21.938 20.103 -14.807 1.0 45.39 ? 775 A 1 +HETATM 6380 O O . HOH Q12 17 647 ? -24.989 36.295 -22.935 1.0 43.64 ? 776 A 1 +HETATM 6381 O O . HOH Q12 17 648 ? -17.497 31.807 -10.15 1.0 42.58 ? 777 A 1 +HETATM 6382 O O . HOH Q12 17 649 ? -6.039 33.991 -21.055 1.0 51.79 ? 778 A 1 +HETATM 6383 O O . HOH Q12 17 650 ? -5.722 3.353 -2.72 1.0 31.55 ? 779 A 1 +HETATM 6384 O O . HOH Q12 17 651 ? -20.602 3.353 -13.238 1.0 49.37 ? 780 A 1 +HETATM 6385 O O . HOH Q12 17 652 ? 30.795 10.225 -34.368 1.0 50.36 ? 781 A 1 +HETATM 6386 O O . HOH Q12 17 653 ? -4.095 16.048 6.473 1.0 46.34 ? 782 A 1 +HETATM 6387 O O . HOH Q12 17 654 ? -10.643 19.894 -11.024 1.0 29.1 ? 783 A 1 +HETATM 6388 O O . HOH Q12 17 655 ? -20.098 17.061 1.818 1.0 45.9 ? 784 A 1 +HETATM 6389 O O . HOH Q12 17 656 ? -22.399 26.672 -31.71 1.0 40.21 ? 785 A 1 +HETATM 6390 O O . HOH Q12 17 657 ? -12.292 1.451 -38.498 1.0 58.52 ? 786 A 1 +HETATM 6391 O O . HOH Q12 17 658 ? -15.241 26.503 -37.757 1.0 67.68 ? 787 A 1 +HETATM 6392 O O . HOH Q12 17 659 ? 11.624 22.377 -7.447 1.0 52.63 ? 788 A 1 +HETATM 6393 O O . HOH Q12 17 660 ? -14.908 15.483 -0.198 1.0 48.52 ? 789 A 1 +HETATM 6394 O O . HOH Q12 17 661 ? 2.648 8.886 1.622 1.0 46.3 ? 790 A 1 +HETATM 6395 O O . HOH Q12 17 662 ? -35.723 18.44 -10.041 1.0 49.75 ? 791 A 1 +HETATM 6396 O O . HOH Q12 17 663 ? -25.079 11.193 3.911 1.0 53.09 ? 792 A 1 +HETATM 6397 O O . HOH Q12 17 664 ? -21.119 20.047 -36.478 1.0 52.6 ? 793 A 1 +HETATM 6398 O O . HOH Q12 17 665 ? -21.435 36.339 -17.224 1.0 55.11 ? 794 A 1 +HETATM 6399 O O . HOH Q12 17 666 ? -19.866 2.36 -36.36 1.0 53.59 ? 795 A 1 +HETATM 6400 O O . HOH Q12 17 667 ? 4.301 1.232 -6.716 1.0 49.92 ? 796 A 1 +HETATM 6401 O O . HOH Q12 17 668 ? -8.848 -1.103 -25.169 1.0 27.86 ? 797 A 1 +HETATM 6402 O O . HOH Q12 17 669 ? -15.414 4.231 -38.292 1.0 31.0 ? 798 A 1 +HETATM 6403 O O . HOH Q12 17 670 ? -31.933 31.636 -25.88 1.0 54.68 ? 799 A 1 +HETATM 6404 O O . HOH Q12 17 671 ? -30.505 36.42 -25.28 1.0 51.92 ? 800 A 1 +HETATM 6405 O O . HOH Q12 17 672 ? 16.456 16.46 -4.947 1.0 55.81 ? 801 A 1 +HETATM 6406 O O . HOH Q12 17 673 ? 14.058 8.305 -6.897 1.0 47.2 ? 802 A 1 +HETATM 6407 O O . HOH Q12 17 674 ? -18.658 4.93 -38.731 1.0 53.99 ? 803 A 1 +HETATM 6408 O O . HOH Q12 17 675 ? -1.803 22.962 0.366 1.0 39.78 ? 804 A 1 +HETATM 6409 O O . HOH Q12 17 676 ? -3.219 9.682 6.721 1.0 43.41 ? 805 A 1 +HETATM 6410 O O . HOH Q12 17 677 ? 19.131 17.233 -8.494 1.0 50.21 ? 806 A 1 +HETATM 6411 O O . HOH Q12 17 678 ? -34.006 8.014 -21.692 1.0 48.75 ? 807 A 1 +HETATM 6412 O O . HOH Q12 17 679 ? -25.537 11.937 -32.44 1.0 31.55 ? 808 A 1 +HETATM 6413 O O A HOH Q12 17 680 ? -22.717 0.234 -29.247 0.57 33.94 ? 809 A 1 +HETATM 6414 O O . HOH Q12 17 681 ? -16.47 1.316 -1.46 1.0 38.28 ? 810 A 1 +HETATM 6415 O O . HOH Q12 17 682 ? 19.952 17.855 -6.85 1.0 52.31 ? 811 A 1 +HETATM 6416 O O . HOH Q12 17 683 ? -16.056 38.993 -16.776 1.0 60.38 ? 812 A 1 +HETATM 6417 O O . HOH Q12 17 684 ? -26.578 -2.141 -11.565 1.0 49.99 ? 813 A 1 +HETATM 6418 O O . HOH Q12 17 685 ? -31.202 10.34 -8.68 1.0 31.49 ? 814 A 1 +HETATM 6419 O O . HOH Q12 17 686 ? -16.272 -0.431 -27.783 1.0 37.22 ? 815 A 1 +HETATM 6420 O O . HOH Q12 17 687 ? -17.925 2.161 -8.841 1.0 45.77 ? 816 A 1 +HETATM 6421 O O . HOH Q12 17 688 ? -25.948 36.669 -20.286 1.0 54.16 ? 817 A 1 +HETATM 6422 O O . HOH Q12 17 689 ? 7.411 2.005 -20.182 1.0 62.22 ? 818 A 1 +HETATM 6423 O O . HOH Q12 17 690 ? -24.54 13.44 -40.024 1.0 49.41 ? 819 A 1 +HETATM 6424 O O . HOH Q12 17 691 ? 19.011 2.307 -19.71 1.0 72.26 ? 820 A 1 +HETATM 6425 O O . HOH Q12 17 692 ? -8.438 36.408 -19.361 1.0 44.71 ? 821 A 1 +HETATM 6426 O O . HOH Q12 17 693 ? 2.756 9.244 -28.131 1.0 41.72 ? 822 A 1 +HETATM 6427 O O . HOH Q12 17 694 ? 7.877 6.549 -21.305 1.0 55.18 ? 823 A 1 +HETATM 6428 O O . HOH Q12 17 695 ? -21.812 36.651 -14.681 1.0 54.51 ? 824 A 1 +HETATM 6429 O O . HOH Q12 17 696 ? -35.13 20.333 -12.863 1.0 55.14 ? 825 A 1 +HETATM 6430 O O . HOH Q12 17 697 ? 7.932 14.244 -1.045 1.0 28.61 ? 826 A 1 +HETATM 6431 O O . HOH Q12 17 698 ? -10.33 -1.791 -29.122 1.0 32.9 ? 827 A 1 +HETATM 6432 O O . HOH Q12 17 699 ? -24.95 27.485 -31.687 1.0 47.37 ? 828 A 1 +HETATM 6433 O O . HOH Q12 17 700 ? -27.741 29.565 -5.431 1.0 36.51 ? 829 A 1 +HETATM 6434 O O . HOH Q12 17 701 ? -30.309 -0.897 -20.418 1.0 32.22 ? 830 A 1 +HETATM 6435 O O . HOH Q12 17 702 ? 15.366 13.07 -32.134 1.0 68.45 ? 831 A 1 +HETATM 6436 O O . HOH Q12 17 703 ? -4.177 30.082 -35.841 1.0 52.9 ? 832 A 1 +HETATM 6437 O O . HOH Q12 17 704 ? -0.527 18.623 3.659 1.0 29.16 ? 833 A 1 +HETATM 6438 O O . HOH Q12 17 705 ? 15.538 22.388 -28.423 1.0 32.17 ? 834 A 1 +HETATM 6439 O O . HOH Q12 17 706 ? -25.057 30.021 -5.334 1.0 47.27 ? 835 A 1 +HETATM 6440 O O . HOH Q12 17 707 ? 16.691 16.851 -30.577 1.0 51.64 ? 836 A 1 +HETATM 6441 O O . HOH Q12 17 708 ? 2.184 0.953 -6.819 1.0 57.87 ? 837 A 1 +HETATM 6442 O O . HOH Q12 17 709 ? -27.675 35.633 -18.166 1.0 51.21 ? 838 A 1 +HETATM 6443 O O . HOH Q12 17 710 ? -34.071 22.607 -14.072 1.0 41.83 ? 839 A 1 +HETATM 6444 O O . HOH Q12 17 711 ? 17.937 24.75 -24.737 1.0 54.26 ? 840 A 1 +HETATM 6445 O O . HOH Q12 17 712 ? -32.856 31.238 -18.108 1.0 58.67 ? 841 A 1 +HETATM 6446 O O . HOH Q12 17 713 ? 1.89 28.301 -11.363 1.0 48.85 ? 842 A 1 +HETATM 6447 O O . HOH Q12 17 714 ? 1.084 33.123 -17.006 1.0 55.94 ? 843 A 1 +HETATM 6448 O O . HOH Q12 17 715 ? -18.263 22.818 1.164 1.0 44.17 ? 844 A 1 +HETATM 6449 O O . HOH Q12 17 716 ? 18.347 4.056 -21.334 1.0 50.61 ? 845 A 1 +HETATM 6450 O O . HOH Q12 17 717 ? 14.028 20.031 -28.61 1.0 36.93 ? 846 A 1 +HETATM 6451 O O . HOH Q12 17 718 ? -4.021 27.53 -34.93 1.0 28.71 ? 847 A 1 +HETATM 6452 O O . HOH Q12 17 719 ? 5.258 30.349 -20.742 1.0 53.33 ? 848 A 1 +HETATM 6453 O O . HOH Q12 17 720 ? 12.749 14.782 -5.299 1.0 51.05 ? 849 A 1 +HETATM 6454 O O . HOH Q12 17 721 ? -32.682 10.538 -6.315 1.0 43.62 ? 850 A 1 +HETATM 6455 O O . HOH Q12 17 722 ? -2.997 32.947 -27.01 1.0 49.82 ? 851 A 1 +HETATM 6456 O O . HOH Q12 17 723 ? -8.608 36.821 -23.965 1.0 49.52 ? 852 A 1 +HETATM 6457 O O . HOH Q12 17 724 ? -31.275 9.384 -12.3 1.0 36.9 ? 853 A 1 +HETATM 6458 O O . HOH Q12 17 725 ? -9.224 24.878 -40.14 1.0 49.04 ? 854 A 1 +HETATM 6459 O O . HOH Q12 17 726 ? -29.556 0.808 -9.907 1.0 45.18 ? 855 A 1 +HETATM 6460 O O . HOH Q12 17 727 ? -2.859 11.429 -40.795 1.0 63.98 ? 856 A 1 +HETATM 6461 O O . HOH Q12 17 728 ? 5.396 28.834 -25.135 1.0 50.13 ? 857 A 1 +HETATM 6462 O O . HOH Q12 17 729 ? -30.014 32.803 -19.098 1.0 42.39 ? 858 A 1 +HETATM 6463 O O . HOH Q12 17 730 ? -14.526 12.801 -41.362 1.0 40.05 ? 859 A 1 +HETATM 6464 O O . HOH Q12 17 731 ? 1.665 6.031 -30.943 1.0 28.39 ? 860 A 1 +HETATM 6465 O O . HOH Q12 17 732 ? 28.197 3.694 -17.794 1.0 51.65 ? 861 A 1 +HETATM 6466 O O . HOH Q12 17 733 ? -0.043 5.768 -33.161 1.0 26.93 ? 862 A 1 +HETATM 6467 O O . HOH Q12 17 734 ? -18.829 29.555 2.369 1.0 71.75 ? 863 A 1 +HETATM 6468 O O . HOH Q12 17 735 ? -11.318 -3.082 -33.279 1.0 44.13 ? 864 A 1 +HETATM 6469 O O . HOH Q12 17 736 ? 26.081 2.239 -15.771 1.0 53.81 ? 865 A 1 +HETATM 6470 O O . HOH Q12 17 737 ? 18.362 6.197 -20.09 1.0 51.22 ? 866 A 1 +HETATM 6471 O O . HOH Q12 17 738 ? -27.299 7.886 -34.247 1.0 49.84 ? 867 A 1 +HETATM 6472 O O . HOH Q12 17 739 ? -30.613 6.014 -6.798 1.0 46.31 ? 868 A 1 +HETATM 6473 O O . HOH Q12 17 740 ? -31.168 2.349 -22.542 1.0 46.5 ? 869 A 1 +HETATM 6474 O O . HOH Q12 17 741 ? -14.08 4.4 -40.735 1.0 57.2 ? 870 A 1 +HETATM 6475 O O . HOH Q12 17 742 ? 15.425 12.844 -28.873 1.0 54.6 ? 871 A 1 +HETATM 6476 O O . HOH Q12 17 743 ? -7.058 23.981 -39.157 1.0 24.7 ? 872 A 1 +HETATM 6477 O O B HOH Q12 17 744 ? -17.781 28.426 -0.941 0.54 49.47 ? 873 A 1 +HETATM 6478 O O . HOH Q12 17 745 ? 11.141 11.962 -30.834 1.0 46.58 ? 874 A 1 +HETATM 6479 O O . HOH Q12 17 746 ? -31.399 6.727 -10.907 1.0 37.13 ? 875 A 1 +HETATM 6480 O O . HOH Q12 17 747 ? -30.732 -0.502 -15.819 1.0 41.52 ? 876 A 1 +HETATM 6481 O O . HOH Q12 17 748 ? -3.534 21.81 2.159 1.0 40.49 ? 877 A 1 +HETATM 6482 O O . HOH Q12 17 749 ? -5.223 22.449 -40.989 1.0 33.98 ? 878 A 1 +HETATM 6483 O O . HOH Q12 17 750 ? 4.872 8.516 -28.777 1.0 48.26 ? 879 A 1 +HETATM 6484 O O . HOH Q12 17 751 ? -22.87 28.752 -2.969 1.0 45.24 ? 880 A 1 +HETATM 6485 O O . HOH Q12 17 752 ? -6.573 -0.82 -28.902 1.0 35.96 ? 881 A 1 +HETATM 6486 O O . HOH Q12 17 753 ? 23.582 2.792 -20.112 1.0 44.6 ? 882 A 1 +HETATM 6487 O O . HOH Q12 17 754 ? -1.666 25.768 0.527 1.0 32.72 ? 883 A 1 +HETATM 6488 O O . HOH Q12 17 755 ? -31.082 30.833 -8.497 1.0 42.34 ? 884 A 1 +HETATM 6489 O O . HOH Q12 17 756 ? -30.972 8.78 -0.181 1.0 40.67 ? 885 A 1 +HETATM 6490 O O . HOH Q12 17 757 ? -34.655 25.537 -24.223 1.0 47.63 ? 886 A 1 +HETATM 6491 O O . HOH Q12 17 758 ? -24.579 30.814 -7.997 1.0 35.22 ? 887 A 1 +HETATM 6492 O O . HOH Q12 17 759 ? -0.313 2.819 -2.717 1.0 49.36 ? 888 A 1 +HETATM 6493 O O . HOH Q12 17 760 ? -36.546 22.245 -20.361 1.0 50.02 ? 889 A 1 +HETATM 6494 O O . HOH Q12 17 761 ? -32.6 9.726 -1.926 1.0 51.63 ? 890 A 1 +HETATM 6495 O O . HOH Q12 17 762 ? 11.646 12.473 -2.84 1.0 57.13 ? 891 A 1 +HETATM 6496 O O . HOH Q12 17 763 ? -21.176 1.393 -2.172 1.0 52.97 ? 892 A 1 +HETATM 6497 O O . HOH Q12 17 764 ? -13.414 9.661 3.866 1.0 42.8 ? 893 A 1 +HETATM 6498 O O . HOH Q12 17 765 ? 17.617 14.615 -7.543 1.0 54.26 ? 894 A 1 +HETATM 6499 O O . HOH Q12 17 766 ? -12.31 9.325 -41.2 1.0 38.7 ? 895 A 1 +HETATM 6500 O O . HOH Q12 17 767 ? -20.916 -1.964 -20.156 1.0 45.22 ? 896 A 1 +HETATM 6501 O O . HOH Q12 17 768 ? -3.859 26.451 -1.109 1.0 31.48 ? 897 A 1 +HETATM 6502 O O . HOH Q12 17 769 ? -20.234 -9.522 -8.763 1.0 55.88 ? 898 A 1 +HETATM 6503 O O . HOH Q12 17 770 ? 27.184 4.947 -21.047 1.0 57.56 ? 899 A 1 +HETATM 6504 O O . HOH Q12 17 771 ? -24.919 3.378 -0.626 1.0 67.49 ? 900 A 1 +HETATM 6505 O O . HOH Q12 17 772 ? -18.554 6.822 1.79 1.0 54.22 ? 901 A 1 +HETATM 6506 O O . HOH Q12 17 773 ? 5.632 18.333 -36.858 1.0 32.87 ? 902 A 1 +HETATM 6507 O O . HOH Q12 17 774 ? 0.616 26.23 -28.68 1.0 36.78 ? 903 A 1 +HETATM 6508 O O . HOH Q12 17 775 ? -24.363 28.417 -1.086 1.0 49.21 ? 904 A 1 +HETATM 6509 O O . HOH Q12 17 776 ? -28.739 5.849 -3.053 1.0 53.43 ? 905 A 1 +HETATM 6510 O O . HOH Q12 17 777 ? 16.37 18.206 -28.365 1.0 32.48 ? 906 A 1 +HETATM 6511 O O . HOH Q12 17 778 ? 3.745 3.978 -27.489 1.0 53.14 ? 907 A 1 +HETATM 6512 O O . HOH Q12 17 779 ? 5.597 14.978 -37.098 1.0 44.7 ? 908 A 1 +HETATM 6513 O O A HOH Q12 17 780 ? -10.66 18.363 -12.968 0.86 32.08 ? 909 A 1 +HETATM 6514 O O . HOH Q12 17 781 ? -4.864 31.064 -1.226 1.0 52.02 ? 910 A 1 +HETATM 6515 O O . HOH Q12 17 782 ? -15.942 35.27 -29.896 1.0 52.51 ? 911 A 1 +HETATM 6516 O O . HOH Q12 17 783 ? -25.337 8.073 1.7 1.0 55.07 ? 912 A 1 +HETATM 6517 O O . HOH Q12 17 784 ? -27.466 -0.463 -26.185 1.0 45.25 ? 913 A 1 +HETATM 6518 O O . HOH Q12 17 785 ? -21.658 29.154 -0.629 1.0 78.1 ? 914 A 1 +HETATM 6519 O O . HOH Q12 17 786 ? -1.818 27.126 -33.21 1.0 41.78 ? 915 A 1 +HETATM 6520 O O . HOH Q12 17 787 ? -12.125 13.194 -42.014 1.0 39.55 ? 916 A 1 +HETATM 6521 O O . HOH Q12 17 788 ? -16.856 -3.918 -30.732 1.0 55.34 ? 917 A 1 +HETATM 6522 O O . HOH Q12 17 789 ? -11.71 26.012 -44.308 1.0 56.23 ? 918 A 1 +HETATM 6523 O O . HOH Q12 17 790 ? -12.523 -3.037 -28.072 1.0 54.13 ? 919 A 1 +HETATM 6524 O O . HOH Q12 17 791 ? -4.231 -2.521 -28.883 1.0 56.89 ? 920 A 1 +HETATM 6525 O O . HOH Q12 17 792 ? -31.746 4.92 -22.512 1.0 47.8 ? 921 A 1 +HETATM 6526 O O . HOH Q12 17 793 ? -30.005 35.872 -20.346 1.0 57.0 ? 922 A 1 +HETATM 6527 O O . HOH Q12 17 794 ? -8.355 -3.836 -29.781 1.0 51.58 ? 923 A 1 +HETATM 6528 O O . HOH Q12 17 795 ? -0.834 0.489 -6.205 1.0 54.17 ? 924 A 1 +HETATM 6529 O O . HOH Q12 17 796 ? -4.398 28.91 -0.263 1.0 43.73 ? 925 A 1 +HETATM 6530 O O . HOH Q12 17 797 ? -2.523 29.748 -31.82 1.0 44.4 ? 926 A 1 +HETATM 6531 O O . HOH Q12 17 798 ? 12.068 11.646 0.601 1.0 65.71 ? 927 A 1 +HETATM 6532 O O . HOH Q12 17 799 ? -11.446 12.037 -44.424 1.0 56.24 ? 928 A 1 +HETATM 6533 O O . HOH Q12 17 800 ? 18.981 13.053 -6.917 1.0 54.14 ? 929 A 1 +HETATM 6534 O O . HOH Q12 17 801 ? -32.518 8.24 -4.408 1.0 51.72 ? 930 A 1 +HETATM 6535 O O . HOH Q12 17 802 ? -30.193 -1.93 -8.743 1.0 61.15 ? 931 A 1 +HETATM 6536 O O . HOH Q12 17 803 ? -8.626 25.044 -47.258 1.0 55.02 ? 932 A 1 +HETATM 6537 O O . HOH Q12 17 804 ? -5.403 25.976 -42.947 1.0 57.15 ? 933 A 1 # loop_ _chem_comp.id @@ -9246,3 +9247,48 @@ VAL CG2 HG22 SING N N 457 VAL CG2 HG23 SING N N 458 VAL OXT HXT SING N N 459 # +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr2_symmetry +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +metalc1 metalc ? ? A CYS 73 SG ? ? ? 1_555 A CYS 63 A SF4 371 FE2 ? ? 1_555 A SF4 415 ? ? ? ? ? ? ? ? ? ? +metalc2 metalc ? ? A CYS 77 SG ? ? ? 1_555 A CYS 67 A SF4 371 FE3 ? ? 1_555 A SF4 415 ? ? ? ? ? ? ? ? ? ? +metalc3 metalc ? ? A CYS 80 SG ? ? ? 1_555 A CYS 70 A SF4 371 FE1 ? ? 1_555 A SF4 415 ? ? ? ? ? ? ? ? ? ? +metalc4 metalc ? ? A CYS 357 N ? ? ? 1_555 A CYS 401 A FE2 358 FE ? ? 1_555 A FE2 402 ? ? ? ? ? ? ? ? ? ? +metalc5 metalc ? ? A CYS 357 SG ? ? ? 1_555 A CYS 401 A FE2 358 FE ? ? 1_555 A FE2 402 ? ? ? ? ? ? ? ? ? ? +metalc6 metalc ? ? A CYS 357 OXT ? ? ? 1_555 A CYS 401 A FE2 358 FE ? ? 1_555 A FE2 402 ? ? ? ? ? ? ? ? ? ? +metalc7 metalc ? ? A SAH 364 N ? ? ? 1_555 A SAH 408 A SF4 371 FE4 ? ? 1_555 A SF4 415 ? ? ? ? ? ? ? ? ? ? +metalc8 metalc ? ? A SAH 364 OXT ? ? ? 1_555 A SAH 408 A SF4 371 FE4 ? ? 1_555 A SF4 415 ? ? ? ? ? ? ? ? ? ? +#