diff --git a/modules/mol/alg/pymod/ligand_scoring.py b/modules/mol/alg/pymod/ligand_scoring.py index d1d1f2622decf98cbc72d4e2239b1f62311d288c..7f8032602879bcbe6916c73f5cec2cbac3d369cd 100644 --- a/modules/mol/alg/pymod/ligand_scoring.py +++ b/modules/mol/alg/pymod/ligand_scoring.py @@ -1,6 +1,7 @@ import warnings import numpy as np +import numpy.ma as np_ma import networkx from ost import mol @@ -64,6 +65,23 @@ class LigandScorer: broken by lowest RMSD. Setting `rmsd_assignment=True` forces a single ligand assignment, based on RMSD only. Ties are broken arbitrarily. + By default, only exact matches between target and model ligands are + considered. This is a problem when the target only contains a subset + of the expected atoms (for instance if atoms are missing in an + experimental structure, which often happens in the PDB). With + `substructure_match=True`, complete model ligands can be scored against + partial target ligands. One problem with this approach is that it is + very easy to find good matches to small, irrelevant ligands like EDO, CO2 + or GOL. To counter that, the assignment algorithm first assigns full + matches (and ignores all partial matches, even if they would result in a + better score). Once all full matches are assigned, it assigns the remaining + matches by decreasing coverage (fraction of atoms of the model ligand atoms + covered in the target) with a window of `coverage_delta` (by default 0.05), + starting from the highest coverage in the ligands which are still to be + assigned. As a result, for instance, with a delta of 0.05, a low-score + match with coverage 0.96 would be preferred to a high-score match with + coverage 0.90. + Assumptions: The class generally assumes that the @@ -193,6 +211,8 @@ class LigandScorer: :type chain_mapper: :class:`ost.mol.alg.chain_mapping.ChainMapper` :param substructure_match: Set this to True to allow partial target ligand. :type substructure_match: :class:`bool` + :param coverage_delta: the coverage delta for partial ligand assignment. + :type coverage_delta: :class:`float` :param radius: Inclusion radius for the binding site. Residues with atoms within this distance of the ligand will be considered for inclusion in the binding site. @@ -238,6 +258,7 @@ class LigandScorer: resnum_alignments=False, check_resnames=True, rename_ligand_chain=False, chain_mapper=None, substructure_match=False, + coverage_delta=0.05, radius=4.0, lddt_pli_radius=6.0, lddt_lp_radius=10.0, binding_sites_topn=100000, global_chain_mapping=False, rmsd_assignment=False, n_max_naive=12, @@ -292,6 +313,7 @@ class LigandScorer: self.rmsd_assignment = rmsd_assignment self.n_max_naive = n_max_naive self.unassigned = unassigned + self.coverage_delta = coverage_delta # scoring matrices self._rmsd_matrix = None @@ -622,8 +644,8 @@ class LigandScorer: (len(self.target_ligands), len(self.model_ligands)), dtype=dict) self._assignment_isomorphisms = np.full( (len(self.target_ligands), len(self.model_ligands)), fill_value=np.nan) - self._assignment_match_coverage = np.full( - (len(self.target_ligands), len(self.model_ligands)), fill_value=np.nan) + self._assignment_match_coverage = np.zeros( + (len(self.target_ligands), len(self.model_ligands))) for target_i, target_ligand in enumerate(self.target_ligands): LogVerbose("Analyzing target ligand %s" % target_ligand) @@ -665,7 +687,7 @@ class LigandScorer: substructure_match = len(symmetries[0][0]) != len( model_ligand.atoms) coverage = len(symmetries[0][0]) / len(model_ligand.atoms) - self._assignment_match_coverage = coverage + self._assignment_match_coverage[target_i, model_i] = coverage self._assignment_isomorphisms[target_i, model_i] = 1 rmsd = SCRMSD(model_ligand, target_ligand, @@ -765,7 +787,7 @@ class LigandScorer: self._lddt_pli_full_matrix = lddt_pli_full_matrix @staticmethod - def _find_ligand_assignment(mat1, mat2=None): + def _find_ligand_assignment(mat1, mat2=None, coverage=None, coverage_delta=None): """ Find the ligand assignment based on mat1. If mat2 is provided, it will be used to break ties in mat1. If mat2 is not provided, ties will be resolved by taking the first match arbitrarily. @@ -780,45 +802,73 @@ class LigandScorer: mat2[~np.isnan(mat2)] = np.inf else: mat2 = np.copy(mat2) + if coverage is None: + coverage = np.copy(mat1) + coverage[:] = 1 # Assume full coverage by default + else: + coverage = np.copy(coverage) + assignments = [] if 0 in mat1.shape: # No model or target ligand LogDebug("No model or target ligand, returning no assignment.") return assignments - min_mat1 = LigandScorer._nanmin_nowarn(mat1) - while not np.isnan(min_mat1): - best_mat1 = np.argwhere(mat1 == min_mat1) - # Multiple "best" - use mat2 to disambiguate - if len(best_mat1) > 1: - # Get the values of mat2 at these positions - best_mat2_match = [mat2[tuple(x)] for x in best_mat1] - # Find the index of the best mat2 - # Note: argmin returns the first value which is min. - best_mat2_idx = np.array(best_mat2_match).argmin() - # Now get the original indices - max_i_trg, max_i_mdl = best_mat1[best_mat2_idx] - else: - max_i_trg, max_i_mdl = best_mat1[0] - - # Disable row and column - mat1[max_i_trg, :] = np.nan - mat1[:, max_i_mdl] = np.nan - mat2[max_i_trg, :] = np.nan - mat2[:, max_i_mdl] = np.nan - # Save - assignments.append((max_i_trg, max_i_mdl)) - - # Recompute min - min_mat1 = LigandScorer._nanmin_nowarn(mat1) + # First only consider full coverage matches. + min_coverage = np.max(coverage) + # If there's no full coverage, allow a small delta + if min_coverage < 1: + min_coverage = min_coverage - coverage_delta + while min_coverage > 0 - coverage_delta: + LogInfo("Looking for matches with coverage >= %s" % min_coverage) + min_mat1 = LigandScorer._nanmin_nowarn(mat1, coverage < min_coverage) + while not np.isnan(min_mat1): + best_mat1 = np.argwhere((mat1 == min_mat1) & (coverage >= min_coverage)) + # Multiple "best" - use mat2 to disambiguate + if len(best_mat1) > 1: + # Get the values of mat2 at these positions + best_mat2_match = [mat2[tuple(x)] for x in best_mat1] + # Find the index of the best mat2 + # Note: argmin returns the first value which is min. + best_mat2_idx = np.array(best_mat2_match).argmin() + # Now get the original indices + max_i_trg, max_i_mdl = best_mat1[best_mat2_idx] + else: + max_i_trg, max_i_mdl = best_mat1[0] + + # Disable row and column + mat1[max_i_trg, :] = np.nan + mat1[:, max_i_mdl] = np.nan + mat2[max_i_trg, :] = np.nan + mat2[:, max_i_mdl] = np.nan + coverage[max_i_trg, :] = -np.inf + coverage[:, max_i_mdl] = -np.inf + + # Save + assignments.append((max_i_trg, max_i_mdl)) + + # Recompute min + min_mat1 = LigandScorer._nanmin_nowarn(mat1, coverage < min_coverage) + # Recompute min_coverage + min_coverage = np.max(coverage) + if min_coverage < 1: + min_coverage = min_coverage - coverage_delta return assignments @staticmethod - def _nanmin_nowarn(array): + def _nanmin_nowarn(array, mask): """Compute np.nanmin but ignore the RuntimeWarning.""" + masked_array = np_ma.masked_array(array, mask=mask) with warnings.catch_warnings(): # RuntimeWarning: All-NaN slice encountered warnings.simplefilter("ignore") - return np.nanmin(array) + min = np.nanmin(masked_array, ) + if np_ma.is_masked(min): + return np.nan # Everything was masked + else: + return min + + + @staticmethod def _reverse_lddt(lddt): @@ -876,7 +926,9 @@ class LigandScorer: :return: a tuple with 2 dictionaries of matrices containing the main data, and details, respectively. """ - assignments = self._find_ligand_assignment(mat1, mat2) + assignments = self._find_ligand_assignment(mat1, mat2, + self._assignment_match_coverage, + self.coverage_delta) out_main = {} out_details = {} assigned_trg = [False] * len(self.target_ligands) @@ -973,7 +1025,9 @@ class LigandScorer: :return: a tuple with 4 dictionaries of matrices containing the main data1, details1, main data2 and details2, respectively. """ - assignments = self._find_ligand_assignment(mat) + assignments = self._find_ligand_assignment(mat, + coverage=self._assignment_match_coverage, + coverage_delta=self.coverage_delta) out_main1 = {} out_details1 = {} out_main2 = {} @@ -1092,6 +1146,23 @@ class LigandScorer: i, j]["lddt_pli"] return self._lddt_pli_matrix + @property + def coverage_matrix(self): + """ Get the matrix of model ligand atom coverage in the target. + + Target ligands are in rows, model ligands in columns. + + A value of 0 indicates that there was no isomorphism between the model + and target ligands. If `substructure_match=False`, only full match + isomorphisms are considered, and therefore only values of 1.0 and 0.0 + are reported. + + :rtype: :class:`~numpy.ndarray` + """ + if self._assignment_match_coverage is None: + self._compute_scores() + return self._assignment_match_coverage + @property def rmsd(self): """Get a dictionary of RMSD score values, keyed by model ligand diff --git a/modules/mol/alg/tests/test_ligand_scoring.py b/modules/mol/alg/tests/test_ligand_scoring.py index 51fb241dc3411ac9841d2693df52a32654bdd40b..4a13ed256791414323e3d72551f231b2f5159930 100644 --- a/modules/mol/alg/tests/test_ligand_scoring.py +++ b/modules/mol/alg/tests/test_ligand_scoring.py @@ -616,6 +616,55 @@ class TestLigandScoring(unittest.TestCase): substructure_match=True) assert sc.rmsd_details["L_2"][1]["coverage"] == 0.75 + def test_6jyf(self): + """6JYF initially caused issues in the CASP15-CAMEO/LIGATE paper where + the ligand RET was wrongly assigned to short copies of OLA that float + around and yielded higher scores. + Here we test that this is resolved correctly.""" + mdl = _LoadPDB("6jyf_mdl.pdb") + trg = _LoadMMCIF("6jyf_trg.cif") + mdl_lig = _LoadEntity("6jyf_RET_pred.sdf") + mdl_lig_full = _LoadEntity("6jyf_RET_pred_complete.sdf") + + # Problem is easily fixed by just prioritizing full coverage + sc = LigandScorer(mdl, trg, model_ligands=[mdl_lig], + substructure_match=True) + assert sc.rmsd_details['00001_'][1]["coverage"] == 1.0 + assert sc.rmsd_details['00001_'][1]["target_ligand"].name == "RET" + self.assertAlmostEqual(sc.rmsd['00001_'][1], 15.56022, 4) + assert np.array_equal(sc.coverage_matrix, + np.array([[1, 0, 0, 0, 0, 0, 0, 0, 0.5, 0.3, 0.45, 0, 0, 0.55]]).transpose()) + + # We need to make sure that it also works if the match is partial. + # For that we load the complete ligand incl. the O missing in target + # with a coverage of around 95% only. + sc = LigandScorer(mdl, trg, model_ligands=[mdl_lig_full], + substructure_match=True) + assert sc.rmsd_details['00001_'][1]["coverage"] > 0.95 + assert sc.rmsd_details['00001_'][1]["target_ligand"].name == "RET" + self.assertAlmostEqual(sc.rmsd['00001_'][1], 15.56022, 4) + + # Next, we check that coverage_delta has an effect. With a large + # delta of 0.5 we will assign to OLA which has a higher RMSD + # but a coverage of 0.52 only. + sc = LigandScorer(mdl, trg, model_ligands=[mdl_lig_full], + substructure_match=True, + coverage_delta=0.5) + assert sc.rmsd_details['00001_'][1]["coverage"] > 0.5 + assert sc.rmsd_details['00001_'][1]["target_ligand"].name == "OLA" + self.assertAlmostEqual(sc.rmsd['00001_'][1], 6.13006878, 4) + + # Finally, we check that we still assign to the full match even with + # a large coverage delta + sc = LigandScorer(mdl, trg, model_ligands=[mdl_lig], + substructure_match=True, + coverage_delta=0.5) + assert sc.rmsd_details['00001_'][1]["coverage"] == 1.0 + assert sc.rmsd_details['00001_'][1]["target_ligand"].name == "RET" + self.assertAlmostEqual(sc.rmsd['00001_'][1], 15.56022, 4) + + + if __name__ == "__main__": from ost import testutils if testutils.DefaultCompoundLibIsSet(): diff --git a/modules/mol/alg/tests/testfiles/6jyf_RET_pred.sdf b/modules/mol/alg/tests/testfiles/6jyf_RET_pred.sdf new file mode 100644 index 0000000000000000000000000000000000000000..e04ccbcdd605174d8c7a84ed9c28e06baaa0442a --- /dev/null +++ b/modules/mol/alg/tests/testfiles/6jyf_RET_pred.sdf @@ -0,0 +1,61 @@ + + + + 20 20 0 0 0 0 0 0 0 0999 V2000 + 13.8295 -3.5306 13.6788 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.7323 -3.2277 12.3773 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.3774 -2.0607 11.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.7720 -0.8472 11.7984 C 0 0 0 0 0 0 0 0 0 0 0 0 + 12.3815 -0.5798 12.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.4296 0.3907 11.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.9186 0.2384 10.9458 C 0 0 0 0 0 0 0 0 0 0 0 0 + 16.1958 -1.0970 10.2708 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.7663 -2.3026 11.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.7821 -3.5486 10.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 + 16.8164 -2.5134 12.2695 C 0 0 0 0 0 0 0 0 0 0 0 0 + 11.8643 -4.6608 14.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.2073 -4.6659 14.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.1080 -5.7880 14.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 + 10.5307 -6.7246 14.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 + 11.0612 -5.6971 15.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 + 7.5207 -8.5561 16.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 + 8.4741 -7.5657 15.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 + 9.7333 -7.7894 15.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 + 10.4392 -9.1191 15.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 + 17 18 1 0 0 0 + 18 19 2 0 0 0 + 19 20 1 0 0 0 + 19 15 1 0 0 0 + 15 16 2 0 0 0 + 16 12 1 0 0 0 + 12 13 2 0 0 0 + 13 14 1 0 0 0 + 13 1 1 0 0 0 + 1 2 2 0 0 0 + 2 3 1 0 0 0 + 3 4 2 0 0 0 + 4 5 1 0 0 0 + 4 6 1 0 0 0 + 6 7 1 0 0 0 + 7 8 1 0 0 0 + 8 9 1 0 0 0 + 9 10 1 0 0 0 + 9 11 1 0 0 0 + 9 3 1 0 0 0 +M END +> <minimizedAffinity> +-5.97225 + +> <CNNscore> +0.7663099170 + +> <CNNaffinity> +5.3031663895 + +> <CNN_VS> +4.0638689995 + +> <CNNaffinity_variance> +0.3327504694 + +$$$$ diff --git a/modules/mol/alg/tests/testfiles/6jyf_RET_pred_complete.sdf b/modules/mol/alg/tests/testfiles/6jyf_RET_pred_complete.sdf new file mode 100644 index 0000000000000000000000000000000000000000..526045c3f3c390578ea7ba07a511b42c8c5be6a6 --- /dev/null +++ b/modules/mol/alg/tests/testfiles/6jyf_RET_pred_complete.sdf @@ -0,0 +1,63 @@ + + + + 21 21 0 0 0 0 0 0 0 0999 V2000 + 13.8295 -3.5306 13.6788 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.7323 -3.2277 12.3773 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.3774 -2.0607 11.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.7720 -0.8472 11.7984 C 0 0 0 0 0 0 0 0 0 0 0 0 + 12.3815 -0.5798 12.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.4296 0.3907 11.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.9186 0.2384 10.9458 C 0 0 0 0 0 0 0 0 0 0 0 0 + 16.1958 -1.0970 10.2708 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.7663 -2.3026 11.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 + 15.7821 -3.5486 10.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 + 16.8164 -2.5134 12.2695 C 0 0 0 0 0 0 0 0 0 0 0 0 + 11.8643 -4.6608 14.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 + 13.2073 -4.6659 14.3579 C 0 0 0 0 0 0 0 0 0 0 0 0 + 14.1080 -5.7880 14.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 + 10.5307 -6.7246 14.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 + 11.0612 -5.6971 15.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 + 7.5207 -8.5561 16.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 + 8.4741 -7.5657 15.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 + 9.7333 -7.7894 15.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 + 10.4392 -9.1191 15.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 + 6.5207 -8.5561 16.0576 O 0 0 0 0 0 0 0 0 0 0 0 0 + 17 18 1 0 0 0 + 17 21 2 0 0 0 + 18 19 2 0 0 0 + 19 20 1 0 0 0 + 19 15 1 0 0 0 + 15 16 2 0 0 0 + 16 12 1 0 0 0 + 12 13 2 0 0 0 + 13 14 1 0 0 0 + 13 1 1 0 0 0 + 1 2 2 0 0 0 + 2 3 1 0 0 0 + 3 4 2 0 0 0 + 4 5 1 0 0 0 + 4 6 1 0 0 0 + 6 7 1 0 0 0 + 7 8 1 0 0 0 + 8 9 1 0 0 0 + 9 10 1 0 0 0 + 9 11 1 0 0 0 + 9 3 1 0 0 0 +M END +> <minimizedAffinity> +-5.97225 + +> <CNNscore> +0.7663099170 + +> <CNNaffinity> +5.3031663895 + +> <CNN_VS> +4.0638689995 + +> <CNNaffinity_variance> +0.3327504694 + +$$$$ diff --git a/modules/mol/alg/tests/testfiles/6jyf_mdl.pdb b/modules/mol/alg/tests/testfiles/6jyf_mdl.pdb new file mode 100644 index 0000000000000000000000000000000000000000..11b79afcafde44b19a7b41b304c2aff44340ff9d --- /dev/null +++ b/modules/mol/alg/tests/testfiles/6jyf_mdl.pdb @@ -0,0 +1,4643 @@ +ATOM 1 N MET A 1 31.934 35.198 -32.949 1.00 42.23 N +ATOM 2 H MET A 1 31.100 34.720 -33.260 1.00 42.23 H +ATOM 3 H2 MET A 1 31.659 35.878 -32.256 1.00 42.23 H +ATOM 4 H3 MET A 1 32.371 35.668 -33.730 1.00 42.23 H +ATOM 5 CA MET A 1 32.869 34.239 -32.319 1.00 42.23 C +ATOM 6 HA MET A 1 33.077 33.424 -33.012 1.00 42.23 H +ATOM 7 C MET A 1 32.165 33.653 -31.110 1.00 42.23 C +ATOM 8 CB MET A 1 34.200 34.894 -31.933 1.00 42.23 C +ATOM 9 HB2 MET A 1 34.017 35.824 -31.396 1.00 42.23 H +ATOM 10 HB3 MET A 1 34.746 34.218 -31.274 1.00 42.23 H +ATOM 11 O MET A 1 31.530 34.406 -30.386 1.00 42.23 O +ATOM 12 CG MET A 1 35.073 35.165 -33.163 1.00 42.23 C +ATOM 13 HG2 MET A 1 35.249 34.230 -33.695 1.00 42.23 H +ATOM 14 HG3 MET A 1 34.550 35.853 -33.827 1.00 42.23 H +ATOM 15 SD MET A 1 36.671 35.893 -32.735 1.00 42.23 S +ATOM 16 CE MET A 1 37.297 36.313 -34.384 1.00 42.23 C +ATOM 17 HE1 MET A 1 38.279 36.776 -34.289 1.00 42.23 H +ATOM 18 HE2 MET A 1 36.618 37.013 -34.872 1.00 42.23 H +ATOM 19 HE3 MET A 1 37.386 35.409 -34.985 1.00 42.23 H +ATOM 20 N ALA A 2 32.155 32.325 -31.019 1.00 37.20 N +ATOM 21 H ALA A 2 32.808 31.794 -31.577 1.00 37.20 H +ATOM 22 CA ALA A 2 31.196 31.513 -30.276 1.00 37.20 C +ATOM 23 HA ALA A 2 30.199 31.715 -30.666 1.00 37.20 H +ATOM 24 C ALA A 2 31.165 31.757 -28.756 1.00 37.20 C +ATOM 25 CB ALA A 2 31.537 30.049 -30.584 1.00 37.20 C +ATOM 26 HB1 ALA A 2 32.530 29.806 -30.207 1.00 37.20 H +ATOM 27 HB2 ALA A 2 31.496 29.864 -31.657 1.00 37.20 H +ATOM 28 HB3 ALA A 2 30.813 29.398 -30.093 1.00 37.20 H +ATOM 29 O ALA A 2 32.206 31.798 -28.105 1.00 37.20 O +ATOM 30 N SER A 3 29.948 31.840 -28.210 1.00 35.53 N +ATOM 31 H SER A 3 29.140 31.797 -28.815 1.00 35.53 H +ATOM 32 CA SER A 3 29.658 31.684 -26.786 1.00 35.53 C +ATOM 33 HA SER A 3 30.430 32.185 -26.202 1.00 35.53 H +ATOM 34 C SER A 3 29.642 30.197 -26.429 1.00 35.53 C +ATOM 35 CB SER A 3 28.301 32.319 -26.443 1.00 35.53 C +ATOM 36 HB2 SER A 3 28.332 33.383 -26.678 1.00 35.53 H +ATOM 37 HB3 SER A 3 28.113 32.206 -25.375 1.00 35.53 H +ATOM 38 O SER A 3 28.874 29.430 -27.011 1.00 35.53 O +ATOM 39 OG SER A 3 27.245 31.713 -27.165 1.00 35.53 O +ATOM 40 HG SER A 3 27.285 30.762 -27.039 1.00 35.53 H +ATOM 41 N MET A 4 30.460 29.790 -25.462 1.00 36.90 N +ATOM 42 H MET A 4 31.081 30.462 -25.034 1.00 36.90 H +ATOM 43 CA MET A 4 30.360 28.473 -24.836 1.00 36.90 C +ATOM 44 HA MET A 4 30.149 27.718 -25.593 1.00 36.90 H +ATOM 45 C MET A 4 29.208 28.488 -23.825 1.00 36.90 C +ATOM 46 CB MET A 4 31.681 28.103 -24.140 1.00 36.90 C +ATOM 47 HB2 MET A 4 31.932 28.860 -23.397 1.00 36.90 H +ATOM 48 HB3 MET A 4 31.538 27.155 -23.621 1.00 36.90 H +ATOM 49 O MET A 4 29.343 29.036 -22.734 1.00 36.90 O +ATOM 50 CG MET A 4 32.865 27.944 -25.097 1.00 36.90 C +ATOM 51 HG2 MET A 4 32.599 27.246 -25.890 1.00 36.90 H +ATOM 52 HG3 MET A 4 33.092 28.912 -25.544 1.00 36.90 H +ATOM 53 SD MET A 4 34.344 27.326 -24.249 1.00 36.90 S +ATOM 54 CE MET A 4 35.604 27.636 -25.510 1.00 36.90 C +ATOM 55 HE1 MET A 4 35.649 28.703 -25.729 1.00 36.90 H +ATOM 56 HE2 MET A 4 36.573 27.301 -25.142 1.00 36.90 H +ATOM 57 HE3 MET A 4 35.354 27.086 -26.418 1.00 36.90 H +ATOM 58 N THR A 5 28.072 27.890 -24.174 1.00 41.79 N +ATOM 59 H THR A 5 27.952 27.559 -25.121 1.00 41.79 H +ATOM 60 CA THR A 5 27.059 27.473 -23.197 1.00 41.79 C +ATOM 61 HA THR A 5 27.045 28.169 -22.358 1.00 41.79 H +ATOM 62 C THR A 5 27.450 26.100 -22.665 1.00 41.79 C +ATOM 63 CB THR A 5 25.646 27.452 -23.801 1.00 41.79 C +ATOM 64 HB THR A 5 24.992 26.843 -23.178 1.00 41.79 H +ATOM 65 O THR A 5 27.275 25.090 -23.344 1.00 41.79 O +ATOM 66 CG2 THR A 5 25.064 28.863 -23.877 1.00 41.79 C +ATOM 67 HG21 THR A 5 24.973 29.278 -22.873 1.00 41.79 H +ATOM 68 HG22 THR A 5 24.073 28.818 -24.329 1.00 41.79 H +ATOM 69 HG23 THR A 5 25.706 29.502 -24.482 1.00 41.79 H +ATOM 70 OG1 THR A 5 25.673 26.924 -25.108 1.00 41.79 O +ATOM 71 HG1 THR A 5 25.827 25.980 -25.025 1.00 41.79 H +ATOM 72 N GLY A 6 28.017 26.072 -21.458 1.00 33.33 N +ATOM 73 H GLY A 6 28.185 26.949 -20.986 1.00 33.33 H +ATOM 74 CA GLY A 6 28.202 24.846 -20.692 1.00 33.33 C +ATOM 75 HA2 GLY A 6 28.719 24.100 -21.296 1.00 33.33 H +ATOM 76 HA3 GLY A 6 28.796 25.049 -19.800 1.00 33.33 H +ATOM 77 C GLY A 6 26.843 24.308 -20.256 1.00 33.33 C +ATOM 78 O GLY A 6 26.211 24.873 -19.367 1.00 33.33 O +ATOM 79 N GLY A 7 26.389 23.234 -20.900 1.00 33.89 N +ATOM 80 H GLY A 7 26.926 22.870 -21.675 1.00 33.89 H +ATOM 81 CA GLY A 7 25.265 22.444 -20.417 1.00 33.89 C +ATOM 82 HA2 GLY A 7 24.396 23.082 -20.259 1.00 33.89 H +ATOM 83 HA3 GLY A 7 25.009 21.672 -21.142 1.00 33.89 H +ATOM 84 C GLY A 7 25.665 21.772 -19.109 1.00 33.89 C +ATOM 85 O GLY A 7 26.513 20.882 -19.099 1.00 33.89 O +ATOM 86 N GLN A 8 25.083 22.219 -17.998 1.00 33.14 N +ATOM 87 H GLN A 8 24.439 22.994 -18.072 1.00 33.14 H +ATOM 88 CA GLN A 8 25.091 21.456 -16.758 1.00 33.14 C +ATOM 89 HA GLN A 8 26.115 21.239 -16.455 1.00 33.14 H +ATOM 90 C GLN A 8 24.368 20.134 -17.034 1.00 33.14 C +ATOM 91 CB GLN A 8 24.382 22.248 -15.641 1.00 33.14 C +ATOM 92 HB2 GLN A 8 23.469 22.693 -16.038 1.00 33.14 H +ATOM 93 HB3 GLN A 8 24.100 21.556 -14.848 1.00 33.14 H +ATOM 94 O GLN A 8 23.146 20.115 -17.158 1.00 33.14 O +ATOM 95 CG GLN A 8 25.266 23.337 -15.018 1.00 33.14 C +ATOM 96 HG2 GLN A 8 26.136 22.867 -14.559 1.00 33.14 H +ATOM 97 HG3 GLN A 8 25.614 24.016 -15.796 1.00 33.14 H +ATOM 98 CD GLN A 8 24.516 24.159 -13.970 1.00 33.14 C +ATOM 99 NE2 GLN A 8 25.096 24.415 -12.818 1.00 33.14 N +ATOM 100 HE21 GLN A 8 24.537 24.946 -12.166 1.00 33.14 H +ATOM 101 HE22 GLN A 8 26.010 24.044 -12.601 1.00 33.14 H +ATOM 102 OE1 GLN A 8 23.402 24.607 -14.165 1.00 33.14 O +ATOM 103 N GLN A 9 25.121 19.038 -17.148 1.00 36.61 N +ATOM 104 H GLN A 9 26.126 19.139 -17.161 1.00 36.61 H +ATOM 105 CA GLN A 9 24.569 17.694 -17.014 1.00 36.61 C +ATOM 106 HA GLN A 9 23.782 17.533 -17.751 1.00 36.61 H +ATOM 107 C GLN A 9 23.956 17.613 -15.611 1.00 36.61 C +ATOM 108 CB GLN A 9 25.675 16.637 -17.208 1.00 36.61 C +ATOM 109 HB2 GLN A 9 26.536 16.890 -16.589 1.00 36.61 H +ATOM 110 HB3 GLN A 9 25.288 15.675 -16.873 1.00 36.61 H +ATOM 111 O GLN A 9 24.684 17.487 -14.624 1.00 36.61 O +ATOM 112 CG GLN A 9 26.124 16.484 -18.671 1.00 36.61 C +ATOM 113 HG2 GLN A 9 26.559 17.420 -19.021 1.00 36.61 H +ATOM 114 HG3 GLN A 9 25.250 16.263 -19.285 1.00 36.61 H +ATOM 115 CD GLN A 9 27.152 15.367 -18.870 1.00 36.61 C +ATOM 116 NE2 GLN A 9 27.400 14.956 -20.094 1.00 36.61 N +ATOM 117 HE21 GLN A 9 28.062 14.198 -20.178 1.00 36.61 H +ATOM 118 HE22 GLN A 9 26.857 15.302 -20.872 1.00 36.61 H +ATOM 119 OE1 GLN A 9 27.764 14.851 -17.950 1.00 36.61 O +ATOM 120 N MET A 10 22.634 17.781 -15.500 1.00 41.89 N +ATOM 121 H MET A 10 22.097 17.965 -16.335 1.00 41.89 H +ATOM 122 CA MET A 10 21.921 17.485 -14.260 1.00 41.89 C +ATOM 123 HA MET A 10 22.331 18.099 -13.458 1.00 41.89 H +ATOM 124 C MET A 10 22.209 16.020 -13.927 1.00 41.89 C +ATOM 125 CB MET A 10 20.411 17.765 -14.380 1.00 41.89 C +ATOM 126 HB2 MET A 10 20.041 17.489 -15.367 1.00 41.89 H +ATOM 127 HB3 MET A 10 19.896 17.151 -13.642 1.00 41.89 H +ATOM 128 O MET A 10 21.907 15.130 -14.715 1.00 41.89 O +ATOM 129 CG MET A 10 20.077 19.231 -14.072 1.00 41.89 C +ATOM 130 HG2 MET A 10 20.692 19.549 -13.230 1.00 41.89 H +ATOM 131 HG3 MET A 10 20.339 19.853 -14.928 1.00 41.89 H +ATOM 132 SD MET A 10 18.350 19.527 -13.591 1.00 41.89 S +ATOM 133 CE MET A 10 17.632 20.046 -15.171 1.00 41.89 C +ATOM 134 HE1 MET A 10 16.570 20.251 -15.038 1.00 41.89 H +ATOM 135 HE2 MET A 10 17.752 19.249 -15.905 1.00 41.89 H +ATOM 136 HE3 MET A 10 18.134 20.946 -15.527 1.00 41.89 H +ATOM 137 N GLY A 11 22.911 15.799 -12.813 1.00 41.54 N +ATOM 138 H GLY A 11 23.172 16.595 -12.249 1.00 41.54 H +ATOM 139 CA GLY A 11 23.435 14.491 -12.435 1.00 41.54 C +ATOM 140 HA2 GLY A 11 24.194 14.192 -13.158 1.00 41.54 H +ATOM 141 HA3 GLY A 11 23.893 14.545 -11.448 1.00 41.54 H +ATOM 142 C GLY A 11 22.329 13.443 -12.393 1.00 41.54 C +ATOM 143 O GLY A 11 21.336 13.625 -11.691 1.00 41.54 O +ATOM 144 N ARG A 12 22.516 12.358 -13.153 1.00 52.69 N +ATOM 145 H ARG A 12 23.331 12.342 -13.749 1.00 52.69 H +ATOM 146 CA ARG A 12 21.632 11.185 -13.165 1.00 52.69 C +ATOM 147 HA ARG A 12 20.666 11.470 -13.582 1.00 52.69 H +ATOM 148 C ARG A 12 21.416 10.697 -11.730 1.00 52.69 C +ATOM 149 CB ARG A 12 22.250 10.062 -14.019 1.00 52.69 C +ATOM 150 HB2 ARG A 12 21.602 9.188 -13.962 1.00 52.69 H +ATOM 151 HB3 ARG A 12 23.219 9.791 -13.599 1.00 52.69 H +ATOM 152 O ARG A 12 22.387 10.569 -10.982 1.00 52.69 O +ATOM 153 CG ARG A 12 22.427 10.440 -15.499 1.00 52.69 C +ATOM 154 HG2 ARG A 12 23.068 11.319 -15.575 1.00 52.69 H +ATOM 155 HG3 ARG A 12 21.457 10.670 -15.940 1.00 52.69 H +ATOM 156 CD ARG A 12 23.079 9.283 -16.267 1.00 52.69 C +ATOM 157 HD2 ARG A 12 22.360 8.468 -16.350 1.00 52.69 H +ATOM 158 HD3 ARG A 12 23.944 8.933 -15.704 1.00 52.69 H +ATOM 159 NE ARG A 12 23.510 9.707 -17.612 1.00 52.69 N +ATOM 160 HE ARG A 12 23.060 10.529 -17.988 1.00 52.69 H +ATOM 161 NH1 ARG A 12 24.808 7.875 -18.103 1.00 52.69 N +ATOM 162 HH11 ARG A 12 25.312 7.328 -18.786 1.00 52.69 H +ATOM 163 HH12 ARG A 12 24.489 7.439 -17.249 1.00 52.69 H +ATOM 164 NH2 ARG A 12 24.596 9.526 -19.598 1.00 52.69 N +ATOM 165 HH21 ARG A 12 24.086 10.336 -19.920 1.00 52.69 H +ATOM 166 HH22 ARG A 12 25.087 8.960 -20.275 1.00 52.69 H +ATOM 167 CZ ARG A 12 24.306 9.037 -18.425 1.00 52.69 C +ATOM 168 N ASP A 13 20.169 10.427 -11.348 1.00 55.82 N +ATOM 169 H ASP A 13 19.417 10.552 -12.011 1.00 55.82 H +ATOM 170 CA ASP A 13 19.854 9.856 -10.034 1.00 55.82 C +ATOM 171 HA ASP A 13 20.158 10.582 -9.281 1.00 55.82 H +ATOM 172 C ASP A 13 20.629 8.530 -9.851 1.00 55.82 C +ATOM 173 CB ASP A 13 18.336 9.675 -9.898 1.00 55.82 C +ATOM 174 HB2 ASP A 13 18.001 9.142 -10.787 1.00 55.82 H +ATOM 175 HB3 ASP A 13 17.872 10.661 -9.915 1.00 55.82 H +ATOM 176 O ASP A 13 20.465 7.599 -10.643 1.00 55.82 O +ATOM 177 CG ASP A 13 17.857 8.930 -8.632 1.00 55.82 C +ATOM 178 OD1 ASP A 13 18.693 8.429 -7.842 1.00 55.82 O +ATOM 179 OD2 ASP A 13 16.626 8.853 -8.445 1.00 55.82 O +ATOM 180 N PRO A 14 21.495 8.418 -8.828 1.00 56.76 N +ATOM 181 CA PRO A 14 22.391 7.278 -8.651 1.00 56.76 C +ATOM 182 HA PRO A 14 23.005 7.167 -9.545 1.00 56.76 H +ATOM 183 C PRO A 14 21.679 5.939 -8.409 1.00 56.76 C +ATOM 184 CB PRO A 14 23.287 7.663 -7.468 1.00 56.76 C +ATOM 185 HB2 PRO A 14 24.180 8.163 -7.843 1.00 56.76 H +ATOM 186 HB3 PRO A 14 23.566 6.803 -6.860 1.00 56.76 H +ATOM 187 O PRO A 14 22.328 4.899 -8.516 1.00 56.76 O +ATOM 188 CG PRO A 14 22.444 8.662 -6.678 1.00 56.76 C +ATOM 189 HG2 PRO A 14 23.059 9.336 -6.082 1.00 56.76 H +ATOM 190 HG3 PRO A 14 21.731 8.128 -6.049 1.00 56.76 H +ATOM 191 CD PRO A 14 21.699 9.401 -7.777 1.00 56.76 C +ATOM 192 HD2 PRO A 14 20.757 9.785 -7.385 1.00 56.76 H +ATOM 193 HD3 PRO A 14 22.311 10.217 -8.161 1.00 56.76 H +ATOM 194 N ASN A 15 20.381 5.926 -8.078 1.00 57.60 N +ATOM 195 H ASN A 15 19.892 6.807 -8.014 1.00 57.60 H +ATOM 196 CA ASN A 15 19.606 4.689 -7.912 1.00 57.60 C +ATOM 197 HA ASN A 15 20.259 3.902 -7.536 1.00 57.60 H +ATOM 198 C ASN A 15 19.019 4.151 -9.222 1.00 57.60 C +ATOM 199 CB ASN A 15 18.500 4.933 -6.881 1.00 57.60 C +ATOM 200 HB2 ASN A 15 17.945 5.829 -7.157 1.00 57.60 H +ATOM 201 HB3 ASN A 15 17.807 4.091 -6.884 1.00 57.60 H +ATOM 202 O ASN A 15 18.431 3.067 -9.240 1.00 57.60 O +ATOM 203 CG ASN A 15 19.022 5.076 -5.468 1.00 57.60 C +ATOM 204 ND2 ASN A 15 18.209 5.636 -4.607 1.00 57.60 N +ATOM 205 HD21 ASN A 15 17.356 6.055 -4.948 1.00 57.60 H +ATOM 206 HD22 ASN A 15 18.525 5.726 -3.652 1.00 57.60 H +ATOM 207 OD1 ASN A 15 20.118 4.667 -5.103 1.00 57.60 O +ATOM 208 N SER A 16 19.149 4.893 -10.315 1.00 58.54 N +ATOM 209 H SER A 16 19.615 5.788 -10.269 1.00 58.54 H +ATOM 210 CA SER A 16 18.515 4.520 -11.566 1.00 58.54 C +ATOM 211 HA SER A 16 17.547 4.071 -11.346 1.00 58.54 H +ATOM 212 C SER A 16 19.300 3.556 -12.420 1.00 58.54 C +ATOM 213 CB SER A 16 18.227 5.748 -12.345 1.00 58.54 C +ATOM 214 HB2 SER A 16 17.384 5.434 -12.961 1.00 58.54 H +ATOM 215 HB3 SER A 16 17.973 6.524 -11.623 1.00 58.54 H +ATOM 216 O SER A 16 18.748 2.607 -12.951 1.00 58.54 O +ATOM 217 OG SER A 16 19.266 6.261 -13.145 1.00 58.54 O +ATOM 218 HG SER A 16 18.818 6.725 -13.856 1.00 58.54 H +ATOM 219 N MET A 17 20.617 3.722 -12.428 1.00 76.92 N +ATOM 220 H MET A 17 20.974 4.585 -12.042 1.00 76.92 H +ATOM 221 CA MET A 17 21.547 2.767 -13.028 1.00 76.92 C +ATOM 222 HA MET A 17 21.153 2.449 -13.993 1.00 76.92 H +ATOM 223 C MET A 17 21.708 1.498 -12.175 1.00 76.92 C +ATOM 224 CB MET A 17 22.896 3.459 -13.257 1.00 76.92 C +ATOM 225 HB2 MET A 17 23.297 3.781 -12.296 1.00 76.92 H +ATOM 226 HB3 MET A 17 23.588 2.744 -13.701 1.00 76.92 H +ATOM 227 O MET A 17 22.487 0.616 -12.518 1.00 76.92 O +ATOM 228 CG MET A 17 22.776 4.662 -14.203 1.00 76.92 C +ATOM 229 HG2 MET A 17 22.297 4.325 -15.123 1.00 76.92 H +ATOM 230 HG3 MET A 17 22.132 5.416 -13.750 1.00 76.92 H +ATOM 231 SD MET A 17 24.354 5.449 -14.648 1.00 76.92 S +ATOM 232 CE MET A 17 24.902 6.026 -13.018 1.00 76.92 C +ATOM 233 HE1 MET A 17 24.122 6.638 -12.566 1.00 76.92 H +ATOM 234 HE2 MET A 17 25.809 6.619 -13.131 1.00 76.92 H +ATOM 235 HE3 MET A 17 25.113 5.171 -12.375 1.00 76.92 H +ATOM 236 N LYS A 18 21.007 1.422 -11.036 1.00 91.99 N +ATOM 237 H LYS A 18 20.369 2.180 -10.840 1.00 91.99 H +ATOM 238 CA LYS A 18 21.016 0.277 -10.117 1.00 91.99 C +ATOM 239 HA LYS A 18 21.882 -0.351 -10.325 1.00 91.99 H +ATOM 240 C LYS A 18 19.813 -0.640 -10.283 1.00 91.99 C +ATOM 241 CB LYS A 18 21.109 0.762 -8.670 1.00 91.99 C +ATOM 242 HB2 LYS A 18 20.282 1.437 -8.449 1.00 91.99 H +ATOM 243 HB3 LYS A 18 21.027 -0.101 -8.009 1.00 91.99 H +ATOM 244 O LYS A 18 19.755 -1.655 -9.602 1.00 91.99 O +ATOM 245 CG LYS A 18 22.441 1.456 -8.400 1.00 91.99 C +ATOM 246 HG2 LYS A 18 23.259 0.787 -8.669 1.00 91.99 H +ATOM 247 HG3 LYS A 18 22.515 2.367 -8.994 1.00 91.99 H +ATOM 248 CD LYS A 18 22.529 1.790 -6.915 1.00 91.99 C +ATOM 249 HD2 LYS A 18 21.697 2.433 -6.628 1.00 91.99 H +ATOM 250 HD3 LYS A 18 22.485 0.862 -6.345 1.00 91.99 H +ATOM 251 CE LYS A 18 23.851 2.494 -6.647 1.00 91.99 C +ATOM 252 HE2 LYS A 18 24.653 1.879 -7.054 1.00 91.99 H +ATOM 253 HE3 LYS A 18 23.845 3.451 -7.170 1.00 91.99 H +ATOM 254 NZ LYS A 18 24.023 2.675 -5.192 1.00 91.99 N +ATOM 255 HZ1 LYS A 18 23.254 3.222 -4.833 1.00 91.99 H +ATOM 256 HZ2 LYS A 18 24.905 3.128 -4.999 1.00 91.99 H +ATOM 257 HZ3 LYS A 18 24.015 1.763 -4.758 1.00 91.99 H +ATOM 258 N ASN A 19 18.867 -0.285 -11.152 1.00 96.47 N +ATOM 259 H ASN A 19 19.038 0.504 -11.759 1.00 96.47 H +ATOM 260 CA ASN A 19 17.706 -1.109 -11.456 1.00 96.47 C +ATOM 261 HA ASN A 19 17.725 -1.991 -10.816 1.00 96.47 H +ATOM 262 C ASN A 19 17.766 -1.636 -12.891 1.00 96.47 C +ATOM 263 CB ASN A 19 16.422 -0.357 -11.107 1.00 96.47 C +ATOM 264 HB2 ASN A 19 15.572 -1.021 -11.263 1.00 96.47 H +ATOM 265 HB3 ASN A 19 16.443 -0.104 -10.046 1.00 96.47 H +ATOM 266 O ASN A 19 18.331 -0.987 -13.779 1.00 96.47 O +ATOM 267 CG ASN A 19 16.202 0.896 -11.929 1.00 96.47 C +ATOM 268 ND2 ASN A 19 16.187 2.041 -11.293 1.00 96.47 N +ATOM 269 HD21 ASN A 19 16.004 2.816 -11.915 1.00 96.47 H +ATOM 270 HD22 ASN A 19 16.707 2.119 -10.431 1.00 96.47 H +ATOM 271 OD1 ASN A 19 16.031 0.882 -13.130 1.00 96.47 O +ATOM 272 N ILE A 20 17.212 -2.832 -13.106 1.00 97.59 N +ATOM 273 H ILE A 20 16.723 -3.287 -12.349 1.00 97.59 H +ATOM 274 CA ILE A 20 17.299 -3.506 -14.404 1.00 97.59 C +ATOM 275 HA ILE A 20 18.346 -3.497 -14.707 1.00 97.59 H +ATOM 276 C ILE A 20 16.529 -2.753 -15.486 1.00 97.59 C +ATOM 277 CB ILE A 20 16.856 -4.982 -14.349 1.00 97.59 C +ATOM 278 HB ILE A 20 17.103 -5.414 -15.319 1.00 97.59 H +ATOM 279 O ILE A 20 16.819 -2.946 -16.662 1.00 97.59 O +ATOM 280 CG1 ILE A 20 15.330 -5.125 -14.160 1.00 97.59 C +ATOM 281 HG12 ILE A 20 15.039 -4.703 -13.198 1.00 97.59 H +ATOM 282 HG13 ILE A 20 14.820 -4.553 -14.935 1.00 97.59 H +ATOM 283 CG2 ILE A 20 17.664 -5.763 -13.299 1.00 97.59 C +ATOM 284 HG21 ILE A 20 18.728 -5.563 -13.425 1.00 97.59 H +ATOM 285 HG22 ILE A 20 17.369 -5.481 -12.288 1.00 97.59 H +ATOM 286 HG23 ILE A 20 17.513 -6.834 -13.439 1.00 97.59 H +ATOM 287 CD1 ILE A 20 14.815 -6.563 -14.287 1.00 97.59 C +ATOM 288 HD11 ILE A 20 15.215 -7.187 -13.489 1.00 97.59 H +ATOM 289 HD12 ILE A 20 13.726 -6.564 -14.234 1.00 97.59 H +ATOM 290 HD13 ILE A 20 15.116 -6.976 -15.250 1.00 97.59 H +ATOM 291 N GLU A 21 15.567 -1.896 -15.116 1.00 97.93 N +ATOM 292 H GLU A 21 15.344 -1.781 -14.138 1.00 97.93 H +ATOM 293 CA GLU A 21 14.827 -1.096 -16.087 1.00 97.93 C +ATOM 294 HA GLU A 21 14.319 -1.790 -16.757 1.00 97.93 H +ATOM 295 C GLU A 21 15.773 -0.264 -16.964 1.00 97.93 C +ATOM 296 CB GLU A 21 13.758 -0.214 -15.411 1.00 97.93 C +ATOM 297 HB2 GLU A 21 14.186 0.418 -14.632 1.00 97.93 H +ATOM 298 HB3 GLU A 21 13.369 0.456 -16.178 1.00 97.93 H +ATOM 299 O GLU A 21 15.557 -0.191 -18.169 1.00 97.93 O +ATOM 300 CG GLU A 21 12.554 -0.996 -14.859 1.00 97.93 C +ATOM 301 HG2 GLU A 21 12.332 -1.780 -15.583 1.00 97.93 H +ATOM 302 HG3 GLU A 21 11.698 -0.321 -14.828 1.00 97.93 H +ATOM 303 CD GLU A 21 12.691 -1.655 -13.474 1.00 97.93 C +ATOM 304 OE1 GLU A 21 11.685 -2.238 -12.981 1.00 97.93 O +ATOM 305 OE2 GLU A 21 13.759 -1.591 -12.837 1.00 97.93 O +ATOM 306 N SER A 22 16.865 0.260 -16.397 1.00 96.52 N +ATOM 307 H SER A 22 16.981 0.132 -15.402 1.00 96.52 H +ATOM 308 CA SER A 22 17.875 1.047 -17.120 1.00 96.52 C +ATOM 309 HA SER A 22 17.354 1.816 -17.689 1.00 96.52 H +ATOM 310 C SER A 22 18.739 0.272 -18.129 1.00 96.52 C +ATOM 311 CB SER A 22 18.790 1.744 -16.108 1.00 96.52 C +ATOM 312 HB2 SER A 22 19.407 2.472 -16.635 1.00 96.52 H +ATOM 313 HB3 SER A 22 18.174 2.275 -15.381 1.00 96.52 H +ATOM 314 O SER A 22 19.491 0.895 -18.878 1.00 96.52 O +ATOM 315 OG SER A 22 19.639 0.826 -15.435 1.00 96.52 O +ATOM 316 HG SER A 22 19.110 0.254 -14.874 1.00 96.52 H +ATOM 317 N LEU A 23 18.676 -1.066 -18.151 1.00 96.79 N +ATOM 318 H LEU A 23 17.992 -1.523 -17.566 1.00 96.79 H +ATOM 319 CA LEU A 23 19.560 -1.908 -18.972 1.00 96.79 C +ATOM 320 HA LEU A 23 20.519 -1.404 -19.091 1.00 96.79 H +ATOM 321 C LEU A 23 19.036 -2.165 -20.389 1.00 96.79 C +ATOM 322 CB LEU A 23 19.791 -3.260 -18.272 1.00 96.79 C +ATOM 323 HB2 LEU A 23 20.430 -3.868 -18.912 1.00 96.79 H +ATOM 324 HB3 LEU A 23 18.831 -3.771 -18.192 1.00 96.79 H +ATOM 325 O LEU A 23 19.768 -2.728 -21.207 1.00 96.79 O +ATOM 326 CG LEU A 23 20.432 -3.200 -16.878 1.00 96.79 C +ATOM 327 HG LEU A 23 19.783 -2.653 -16.194 1.00 96.79 H +ATOM 328 CD1 LEU A 23 20.597 -4.634 -16.364 1.00 96.79 C +ATOM 329 HD11 LEU A 23 21.252 -5.197 -17.029 1.00 96.79 H +ATOM 330 HD12 LEU A 23 21.023 -4.622 -15.361 1.00 96.79 H +ATOM 331 HD13 LEU A 23 19.622 -5.119 -16.326 1.00 96.79 H +ATOM 332 CD2 LEU A 23 21.804 -2.523 -16.901 1.00 96.79 C +ATOM 333 HD21 LEU A 23 22.454 -3.012 -17.625 1.00 96.79 H +ATOM 334 HD22 LEU A 23 21.685 -1.471 -17.164 1.00 96.79 H +ATOM 335 HD23 LEU A 23 22.252 -2.572 -15.908 1.00 96.79 H +ATOM 336 N PHE A 24 17.776 -1.830 -20.669 1.00 97.83 N +ATOM 337 H PHE A 24 17.247 -1.302 -19.989 1.00 97.83 H +ATOM 338 CA PHE A 24 17.083 -2.282 -21.872 1.00 97.83 C +ATOM 339 HA PHE A 24 17.799 -2.771 -22.533 1.00 97.83 H +ATOM 340 C PHE A 24 16.472 -1.129 -22.660 1.00 97.83 C +ATOM 341 CB PHE A 24 16.006 -3.316 -21.503 1.00 97.83 C +ATOM 342 HB2 PHE A 24 15.178 -2.794 -21.022 1.00 97.83 H +ATOM 343 HB3 PHE A 24 15.623 -3.755 -22.424 1.00 97.83 H +ATOM 344 O PHE A 24 15.945 -0.178 -22.087 1.00 97.83 O +ATOM 345 CG PHE A 24 16.480 -4.435 -20.592 1.00 97.83 C +ATOM 346 CD1 PHE A 24 17.517 -5.292 -21.005 1.00 97.83 C +ATOM 347 HD1 PHE A 24 17.964 -5.164 -21.980 1.00 97.83 H +ATOM 348 CD2 PHE A 24 15.930 -4.577 -19.305 1.00 97.83 C +ATOM 349 HD2 PHE A 24 15.158 -3.901 -18.969 1.00 97.83 H +ATOM 350 CE1 PHE A 24 18.023 -6.264 -20.125 1.00 97.83 C +ATOM 351 HE1 PHE A 24 18.849 -6.892 -20.428 1.00 97.83 H +ATOM 352 CE2 PHE A 24 16.427 -5.558 -18.429 1.00 97.83 C +ATOM 353 HE2 PHE A 24 16.025 -5.639 -17.430 1.00 97.83 H +ATOM 354 CZ PHE A 24 17.488 -6.385 -18.832 1.00 97.83 C +ATOM 355 HZ PHE A 24 17.904 -7.108 -18.146 1.00 97.83 H +ATOM 356 N ASP A 25 16.465 -1.289 -23.980 1.00 98.17 N +ATOM 357 H ASP A 25 16.955 -2.076 -24.380 1.00 98.17 H +ATOM 358 CA ASP A 25 15.539 -0.575 -24.849 1.00 98.17 C +ATOM 359 HA ASP A 25 15.363 0.423 -24.447 1.00 98.17 H +ATOM 360 C ASP A 25 14.210 -1.334 -24.904 1.00 98.17 C +ATOM 361 CB ASP A 25 16.108 -0.429 -26.263 1.00 98.17 C +ATOM 362 HB2 ASP A 25 15.372 0.087 -26.880 1.00 98.17 H +ATOM 363 HB3 ASP A 25 16.262 -1.421 -26.685 1.00 98.17 H +ATOM 364 O ASP A 25 14.171 -2.567 -24.828 1.00 98.17 O +ATOM 365 CG ASP A 25 17.415 0.358 -26.329 1.00 98.17 C +ATOM 366 OD1 ASP A 25 17.614 1.268 -25.493 1.00 98.17 O +ATOM 367 OD2 ASP A 25 18.178 0.058 -27.274 1.00 98.17 O +ATOM 368 N TYR A 26 13.116 -0.604 -25.091 1.00 98.63 N +ATOM 369 H TYR A 26 13.225 0.398 -25.159 1.00 98.63 H +ATOM 370 CA TYR A 26 11.771 -1.172 -25.093 1.00 98.63 C +ATOM 371 HA TYR A 26 11.829 -2.233 -24.851 1.00 98.63 H +ATOM 372 C TYR A 26 11.135 -1.060 -26.473 1.00 98.63 C +ATOM 373 CB TYR A 26 10.920 -0.524 -23.993 1.00 98.63 C +ATOM 374 HB2 TYR A 26 9.911 -0.933 -24.037 1.00 98.63 H +ATOM 375 HB3 TYR A 26 10.852 0.550 -24.169 1.00 98.63 H +ATOM 376 O TYR A 26 11.192 -0.022 -27.134 1.00 98.63 O +ATOM 377 CG TYR A 26 11.485 -0.748 -22.606 1.00 98.63 C +ATOM 378 CD1 TYR A 26 11.077 -1.861 -21.845 1.00 98.63 C +ATOM 379 HD1 TYR A 26 10.323 -2.532 -22.229 1.00 98.63 H +ATOM 380 CD2 TYR A 26 12.485 0.113 -22.116 1.00 98.63 C +ATOM 381 HD2 TYR A 26 12.826 0.953 -22.703 1.00 98.63 H +ATOM 382 CE1 TYR A 26 11.675 -2.118 -20.596 1.00 98.63 C +ATOM 383 HE1 TYR A 26 11.377 -2.971 -20.006 1.00 98.63 H +ATOM 384 CE2 TYR A 26 13.103 -0.164 -20.886 1.00 98.63 C +ATOM 385 HE2 TYR A 26 13.924 0.444 -20.536 1.00 98.63 H +ATOM 386 OH TYR A 26 13.296 -1.503 -18.934 1.00 98.63 O +ATOM 387 HH TYR A 26 14.045 -0.914 -18.822 1.00 98.63 H +ATOM 388 CZ TYR A 26 12.700 -1.271 -20.125 1.00 98.63 C +ATOM 389 N SER A 27 10.461 -2.121 -26.914 1.00 98.61 N +ATOM 390 H SER A 27 10.448 -2.952 -26.341 1.00 98.61 H +ATOM 391 CA SER A 27 9.521 -1.989 -28.032 1.00 98.61 C +ATOM 392 HA SER A 27 10.050 -1.556 -28.881 1.00 98.61 H +ATOM 393 C SER A 27 8.373 -1.047 -27.647 1.00 98.61 C +ATOM 394 CB SER A 27 8.976 -3.354 -28.455 1.00 98.61 C +ATOM 395 HB2 SER A 27 8.347 -3.232 -29.336 1.00 98.61 H +ATOM 396 HB3 SER A 27 9.805 -4.016 -28.705 1.00 98.61 H +ATOM 397 O SER A 27 8.036 -0.931 -26.467 1.00 98.61 O +ATOM 398 OG SER A 27 8.209 -3.929 -27.416 1.00 98.61 O +ATOM 399 HG SER A 27 8.828 -4.207 -26.737 1.00 98.61 H +ATOM 400 N ALA A 28 7.717 -0.427 -28.635 1.00 98.48 N +ATOM 401 H ALA A 28 8.060 -0.497 -29.583 1.00 98.48 H +ATOM 402 CA ALA A 28 6.533 0.401 -28.380 1.00 98.48 C +ATOM 403 HA ALA A 28 6.827 1.265 -27.784 1.00 98.48 H +ATOM 404 C ALA A 28 5.467 -0.362 -27.569 1.00 98.48 C +ATOM 405 CB ALA A 28 5.975 0.899 -29.719 1.00 98.48 C +ATOM 406 HB1 ALA A 28 5.107 1.530 -29.530 1.00 98.48 H +ATOM 407 HB2 ALA A 28 6.727 1.496 -30.236 1.00 98.48 H +ATOM 408 HB3 ALA A 28 5.673 0.061 -30.346 1.00 98.48 H +ATOM 409 O ALA A 28 4.942 0.160 -26.594 1.00 98.48 O +ATOM 410 N GLY A 29 5.244 -1.644 -27.885 1.00 98.61 N +ATOM 411 H GLY A 29 5.742 -2.035 -28.672 1.00 98.61 H +ATOM 412 CA GLY A 29 4.294 -2.486 -27.157 1.00 98.61 C +ATOM 413 HA2 GLY A 29 3.307 -2.025 -27.202 1.00 98.61 H +ATOM 414 HA3 GLY A 29 4.245 -3.464 -27.636 1.00 98.61 H +ATOM 415 C GLY A 29 4.651 -2.698 -25.682 1.00 98.61 C +ATOM 416 O GLY A 29 3.773 -2.604 -24.831 1.00 98.61 O +ATOM 417 N GLN A 30 5.922 -2.956 -25.353 1.00 98.76 N +ATOM 418 H GLN A 30 6.624 -2.959 -26.080 1.00 98.76 H +ATOM 419 CA GLN A 30 6.356 -3.108 -23.955 1.00 98.76 C +ATOM 420 HA GLN A 30 5.703 -3.816 -23.444 1.00 98.76 H +ATOM 421 C GLN A 30 6.267 -1.777 -23.199 1.00 98.76 C +ATOM 422 CB GLN A 30 7.797 -3.633 -23.905 1.00 98.76 C +ATOM 423 HB2 GLN A 30 8.178 -3.538 -22.888 1.00 98.76 H +ATOM 424 HB3 GLN A 30 8.407 -2.999 -24.549 1.00 98.76 H +ATOM 425 O GLN A 30 5.770 -1.740 -22.072 1.00 98.76 O +ATOM 426 CG GLN A 30 7.929 -5.110 -24.324 1.00 98.76 C +ATOM 427 HG2 GLN A 30 7.303 -5.313 -25.194 1.00 98.76 H +ATOM 428 HG3 GLN A 30 7.588 -5.753 -23.514 1.00 98.76 H +ATOM 429 CD GLN A 30 9.362 -5.475 -24.692 1.00 98.76 C +ATOM 430 NE2 GLN A 30 9.819 -6.675 -24.416 1.00 98.76 N +ATOM 431 HE21 GLN A 30 10.753 -6.900 -24.727 1.00 98.76 H +ATOM 432 HE22 GLN A 30 9.249 -7.401 -24.006 1.00 98.76 H +ATOM 433 OE1 GLN A 30 10.067 -4.688 -25.315 1.00 98.76 O +ATOM 434 N PHE A 31 6.719 -0.692 -23.834 1.00 98.76 N +ATOM 435 H PHE A 31 7.088 -0.794 -24.768 1.00 98.76 H +ATOM 436 CA PHE A 31 6.739 0.640 -23.244 1.00 98.76 C +ATOM 437 HA PHE A 31 7.271 0.589 -22.294 1.00 98.76 H +ATOM 438 C PHE A 31 5.332 1.163 -22.934 1.00 98.76 C +ATOM 439 CB PHE A 31 7.502 1.583 -24.177 1.00 98.76 C +ATOM 440 HB2 PHE A 31 8.511 1.201 -24.331 1.00 98.76 H +ATOM 441 HB3 PHE A 31 7.009 1.613 -25.148 1.00 98.76 H +ATOM 442 O PHE A 31 5.046 1.526 -21.790 1.00 98.76 O +ATOM 443 CG PHE A 31 7.590 2.983 -23.621 1.00 98.76 C +ATOM 444 CD1 PHE A 31 6.621 3.940 -23.977 1.00 98.76 C +ATOM 445 HD1 PHE A 31 5.840 3.692 -24.680 1.00 98.76 H +ATOM 446 CD2 PHE A 31 8.593 3.304 -22.691 1.00 98.76 C +ATOM 447 HD2 PHE A 31 9.325 2.567 -22.392 1.00 98.76 H +ATOM 448 CE1 PHE A 31 6.682 5.232 -23.436 1.00 98.76 C +ATOM 449 HE1 PHE A 31 5.954 5.976 -23.723 1.00 98.76 H +ATOM 450 CE2 PHE A 31 8.625 4.583 -22.120 1.00 98.76 C +ATOM 451 HE2 PHE A 31 9.348 4.814 -21.352 1.00 98.76 H +ATOM 452 CZ PHE A 31 7.701 5.555 -22.529 1.00 98.76 C +ATOM 453 HZ PHE A 31 7.775 6.562 -22.146 1.00 98.76 H +ATOM 454 N GLU A 32 4.439 1.138 -23.926 1.00 98.69 N +ATOM 455 H GLU A 32 4.739 0.838 -24.843 1.00 98.69 H +ATOM 456 CA GLU A 32 3.051 1.583 -23.787 1.00 98.69 C +ATOM 457 HA GLU A 32 3.024 2.597 -23.389 1.00 98.69 H +ATOM 458 C GLU A 32 2.269 0.684 -22.824 1.00 98.69 C +ATOM 459 CB GLU A 32 2.360 1.572 -25.160 1.00 98.69 C +ATOM 460 HB2 GLU A 32 1.294 1.741 -25.010 1.00 98.69 H +ATOM 461 HB3 GLU A 32 2.484 0.584 -25.602 1.00 98.69 H +ATOM 462 O GLU A 32 1.436 1.164 -22.063 1.00 98.69 O +ATOM 463 CG GLU A 32 2.881 2.647 -26.131 1.00 98.69 C +ATOM 464 HG2 GLU A 32 2.607 3.628 -25.743 1.00 98.69 H +ATOM 465 HG3 GLU A 32 3.969 2.601 -26.174 1.00 98.69 H +ATOM 466 CD GLU A 32 2.315 2.482 -27.555 1.00 98.69 C +ATOM 467 OE1 GLU A 32 2.865 3.127 -28.476 1.00 98.69 O +ATOM 468 OE2 GLU A 32 1.344 1.706 -27.735 1.00 98.69 O +ATOM 469 N PHE A 33 2.534 -0.627 -22.794 1.00 98.74 N +ATOM 470 H PHE A 33 3.211 -1.007 -23.441 1.00 98.74 H +ATOM 471 CA PHE A 33 1.849 -1.524 -21.863 1.00 98.74 C +ATOM 472 HA PHE A 33 0.776 -1.373 -21.976 1.00 98.74 H +ATOM 473 C PHE A 33 2.180 -1.218 -20.394 1.00 98.74 C +ATOM 474 CB PHE A 33 2.160 -2.976 -22.225 1.00 98.74 C +ATOM 475 HB2 PHE A 33 3.237 -3.138 -22.167 1.00 98.74 H +ATOM 476 HB3 PHE A 33 1.847 -3.152 -23.254 1.00 98.74 H +ATOM 477 O PHE A 33 1.274 -1.225 -19.557 1.00 98.74 O +ATOM 478 CG PHE A 33 1.449 -3.984 -21.350 1.00 98.74 C +ATOM 479 CD1 PHE A 33 2.158 -4.662 -20.347 1.00 98.74 C +ATOM 480 HD1 PHE A 33 3.204 -4.434 -20.204 1.00 98.74 H +ATOM 481 CD2 PHE A 33 0.078 -4.238 -21.531 1.00 98.74 C +ATOM 482 HD2 PHE A 33 -0.469 -3.708 -22.296 1.00 98.74 H +ATOM 483 CE1 PHE A 33 1.512 -5.621 -19.547 1.00 98.74 C +ATOM 484 HE1 PHE A 33 2.070 -6.152 -18.790 1.00 98.74 H +ATOM 485 CE2 PHE A 33 -0.578 -5.178 -20.717 1.00 98.74 C +ATOM 486 HE2 PHE A 33 -1.631 -5.368 -20.857 1.00 98.74 H +ATOM 487 CZ PHE A 33 0.141 -5.875 -19.728 1.00 98.74 C +ATOM 488 HZ PHE A 33 -0.360 -6.604 -19.108 1.00 98.74 H +ATOM 489 N ILE A 34 3.443 -0.913 -20.071 1.00 98.77 N +ATOM 490 H ILE A 34 4.137 -0.895 -20.804 1.00 98.77 H +ATOM 491 CA ILE A 34 3.833 -0.479 -18.719 1.00 98.77 C +ATOM 492 HA ILE A 34 3.480 -1.219 -18.001 1.00 98.77 H +ATOM 493 C ILE A 34 3.143 0.842 -18.361 1.00 98.77 C +ATOM 494 CB ILE A 34 5.372 -0.385 -18.593 1.00 98.77 C +ATOM 495 HB ILE A 34 5.758 0.171 -19.448 1.00 98.77 H +ATOM 496 O ILE A 34 2.566 0.944 -17.276 1.00 98.77 O +ATOM 497 CG1 ILE A 34 5.976 -1.807 -18.607 1.00 98.77 C +ATOM 498 HG12 ILE A 34 5.761 -2.305 -17.662 1.00 98.77 H +ATOM 499 HG13 ILE A 34 5.512 -2.388 -19.404 1.00 98.77 H +ATOM 500 CG2 ILE A 34 5.783 0.358 -17.305 1.00 98.77 C +ATOM 501 HG21 ILE A 34 6.865 0.343 -17.178 1.00 98.77 H +ATOM 502 HG22 ILE A 34 5.499 1.409 -17.377 1.00 98.77 H +ATOM 503 HG23 ILE A 34 5.296 -0.086 -16.437 1.00 98.77 H +ATOM 504 CD1 ILE A 34 7.489 -1.825 -18.853 1.00 98.77 C +ATOM 505 HD11 ILE A 34 8.022 -1.312 -18.052 1.00 98.77 H +ATOM 506 HD12 ILE A 34 7.712 -1.345 -19.805 1.00 98.77 H +ATOM 507 HD13 ILE A 34 7.832 -2.858 -18.898 1.00 98.77 H +ATOM 508 N ASP A 35 3.139 1.815 -19.274 1.00 98.71 N +ATOM 509 H ASP A 35 3.628 1.677 -20.147 1.00 98.71 H +ATOM 510 CA ASP A 35 2.463 3.100 -19.064 1.00 98.71 C +ATOM 511 HA ASP A 35 2.885 3.578 -18.180 1.00 98.71 H +ATOM 512 C ASP A 35 0.952 2.924 -18.816 1.00 98.71 C +ATOM 513 CB ASP A 35 2.724 4.016 -20.268 1.00 98.71 C +ATOM 514 HB2 ASP A 35 3.798 4.141 -20.406 1.00 98.71 H +ATOM 515 HB3 ASP A 35 2.314 3.561 -21.169 1.00 98.71 H +ATOM 516 O ASP A 35 0.396 3.426 -17.832 1.00 98.71 O +ATOM 517 CG ASP A 35 2.085 5.389 -20.047 1.00 98.71 C +ATOM 518 OD1 ASP A 35 2.207 5.895 -18.909 1.00 98.71 O +ATOM 519 OD2 ASP A 35 1.422 5.879 -20.985 1.00 98.71 O +ATOM 520 N HIS A 36 0.284 2.103 -19.631 1.00 98.75 N +ATOM 521 H HIS A 36 0.768 1.753 -20.446 1.00 98.75 H +ATOM 522 CA HIS A 36 -1.133 1.783 -19.467 1.00 98.75 C +ATOM 523 HA HIS A 36 -1.696 2.716 -19.471 1.00 98.75 H +ATOM 524 C HIS A 36 -1.431 1.080 -18.135 1.00 98.75 C +ATOM 525 CB HIS A 36 -1.610 0.913 -20.638 1.00 98.75 C +ATOM 526 HB2 HIS A 36 -0.985 0.021 -20.692 1.00 98.75 H +ATOM 527 HB3 HIS A 36 -2.631 0.592 -20.436 1.00 98.75 H +ATOM 528 O HIS A 36 -2.448 1.384 -17.505 1.00 98.75 O +ATOM 529 CG HIS A 36 -1.607 1.588 -21.989 1.00 98.75 C +ATOM 530 CD2 HIS A 36 -1.847 2.908 -22.266 1.00 98.75 C +ATOM 531 HD2 HIS A 36 -2.054 3.687 -21.547 1.00 98.75 H +ATOM 532 ND1 HIS A 36 -1.353 0.968 -23.194 1.00 98.75 N +ATOM 533 HD1 HIS A 36 -0.912 0.067 -23.306 1.00 98.75 H +ATOM 534 CE1 HIS A 36 -1.431 1.893 -24.165 1.00 98.75 C +ATOM 535 HE1 HIS A 36 -1.183 1.731 -25.204 1.00 98.75 H +ATOM 536 NE2 HIS A 36 -1.776 3.080 -23.650 1.00 98.75 N +ATOM 537 N LEU A 37 -0.567 0.169 -17.669 1.00 98.76 N +ATOM 538 H LEU A 37 0.247 -0.044 -18.228 1.00 98.76 H +ATOM 539 CA LEU A 37 -0.723 -0.484 -16.363 1.00 98.76 C +ATOM 540 HA LEU A 37 -1.715 -0.932 -16.309 1.00 98.76 H +ATOM 541 C LEU A 37 -0.635 0.522 -15.210 1.00 98.76 C +ATOM 542 CB LEU A 37 0.352 -1.570 -16.171 1.00 98.76 C +ATOM 543 HB2 LEU A 37 1.312 -1.176 -16.505 1.00 98.76 H +ATOM 544 HB3 LEU A 37 0.442 -1.774 -15.104 1.00 98.76 H +ATOM 545 O LEU A 37 -1.489 0.512 -14.317 1.00 98.76 O +ATOM 546 CG LEU A 37 0.095 -2.909 -16.880 1.00 98.76 C +ATOM 547 HG LEU A 37 -0.053 -2.756 -17.949 1.00 98.76 H +ATOM 548 CD1 LEU A 37 1.319 -3.798 -16.654 1.00 98.76 C +ATOM 549 HD11 LEU A 37 2.163 -3.385 -17.207 1.00 98.76 H +ATOM 550 HD12 LEU A 37 1.570 -3.837 -15.594 1.00 98.76 H +ATOM 551 HD13 LEU A 37 1.123 -4.806 -17.020 1.00 98.76 H +ATOM 552 CD2 LEU A 37 -1.124 -3.645 -16.315 1.00 98.76 C +ATOM 553 HD21 LEU A 37 -0.987 -3.829 -15.249 1.00 98.76 H +ATOM 554 HD22 LEU A 37 -2.027 -3.057 -16.478 1.00 98.76 H +ATOM 555 HD23 LEU A 37 -1.242 -4.595 -16.837 1.00 98.76 H +ATOM 556 N LEU A 38 0.371 1.401 -15.234 1.00 98.62 N +ATOM 557 H LEU A 38 1.008 1.376 -16.017 1.00 98.62 H +ATOM 558 CA LEU A 38 0.557 2.437 -14.217 1.00 98.62 C +ATOM 559 HA LEU A 38 0.590 1.966 -13.234 1.00 98.62 H +ATOM 560 C LEU A 38 -0.636 3.401 -14.205 1.00 98.62 C +ATOM 561 CB LEU A 38 1.885 3.175 -14.473 1.00 98.62 C +ATOM 562 HB2 LEU A 38 1.873 3.569 -15.490 1.00 98.62 H +ATOM 563 HB3 LEU A 38 1.951 4.021 -13.789 1.00 98.62 H +ATOM 564 O LEU A 38 -1.228 3.633 -13.147 1.00 98.62 O +ATOM 565 CG LEU A 38 3.146 2.310 -14.293 1.00 98.62 C +ATOM 566 HG LEU A 38 3.050 1.380 -14.852 1.00 98.62 H +ATOM 567 CD1 LEU A 38 4.386 3.047 -14.792 1.00 98.62 C +ATOM 568 HD11 LEU A 38 5.261 2.399 -14.734 1.00 98.62 H +ATOM 569 HD12 LEU A 38 4.247 3.325 -15.837 1.00 98.62 H +ATOM 570 HD13 LEU A 38 4.558 3.949 -14.205 1.00 98.62 H +ATOM 571 CD2 LEU A 38 3.374 1.951 -12.824 1.00 98.62 C +ATOM 572 HD21 LEU A 38 2.565 1.305 -12.483 1.00 98.62 H +ATOM 573 HD22 LEU A 38 3.414 2.860 -12.225 1.00 98.62 H +ATOM 574 HD23 LEU A 38 4.318 1.411 -12.751 1.00 98.62 H +ATOM 575 N THR A 39 -1.053 3.871 -15.381 1.00 98.64 N +ATOM 576 H THR A 39 -0.491 3.662 -16.194 1.00 98.64 H +ATOM 577 CA THR A 39 -2.198 4.772 -15.571 1.00 98.64 C +ATOM 578 HA THR A 39 -2.041 5.667 -14.969 1.00 98.64 H +ATOM 579 C THR A 39 -3.517 4.139 -15.123 1.00 98.64 C +ATOM 580 CB THR A 39 -2.268 5.211 -17.043 1.00 98.64 C +ATOM 581 HB THR A 39 -2.280 4.341 -17.701 1.00 98.64 H +ATOM 582 O THR A 39 -4.292 4.755 -14.383 1.00 98.64 O +ATOM 583 CG2 THR A 39 -3.484 6.091 -17.338 1.00 98.64 C +ATOM 584 HG21 THR A 39 -3.513 6.928 -16.640 1.00 98.64 H +ATOM 585 HG22 THR A 39 -3.402 6.480 -18.353 1.00 98.64 H +ATOM 586 HG23 THR A 39 -4.403 5.509 -17.264 1.00 98.64 H +ATOM 587 OG1 THR A 39 -1.143 6.003 -17.318 1.00 98.64 O +ATOM 588 HG1 THR A 39 -0.462 5.491 -17.761 1.00 98.64 H +ATOM 589 N MET A 40 -3.774 2.879 -15.486 1.00 98.78 N +ATOM 590 H MET A 40 -3.127 2.409 -16.103 1.00 98.78 H +ATOM 591 CA MET A 40 -4.938 2.139 -14.992 1.00 98.78 C +ATOM 592 HA MET A 40 -5.838 2.701 -15.244 1.00 98.78 H +ATOM 593 C MET A 40 -4.887 2.007 -13.464 1.00 98.78 C +ATOM 594 CB MET A 40 -5.011 0.775 -15.697 1.00 98.78 C +ATOM 595 HB2 MET A 40 -4.071 0.241 -15.557 1.00 98.78 H +ATOM 596 HB3 MET A 40 -5.125 0.944 -16.768 1.00 98.78 H +ATOM 597 O MET A 40 -5.900 2.203 -12.789 1.00 98.78 O +ATOM 598 CG MET A 40 -6.194 -0.081 -15.216 1.00 98.78 C +ATOM 599 HG2 MET A 40 -6.897 -0.176 -16.044 1.00 98.78 H +ATOM 600 HG3 MET A 40 -6.727 0.433 -14.416 1.00 98.78 H +ATOM 601 SD MET A 40 -5.798 -1.754 -14.633 1.00 98.78 S +ATOM 602 CE MET A 40 -4.502 -1.413 -13.421 1.00 98.78 C +ATOM 603 HE1 MET A 40 -4.292 -2.339 -12.887 1.00 98.78 H +ATOM 604 HE2 MET A 40 -3.592 -1.069 -13.912 1.00 98.78 H +ATOM 605 HE3 MET A 40 -4.854 -0.663 -12.712 1.00 98.78 H +ATOM 606 N GLY A 41 -3.705 1.749 -12.900 1.00 98.68 N +ATOM 607 H GLY A 41 -2.909 1.598 -13.503 1.00 98.68 H +ATOM 608 CA GLY A 41 -3.489 1.710 -11.458 1.00 98.68 C +ATOM 609 HA2 GLY A 41 -2.425 1.549 -11.281 1.00 98.68 H +ATOM 610 HA3 GLY A 41 -4.051 0.881 -11.028 1.00 98.68 H +ATOM 611 C GLY A 41 -3.912 3.011 -10.770 1.00 98.68 C +ATOM 612 O GLY A 41 -4.631 2.959 -9.769 1.00 98.68 O +ATOM 613 N VAL A 42 -3.540 4.170 -11.324 1.00 98.73 N +ATOM 614 H VAL A 42 -2.942 4.132 -12.137 1.00 98.73 H +ATOM 615 CA VAL A 42 -3.983 5.493 -10.844 1.00 98.73 C +ATOM 616 HA VAL A 42 -3.656 5.621 -9.812 1.00 98.73 H +ATOM 617 C VAL A 42 -5.509 5.590 -10.858 1.00 98.73 C +ATOM 618 CB VAL A 42 -3.369 6.632 -11.688 1.00 98.73 C +ATOM 619 HB VAL A 42 -3.625 6.497 -12.739 1.00 98.73 H +ATOM 620 O VAL A 42 -6.118 5.875 -9.822 1.00 98.73 O +ATOM 621 CG1 VAL A 42 -3.862 8.018 -11.257 1.00 98.73 C +ATOM 622 HG11 VAL A 42 -3.608 8.192 -10.211 1.00 98.73 H +ATOM 623 HG12 VAL A 42 -3.378 8.781 -11.866 1.00 98.73 H +ATOM 624 HG13 VAL A 42 -4.938 8.111 -11.403 1.00 98.73 H +ATOM 625 CG2 VAL A 42 -1.849 6.653 -11.555 1.00 98.73 C +ATOM 626 HG21 VAL A 42 -1.573 6.827 -10.515 1.00 98.73 H +ATOM 627 HG22 VAL A 42 -1.414 5.713 -11.893 1.00 98.73 H +ATOM 628 HG23 VAL A 42 -1.442 7.446 -12.183 1.00 98.73 H +ATOM 629 N GLY A 43 -6.134 5.299 -12.003 1.00 98.33 N +ATOM 630 H GLY A 43 -5.568 5.054 -12.803 1.00 98.33 H +ATOM 631 CA GLY A 43 -7.586 5.387 -12.175 1.00 98.33 C +ATOM 632 HA2 GLY A 43 -7.840 5.036 -13.175 1.00 98.33 H +ATOM 633 HA3 GLY A 43 -7.899 6.426 -12.079 1.00 98.33 H +ATOM 634 C GLY A 43 -8.362 4.545 -11.159 1.00 98.33 C +ATOM 635 O GLY A 43 -9.302 5.039 -10.533 1.00 98.33 O +ATOM 636 N VAL A 44 -7.930 3.301 -10.921 1.00 98.71 N +ATOM 637 H VAL A 44 -7.152 2.959 -11.465 1.00 98.71 H +ATOM 638 CA VAL A 44 -8.570 2.402 -9.946 1.00 98.71 C +ATOM 639 HA VAL A 44 -9.632 2.339 -10.186 1.00 98.71 H +ATOM 640 C VAL A 44 -8.473 2.956 -8.517 1.00 98.71 C +ATOM 641 CB VAL A 44 -7.981 0.978 -10.040 1.00 98.71 C +ATOM 642 HB VAL A 44 -6.901 1.023 -9.899 1.00 98.71 H +ATOM 643 O VAL A 44 -9.467 2.939 -7.789 1.00 98.71 O +ATOM 644 CG1 VAL A 44 -8.578 0.042 -8.983 1.00 98.71 C +ATOM 645 HG11 VAL A 44 -8.135 -0.950 -9.071 1.00 98.71 H +ATOM 646 HG12 VAL A 44 -8.378 0.432 -7.985 1.00 98.71 H +ATOM 647 HG13 VAL A 44 -9.657 -0.033 -9.116 1.00 98.71 H +ATOM 648 CG2 VAL A 44 -8.287 0.324 -11.395 1.00 98.71 C +ATOM 649 HG21 VAL A 44 -9.361 0.180 -11.513 1.00 98.71 H +ATOM 650 HG22 VAL A 44 -7.783 -0.640 -11.466 1.00 98.71 H +ATOM 651 HG23 VAL A 44 -7.937 0.950 -12.216 1.00 98.71 H +ATOM 652 N HIS A 45 -7.312 3.479 -8.104 1.00 98.78 N +ATOM 653 H HIS A 45 -6.541 3.529 -8.755 1.00 98.78 H +ATOM 654 CA HIS A 45 -7.130 4.001 -6.744 1.00 98.78 C +ATOM 655 HA HIS A 45 -7.492 3.254 -6.037 1.00 98.78 H +ATOM 656 C HIS A 45 -7.953 5.272 -6.494 1.00 98.78 C +ATOM 657 CB HIS A 45 -5.642 4.240 -6.450 1.00 98.78 C +ATOM 658 HB2 HIS A 45 -5.186 4.786 -7.275 1.00 98.78 H +ATOM 659 HB3 HIS A 45 -5.559 4.859 -5.557 1.00 98.78 H +ATOM 660 O HIS A 45 -8.612 5.382 -5.458 1.00 98.78 O +ATOM 661 CG HIS A 45 -4.873 2.967 -6.202 1.00 98.78 C +ATOM 662 CD2 HIS A 45 -4.540 2.427 -4.991 1.00 98.78 C +ATOM 663 HD2 HIS A 45 -4.786 2.847 -4.027 1.00 98.78 H +ATOM 664 ND1 HIS A 45 -4.372 2.124 -7.160 1.00 98.78 N +ATOM 665 HD1 HIS A 45 -4.419 2.281 -8.156 1.00 98.78 H +ATOM 666 CE1 HIS A 45 -3.747 1.106 -6.550 1.00 98.78 C +ATOM 667 HE1 HIS A 45 -3.241 0.300 -7.060 1.00 98.78 H +ATOM 668 NE2 HIS A 45 -3.821 1.246 -5.215 1.00 98.78 N +ATOM 669 N PHE A 46 -7.981 6.215 -7.439 1.00 98.67 N +ATOM 670 H PHE A 46 -7.431 6.089 -8.277 1.00 98.67 H +ATOM 671 CA PHE A 46 -8.784 7.434 -7.290 1.00 98.67 C +ATOM 672 HA PHE A 46 -8.630 7.822 -6.283 1.00 98.67 H +ATOM 673 C PHE A 46 -10.293 7.174 -7.413 1.00 98.67 C +ATOM 674 CB PHE A 46 -8.302 8.512 -8.266 1.00 98.67 C +ATOM 675 HB2 PHE A 46 -9.096 9.247 -8.396 1.00 98.67 H +ATOM 676 HB3 PHE A 46 -8.111 8.067 -9.242 1.00 98.67 H +ATOM 677 O PHE A 46 -11.075 7.815 -6.712 1.00 98.67 O +ATOM 678 CG PHE A 46 -7.069 9.249 -7.775 1.00 98.67 C +ATOM 679 CD1 PHE A 46 -7.202 10.295 -6.842 1.00 98.67 C +ATOM 680 HD1 PHE A 46 -8.182 10.579 -6.489 1.00 98.67 H +ATOM 681 CD2 PHE A 46 -5.791 8.902 -8.247 1.00 98.67 C +ATOM 682 HD2 PHE A 46 -5.681 8.114 -8.977 1.00 98.67 H +ATOM 683 CE1 PHE A 46 -6.065 10.986 -6.384 1.00 98.67 C +ATOM 684 HE1 PHE A 46 -6.172 11.798 -5.680 1.00 98.67 H +ATOM 685 CE2 PHE A 46 -4.654 9.596 -7.796 1.00 98.67 C +ATOM 686 HE2 PHE A 46 -3.677 9.345 -8.182 1.00 98.67 H +ATOM 687 CZ PHE A 46 -4.790 10.636 -6.862 1.00 98.67 C +ATOM 688 HZ PHE A 46 -3.916 11.175 -6.527 1.00 98.67 H +ATOM 689 N ALA A 47 -10.727 6.194 -8.211 1.00 98.71 N +ATOM 690 H ALA A 47 -10.078 5.727 -8.828 1.00 98.71 H +ATOM 691 CA ALA A 47 -12.125 5.765 -8.211 1.00 98.71 C +ATOM 692 HA ALA A 47 -12.760 6.632 -8.394 1.00 98.71 H +ATOM 693 C ALA A 47 -12.531 5.170 -6.847 1.00 98.71 C +ATOM 694 CB ALA A 47 -12.333 4.767 -9.356 1.00 98.71 C +ATOM 695 HB1 ALA A 47 -11.694 3.895 -9.220 1.00 98.71 H +ATOM 696 HB2 ALA A 47 -12.087 5.241 -10.306 1.00 98.71 H +ATOM 697 HB3 ALA A 47 -13.375 4.448 -9.381 1.00 98.71 H +ATOM 698 O ALA A 47 -13.556 5.547 -6.270 1.00 98.71 O +ATOM 699 N ALA A 48 -11.695 4.291 -6.285 1.00 98.59 N +ATOM 700 H ALA A 48 -10.878 4.001 -6.803 1.00 98.59 H +ATOM 701 CA ALA A 48 -11.923 3.701 -4.968 1.00 98.59 C +ATOM 702 HA ALA A 48 -12.917 3.253 -4.959 1.00 98.59 H +ATOM 703 C ALA A 48 -11.878 4.740 -3.832 1.00 98.59 C +ATOM 704 CB ALA A 48 -10.897 2.584 -4.766 1.00 98.59 C +ATOM 705 HB1 ALA A 48 -9.889 2.997 -4.807 1.00 98.59 H +ATOM 706 HB2 ALA A 48 -11.059 2.105 -3.800 1.00 98.59 H +ATOM 707 HB3 ALA A 48 -11.005 1.843 -5.557 1.00 98.59 H +ATOM 708 O ALA A 48 -12.640 4.627 -2.871 1.00 98.59 O +ATOM 709 N LEU A 49 -11.053 5.789 -3.949 1.00 98.71 N +ATOM 710 H LEU A 49 -10.401 5.793 -4.720 1.00 98.71 H +ATOM 711 CA LEU A 49 -11.026 6.914 -3.006 1.00 98.71 C +ATOM 712 HA LEU A 49 -10.713 6.544 -2.030 1.00 98.71 H +ATOM 713 C LEU A 49 -12.414 7.543 -2.840 1.00 98.71 C +ATOM 714 CB LEU A 49 -10.011 7.965 -3.495 1.00 98.71 C +ATOM 715 HB2 LEU A 49 -10.244 8.221 -4.529 1.00 98.71 H +ATOM 716 HB3 LEU A 49 -9.011 7.531 -3.486 1.00 98.71 H +ATOM 717 O LEU A 49 -12.866 7.737 -1.710 1.00 98.71 O +ATOM 718 CG LEU A 49 -9.997 9.287 -2.709 1.00 98.71 C +ATOM 719 HG LEU A 49 -10.981 9.753 -2.746 1.00 98.71 H +ATOM 720 CD1 LEU A 49 -9.606 9.078 -1.250 1.00 98.71 C +ATOM 721 HD11 LEU A 49 -9.561 10.042 -0.744 1.00 98.71 H +ATOM 722 HD12 LEU A 49 -8.627 8.601 -1.200 1.00 98.71 H +ATOM 723 HD13 LEU A 49 -10.352 8.458 -0.753 1.00 98.71 H +ATOM 724 CD2 LEU A 49 -9.001 10.251 -3.350 1.00 98.71 C +ATOM 725 HD21 LEU A 49 -8.983 11.190 -2.798 1.00 98.71 H +ATOM 726 HD22 LEU A 49 -9.307 10.458 -4.376 1.00 98.71 H +ATOM 727 HD23 LEU A 49 -8.002 9.815 -3.356 1.00 98.71 H +ATOM 728 N ILE A 50 -13.100 7.830 -3.951 1.00 98.74 N +ATOM 729 H ILE A 50 -12.674 7.634 -4.845 1.00 98.74 H +ATOM 730 CA ILE A 50 -14.445 8.417 -3.916 1.00 98.74 C +ATOM 731 HA ILE A 50 -14.414 9.315 -3.299 1.00 98.74 H +ATOM 732 C ILE A 50 -15.427 7.463 -3.238 1.00 98.74 C +ATOM 733 CB ILE A 50 -14.914 8.815 -5.333 1.00 98.74 C +ATOM 734 HB ILE A 50 -14.931 7.921 -5.956 1.00 98.74 H +ATOM 735 O ILE A 50 -16.204 7.900 -2.389 1.00 98.74 O +ATOM 736 CG1 ILE A 50 -13.963 9.831 -6.007 1.00 98.74 C +ATOM 737 HG12 ILE A 50 -14.378 10.109 -6.976 1.00 98.74 H +ATOM 738 HG13 ILE A 50 -13.008 9.344 -6.204 1.00 98.74 H +ATOM 739 CG2 ILE A 50 -16.347 9.382 -5.301 1.00 98.74 C +ATOM 740 HG21 ILE A 50 -16.622 9.744 -6.291 1.00 98.74 H +ATOM 741 HG22 ILE A 50 -17.056 8.603 -5.022 1.00 98.74 H +ATOM 742 HG23 ILE A 50 -16.420 10.202 -4.587 1.00 98.74 H +ATOM 743 CD1 ILE A 50 -13.682 11.114 -5.211 1.00 98.74 C +ATOM 744 HD11 ILE A 50 -13.053 11.772 -5.811 1.00 98.74 H +ATOM 745 HD12 ILE A 50 -13.153 10.883 -4.287 1.00 98.74 H +ATOM 746 HD13 ILE A 50 -14.612 11.635 -4.984 1.00 98.74 H +ATOM 747 N PHE A 51 -15.351 6.162 -3.534 1.00 98.75 N +ATOM 748 H PHE A 51 -14.680 5.865 -4.228 1.00 98.75 H +ATOM 749 CA PHE A 51 -16.168 5.153 -2.861 1.00 98.75 C +ATOM 750 HA PHE A 51 -17.219 5.382 -3.040 1.00 98.75 H +ATOM 751 C PHE A 51 -15.961 5.163 -1.336 1.00 98.75 C +ATOM 752 CB PHE A 51 -15.886 3.768 -3.459 1.00 98.75 C +ATOM 753 HB2 PHE A 51 -16.189 3.766 -4.506 1.00 98.75 H +ATOM 754 HB3 PHE A 51 -14.816 3.562 -3.430 1.00 98.75 H +ATOM 755 O PHE A 51 -16.931 5.286 -0.584 1.00 98.75 O +ATOM 756 CG PHE A 51 -16.604 2.653 -2.729 1.00 98.75 C +ATOM 757 CD1 PHE A 51 -15.983 2.005 -1.643 1.00 98.75 C +ATOM 758 HD1 PHE A 51 -14.977 2.274 -1.356 1.00 98.75 H +ATOM 759 CD2 PHE A 51 -17.909 2.290 -3.105 1.00 98.75 C +ATOM 760 HD2 PHE A 51 -18.389 2.785 -3.937 1.00 98.75 H +ATOM 761 CE1 PHE A 51 -16.671 1.007 -0.930 1.00 98.75 C +ATOM 762 HE1 PHE A 51 -16.193 0.515 -0.096 1.00 98.75 H +ATOM 763 CE2 PHE A 51 -18.585 1.273 -2.410 1.00 98.75 C +ATOM 764 HE2 PHE A 51 -19.580 0.982 -2.715 1.00 98.75 H +ATOM 765 CZ PHE A 51 -17.966 0.631 -1.323 1.00 98.75 C +ATOM 766 HZ PHE A 51 -18.486 -0.153 -0.792 1.00 98.75 H +ATOM 767 N PHE A 52 -14.714 5.084 -0.858 1.00 98.73 N +ATOM 768 H PHE A 52 -13.949 4.997 -1.512 1.00 98.73 H +ATOM 769 CA PHE A 52 -14.425 5.082 0.580 1.00 98.73 C +ATOM 770 HA PHE A 52 -14.990 4.274 1.045 1.00 98.73 H +ATOM 771 C PHE A 52 -14.880 6.377 1.258 1.00 98.73 C +ATOM 772 CB PHE A 52 -12.928 4.848 0.822 1.00 98.73 C +ATOM 773 HB2 PHE A 52 -12.366 5.620 0.296 1.00 98.73 H +ATOM 774 HB3 PHE A 52 -12.726 4.955 1.888 1.00 98.73 H +ATOM 775 O PHE A 52 -15.445 6.331 2.355 1.00 98.73 O +ATOM 776 CG PHE A 52 -12.418 3.487 0.399 1.00 98.73 C +ATOM 777 CD1 PHE A 52 -13.050 2.321 0.865 1.00 98.73 C +ATOM 778 HD1 PHE A 52 -13.887 2.384 1.544 1.00 98.73 H +ATOM 779 CD2 PHE A 52 -11.306 3.382 -0.456 1.00 98.73 C +ATOM 780 HD2 PHE A 52 -10.816 4.274 -0.816 1.00 98.73 H +ATOM 781 CE1 PHE A 52 -12.604 1.061 0.440 1.00 98.73 C +ATOM 782 HE1 PHE A 52 -13.109 0.175 0.796 1.00 98.73 H +ATOM 783 CE2 PHE A 52 -10.855 2.119 -0.877 1.00 98.73 C +ATOM 784 HE2 PHE A 52 -10.016 2.041 -1.553 1.00 98.73 H +ATOM 785 CZ PHE A 52 -11.512 0.958 -0.441 1.00 98.73 C +ATOM 786 HZ PHE A 52 -11.177 -0.008 -0.789 1.00 98.73 H +ATOM 787 N LEU A 53 -14.706 7.520 0.590 1.00 98.61 N +ATOM 788 H LEU A 53 -14.221 7.488 -0.295 1.00 98.61 H +ATOM 789 CA LEU A 53 -15.153 8.818 1.084 1.00 98.61 C +ATOM 790 HA LEU A 53 -14.687 8.985 2.055 1.00 98.61 H +ATOM 791 C LEU A 53 -16.672 8.847 1.292 1.00 98.61 C +ATOM 792 CB LEU A 53 -14.675 9.912 0.112 1.00 98.61 C +ATOM 793 HB2 LEU A 53 -13.586 9.890 0.067 1.00 98.61 H +ATOM 794 HB3 LEU A 53 -15.050 9.684 -0.886 1.00 98.61 H +ATOM 795 O LEU A 53 -17.127 9.123 2.404 1.00 98.61 O +ATOM 796 CG LEU A 53 -15.134 11.333 0.483 1.00 98.61 C +ATOM 797 HG LEU A 53 -16.223 11.372 0.513 1.00 98.61 H +ATOM 798 CD1 LEU A 53 -14.587 11.777 1.842 1.00 98.61 C +ATOM 799 HD11 LEU A 53 -13.500 11.702 1.850 1.00 98.61 H +ATOM 800 HD12 LEU A 53 -14.875 12.811 2.030 1.00 98.61 H +ATOM 801 HD13 LEU A 53 -15.006 11.159 2.637 1.00 98.61 H +ATOM 802 CD2 LEU A 53 -14.660 12.319 -0.583 1.00 98.61 C +ATOM 803 HD21 LEU A 53 -15.011 13.322 -0.343 1.00 98.61 H +ATOM 804 HD22 LEU A 53 -13.572 12.322 -0.637 1.00 98.61 H +ATOM 805 HD23 LEU A 53 -15.064 12.033 -1.554 1.00 98.61 H +ATOM 806 N VAL A 54 -17.462 8.525 0.262 1.00 98.43 N +ATOM 807 H VAL A 54 -17.034 8.270 -0.616 1.00 98.43 H +ATOM 808 CA VAL A 54 -18.931 8.635 0.338 1.00 98.43 C +ATOM 809 HA VAL A 54 -19.165 9.601 0.787 1.00 98.43 H +ATOM 810 C VAL A 54 -19.557 7.581 1.248 1.00 98.43 C +ATOM 811 CB VAL A 54 -19.604 8.616 -1.049 1.00 98.43 C +ATOM 812 HB VAL A 54 -20.668 8.798 -0.898 1.00 98.43 H +ATOM 813 O VAL A 54 -20.602 7.832 1.848 1.00 98.43 O +ATOM 814 CG1 VAL A 54 -19.083 9.752 -1.936 1.00 98.43 C +ATOM 815 HG11 VAL A 54 -19.647 9.780 -2.869 1.00 98.43 H +ATOM 816 HG12 VAL A 54 -19.208 10.707 -1.426 1.00 98.43 H +ATOM 817 HG13 VAL A 54 -18.028 9.612 -2.173 1.00 98.43 H +ATOM 818 CG2 VAL A 54 -19.478 7.276 -1.781 1.00 98.43 C +ATOM 819 HG21 VAL A 54 -19.892 7.363 -2.785 1.00 98.43 H +ATOM 820 HG22 VAL A 54 -20.034 6.503 -1.250 1.00 98.43 H +ATOM 821 HG23 VAL A 54 -18.432 6.979 -1.859 1.00 98.43 H +ATOM 822 N VAL A 55 -18.924 6.413 1.393 1.00 98.35 N +ATOM 823 H VAL A 55 -18.108 6.243 0.822 1.00 98.35 H +ATOM 824 CA VAL A 55 -19.415 5.325 2.250 1.00 98.35 C +ATOM 825 HA VAL A 55 -20.504 5.330 2.209 1.00 98.35 H +ATOM 826 C VAL A 55 -19.044 5.528 3.727 1.00 98.35 C +ATOM 827 CB VAL A 55 -18.944 3.973 1.682 1.00 98.35 C +ATOM 828 HB VAL A 55 -17.866 3.997 1.529 1.00 98.35 H +ATOM 829 O VAL A 55 -19.733 5.013 4.609 1.00 98.35 O +ATOM 830 CG1 VAL A 55 -19.263 2.800 2.598 1.00 98.35 C +ATOM 831 HG11 VAL A 55 -20.327 2.787 2.838 1.00 98.35 H +ATOM 832 HG12 VAL A 55 -18.677 2.871 3.515 1.00 98.35 H +ATOM 833 HG13 VAL A 55 -18.992 1.873 2.094 1.00 98.35 H +ATOM 834 CG2 VAL A 55 -19.650 3.680 0.350 1.00 98.35 C +ATOM 835 HG21 VAL A 55 -19.398 4.441 -0.388 1.00 98.35 H +ATOM 836 HG22 VAL A 55 -19.309 2.722 -0.044 1.00 98.35 H +ATOM 837 HG23 VAL A 55 -20.731 3.650 0.485 1.00 98.35 H +ATOM 838 N SER A 56 -18.022 6.336 4.031 1.00 98.31 N +ATOM 839 H SER A 56 -17.478 6.715 3.269 1.00 98.31 H +ATOM 840 CA SER A 56 -17.539 6.570 5.403 1.00 98.31 C +ATOM 841 HA SER A 56 -17.176 5.621 5.796 1.00 98.31 H +ATOM 842 C SER A 56 -18.607 7.088 6.385 1.00 98.31 C +ATOM 843 CB SER A 56 -16.359 7.547 5.380 1.00 98.31 C +ATOM 844 HB2 SER A 56 -15.905 7.566 6.370 1.00 98.31 H +ATOM 845 HB3 SER A 56 -15.605 7.216 4.666 1.00 98.31 H +ATOM 846 O SER A 56 -18.537 6.801 7.585 1.00 98.31 O +ATOM 847 OG SER A 56 -16.786 8.856 5.057 1.00 98.31 O +ATOM 848 HG SER A 56 -16.878 8.942 4.105 1.00 98.31 H +ATOM 849 N GLN A 57 -19.629 7.797 5.892 1.00 98.33 N +ATOM 850 H GLN A 57 -19.603 8.027 4.909 1.00 98.33 H +ATOM 851 CA GLN A 57 -20.752 8.296 6.697 1.00 98.33 C +ATOM 852 HA GLN A 57 -20.340 8.840 7.547 1.00 98.33 H +ATOM 853 C GLN A 57 -21.637 7.174 7.271 1.00 98.33 C +ATOM 854 CB GLN A 57 -21.572 9.295 5.863 1.00 98.33 C +ATOM 855 HB2 GLN A 57 -20.895 10.040 5.445 1.00 98.33 H +ATOM 856 HB3 GLN A 57 -22.271 9.810 6.522 1.00 98.33 H +ATOM 857 O GLN A 57 -22.271 7.354 8.307 1.00 98.33 O +ATOM 858 CG GLN A 57 -22.366 8.640 4.723 1.00 98.33 C +ATOM 859 HG2 GLN A 57 -21.714 7.986 4.144 1.00 98.33 H +ATOM 860 HG3 GLN A 57 -23.170 8.035 5.141 1.00 98.33 H +ATOM 861 CD GLN A 57 -22.995 9.678 3.803 1.00 98.33 C +ATOM 862 NE2 GLN A 57 -22.647 9.697 2.536 1.00 98.33 N +ATOM 863 HE21 GLN A 57 -23.046 10.434 1.972 1.00 98.33 H +ATOM 864 HE22 GLN A 57 -21.949 9.051 2.196 1.00 98.33 H +ATOM 865 OE1 GLN A 57 -23.800 10.495 4.211 1.00 98.33 O +ATOM 866 N PHE A 58 -21.639 5.994 6.644 1.00 98.48 N +ATOM 867 H PHE A 58 -21.079 5.888 5.810 1.00 98.48 H +ATOM 868 CA PHE A 58 -22.396 4.821 7.096 1.00 98.48 C +ATOM 869 HA PHE A 58 -23.277 5.164 7.638 1.00 98.48 H +ATOM 870 C PHE A 58 -21.599 3.942 8.067 1.00 98.48 C +ATOM 871 CB PHE A 58 -22.885 4.027 5.878 1.00 98.48 C +ATOM 872 HB2 PHE A 58 -23.572 3.251 6.215 1.00 98.48 H +ATOM 873 HB3 PHE A 58 -22.029 3.531 5.420 1.00 98.48 H +ATOM 874 O PHE A 58 -22.104 2.935 8.548 1.00 98.48 O +ATOM 875 CG PHE A 58 -23.593 4.875 4.838 1.00 98.48 C +ATOM 876 CD1 PHE A 58 -24.746 5.606 5.179 1.00 98.48 C +ATOM 877 HD1 PHE A 58 -25.156 5.542 6.176 1.00 98.48 H +ATOM 878 CD2 PHE A 58 -23.071 4.968 3.535 1.00 98.48 C +ATOM 879 HD2 PHE A 58 -22.180 4.414 3.277 1.00 98.48 H +ATOM 880 CE1 PHE A 58 -25.371 6.427 4.225 1.00 98.48 C +ATOM 881 HE1 PHE A 58 -26.247 6.996 4.498 1.00 98.48 H +ATOM 882 CE2 PHE A 58 -23.676 5.812 2.588 1.00 98.48 C +ATOM 883 HE2 PHE A 58 -23.225 5.934 1.614 1.00 98.48 H +ATOM 884 CZ PHE A 58 -24.829 6.541 2.933 1.00 98.48 C +ATOM 885 HZ PHE A 58 -25.276 7.223 2.225 1.00 98.48 H +ATOM 886 N VAL A 59 -20.359 4.314 8.390 1.00 98.68 N +ATOM 887 H VAL A 59 -19.993 5.158 7.974 1.00 98.68 H +ATOM 888 CA VAL A 59 -19.512 3.597 9.348 1.00 98.68 C +ATOM 889 HA VAL A 59 -19.879 2.576 9.453 1.00 98.68 H +ATOM 890 C VAL A 59 -19.599 4.280 10.711 1.00 98.68 C +ATOM 891 CB VAL A 59 -18.064 3.514 8.833 1.00 98.68 C +ATOM 892 HB VAL A 59 -17.635 4.514 8.772 1.00 98.68 H +ATOM 893 O VAL A 59 -19.444 5.498 10.808 1.00 98.68 O +ATOM 894 CG1 VAL A 59 -17.213 2.669 9.779 1.00 98.68 C +ATOM 895 HG11 VAL A 59 -17.665 1.685 9.898 1.00 98.68 H +ATOM 896 HG12 VAL A 59 -17.145 3.158 10.752 1.00 98.68 H +ATOM 897 HG13 VAL A 59 -16.208 2.560 9.371 1.00 98.68 H +ATOM 898 CG2 VAL A 59 -17.991 2.857 7.450 1.00 98.68 C +ATOM 899 HG21 VAL A 59 -18.553 3.434 6.715 1.00 98.68 H +ATOM 900 HG22 VAL A 59 -18.394 1.846 7.500 1.00 98.68 H +ATOM 901 HG23 VAL A 59 -16.955 2.809 7.114 1.00 98.68 H +ATOM 902 N ALA A 60 -19.829 3.514 11.781 1.00 98.55 N +ATOM 903 H ALA A 60 -19.937 2.520 11.643 1.00 98.55 H +ATOM 904 CA ALA A 60 -19.913 4.029 13.147 1.00 98.55 C +ATOM 905 HA ALA A 60 -20.700 4.783 13.161 1.00 98.55 H +ATOM 906 C ALA A 60 -18.585 4.667 13.600 1.00 98.55 C +ATOM 907 CB ALA A 60 -20.315 2.889 14.093 1.00 98.55 C +ATOM 908 HB1 ALA A 60 -21.258 2.453 13.764 1.00 98.55 H +ATOM 909 HB2 ALA A 60 -19.547 2.116 14.094 1.00 98.55 H +ATOM 910 HB3 ALA A 60 -20.447 3.267 15.107 1.00 98.55 H +ATOM 911 O ALA A 60 -17.517 4.243 13.144 1.00 98.55 O +ATOM 912 N PRO A 61 -18.602 5.616 14.562 1.00 98.69 N +ATOM 913 CA PRO A 61 -17.390 6.293 15.037 1.00 98.69 C +ATOM 914 HA PRO A 61 -17.032 6.957 14.250 1.00 98.69 H +ATOM 915 C PRO A 61 -16.243 5.347 15.418 1.00 98.69 C +ATOM 916 CB PRO A 61 -17.841 7.130 16.239 1.00 98.69 C +ATOM 917 HB2 PRO A 61 -17.250 8.040 16.339 1.00 98.69 H +ATOM 918 HB3 PRO A 61 -17.786 6.541 17.154 1.00 98.69 H +ATOM 919 O PRO A 61 -15.094 5.620 15.087 1.00 98.69 O +ATOM 920 CG PRO A 61 -19.305 7.437 15.929 1.00 98.69 C +ATOM 921 HG2 PRO A 61 -19.878 7.631 16.835 1.00 98.69 H +ATOM 922 HG3 PRO A 61 -19.367 8.287 15.249 1.00 98.69 H +ATOM 923 CD PRO A 61 -19.782 6.173 15.218 1.00 98.69 C +ATOM 924 HD2 PRO A 61 -20.161 5.462 15.952 1.00 98.69 H +ATOM 925 HD3 PRO A 61 -20.565 6.425 14.503 1.00 98.69 H +ATOM 926 N LYS A 62 -16.565 4.197 16.029 1.00 98.50 N +ATOM 927 H LYS A 62 -17.541 4.047 16.243 1.00 98.50 H +ATOM 928 CA LYS A 62 -15.601 3.157 16.423 1.00 98.50 C +ATOM 929 HA LYS A 62 -14.906 3.580 17.149 1.00 98.50 H +ATOM 930 C LYS A 62 -14.738 2.642 15.261 1.00 98.50 C +ATOM 931 CB LYS A 62 -16.383 2.006 17.080 1.00 98.50 C +ATOM 932 HB2 LYS A 62 -17.085 1.598 16.353 1.00 98.50 H +ATOM 933 HB3 LYS A 62 -16.951 2.400 17.923 1.00 98.50 H +ATOM 934 O LYS A 62 -13.572 2.336 15.480 1.00 98.50 O +ATOM 935 CG LYS A 62 -15.476 0.872 17.585 1.00 98.50 C +ATOM 936 HG2 LYS A 62 -14.780 1.259 18.329 1.00 98.50 H +ATOM 937 HG3 LYS A 62 -14.911 0.459 16.750 1.00 98.50 H +ATOM 938 CD LYS A 62 -16.309 -0.258 18.196 1.00 98.50 C +ATOM 939 HD2 LYS A 62 -16.783 0.081 19.118 1.00 98.50 H +ATOM 940 HD3 LYS A 62 -17.084 -0.541 17.483 1.00 98.50 H +ATOM 941 CE LYS A 62 -15.410 -1.467 18.472 1.00 98.50 C +ATOM 942 HE2 LYS A 62 -14.773 -1.268 19.333 1.00 98.50 H +ATOM 943 HE3 LYS A 62 -14.765 -1.610 17.605 1.00 98.50 H +ATOM 944 NZ LYS A 62 -16.211 -2.699 18.656 1.00 98.50 N +ATOM 945 HZ1 LYS A 62 -15.616 -3.514 18.614 1.00 98.50 H +ATOM 946 HZ2 LYS A 62 -16.758 -2.851 17.821 1.00 98.50 H +ATOM 947 HZ3 LYS A 62 -16.822 -2.700 19.461 1.00 98.50 H +ATOM 948 N TYR A 63 -15.296 2.532 14.054 1.00 98.74 N +ATOM 949 H TYR A 63 -16.247 2.850 13.933 1.00 98.74 H +ATOM 950 CA TYR A 63 -14.620 1.921 12.901 1.00 98.74 C +ATOM 951 HA TYR A 63 -13.667 1.504 13.224 1.00 98.74 H +ATOM 952 C TYR A 63 -14.299 2.915 11.781 1.00 98.74 C +ATOM 953 CB TYR A 63 -15.458 0.760 12.353 1.00 98.74 C +ATOM 954 HB2 TYR A 63 -14.869 0.236 11.601 1.00 98.74 H +ATOM 955 HB3 TYR A 63 -16.337 1.171 11.857 1.00 98.74 H +ATOM 956 O TYR A 63 -13.597 2.557 10.840 1.00 98.74 O +ATOM 957 CG TYR A 63 -15.918 -0.255 13.375 1.00 98.74 C +ATOM 958 CD1 TYR A 63 -14.986 -1.078 14.036 1.00 98.74 C +ATOM 959 HD1 TYR A 63 -13.930 -0.983 13.831 1.00 98.74 H +ATOM 960 CD2 TYR A 63 -17.293 -0.397 13.636 1.00 98.74 C +ATOM 961 HD2 TYR A 63 -18.005 0.230 13.120 1.00 98.74 H +ATOM 962 CE1 TYR A 63 -15.436 -2.050 14.948 1.00 98.74 C +ATOM 963 HE1 TYR A 63 -14.724 -2.712 15.418 1.00 98.74 H +ATOM 964 CE2 TYR A 63 -17.749 -1.372 14.535 1.00 98.74 C +ATOM 965 HE2 TYR A 63 -18.808 -1.488 14.711 1.00 98.74 H +ATOM 966 OH TYR A 63 -17.291 -3.125 16.068 1.00 98.74 O +ATOM 967 HH TYR A 63 -18.210 -3.332 15.883 1.00 98.74 H +ATOM 968 CZ TYR A 63 -16.820 -2.205 15.188 1.00 98.74 C +ATOM 969 N ARG A 64 -14.782 4.163 11.856 1.00 98.66 N +ATOM 970 H ARG A 64 -15.383 4.387 12.636 1.00 98.66 H +ATOM 971 CA ARG A 64 -14.677 5.138 10.755 1.00 98.66 C +ATOM 972 HA ARG A 64 -15.164 4.713 9.878 1.00 98.66 H +ATOM 973 C ARG A 64 -13.236 5.426 10.333 1.00 98.66 C +ATOM 974 CB ARG A 64 -15.426 6.415 11.151 1.00 98.66 C +ATOM 975 HB2 ARG A 64 -14.881 6.940 11.935 1.00 98.66 H +ATOM 976 HB3 ARG A 64 -16.400 6.123 11.542 1.00 98.66 H +ATOM 977 O ARG A 64 -12.978 5.597 9.145 1.00 98.66 O +ATOM 978 CG ARG A 64 -15.628 7.345 9.941 1.00 98.66 C +ATOM 979 HG2 ARG A 64 -16.091 6.786 9.128 1.00 98.66 H +ATOM 980 HG3 ARG A 64 -14.663 7.719 9.597 1.00 98.66 H +ATOM 981 CD ARG A 64 -16.518 8.543 10.281 1.00 98.66 C +ATOM 982 HD2 ARG A 64 -16.020 9.150 11.037 1.00 98.66 H +ATOM 983 HD3 ARG A 64 -16.630 9.151 9.383 1.00 98.66 H +ATOM 984 NE ARG A 64 -17.856 8.103 10.724 1.00 98.66 N +ATOM 985 HE ARG A 64 -18.374 7.531 10.072 1.00 98.66 H +ATOM 986 NH1 ARG A 64 -17.881 9.054 12.817 1.00 98.66 N +ATOM 987 HH11 ARG A 64 -18.405 9.327 13.636 1.00 98.66 H +ATOM 988 HH12 ARG A 64 -16.984 9.472 12.617 1.00 98.66 H +ATOM 989 NH2 ARG A 64 -19.649 7.910 12.096 1.00 98.66 N +ATOM 990 HH21 ARG A 64 -20.219 8.235 12.863 1.00 98.66 H +ATOM 991 HH22 ARG A 64 -20.044 7.277 11.415 1.00 98.66 H +ATOM 992 CZ ARG A 64 -18.450 8.355 11.873 1.00 98.66 C +ATOM 993 N ILE A 65 -12.294 5.393 11.280 1.00 98.55 N +ATOM 994 H ILE A 65 -12.586 5.239 12.234 1.00 98.55 H +ATOM 995 CA ILE A 65 -10.860 5.542 10.988 1.00 98.55 C +ATOM 996 HA ILE A 65 -10.724 6.479 10.447 1.00 98.55 H +ATOM 997 C ILE A 65 -10.354 4.432 10.051 1.00 98.55 C +ATOM 998 CB ILE A 65 -10.031 5.643 12.293 1.00 98.55 C +ATOM 999 HB ILE A 65 -10.280 4.795 12.930 1.00 98.55 H +ATOM 1000 O ILE A 65 -9.510 4.712 9.211 1.00 98.55 O +ATOM 1001 CG1 ILE A 65 -10.400 6.948 13.039 1.00 98.55 C +ATOM 1002 HG12 ILE A 65 -11.468 6.942 13.259 1.00 98.55 H +ATOM 1003 HG13 ILE A 65 -10.196 7.803 12.395 1.00 98.55 H +ATOM 1004 CG2 ILE A 65 -8.516 5.604 12.009 1.00 98.55 C +ATOM 1005 HG21 ILE A 65 -8.231 4.677 11.511 1.00 98.55 H +ATOM 1006 HG22 ILE A 65 -7.945 5.643 12.937 1.00 98.55 H +ATOM 1007 HG23 ILE A 65 -8.228 6.444 11.377 1.00 98.55 H +ATOM 1008 CD1 ILE A 65 -9.664 7.158 14.370 1.00 98.55 C +ATOM 1009 HD11 ILE A 65 -9.759 6.269 14.993 1.00 98.55 H +ATOM 1010 HD12 ILE A 65 -10.105 8.006 14.893 1.00 98.55 H +ATOM 1011 HD13 ILE A 65 -8.610 7.376 14.196 1.00 98.55 H +ATOM 1012 N ALA A 66 -10.896 3.209 10.101 1.00 98.65 N +ATOM 1013 H ALA A 66 -11.668 3.027 10.726 1.00 98.65 H +ATOM 1014 CA ALA A 66 -10.499 2.145 9.174 1.00 98.65 C +ATOM 1015 HA ALA A 66 -9.421 2.008 9.247 1.00 98.65 H +ATOM 1016 C ALA A 66 -10.815 2.503 7.708 1.00 98.65 C +ATOM 1017 CB ALA A 66 -11.183 0.835 9.589 1.00 98.65 C +ATOM 1018 HB1 ALA A 66 -10.953 0.605 10.630 1.00 98.65 H +ATOM 1019 HB2 ALA A 66 -12.262 0.904 9.457 1.00 98.65 H +ATOM 1020 HB3 ALA A 66 -10.816 0.018 8.967 1.00 98.65 H +ATOM 1021 O ALA A 66 -10.002 2.262 6.821 1.00 98.65 O +ATOM 1022 N THR A 67 -11.968 3.134 7.454 1.00 98.61 N +ATOM 1023 H THR A 67 -12.567 3.365 8.234 1.00 98.61 H +ATOM 1024 CA THR A 67 -12.333 3.624 6.112 1.00 98.61 C +ATOM 1025 HA THR A 67 -12.060 2.872 5.371 1.00 98.61 H +ATOM 1026 C THR A 67 -11.563 4.895 5.740 1.00 98.61 C +ATOM 1027 CB THR A 67 -13.849 3.838 6.017 1.00 98.61 C +ATOM 1028 HB THR A 67 -14.162 4.575 6.756 1.00 98.61 H +ATOM 1029 O THR A 67 -11.129 5.027 4.600 1.00 98.61 O +ATOM 1030 CG2 THR A 67 -14.321 4.279 4.635 1.00 98.61 C +ATOM 1031 HG21 THR A 67 -13.931 3.609 3.869 1.00 98.61 H +ATOM 1032 HG22 THR A 67 -15.411 4.275 4.594 1.00 98.61 H +ATOM 1033 HG23 THR A 67 -13.970 5.290 4.425 1.00 98.61 H +ATOM 1034 OG1 THR A 67 -14.481 2.607 6.295 1.00 98.61 O +ATOM 1035 HG1 THR A 67 -13.814 2.033 6.680 1.00 98.61 H +ATOM 1036 N ALA A 68 -11.301 5.793 6.696 1.00 98.73 N +ATOM 1037 H ALA A 68 -11.692 5.661 7.618 1.00 98.73 H +ATOM 1038 CA ALA A 68 -10.458 6.969 6.456 1.00 98.73 C +ATOM 1039 HA ALA A 68 -10.879 7.531 5.622 1.00 98.73 H +ATOM 1040 C ALA A 68 -9.015 6.590 6.069 1.00 98.73 C +ATOM 1041 CB ALA A 68 -10.484 7.860 7.703 1.00 98.73 C +ATOM 1042 HB1 ALA A 68 -9.954 8.788 7.491 1.00 98.73 H +ATOM 1043 HB2 ALA A 68 -11.513 8.094 7.974 1.00 98.73 H +ATOM 1044 HB3 ALA A 68 -9.987 7.356 8.532 1.00 98.73 H +ATOM 1045 O ALA A 68 -8.438 7.194 5.168 1.00 98.73 O +ATOM 1046 N LEU A 69 -8.448 5.552 6.695 1.00 98.71 N +ATOM 1047 H LEU A 69 -8.944 5.123 7.462 1.00 98.71 H +ATOM 1048 CA LEU A 69 -7.140 5.001 6.328 1.00 98.71 C +ATOM 1049 HA LEU A 69 -6.402 5.803 6.338 1.00 98.71 H +ATOM 1050 C LEU A 69 -7.135 4.436 4.903 1.00 98.71 C +ATOM 1051 CB LEU A 69 -6.728 3.922 7.342 1.00 98.71 C +ATOM 1052 HB2 LEU A 69 -5.909 3.334 6.927 1.00 98.71 H +ATOM 1053 HB3 LEU A 69 -7.573 3.249 7.485 1.00 98.71 H +ATOM 1054 O LEU A 69 -6.146 4.614 4.202 1.00 98.71 O +ATOM 1055 CG LEU A 69 -6.282 4.482 8.705 1.00 98.71 C +ATOM 1056 HG LEU A 69 -6.999 5.223 9.057 1.00 98.71 H +ATOM 1057 CD1 LEU A 69 -6.218 3.346 9.724 1.00 98.71 C +ATOM 1058 HD11 LEU A 69 -7.200 2.880 9.810 1.00 98.71 H +ATOM 1059 HD12 LEU A 69 -5.933 3.746 10.697 1.00 98.71 H +ATOM 1060 HD13 LEU A 69 -5.491 2.600 9.400 1.00 98.71 H +ATOM 1061 CD2 LEU A 69 -4.903 5.141 8.644 1.00 98.71 C +ATOM 1062 HD21 LEU A 69 -4.905 5.973 7.940 1.00 98.71 H +ATOM 1063 HD22 LEU A 69 -4.632 5.525 9.628 1.00 98.71 H +ATOM 1064 HD23 LEU A 69 -4.154 4.415 8.326 1.00 98.71 H +ATOM 1065 N SER A 70 -8.243 3.849 4.435 1.00 98.73 N +ATOM 1066 H SER A 70 -9.043 3.755 5.044 1.00 98.73 H +ATOM 1067 CA SER A 70 -8.356 3.435 3.029 1.00 98.73 C +ATOM 1068 HA SER A 70 -7.494 2.812 2.789 1.00 98.73 H +ATOM 1069 C SER A 70 -8.302 4.640 2.084 1.00 98.73 C +ATOM 1070 CB SER A 70 -9.606 2.584 2.789 1.00 98.73 C +ATOM 1071 HB2 SER A 70 -9.672 2.323 1.733 1.00 98.73 H +ATOM 1072 HB3 SER A 70 -10.503 3.134 3.074 1.00 98.73 H +ATOM 1073 O SER A 70 -7.559 4.588 1.110 1.00 98.73 O +ATOM 1074 OG SER A 70 -9.503 1.394 3.552 1.00 98.73 O +ATOM 1075 HG SER A 70 -9.103 1.619 4.395 1.00 98.73 H +ATOM 1076 N CYS A 71 -8.964 5.763 2.398 1.00 98.75 N +ATOM 1077 H CYS A 71 -9.588 5.763 3.192 1.00 98.75 H +ATOM 1078 CA CYS A 71 -8.813 7.004 1.622 1.00 98.75 C +ATOM 1079 HA CYS A 71 -9.123 6.812 0.595 1.00 98.75 H +ATOM 1080 C CYS A 71 -7.351 7.489 1.572 1.00 98.75 C +ATOM 1081 CB CYS A 71 -9.696 8.121 2.201 1.00 98.75 C +ATOM 1082 HB2 CYS A 71 -9.546 9.022 1.606 1.00 98.75 H +ATOM 1083 HB3 CYS A 71 -9.399 8.342 3.227 1.00 98.75 H +ATOM 1084 O CYS A 71 -6.852 7.832 0.501 1.00 98.75 O +ATOM 1085 SG CYS A 71 -11.454 7.682 2.158 1.00 98.75 S +ATOM 1086 HG CYS A 71 -11.937 8.904 2.401 1.00 98.75 H +ATOM 1087 N ILE A 72 -6.654 7.482 2.714 1.00 98.73 N +ATOM 1088 H ILE A 72 -7.131 7.195 3.557 1.00 98.73 H +ATOM 1089 CA ILE A 72 -5.238 7.882 2.812 1.00 98.73 C +ATOM 1090 HA ILE A 72 -5.132 8.895 2.423 1.00 98.73 H +ATOM 1091 C ILE A 72 -4.353 6.975 1.947 1.00 98.73 C +ATOM 1092 CB ILE A 72 -4.781 7.889 4.291 1.00 98.73 C +ATOM 1093 HB ILE A 72 -5.040 6.930 4.739 1.00 98.73 H +ATOM 1094 O ILE A 72 -3.505 7.463 1.201 1.00 98.73 O +ATOM 1095 CG1 ILE A 72 -5.506 9.013 5.068 1.00 98.73 C +ATOM 1096 HG12 ILE A 72 -6.565 9.018 4.810 1.00 98.73 H +ATOM 1097 HG13 ILE A 72 -5.096 9.978 4.771 1.00 98.73 H +ATOM 1098 CG2 ILE A 72 -3.254 8.071 4.409 1.00 98.73 C +ATOM 1099 HG21 ILE A 72 -2.729 7.227 3.960 1.00 98.73 H +ATOM 1100 HG22 ILE A 72 -2.948 8.113 5.454 1.00 98.73 H +ATOM 1101 HG23 ILE A 72 -2.944 8.988 3.909 1.00 98.73 H +ATOM 1102 CD1 ILE A 72 -5.416 8.879 6.593 1.00 98.73 C +ATOM 1103 HD11 ILE A 72 -5.842 7.927 6.909 1.00 98.73 H +ATOM 1104 HD12 ILE A 72 -5.986 9.685 7.056 1.00 98.73 H +ATOM 1105 HD13 ILE A 72 -4.382 8.950 6.931 1.00 98.73 H +ATOM 1106 N VAL A 73 -4.572 5.659 1.999 1.00 98.77 N +ATOM 1107 H VAL A 73 -5.268 5.310 2.643 1.00 98.77 H +ATOM 1108 CA VAL A 73 -3.837 4.698 1.167 1.00 98.77 C +ATOM 1109 HA VAL A 73 -2.769 4.871 1.301 1.00 98.77 H +ATOM 1110 C VAL A 73 -4.131 4.915 -0.317 1.00 98.77 C +ATOM 1111 CB VAL A 73 -4.141 3.248 1.592 1.00 98.77 C +ATOM 1112 HB VAL A 73 -5.220 3.094 1.614 1.00 98.77 H +ATOM 1113 O VAL A 73 -3.198 4.855 -1.114 1.00 98.77 O +ATOM 1114 CG1 VAL A 73 -3.517 2.218 0.641 1.00 98.77 C +ATOM 1115 HG11 VAL A 73 -3.714 1.211 1.010 1.00 98.77 H +ATOM 1116 HG12 VAL A 73 -2.441 2.375 0.569 1.00 98.77 H +ATOM 1117 HG13 VAL A 73 -3.955 2.303 -0.354 1.00 98.77 H +ATOM 1118 CG2 VAL A 73 -3.562 2.951 2.982 1.00 98.77 C +ATOM 1119 HG21 VAL A 73 -3.900 3.694 3.705 1.00 98.77 H +ATOM 1120 HG22 VAL A 73 -3.893 1.968 3.317 1.00 98.77 H +ATOM 1121 HG23 VAL A 73 -2.472 2.974 2.948 1.00 98.77 H +ATOM 1122 N MET A 74 -5.382 5.197 -0.700 1.00 98.83 N +ATOM 1123 H MET A 74 -6.112 5.218 -0.003 1.00 98.83 H +ATOM 1124 CA MET A 74 -5.746 5.431 -2.103 1.00 98.83 C +ATOM 1125 HA MET A 74 -5.434 4.571 -2.695 1.00 98.83 H +ATOM 1126 C MET A 74 -5.022 6.641 -2.694 1.00 98.83 C +ATOM 1127 CB MET A 74 -7.259 5.620 -2.278 1.00 98.83 C +ATOM 1128 HB2 MET A 74 -7.419 5.974 -3.296 1.00 98.83 H +ATOM 1129 HB3 MET A 74 -7.616 6.392 -1.596 1.00 98.83 H +ATOM 1130 O MET A 74 -4.444 6.522 -3.771 1.00 98.83 O +ATOM 1131 CG MET A 74 -8.120 4.367 -2.101 1.00 98.83 C +ATOM 1132 HG2 MET A 74 -9.135 4.630 -2.400 1.00 98.83 H +ATOM 1133 HG3 MET A 74 -8.161 4.076 -1.051 1.00 98.83 H +ATOM 1134 SD MET A 74 -7.631 2.923 -3.069 1.00 98.83 S +ATOM 1135 CE MET A 74 -6.765 1.965 -1.810 1.00 98.83 C +ATOM 1136 HE1 MET A 74 -7.452 1.699 -1.007 1.00 98.83 H +ATOM 1137 HE2 MET A 74 -6.392 1.057 -2.283 1.00 98.83 H +ATOM 1138 HE3 MET A 74 -5.934 2.545 -1.409 1.00 98.83 H +ATOM 1139 N VAL A 75 -4.998 7.781 -1.992 1.00 98.51 N +ATOM 1140 H VAL A 75 -5.488 7.826 -1.111 1.00 98.51 H +ATOM 1141 CA VAL A 75 -4.282 8.968 -2.489 1.00 98.51 C +ATOM 1142 HA VAL A 75 -4.566 9.108 -3.532 1.00 98.51 H +ATOM 1143 C VAL A 75 -2.768 8.752 -2.491 1.00 98.51 C +ATOM 1144 CB VAL A 75 -4.701 10.250 -1.743 1.00 98.51 C +ATOM 1145 HB VAL A 75 -5.786 10.332 -1.818 1.00 98.51 H +ATOM 1146 O VAL A 75 -2.108 9.090 -3.466 1.00 98.51 O +ATOM 1147 CG1 VAL A 75 -4.339 10.267 -0.254 1.00 98.51 C +ATOM 1148 HG11 VAL A 75 -3.259 10.227 -0.112 1.00 98.51 H +ATOM 1149 HG12 VAL A 75 -4.812 9.419 0.242 1.00 98.51 H +ATOM 1150 HG13 VAL A 75 -4.717 11.182 0.201 1.00 98.51 H +ATOM 1151 CG2 VAL A 75 -4.104 11.496 -2.401 1.00 98.51 C +ATOM 1152 HG21 VAL A 75 -4.521 12.393 -1.943 1.00 98.51 H +ATOM 1153 HG22 VAL A 75 -3.020 11.509 -2.281 1.00 98.51 H +ATOM 1154 HG23 VAL A 75 -4.343 11.504 -3.464 1.00 98.51 H +ATOM 1155 N SER A 76 -2.210 8.125 -1.454 1.00 98.62 N +ATOM 1156 H SER A 76 -2.799 7.858 -0.678 1.00 98.62 H +ATOM 1157 CA SER A 76 -0.772 7.843 -1.375 1.00 98.62 C +ATOM 1158 HA SER A 76 -0.222 8.776 -1.498 1.00 98.62 H +ATOM 1159 C SER A 76 -0.304 6.895 -2.488 1.00 98.62 C +ATOM 1160 CB SER A 76 -0.468 7.291 0.019 1.00 98.62 C +ATOM 1161 HB2 SER A 76 -0.480 8.108 0.740 1.00 98.62 H +ATOM 1162 HB3 SER A 76 -1.246 6.578 0.293 1.00 98.62 H +ATOM 1163 O SER A 76 0.675 7.184 -3.173 1.00 98.62 O +ATOM 1164 OG SER A 76 0.763 6.613 0.085 1.00 98.62 O +ATOM 1165 HG SER A 76 1.496 7.144 -0.235 1.00 98.62 H +ATOM 1166 N ALA A 77 -1.011 5.785 -2.713 1.00 98.43 N +ATOM 1167 H ALA A 77 -1.824 5.598 -2.144 1.00 98.43 H +ATOM 1168 CA ALA A 77 -0.680 4.844 -3.779 1.00 98.43 C +ATOM 1169 HA ALA A 77 0.387 4.623 -3.734 1.00 98.43 H +ATOM 1170 C ALA A 77 -0.955 5.429 -5.171 1.00 98.43 C +ATOM 1171 CB ALA A 77 -1.451 3.545 -3.541 1.00 98.43 C +ATOM 1172 HB1 ALA A 77 -1.177 3.139 -2.567 1.00 98.43 H +ATOM 1173 HB2 ALA A 77 -2.523 3.743 -3.562 1.00 98.43 H +ATOM 1174 HB3 ALA A 77 -1.208 2.824 -4.321 1.00 98.43 H +ATOM 1175 O ALA A 77 -0.116 5.290 -6.055 1.00 98.43 O +ATOM 1176 N GLY A 78 -2.080 6.129 -5.353 1.00 98.58 N +ATOM 1177 H GLY A 78 -2.740 6.212 -4.593 1.00 98.58 H +ATOM 1178 CA GLY A 78 -2.415 6.794 -6.612 1.00 98.58 C +ATOM 1179 HA2 GLY A 78 -2.489 6.053 -7.408 1.00 98.58 H +ATOM 1180 HA3 GLY A 78 -3.380 7.288 -6.502 1.00 98.58 H +ATOM 1181 C GLY A 78 -1.380 7.845 -7.017 1.00 98.58 C +ATOM 1182 O GLY A 78 -0.984 7.884 -8.176 1.00 98.58 O +ATOM 1183 N LEU A 79 -0.879 8.646 -6.069 1.00 98.70 N +ATOM 1184 H LEU A 79 -1.256 8.591 -5.133 1.00 98.70 H +ATOM 1185 CA LEU A 79 0.170 9.636 -6.337 1.00 98.70 C +ATOM 1186 HA LEU A 79 -0.133 10.245 -7.189 1.00 98.70 H +ATOM 1187 C LEU A 79 1.500 8.992 -6.738 1.00 98.70 C +ATOM 1188 CB LEU A 79 0.371 10.540 -5.108 1.00 98.70 C +ATOM 1189 HB2 LEU A 79 0.441 9.912 -4.220 1.00 98.70 H +ATOM 1190 HB3 LEU A 79 1.323 11.061 -5.214 1.00 98.70 H +ATOM 1191 O LEU A 79 2.146 9.477 -7.662 1.00 98.70 O +ATOM 1192 CG LEU A 79 -0.726 11.599 -4.904 1.00 98.70 C +ATOM 1193 HG LEU A 79 -1.708 11.127 -4.879 1.00 98.70 H +ATOM 1194 CD1 LEU A 79 -0.487 12.314 -3.573 1.00 98.70 C +ATOM 1195 HD11 LEU A 79 0.483 12.811 -3.586 1.00 98.70 H +ATOM 1196 HD12 LEU A 79 -0.511 11.587 -2.761 1.00 98.70 H +ATOM 1197 HD13 LEU A 79 -1.269 13.056 -3.409 1.00 98.70 H +ATOM 1198 CD2 LEU A 79 -0.736 12.652 -6.014 1.00 98.70 C +ATOM 1199 HD21 LEU A 79 -1.465 13.428 -5.782 1.00 98.70 H +ATOM 1200 HD22 LEU A 79 0.250 13.106 -6.111 1.00 98.70 H +ATOM 1201 HD23 LEU A 79 -1.017 12.200 -6.966 1.00 98.70 H +ATOM 1202 N ILE A 80 1.900 7.891 -6.096 1.00 98.48 N +ATOM 1203 H ILE A 80 1.345 7.546 -5.326 1.00 98.48 H +ATOM 1204 CA ILE A 80 3.124 7.177 -6.484 1.00 98.48 C +ATOM 1205 HA ILE A 80 3.922 7.908 -6.620 1.00 98.48 H +ATOM 1206 C ILE A 80 2.966 6.493 -7.834 1.00 98.48 C +ATOM 1207 CB ILE A 80 3.553 6.191 -5.389 1.00 98.48 C +ATOM 1208 HB ILE A 80 2.673 5.627 -5.078 1.00 98.48 H +ATOM 1209 O ILE A 80 3.879 6.578 -8.642 1.00 98.48 O +ATOM 1210 CG1 ILE A 80 4.063 6.975 -4.169 1.00 98.48 C +ATOM 1211 HG12 ILE A 80 4.162 6.240 -3.371 1.00 98.48 H +ATOM 1212 HG13 ILE A 80 3.311 7.696 -3.848 1.00 98.48 H +ATOM 1213 CG2 ILE A 80 4.608 5.165 -5.853 1.00 98.48 C +ATOM 1214 HG21 ILE A 80 4.167 4.466 -6.564 1.00 98.48 H +ATOM 1215 HG22 ILE A 80 4.985 4.601 -4.999 1.00 98.48 H +ATOM 1216 HG23 ILE A 80 5.441 5.673 -6.340 1.00 98.48 H +ATOM 1217 CD1 ILE A 80 5.411 7.699 -4.309 1.00 98.48 C +ATOM 1218 HD11 ILE A 80 5.652 8.185 -3.364 1.00 98.48 H +ATOM 1219 HD12 ILE A 80 5.360 8.462 -5.086 1.00 98.48 H +ATOM 1220 HD13 ILE A 80 6.205 6.990 -4.543 1.00 98.48 H +ATOM 1221 N LEU A 81 1.825 5.863 -8.123 1.00 98.57 N +ATOM 1222 H LEU A 81 1.097 5.824 -7.425 1.00 98.57 H +ATOM 1223 CA LEU A 81 1.571 5.278 -9.443 1.00 98.57 C +ATOM 1224 HA LEU A 81 2.374 4.582 -9.685 1.00 98.57 H +ATOM 1225 C LEU A 81 1.596 6.346 -10.543 1.00 98.57 C +ATOM 1226 CB LEU A 81 0.231 4.525 -9.424 1.00 98.57 C +ATOM 1227 HB2 LEU A 81 -0.535 5.188 -9.021 1.00 98.57 H +ATOM 1228 HB3 LEU A 81 -0.049 4.278 -10.448 1.00 98.57 H +ATOM 1229 O LEU A 81 2.208 6.125 -11.582 1.00 98.57 O +ATOM 1230 CG LEU A 81 0.261 3.225 -8.602 1.00 98.57 C +ATOM 1231 HG LEU A 81 0.681 3.413 -7.614 1.00 98.57 H +ATOM 1232 CD1 LEU A 81 -1.159 2.691 -8.426 1.00 98.57 C +ATOM 1233 HD11 LEU A 81 -1.774 3.442 -7.930 1.00 98.57 H +ATOM 1234 HD12 LEU A 81 -1.134 1.790 -7.813 1.00 98.57 H +ATOM 1235 HD13 LEU A 81 -1.580 2.457 -9.403 1.00 98.57 H +ATOM 1236 CD2 LEU A 81 1.096 2.136 -9.278 1.00 98.57 C +ATOM 1237 HD21 LEU A 81 2.139 2.448 -9.323 1.00 98.57 H +ATOM 1238 HD22 LEU A 81 1.013 1.211 -8.706 1.00 98.57 H +ATOM 1239 HD23 LEU A 81 0.728 1.965 -10.289 1.00 98.57 H +ATOM 1240 N ASN A 82 1.023 7.524 -10.281 1.00 98.61 N +ATOM 1241 H ASN A 82 0.497 7.628 -9.424 1.00 98.61 H +ATOM 1242 CA ASN A 82 1.076 8.662 -11.196 1.00 98.61 C +ATOM 1243 HA ASN A 82 0.714 8.353 -12.177 1.00 98.61 H +ATOM 1244 C ASN A 82 2.513 9.160 -11.387 1.00 98.61 C +ATOM 1245 CB ASN A 82 0.160 9.766 -10.649 1.00 98.61 C +ATOM 1246 HB2 ASN A 82 -0.851 9.374 -10.535 1.00 98.61 H +ATOM 1247 HB3 ASN A 82 0.512 10.104 -9.674 1.00 98.61 H +ATOM 1248 O ASN A 82 2.942 9.402 -12.508 1.00 98.61 O +ATOM 1249 CG ASN A 82 0.089 10.949 -11.592 1.00 98.61 C +ATOM 1250 ND2 ASN A 82 0.920 11.951 -11.419 1.00 98.61 N +ATOM 1251 HD21 ASN A 82 0.908 12.637 -12.160 1.00 98.61 H +ATOM 1252 HD22 ASN A 82 1.685 11.884 -10.763 1.00 98.61 H +ATOM 1253 OD1 ASN A 82 -0.725 10.989 -12.491 1.00 98.61 O +ATOM 1254 N SER A 83 3.274 9.279 -10.296 1.00 98.29 N +ATOM 1255 H SER A 83 2.863 9.092 -9.393 1.00 98.29 H +ATOM 1256 CA SER A 83 4.687 9.653 -10.361 1.00 98.29 C +ATOM 1257 HA SER A 83 4.772 10.616 -10.864 1.00 98.29 H +ATOM 1258 C SER A 83 5.504 8.635 -11.155 1.00 98.29 C +ATOM 1259 CB SER A 83 5.264 9.786 -8.951 1.00 98.29 C +ATOM 1260 HB2 SER A 83 5.374 8.799 -8.501 1.00 98.29 H +ATOM 1261 HB3 SER A 83 4.585 10.377 -8.336 1.00 98.29 H +ATOM 1262 O SER A 83 6.335 9.040 -11.956 1.00 98.29 O +ATOM 1263 OG SER A 83 6.518 10.435 -8.978 1.00 98.29 O +ATOM 1264 HG SER A 83 7.018 10.168 -9.752 1.00 98.29 H +ATOM 1265 N GLN A 84 5.274 7.331 -10.959 1.00 98.34 N +ATOM 1266 H GLN A 84 4.586 7.059 -10.270 1.00 98.34 H +ATOM 1267 CA GLN A 84 5.944 6.276 -11.723 1.00 98.34 C +ATOM 1268 HA GLN A 84 7.023 6.411 -11.647 1.00 98.34 H +ATOM 1269 C GLN A 84 5.593 6.359 -13.212 1.00 98.34 C +ATOM 1270 CB GLN A 84 5.580 4.876 -11.196 1.00 98.34 C +ATOM 1271 HB2 GLN A 84 4.494 4.792 -11.150 1.00 98.34 H +ATOM 1272 HB3 GLN A 84 5.930 4.133 -11.912 1.00 98.34 H +ATOM 1273 O GLN A 84 6.490 6.179 -14.021 1.00 98.34 O +ATOM 1274 CG GLN A 84 6.149 4.500 -9.820 1.00 98.34 C +ATOM 1275 HG2 GLN A 84 5.756 3.520 -9.547 1.00 98.34 H +ATOM 1276 HG3 GLN A 84 5.808 5.215 -9.072 1.00 98.34 H +ATOM 1277 CD GLN A 84 7.667 4.442 -9.736 1.00 98.34 C +ATOM 1278 NE2 GLN A 84 8.331 3.471 -10.313 1.00 98.34 N +ATOM 1279 HE21 GLN A 84 7.938 2.934 -11.073 1.00 98.34 H +ATOM 1280 HE22 GLN A 84 9.331 3.542 -10.194 1.00 98.34 H +ATOM 1281 OE1 GLN A 84 8.282 5.238 -9.058 1.00 98.34 O +ATOM 1282 N ALA A 85 4.335 6.638 -13.575 1.00 98.44 N +ATOM 1283 H ALA A 85 3.624 6.743 -12.866 1.00 98.44 H +ATOM 1284 CA ALA A 85 3.931 6.793 -14.975 1.00 98.44 C +ATOM 1285 HA ALA A 85 4.190 5.890 -15.529 1.00 98.44 H +ATOM 1286 C ALA A 85 4.674 7.958 -15.648 1.00 98.44 C +ATOM 1287 CB ALA A 85 2.409 6.973 -15.046 1.00 98.44 C +ATOM 1288 HB1 ALA A 85 1.902 6.143 -14.553 1.00 98.44 H +ATOM 1289 HB2 ALA A 85 2.112 7.909 -14.573 1.00 98.44 H +ATOM 1290 HB3 ALA A 85 2.102 6.995 -16.091 1.00 98.44 H +ATOM 1291 O ALA A 85 5.302 7.770 -16.682 1.00 98.44 O +ATOM 1292 N VAL A 86 4.707 9.130 -15.004 1.00 98.38 N +ATOM 1293 H VAL A 86 4.165 9.228 -14.157 1.00 98.38 H +ATOM 1294 CA VAL A 86 5.430 10.303 -15.529 1.00 98.38 C +ATOM 1295 HA VAL A 86 5.095 10.489 -16.549 1.00 98.38 H +ATOM 1296 C VAL A 86 6.937 10.044 -15.609 1.00 98.38 C +ATOM 1297 CB VAL A 86 5.127 11.557 -14.690 1.00 98.38 C +ATOM 1298 HB VAL A 86 5.365 11.355 -13.645 1.00 98.38 H +ATOM 1299 O VAL A 86 7.550 10.312 -16.634 1.00 98.38 O +ATOM 1300 CG1 VAL A 86 5.935 12.777 -15.144 1.00 98.38 C +ATOM 1301 HG11 VAL A 86 5.795 12.948 -16.211 1.00 98.38 H +ATOM 1302 HG12 VAL A 86 5.632 13.667 -14.593 1.00 98.38 H +ATOM 1303 HG13 VAL A 86 6.999 12.620 -14.967 1.00 98.38 H +ATOM 1304 CG2 VAL A 86 3.641 11.934 -14.785 1.00 98.38 C +ATOM 1305 HG21 VAL A 86 3.389 12.158 -15.822 1.00 98.38 H +ATOM 1306 HG22 VAL A 86 3.441 12.810 -14.168 1.00 98.38 H +ATOM 1307 HG23 VAL A 86 3.012 11.111 -14.444 1.00 98.38 H +ATOM 1308 N MET A 87 7.540 9.456 -14.571 1.00 97.52 N +ATOM 1309 H MET A 87 6.994 9.247 -13.746 1.00 97.52 H +ATOM 1310 CA MET A 87 8.962 9.086 -14.594 1.00 97.52 C +ATOM 1311 HA MET A 87 9.558 9.970 -14.819 1.00 97.52 H +ATOM 1312 C MET A 87 9.280 8.057 -15.683 1.00 97.52 C +ATOM 1313 CB MET A 87 9.381 8.531 -13.227 1.00 97.52 C +ATOM 1314 HB2 MET A 87 10.321 7.989 -13.331 1.00 97.52 H +ATOM 1315 HB3 MET A 87 8.629 7.827 -12.872 1.00 97.52 H +ATOM 1316 O MET A 87 10.352 8.108 -16.274 1.00 97.52 O +ATOM 1317 CG MET A 87 9.584 9.657 -12.210 1.00 97.52 C +ATOM 1318 HG2 MET A 87 8.638 10.175 -12.055 1.00 97.52 H +ATOM 1319 HG3 MET A 87 10.287 10.373 -12.636 1.00 97.52 H +ATOM 1320 SD MET A 87 10.242 9.139 -10.600 1.00 97.52 S +ATOM 1321 CE MET A 87 8.952 8.000 -10.057 1.00 97.52 C +ATOM 1322 HE1 MET A 87 9.107 7.739 -9.010 1.00 97.52 H +ATOM 1323 HE2 MET A 87 7.976 8.476 -10.154 1.00 97.52 H +ATOM 1324 HE3 MET A 87 8.987 7.098 -10.667 1.00 97.52 H +ATOM 1325 N TRP A 88 8.360 7.130 -15.963 1.00 98.29 N +ATOM 1326 H TRP A 88 7.486 7.139 -15.457 1.00 98.29 H +ATOM 1327 CA TRP A 88 8.505 6.161 -17.047 1.00 98.29 C +ATOM 1328 HA TRP A 88 9.464 5.651 -16.949 1.00 98.29 H +ATOM 1329 C TRP A 88 8.519 6.861 -18.406 1.00 98.29 C +ATOM 1330 CB TRP A 88 7.383 5.120 -16.960 1.00 98.29 C +ATOM 1331 HB2 TRP A 88 7.446 4.611 -15.998 1.00 98.29 H +ATOM 1332 HB3 TRP A 88 6.413 5.616 -17.008 1.00 98.29 H +ATOM 1333 O TRP A 88 9.396 6.589 -19.219 1.00 98.29 O +ATOM 1334 CG TRP A 88 7.422 4.083 -18.027 1.00 98.29 C +ATOM 1335 CD1 TRP A 88 6.526 3.937 -19.029 1.00 98.29 C +ATOM 1336 HD1 TRP A 88 5.661 4.566 -19.179 1.00 98.29 H +ATOM 1337 CD2 TRP A 88 8.444 3.071 -18.246 1.00 98.29 C +ATOM 1338 CE2 TRP A 88 8.100 2.335 -19.418 1.00 98.29 C +ATOM 1339 CE3 TRP A 88 9.629 2.712 -17.566 1.00 98.29 C +ATOM 1340 HE3 TRP A 88 9.911 3.256 -16.677 1.00 98.29 H +ATOM 1341 NE1 TRP A 88 6.909 2.889 -19.843 1.00 98.29 N +ATOM 1342 HE1 TRP A 88 6.396 2.623 -20.672 1.00 98.29 H +ATOM 1343 CH2 TRP A 88 10.082 0.972 -19.203 1.00 98.29 C +ATOM 1344 HH2 TRP A 88 10.714 0.178 -19.574 1.00 98.29 H +ATOM 1345 CZ2 TRP A 88 8.909 1.297 -19.896 1.00 98.29 C +ATOM 1346 HZ2 TRP A 88 8.649 0.753 -20.791 1.00 98.29 H +ATOM 1347 CZ3 TRP A 88 10.441 1.668 -18.040 1.00 98.29 C +ATOM 1348 HZ3 TRP A 88 11.351 1.403 -17.522 1.00 98.29 H +ATOM 1349 N THR A 89 7.615 7.814 -18.633 1.00 98.10 N +ATOM 1350 H THR A 89 6.899 8.001 -17.945 1.00 98.10 H +ATOM 1351 CA THR A 89 7.577 8.570 -19.890 1.00 98.10 C +ATOM 1352 HA THR A 89 7.710 7.862 -20.708 1.00 98.10 H +ATOM 1353 C THR A 89 8.717 9.569 -20.043 1.00 98.10 C +ATOM 1354 CB THR A 89 6.225 9.253 -20.108 1.00 98.10 C +ATOM 1355 HB THR A 89 6.273 9.839 -21.026 1.00 98.10 H +ATOM 1356 O THR A 89 9.200 9.765 -21.152 1.00 98.10 O +ATOM 1357 CG2 THR A 89 5.101 8.223 -20.249 1.00 98.10 C +ATOM 1358 HG21 THR A 89 5.317 7.545 -21.075 1.00 98.10 H +ATOM 1359 HG22 THR A 89 4.988 7.646 -19.332 1.00 98.10 H +ATOM 1360 HG23 THR A 89 4.161 8.736 -20.452 1.00 98.10 H +ATOM 1361 OG1 THR A 89 5.887 10.109 -19.039 1.00 98.10 O +ATOM 1362 HG1 THR A 89 6.646 10.655 -18.820 1.00 98.10 H +ATOM 1363 N ASP A 90 9.181 10.172 -18.949 1.00 97.71 N +ATOM 1364 H ASP A 90 8.700 10.021 -18.074 1.00 97.71 H +ATOM 1365 CA ASP A 90 10.290 11.131 -18.961 1.00 97.71 C +ATOM 1366 HA ASP A 90 10.153 11.837 -19.780 1.00 97.71 H +ATOM 1367 C ASP A 90 11.652 10.446 -19.167 1.00 97.71 C +ATOM 1368 CB ASP A 90 10.303 11.910 -17.633 1.00 97.71 C +ATOM 1369 HB2 ASP A 90 10.231 11.207 -16.803 1.00 97.71 H +ATOM 1370 HB3 ASP A 90 11.267 12.411 -17.546 1.00 97.71 H +ATOM 1371 O ASP A 90 12.577 11.044 -19.719 1.00 97.71 O +ATOM 1372 CG ASP A 90 9.218 12.987 -17.488 1.00 97.71 C +ATOM 1373 OD1 ASP A 90 8.520 13.296 -18.480 1.00 97.71 O +ATOM 1374 OD2 ASP A 90 9.130 13.544 -16.367 1.00 97.71 O +ATOM 1375 N ALA A 91 11.799 9.198 -18.709 1.00 97.23 N +ATOM 1376 H ALA A 91 11.024 8.769 -18.225 1.00 97.23 H +ATOM 1377 CA ALA A 91 13.057 8.461 -18.787 1.00 97.23 C +ATOM 1378 HA ALA A 91 13.869 9.139 -18.526 1.00 97.23 H +ATOM 1379 C ALA A 91 13.375 7.924 -20.191 1.00 97.23 C +ATOM 1380 CB ALA A 91 13.036 7.338 -17.744 1.00 97.23 C +ATOM 1381 HB1 ALA A 91 12.931 7.770 -16.749 1.00 97.23 H +ATOM 1382 HB2 ALA A 91 12.198 6.667 -17.935 1.00 97.23 H +ATOM 1383 HB3 ALA A 91 13.969 6.776 -17.790 1.00 97.23 H +ATOM 1384 O ALA A 91 14.546 7.679 -20.468 1.00 97.23 O +ATOM 1385 N TYR A 92 12.391 7.754 -21.083 1.00 98.08 N +ATOM 1386 H TYR A 92 11.455 8.045 -20.840 1.00 98.08 H +ATOM 1387 CA TYR A 92 12.603 7.137 -22.398 1.00 98.08 C +ATOM 1388 HA TYR A 92 13.674 7.030 -22.568 1.00 98.08 H +ATOM 1389 C TYR A 92 12.038 7.973 -23.546 1.00 98.08 C +ATOM 1390 CB TYR A 92 11.996 5.734 -22.459 1.00 98.08 C +ATOM 1391 HB2 TYR A 92 12.160 5.342 -23.463 1.00 98.08 H +ATOM 1392 HB3 TYR A 92 10.920 5.833 -22.315 1.00 98.08 H +ATOM 1393 O TYR A 92 10.949 8.529 -23.455 1.00 98.08 O +ATOM 1394 CG TYR A 92 12.562 4.742 -21.466 1.00 98.08 C +ATOM 1395 CD1 TYR A 92 13.583 3.856 -21.856 1.00 98.08 C +ATOM 1396 HD1 TYR A 92 13.929 3.836 -22.879 1.00 98.08 H +ATOM 1397 CD2 TYR A 92 12.094 4.731 -20.142 1.00 98.08 C +ATOM 1398 HD2 TYR A 92 11.301 5.405 -19.853 1.00 98.08 H +ATOM 1399 CE1 TYR A 92 14.177 3.010 -20.904 1.00 98.08 C +ATOM 1400 HE1 TYR A 92 14.985 2.349 -21.184 1.00 98.08 H +ATOM 1401 CE2 TYR A 92 12.667 3.879 -19.189 1.00 98.08 C +ATOM 1402 HE2 TYR A 92 12.308 3.892 -18.171 1.00 98.08 H +ATOM 1403 OH TYR A 92 14.291 2.238 -18.635 1.00 98.08 O +ATOM 1404 HH TYR A 92 13.885 2.350 -17.773 1.00 98.08 H +ATOM 1405 CZ TYR A 92 13.718 3.026 -19.570 1.00 98.08 C +ATOM 1406 N ALA A 93 12.739 7.975 -24.680 1.00 98.34 N +ATOM 1407 H ALA A 93 13.603 7.452 -24.709 1.00 98.34 H +ATOM 1408 CA ALA A 93 12.256 8.558 -25.929 1.00 98.34 C +ATOM 1409 HA ALA A 93 11.211 8.842 -25.811 1.00 98.34 H +ATOM 1410 C ALA A 93 12.327 7.537 -27.064 1.00 98.34 C +ATOM 1411 CB ALA A 93 13.045 9.828 -26.262 1.00 98.34 C +ATOM 1412 HB1 ALA A 93 12.996 10.526 -25.426 1.00 98.34 H +ATOM 1413 HB2 ALA A 93 12.617 10.305 -27.143 1.00 98.34 H +ATOM 1414 HB3 ALA A 93 14.083 9.574 -26.475 1.00 98.34 H +ATOM 1415 O ALA A 93 13.211 6.680 -27.087 1.00 98.34 O +ATOM 1416 N TYR A 94 11.400 7.640 -28.016 1.00 98.24 N +ATOM 1417 H TYR A 94 10.713 8.378 -27.952 1.00 98.24 H +ATOM 1418 CA TYR A 94 11.365 6.764 -29.182 1.00 98.24 C +ATOM 1419 HA TYR A 94 11.604 5.754 -28.850 1.00 98.24 H +ATOM 1420 C TYR A 94 12.420 7.195 -30.213 1.00 98.24 C +ATOM 1421 CB TYR A 94 9.946 6.730 -29.761 1.00 98.24 C +ATOM 1422 HB2 TYR A 94 9.236 6.603 -28.943 1.00 98.24 H +ATOM 1423 HB3 TYR A 94 9.722 7.682 -30.243 1.00 98.24 H +ATOM 1424 O TYR A 94 12.274 8.237 -30.857 1.00 98.24 O +ATOM 1425 CG TYR A 94 9.731 5.591 -30.735 1.00 98.24 C +ATOM 1426 CD1 TYR A 94 9.623 5.833 -32.118 1.00 98.24 C +ATOM 1427 HD1 TYR A 94 9.702 6.842 -32.494 1.00 98.24 H +ATOM 1428 CD2 TYR A 94 9.656 4.276 -30.243 1.00 98.24 C +ATOM 1429 HD2 TYR A 94 9.769 4.099 -29.184 1.00 98.24 H +ATOM 1430 CE1 TYR A 94 9.412 4.757 -33.003 1.00 98.24 C +ATOM 1431 HE1 TYR A 94 9.325 4.928 -34.066 1.00 98.24 H +ATOM 1432 CE2 TYR A 94 9.460 3.197 -31.123 1.00 98.24 C +ATOM 1433 HE2 TYR A 94 9.422 2.188 -30.739 1.00 98.24 H +ATOM 1434 OH TYR A 94 9.168 2.397 -33.360 1.00 98.24 O +ATOM 1435 HH TYR A 94 9.357 1.566 -32.918 1.00 98.24 H +ATOM 1436 CZ TYR A 94 9.329 3.439 -32.505 1.00 98.24 C +ATOM 1437 N VAL A 95 13.483 6.402 -30.357 1.00 98.24 N +ATOM 1438 H VAL A 95 13.507 5.552 -29.813 1.00 98.24 H +ATOM 1439 CA VAL A 95 14.652 6.660 -31.210 1.00 98.24 C +ATOM 1440 HA VAL A 95 14.409 7.446 -31.924 1.00 98.24 H +ATOM 1441 C VAL A 95 14.989 5.387 -31.988 1.00 98.24 C +ATOM 1442 CB VAL A 95 15.860 7.133 -30.371 1.00 98.24 C +ATOM 1443 HB VAL A 95 16.132 6.352 -29.660 1.00 98.24 H +ATOM 1444 O VAL A 95 15.079 4.303 -31.419 1.00 98.24 O +ATOM 1445 CG1 VAL A 95 17.076 7.437 -31.255 1.00 98.24 C +ATOM 1446 HG11 VAL A 95 16.826 8.184 -32.009 1.00 98.24 H +ATOM 1447 HG12 VAL A 95 17.422 6.528 -31.748 1.00 98.24 H +ATOM 1448 HG13 VAL A 95 17.897 7.803 -30.640 1.00 98.24 H +ATOM 1449 CG2 VAL A 95 15.537 8.410 -29.580 1.00 98.24 C +ATOM 1450 HG21 VAL A 95 14.765 8.204 -28.839 1.00 98.24 H +ATOM 1451 HG22 VAL A 95 15.190 9.193 -30.255 1.00 98.24 H +ATOM 1452 HG23 VAL A 95 16.425 8.752 -29.049 1.00 98.24 H +ATOM 1453 N ASP A 96 15.149 5.509 -33.307 1.00 97.40 N +ATOM 1454 H ASP A 96 15.196 6.442 -33.692 1.00 97.40 H +ATOM 1455 CA ASP A 96 15.567 4.421 -34.206 1.00 97.40 C +ATOM 1456 HA ASP A 96 15.376 4.776 -35.219 1.00 97.40 H +ATOM 1457 C ASP A 96 14.742 3.117 -34.107 1.00 97.40 C +ATOM 1458 CB ASP A 96 17.090 4.219 -34.114 1.00 97.40 C +ATOM 1459 HB2 ASP A 96 17.354 3.915 -33.100 1.00 97.40 H +ATOM 1460 HB3 ASP A 96 17.388 3.423 -34.796 1.00 97.40 H +ATOM 1461 O ASP A 96 15.232 2.023 -34.379 1.00 97.40 O +ATOM 1462 CG ASP A 96 17.872 5.479 -34.500 1.00 97.40 C +ATOM 1463 OD1 ASP A 96 17.353 6.264 -35.332 1.00 97.40 O +ATOM 1464 OD2 ASP A 96 18.994 5.648 -33.976 1.00 97.40 O +ATOM 1465 N GLY A 97 13.452 3.231 -33.769 1.00 96.93 N +ATOM 1466 H GLY A 97 13.132 4.144 -33.477 1.00 96.93 H +ATOM 1467 CA GLY A 97 12.507 2.109 -33.745 1.00 96.93 C +ATOM 1468 HA2 GLY A 97 11.562 2.452 -34.165 1.00 96.93 H +ATOM 1469 HA3 GLY A 97 12.879 1.306 -34.381 1.00 96.93 H +ATOM 1470 C GLY A 97 12.229 1.506 -32.361 1.00 96.93 C +ATOM 1471 O GLY A 97 11.371 0.622 -32.262 1.00 96.93 O +ATOM 1472 N SER A 98 12.876 1.994 -31.298 1.00 98.23 N +ATOM 1473 H SER A 98 13.597 2.687 -31.441 1.00 98.23 H +ATOM 1474 CA SER A 98 12.673 1.567 -29.905 1.00 98.23 C +ATOM 1475 HA SER A 98 11.714 1.055 -29.819 1.00 98.23 H +ATOM 1476 C SER A 98 12.641 2.755 -28.935 1.00 98.23 C +ATOM 1477 CB SER A 98 13.768 0.576 -29.482 1.00 98.23 C +ATOM 1478 HB2 SER A 98 13.599 0.269 -28.450 1.00 98.23 H +ATOM 1479 HB3 SER A 98 13.725 -0.306 -30.121 1.00 98.23 H +ATOM 1480 O SER A 98 13.086 3.853 -29.252 1.00 98.23 O +ATOM 1481 OG SER A 98 15.047 1.170 -29.593 1.00 98.23 O +ATOM 1482 HG SER A 98 15.696 0.680 -29.083 1.00 98.23 H +ATOM 1483 N TYR A 99 12.091 2.552 -27.740 1.00 98.49 N +ATOM 1484 H TYR A 99 11.756 1.625 -27.519 1.00 98.49 H +ATOM 1485 CA TYR A 99 12.215 3.485 -26.622 1.00 98.49 C +ATOM 1486 HA TYR A 99 12.179 4.508 -26.995 1.00 98.49 H +ATOM 1487 C TYR A 99 13.559 3.270 -25.927 1.00 98.49 C +ATOM 1488 CB TYR A 99 11.044 3.295 -25.653 1.00 98.49 C +ATOM 1489 HB2 TYR A 99 10.825 2.232 -25.553 1.00 98.49 H +ATOM 1490 HB3 TYR A 99 11.329 3.657 -24.665 1.00 98.49 H +ATOM 1491 O TYR A 99 13.781 2.205 -25.353 1.00 98.49 O +ATOM 1492 CG TYR A 99 9.792 4.023 -26.082 1.00 98.49 C +ATOM 1493 CD1 TYR A 99 9.594 5.360 -25.687 1.00 98.49 C +ATOM 1494 HD1 TYR A 99 10.319 5.852 -25.055 1.00 98.49 H +ATOM 1495 CD2 TYR A 99 8.829 3.365 -26.870 1.00 98.49 C +ATOM 1496 HD2 TYR A 99 8.983 2.335 -27.156 1.00 98.49 H +ATOM 1497 CE1 TYR A 99 8.430 6.044 -26.077 1.00 98.49 C +ATOM 1498 HE1 TYR A 99 8.267 7.058 -25.740 1.00 98.49 H +ATOM 1499 CE2 TYR A 99 7.667 4.052 -27.272 1.00 98.49 C +ATOM 1500 HE2 TYR A 99 6.906 3.571 -27.869 1.00 98.49 H +ATOM 1501 OH TYR A 99 6.331 6.037 -27.234 1.00 98.49 O +ATOM 1502 HH TYR A 99 6.257 6.893 -26.806 1.00 98.49 H +ATOM 1503 CZ TYR A 99 7.464 5.387 -26.868 1.00 98.49 C +ATOM 1504 N GLN A 100 14.426 4.280 -25.973 1.00 97.97 N +ATOM 1505 H GLN A 100 14.150 5.122 -26.459 1.00 97.97 H +ATOM 1506 CA GLN A 100 15.776 4.248 -25.406 1.00 97.97 C +ATOM 1507 HA GLN A 100 16.009 3.236 -25.074 1.00 97.97 H +ATOM 1508 C GLN A 100 15.875 5.179 -24.198 1.00 97.97 C +ATOM 1509 CB GLN A 100 16.822 4.640 -26.461 1.00 97.97 C +ATOM 1510 HB2 GLN A 100 17.809 4.528 -26.013 1.00 97.97 H +ATOM 1511 HB3 GLN A 100 16.684 5.686 -26.735 1.00 97.97 H +ATOM 1512 O GLN A 100 15.250 6.247 -24.181 1.00 97.97 O +ATOM 1513 CG GLN A 100 16.750 3.783 -27.734 1.00 97.97 C +ATOM 1514 HG2 GLN A 100 15.806 3.975 -28.244 1.00 97.97 H +ATOM 1515 HG3 GLN A 100 16.779 2.725 -27.472 1.00 97.97 H +ATOM 1516 CD GLN A 100 17.888 4.060 -28.710 1.00 97.97 C +ATOM 1517 NE2 GLN A 100 17.698 3.750 -29.974 1.00 97.97 N +ATOM 1518 HE21 GLN A 100 16.798 3.411 -30.282 1.00 97.97 H +ATOM 1519 HE22 GLN A 100 18.445 3.970 -30.617 1.00 97.97 H +ATOM 1520 OE1 GLN A 100 18.937 4.601 -28.388 1.00 97.97 O +ATOM 1521 N LEU A 101 16.670 4.795 -23.200 1.00 96.65 N +ATOM 1522 H LEU A 101 17.170 3.923 -23.297 1.00 96.65 H +ATOM 1523 CA LEU A 101 16.896 5.597 -21.995 1.00 96.65 C +ATOM 1524 HA LEU A 101 15.928 5.771 -21.525 1.00 96.65 H +ATOM 1525 C LEU A 101 17.524 6.958 -22.350 1.00 96.65 C +ATOM 1526 CB LEU A 101 17.782 4.794 -21.024 1.00 96.65 C +ATOM 1527 HB2 LEU A 101 18.752 4.647 -21.498 1.00 96.65 H +ATOM 1528 HB3 LEU A 101 17.337 3.811 -20.866 1.00 96.65 H +ATOM 1529 O LEU A 101 18.492 7.028 -23.105 1.00 96.65 O +ATOM 1530 CG LEU A 101 17.998 5.463 -19.652 1.00 96.65 C +ATOM 1531 HG LEU A 101 18.320 6.496 -19.788 1.00 96.65 H +ATOM 1532 CD1 LEU A 101 16.735 5.442 -18.790 1.00 96.65 C +ATOM 1533 HD11 LEU A 101 16.925 5.945 -17.842 1.00 96.65 H +ATOM 1534 HD12 LEU A 101 16.423 4.413 -18.608 1.00 96.65 H +ATOM 1535 HD13 LEU A 101 15.925 5.967 -19.297 1.00 96.65 H +ATOM 1536 CD2 LEU A 101 19.093 4.725 -18.882 1.00 96.65 C +ATOM 1537 HD21 LEU A 101 20.027 4.776 -19.442 1.00 96.65 H +ATOM 1538 HD22 LEU A 101 18.816 3.678 -18.758 1.00 96.65 H +ATOM 1539 HD23 LEU A 101 19.235 5.187 -17.905 1.00 96.65 H +ATOM 1540 N GLN A 102 16.968 8.036 -21.801 1.00 95.25 N +ATOM 1541 H GLN A 102 16.170 7.887 -21.201 1.00 95.25 H +ATOM 1542 CA GLN A 102 17.427 9.415 -21.985 1.00 95.25 C +ATOM 1543 HA GLN A 102 18.102 9.463 -22.839 1.00 95.25 H +ATOM 1544 C GLN A 102 18.240 9.881 -20.761 1.00 95.25 C +ATOM 1545 CB GLN A 102 16.212 10.321 -22.293 1.00 95.25 C +ATOM 1546 HB2 GLN A 102 15.565 10.361 -21.416 1.00 95.25 H +ATOM 1547 HB3 GLN A 102 16.565 11.331 -22.503 1.00 95.25 H +ATOM 1548 O GLN A 102 18.979 9.110 -20.148 1.00 95.25 O +ATOM 1549 CG GLN A 102 15.369 9.871 -23.491 1.00 95.25 C +ATOM 1550 HG2 GLN A 102 14.909 8.909 -23.263 1.00 95.25 H +ATOM 1551 HG3 GLN A 102 14.569 10.595 -23.644 1.00 95.25 H +ATOM 1552 CD GLN A 102 16.179 9.758 -24.778 1.00 95.25 C +ATOM 1553 NE2 GLN A 102 16.510 8.567 -25.217 1.00 95.25 N +ATOM 1554 HE21 GLN A 102 16.233 7.737 -24.713 1.00 95.25 H +ATOM 1555 HE22 GLN A 102 17.095 8.518 -26.039 1.00 95.25 H +ATOM 1556 OE1 GLN A 102 16.524 10.741 -25.414 1.00 95.25 O +ATOM 1557 N ASP A 103 18.123 11.157 -20.390 1.00 87.47 N +ATOM 1558 H ASP A 103 17.574 11.775 -20.970 1.00 87.47 H +ATOM 1559 CA ASP A 103 18.853 11.739 -19.260 1.00 87.47 C +ATOM 1560 HA ASP A 103 19.851 11.304 -19.220 1.00 87.47 H +ATOM 1561 C ASP A 103 18.186 11.472 -17.899 1.00 87.47 C +ATOM 1562 CB ASP A 103 18.999 13.248 -19.499 1.00 87.47 C +ATOM 1563 HB2 ASP A 103 19.474 13.697 -18.627 1.00 87.47 H +ATOM 1564 HB3 ASP A 103 18.008 13.690 -19.605 1.00 87.47 H +ATOM 1565 O ASP A 103 18.842 11.576 -16.857 1.00 87.47 O +ATOM 1566 CG ASP A 103 19.851 13.585 -20.728 1.00 87.47 C +ATOM 1567 OD1 ASP A 103 20.880 12.899 -20.935 1.00 87.47 O +ATOM 1568 OD2 ASP A 103 19.506 14.577 -21.406 1.00 87.47 O +ATOM 1569 N LEU A 104 16.885 11.149 -17.898 1.00 88.52 N +ATOM 1570 H LEU A 104 16.443 10.984 -18.791 1.00 88.52 H +ATOM 1571 CA LEU A 104 16.059 11.056 -16.697 1.00 88.52 C +ATOM 1572 HA LEU A 104 16.622 11.534 -15.895 1.00 88.52 H +ATOM 1573 C LEU A 104 15.814 9.638 -16.166 1.00 88.52 C +ATOM 1574 CB LEU A 104 14.744 11.853 -16.870 1.00 88.52 C +ATOM 1575 HB2 LEU A 104 13.997 11.508 -16.156 1.00 88.52 H +ATOM 1576 HB3 LEU A 104 14.343 11.645 -17.862 1.00 88.52 H +ATOM 1577 O LEU A 104 16.111 8.595 -16.739 1.00 88.52 O +ATOM 1578 CG LEU A 104 14.878 13.379 -16.698 1.00 88.52 C +ATOM 1579 HG LEU A 104 15.537 13.774 -17.471 1.00 88.52 H +ATOM 1580 CD1 LEU A 104 13.501 14.023 -16.851 1.00 88.52 C +ATOM 1581 HD11 LEU A 104 13.578 15.107 -16.767 1.00 88.52 H +ATOM 1582 HD12 LEU A 104 12.812 13.648 -16.094 1.00 88.52 H +ATOM 1583 HD13 LEU A 104 13.103 13.787 -17.837 1.00 88.52 H +ATOM 1584 CD2 LEU A 104 15.421 13.800 -15.325 1.00 88.52 C +ATOM 1585 HD21 LEU A 104 16.470 13.522 -15.231 1.00 88.52 H +ATOM 1586 HD22 LEU A 104 14.834 13.334 -14.533 1.00 88.52 H +ATOM 1587 HD23 LEU A 104 15.358 14.884 -15.227 1.00 88.52 H +ATOM 1588 N THR A 105 15.328 9.689 -14.936 1.00 87.38 N +ATOM 1589 H THR A 105 15.074 10.623 -14.647 1.00 87.38 H +ATOM 1590 CA THR A 105 15.046 8.664 -13.949 1.00 87.38 C +ATOM 1591 HA THR A 105 14.696 9.331 -13.161 1.00 87.38 H +ATOM 1592 C THR A 105 13.817 7.756 -14.051 1.00 87.38 C +ATOM 1593 CB THR A 105 16.272 8.075 -13.313 1.00 87.38 C +ATOM 1594 HB THR A 105 17.024 8.853 -13.179 1.00 87.38 H +ATOM 1595 O THR A 105 12.750 8.294 -13.797 1.00 87.38 O +ATOM 1596 CG2 THR A 105 15.810 7.559 -11.932 1.00 87.38 C +ATOM 1597 HG21 THR A 105 15.619 6.486 -11.969 1.00 87.38 H +ATOM 1598 HG22 THR A 105 14.898 8.041 -11.581 1.00 87.38 H +ATOM 1599 HG23 THR A 105 16.533 7.773 -11.145 1.00 87.38 H +ATOM 1600 OG1 THR A 105 16.725 7.119 -14.239 1.00 87.38 O +ATOM 1601 HG1 THR A 105 16.634 7.496 -15.118 1.00 87.38 H +ATOM 1602 N PHE A 106 13.914 6.421 -14.158 1.00 96.10 N +ATOM 1603 H PHE A 106 14.822 6.028 -14.359 1.00 96.10 H +ATOM 1604 CA PHE A 106 12.893 5.526 -13.574 1.00 96.10 C +ATOM 1605 HA PHE A 106 12.126 6.138 -13.099 1.00 96.10 H +ATOM 1606 C PHE A 106 13.484 4.635 -12.471 1.00 96.10 C +ATOM 1607 CB PHE A 106 12.170 4.705 -14.648 1.00 96.10 C +ATOM 1608 HB2 PHE A 106 11.780 5.386 -15.406 1.00 96.10 H +ATOM 1609 HB3 PHE A 106 12.887 4.046 -15.137 1.00 96.10 H +ATOM 1610 O PHE A 106 14.580 4.093 -12.606 1.00 96.10 O +ATOM 1611 CG PHE A 106 11.018 3.875 -14.098 1.00 96.10 C +ATOM 1612 CD1 PHE A 106 11.232 2.548 -13.676 1.00 96.10 C +ATOM 1613 HD1 PHE A 106 12.220 2.116 -13.741 1.00 96.10 H +ATOM 1614 CD2 PHE A 106 9.724 4.422 -14.016 1.00 96.10 C +ATOM 1615 HD2 PHE A 106 9.550 5.439 -14.336 1.00 96.10 H +ATOM 1616 CE1 PHE A 106 10.158 1.767 -13.211 1.00 96.10 C +ATOM 1617 HE1 PHE A 106 10.330 0.738 -12.931 1.00 96.10 H +ATOM 1618 CE2 PHE A 106 8.645 3.633 -13.577 1.00 96.10 C +ATOM 1619 HE2 PHE A 106 7.645 4.040 -13.597 1.00 96.10 H +ATOM 1620 CZ PHE A 106 8.858 2.300 -13.186 1.00 96.10 C +ATOM 1621 HZ PHE A 106 8.025 1.673 -12.905 1.00 96.10 H +ATOM 1622 N SER A 107 12.767 4.477 -11.353 1.00 96.11 N +ATOM 1623 H SER A 107 11.873 4.942 -11.284 1.00 96.11 H +ATOM 1624 CA SER A 107 13.172 3.583 -10.261 1.00 96.11 C +ATOM 1625 HA SER A 107 13.709 2.735 -10.686 1.00 96.11 H +ATOM 1626 C SER A 107 11.969 3.040 -9.496 1.00 96.11 C +ATOM 1627 CB SER A 107 14.108 4.316 -9.290 1.00 96.11 C +ATOM 1628 HB2 SER A 107 14.976 4.693 -9.830 1.00 96.11 H +ATOM 1629 HB3 SER A 107 13.578 5.158 -8.845 1.00 96.11 H +ATOM 1630 O SER A 107 11.021 3.768 -9.210 1.00 96.11 O +ATOM 1631 OG SER A 107 14.535 3.434 -8.262 1.00 96.11 O +ATOM 1632 HG SER A 107 15.381 3.069 -8.533 1.00 96.11 H +ATOM 1633 N ASN A 108 12.019 1.771 -9.082 1.00 97.30 N +ATOM 1634 H ASN A 108 12.807 1.206 -9.364 1.00 97.30 H +ATOM 1635 CA ASN A 108 11.035 1.210 -8.151 1.00 97.30 C +ATOM 1636 HA ASN A 108 10.049 1.582 -8.431 1.00 97.30 H +ATOM 1637 C ASN A 108 11.265 1.662 -6.695 1.00 97.30 C +ATOM 1638 CB ASN A 108 11.006 -0.321 -8.279 1.00 97.30 C +ATOM 1639 HB2 ASN A 108 10.346 -0.739 -7.518 1.00 97.30 H +ATOM 1640 HB3 ASN A 108 12.005 -0.724 -8.114 1.00 97.30 H +ATOM 1641 O ASN A 108 10.394 1.448 -5.849 1.00 97.30 O +ATOM 1642 CG ASN A 108 10.477 -0.771 -9.629 1.00 97.30 C +ATOM 1643 ND2 ASN A 108 11.305 -1.438 -10.396 1.00 97.30 N +ATOM 1644 HD21 ASN A 108 11.091 -1.627 -11.365 1.00 97.30 H +ATOM 1645 HD22 ASN A 108 12.264 -1.600 -10.125 1.00 97.30 H +ATOM 1646 OD1 ASN A 108 9.324 -0.530 -9.974 1.00 97.30 O +ATOM 1647 N GLY A 109 12.389 2.323 -6.384 1.00 96.70 N +ATOM 1648 H GLY A 109 13.064 2.490 -7.117 1.00 96.70 H +ATOM 1649 CA GLY A 109 12.740 2.771 -5.031 1.00 96.70 C +ATOM 1650 HA2 GLY A 109 12.907 1.900 -4.397 1.00 96.70 H +ATOM 1651 HA3 GLY A 109 13.669 3.338 -5.089 1.00 96.70 H +ATOM 1652 C GLY A 109 11.678 3.665 -4.376 1.00 96.70 C +ATOM 1653 O GLY A 109 11.419 3.542 -3.178 1.00 96.70 O +ATOM 1654 N TYR A 110 10.970 4.488 -5.156 1.00 96.99 N +ATOM 1655 H TYR A 110 11.229 4.581 -6.127 1.00 96.99 H +ATOM 1656 CA TYR A 110 9.873 5.325 -4.650 1.00 96.99 C +ATOM 1657 HA TYR A 110 10.255 5.942 -3.837 1.00 96.99 H +ATOM 1658 C TYR A 110 8.698 4.505 -4.096 1.00 96.99 C +ATOM 1659 CB TYR A 110 9.384 6.253 -5.765 1.00 96.99 C +ATOM 1660 HB2 TYR A 110 8.587 6.885 -5.373 1.00 96.99 H +ATOM 1661 HB3 TYR A 110 8.958 5.651 -6.567 1.00 96.99 H +ATOM 1662 O TYR A 110 8.062 4.915 -3.121 1.00 96.99 O +ATOM 1663 CG TYR A 110 10.465 7.150 -6.331 1.00 96.99 C +ATOM 1664 CD1 TYR A 110 10.897 8.281 -5.609 1.00 96.99 C +ATOM 1665 HD1 TYR A 110 10.454 8.514 -4.652 1.00 96.99 H +ATOM 1666 CD2 TYR A 110 11.035 6.853 -7.582 1.00 96.99 C +ATOM 1667 HD2 TYR A 110 10.685 6.009 -8.158 1.00 96.99 H +ATOM 1668 CE1 TYR A 110 11.888 9.125 -6.148 1.00 96.99 C +ATOM 1669 HE1 TYR A 110 12.213 10.005 -5.612 1.00 96.99 H +ATOM 1670 CE2 TYR A 110 12.016 7.700 -8.125 1.00 96.99 C +ATOM 1671 HE2 TYR A 110 12.435 7.510 -9.102 1.00 96.99 H +ATOM 1672 OH TYR A 110 13.370 9.651 -7.977 1.00 96.99 O +ATOM 1673 HH TYR A 110 13.738 10.313 -7.388 1.00 96.99 H +ATOM 1674 CZ TYR A 110 12.439 8.841 -7.418 1.00 96.99 C +ATOM 1675 N ARG A 111 8.437 3.309 -4.651 1.00 98.33 N +ATOM 1676 H ARG A 111 9.041 2.991 -5.395 1.00 98.33 H +ATOM 1677 CA ARG A 111 7.417 2.388 -4.120 1.00 98.33 C +ATOM 1678 HA ARG A 111 6.472 2.924 -4.034 1.00 98.33 H +ATOM 1679 C ARG A 111 7.783 1.929 -2.711 1.00 98.33 C +ATOM 1680 CB ARG A 111 7.216 1.169 -5.038 1.00 98.33 C +ATOM 1681 HB2 ARG A 111 8.145 0.604 -5.107 1.00 98.33 H +ATOM 1682 HB3 ARG A 111 6.476 0.518 -4.572 1.00 98.33 H +ATOM 1683 O ARG A 111 6.932 1.989 -1.826 1.00 98.33 O +ATOM 1684 CG ARG A 111 6.723 1.518 -6.450 1.00 98.33 C +ATOM 1685 HG2 ARG A 111 7.445 2.161 -6.952 1.00 98.33 H +ATOM 1686 HG3 ARG A 111 5.767 2.038 -6.382 1.00 98.33 H +ATOM 1687 CD ARG A 111 6.557 0.222 -7.258 1.00 98.33 C +ATOM 1688 HD2 ARG A 111 5.930 -0.479 -6.708 1.00 98.33 H +ATOM 1689 HD3 ARG A 111 7.536 -0.240 -7.379 1.00 98.33 H +ATOM 1690 NE ARG A 111 5.983 0.456 -8.596 1.00 98.33 N +ATOM 1691 HE ARG A 111 6.633 0.436 -9.368 1.00 98.33 H +ATOM 1692 NH1 ARG A 111 3.759 0.534 -8.004 1.00 98.33 N +ATOM 1693 HH11 ARG A 111 4.010 0.377 -7.038 1.00 98.33 H +ATOM 1694 HH12 ARG A 111 2.789 0.402 -8.251 1.00 98.33 H +ATOM 1695 NH2 ARG A 111 4.355 0.580 -10.162 1.00 98.33 N +ATOM 1696 HH21 ARG A 111 5.030 0.363 -10.881 1.00 98.33 H +ATOM 1697 HH22 ARG A 111 3.383 0.642 -10.430 1.00 98.33 H +ATOM 1698 CZ ARG A 111 4.702 0.536 -8.911 1.00 98.33 C +ATOM 1699 N TYR A 112 9.045 1.558 -2.486 1.00 98.36 N +ATOM 1700 H TYR A 112 9.690 1.579 -3.263 1.00 98.36 H +ATOM 1701 CA TYR A 112 9.547 1.150 -1.168 1.00 98.36 C +ATOM 1702 HA TYR A 112 8.964 0.301 -0.812 1.00 98.36 H +ATOM 1703 C TYR A 112 9.403 2.266 -0.136 1.00 98.36 C +ATOM 1704 CB TYR A 112 11.017 0.724 -1.255 1.00 98.36 C +ATOM 1705 HB2 TYR A 112 11.585 1.466 -1.817 1.00 98.36 H +ATOM 1706 HB3 TYR A 112 11.423 0.709 -0.244 1.00 98.36 H +ATOM 1707 O TYR A 112 8.889 2.033 0.958 1.00 98.36 O +ATOM 1708 CG TYR A 112 11.233 -0.638 -1.871 1.00 98.36 C +ATOM 1709 CD1 TYR A 112 11.450 -1.752 -1.038 1.00 98.36 C +ATOM 1710 HD1 TYR A 112 11.492 -1.630 0.035 1.00 98.36 H +ATOM 1711 CD2 TYR A 112 11.201 -0.796 -3.270 1.00 98.36 C +ATOM 1712 HD2 TYR A 112 11.064 0.060 -3.915 1.00 98.36 H +ATOM 1713 CE1 TYR A 112 11.615 -3.029 -1.602 1.00 98.36 C +ATOM 1714 HE1 TYR A 112 11.769 -3.890 -0.969 1.00 98.36 H +ATOM 1715 CE2 TYR A 112 11.344 -2.073 -3.836 1.00 98.36 C +ATOM 1716 HE2 TYR A 112 11.318 -2.211 -4.907 1.00 98.36 H +ATOM 1717 OH TYR A 112 11.642 -4.421 -3.545 1.00 98.36 O +ATOM 1718 HH TYR A 112 11.900 -5.090 -2.907 1.00 98.36 H +ATOM 1719 CZ TYR A 112 11.547 -3.188 -3.001 1.00 98.36 C +ATOM 1720 N VAL A 113 9.779 3.497 -0.492 1.00 97.45 N +ATOM 1721 H VAL A 113 10.219 3.626 -1.392 1.00 97.45 H +ATOM 1722 CA VAL A 113 9.618 4.655 0.400 1.00 97.45 C +ATOM 1723 HA VAL A 113 10.140 4.448 1.334 1.00 97.45 H +ATOM 1724 C VAL A 113 8.143 4.869 0.750 1.00 97.45 C +ATOM 1725 CB VAL A 113 10.242 5.918 -0.223 1.00 97.45 C +ATOM 1726 HB VAL A 113 9.787 6.106 -1.195 1.00 97.45 H +ATOM 1727 O VAL A 113 7.806 5.084 1.912 1.00 97.45 O +ATOM 1728 CG1 VAL A 113 10.033 7.152 0.664 1.00 97.45 C +ATOM 1729 HG11 VAL A 113 8.973 7.398 0.731 1.00 97.45 H +ATOM 1730 HG12 VAL A 113 10.548 8.008 0.229 1.00 97.45 H +ATOM 1731 HG13 VAL A 113 10.426 6.968 1.664 1.00 97.45 H +ATOM 1732 CG2 VAL A 113 11.755 5.739 -0.410 1.00 97.45 C +ATOM 1733 HG21 VAL A 113 12.180 6.633 -0.866 1.00 97.45 H +ATOM 1734 HG22 VAL A 113 11.967 4.896 -1.068 1.00 97.45 H +ATOM 1735 HG23 VAL A 113 12.238 5.564 0.552 1.00 97.45 H +ATOM 1736 N ASN A 114 7.231 4.725 -0.212 1.00 98.18 N +ATOM 1737 H ASN A 114 7.546 4.573 -1.160 1.00 98.18 H +ATOM 1738 CA ASN A 114 5.798 4.858 0.043 1.00 98.18 C +ATOM 1739 HA ASN A 114 5.631 5.792 0.579 1.00 98.18 H +ATOM 1740 C ASN A 114 5.207 3.725 0.900 1.00 98.18 C +ATOM 1741 CB ASN A 114 5.098 4.945 -1.307 1.00 98.18 C +ATOM 1742 HB2 ASN A 114 5.166 3.994 -1.835 1.00 98.18 H +ATOM 1743 HB3 ASN A 114 5.602 5.709 -1.898 1.00 98.18 H +ATOM 1744 O ASN A 114 4.255 3.931 1.665 1.00 98.18 O +ATOM 1745 CG ASN A 114 3.651 5.350 -1.120 1.00 98.18 C +ATOM 1746 ND2 ASN A 114 2.706 4.490 -1.418 1.00 98.18 N +ATOM 1747 HD21 ASN A 114 2.937 3.619 -1.875 1.00 98.18 H +ATOM 1748 HD22 ASN A 114 1.768 4.847 -1.308 1.00 98.18 H +ATOM 1749 OD1 ASN A 114 3.353 6.451 -0.695 1.00 98.18 O +ATOM 1750 N TRP A 115 5.758 2.514 0.808 1.00 98.70 N +ATOM 1751 H TRP A 115 6.491 2.362 0.129 1.00 98.70 H +ATOM 1752 CA TRP A 115 5.356 1.393 1.658 1.00 98.70 C +ATOM 1753 HA TRP A 115 4.279 1.244 1.571 1.00 98.70 H +ATOM 1754 C TRP A 115 5.613 1.668 3.141 1.00 98.70 C +ATOM 1755 CB TRP A 115 6.012 0.099 1.177 1.00 98.70 C +ATOM 1756 HB2 TRP A 115 7.095 0.215 1.209 1.00 98.70 H +ATOM 1757 HB3 TRP A 115 5.757 -0.697 1.876 1.00 98.70 H +ATOM 1758 O TRP A 115 4.844 1.187 3.975 1.00 98.70 O +ATOM 1759 CG TRP A 115 5.623 -0.363 -0.198 1.00 98.70 C +ATOM 1760 CD1 TRP A 115 4.529 0.011 -0.909 1.00 98.70 C +ATOM 1761 HD1 TRP A 115 3.781 0.710 -0.566 1.00 98.70 H +ATOM 1762 CD2 TRP A 115 6.355 -1.283 -1.060 1.00 98.70 C +ATOM 1763 CE2 TRP A 115 5.657 -1.400 -2.299 1.00 98.70 C +ATOM 1764 CE3 TRP A 115 7.547 -2.024 -0.921 1.00 98.70 C +ATOM 1765 HE3 TRP A 115 8.108 -1.962 0.000 1.00 98.70 H +ATOM 1766 NE1 TRP A 115 4.550 -0.595 -2.152 1.00 98.70 N +ATOM 1767 HE1 TRP A 115 3.874 -0.426 -2.884 1.00 98.70 H +ATOM 1768 CH2 TRP A 115 7.322 -2.907 -3.189 1.00 98.70 C +ATOM 1769 HH2 TRP A 115 7.714 -3.511 -3.993 1.00 98.70 H +ATOM 1770 CZ2 TRP A 115 6.126 -2.190 -3.358 1.00 98.70 C +ATOM 1771 HZ2 TRP A 115 5.583 -2.247 -4.289 1.00 98.70 H +ATOM 1772 CZ3 TRP A 115 8.020 -2.829 -1.972 1.00 98.70 C +ATOM 1773 HZ3 TRP A 115 8.938 -3.386 -1.854 1.00 98.70 H +ATOM 1774 N MET A 116 6.591 2.522 3.477 1.00 98.54 N +ATOM 1775 H MET A 116 7.189 2.879 2.745 1.00 98.54 H +ATOM 1776 CA MET A 116 6.848 2.953 4.859 1.00 98.54 C +ATOM 1777 HA MET A 116 7.074 2.073 5.461 1.00 98.54 H +ATOM 1778 C MET A 116 5.641 3.640 5.508 1.00 98.54 C +ATOM 1779 CB MET A 116 8.050 3.908 4.926 1.00 98.54 C +ATOM 1780 HB2 MET A 116 8.167 4.254 5.953 1.00 98.54 H +ATOM 1781 HB3 MET A 116 7.853 4.792 4.320 1.00 98.54 H +ATOM 1782 O MET A 116 5.512 3.587 6.731 1.00 98.54 O +ATOM 1783 CG MET A 116 9.364 3.257 4.484 1.00 98.54 C +ATOM 1784 HG2 MET A 116 9.244 2.858 3.477 1.00 98.54 H +ATOM 1785 HG3 MET A 116 10.137 4.024 4.440 1.00 98.54 H +ATOM 1786 SD MET A 116 9.936 1.926 5.578 1.00 98.54 S +ATOM 1787 CE MET A 116 10.479 2.891 7.012 1.00 98.54 C +ATOM 1788 HE1 MET A 116 9.633 3.413 7.459 1.00 98.54 H +ATOM 1789 HE2 MET A 116 11.233 3.615 6.703 1.00 98.54 H +ATOM 1790 HE3 MET A 116 10.914 2.221 7.753 1.00 98.54 H +ATOM 1791 N ALA A 117 4.754 4.252 4.714 1.00 98.29 N +ATOM 1792 H ALA A 117 4.950 4.271 3.723 1.00 98.29 H +ATOM 1793 CA ALA A 117 3.523 4.890 5.180 1.00 98.29 C +ATOM 1794 HA ALA A 117 3.589 5.068 6.254 1.00 98.29 H +ATOM 1795 C ALA A 117 2.277 4.021 4.938 1.00 98.29 C +ATOM 1796 CB ALA A 117 3.405 6.252 4.486 1.00 98.29 C +ATOM 1797 HB1 ALA A 117 4.276 6.863 4.720 1.00 98.29 H +ATOM 1798 HB2 ALA A 117 2.510 6.767 4.835 1.00 98.29 H +ATOM 1799 HB3 ALA A 117 3.343 6.124 3.405 1.00 98.29 H +ATOM 1800 O ALA A 117 1.447 3.845 5.835 1.00 98.29 O +ATOM 1801 N THR A 118 2.140 3.448 3.739 1.00 98.65 N +ATOM 1802 H THR A 118 2.851 3.621 3.043 1.00 98.65 H +ATOM 1803 CA THR A 118 0.925 2.703 3.364 1.00 98.65 C +ATOM 1804 HA THR A 118 0.063 3.305 3.651 1.00 98.65 H +ATOM 1805 C THR A 118 0.778 1.379 4.105 1.00 98.65 C +ATOM 1806 CB THR A 118 0.816 2.457 1.854 1.00 98.65 C +ATOM 1807 HB THR A 118 -0.002 1.761 1.664 1.00 98.65 H +ATOM 1808 O THR A 118 -0.334 1.058 4.522 1.00 98.65 O +ATOM 1809 CG2 THR A 118 0.541 3.745 1.099 1.00 98.65 C +ATOM 1810 HG21 THR A 118 1.379 4.430 1.229 1.00 98.65 H +ATOM 1811 HG22 THR A 118 0.404 3.532 0.039 1.00 98.65 H +ATOM 1812 HG23 THR A 118 -0.366 4.215 1.480 1.00 98.65 H +ATOM 1813 OG1 THR A 118 2.004 1.934 1.319 1.00 98.65 O +ATOM 1814 HG1 THR A 118 2.622 2.666 1.252 1.00 98.65 H +ATOM 1815 N ILE A 119 1.862 0.632 4.346 1.00 98.73 N +ATOM 1816 H ILE A 119 2.765 0.951 4.025 1.00 98.73 H +ATOM 1817 CA ILE A 119 1.784 -0.653 5.059 1.00 98.73 C +ATOM 1818 HA ILE A 119 0.992 -1.234 4.588 1.00 98.73 H +ATOM 1819 C ILE A 119 1.318 -0.464 6.516 1.00 98.73 C +ATOM 1820 CB ILE A 119 3.083 -1.483 4.894 1.00 98.73 C +ATOM 1821 HB ILE A 119 3.948 -0.887 5.184 1.00 98.73 H +ATOM 1822 O ILE A 119 0.374 -1.150 6.916 1.00 98.73 O +ATOM 1823 CG1 ILE A 119 3.234 -1.873 3.404 1.00 98.73 C +ATOM 1824 HG12 ILE A 119 3.398 -0.967 2.820 1.00 98.73 H +ATOM 1825 HG13 ILE A 119 2.303 -2.323 3.058 1.00 98.73 H +ATOM 1826 CG2 ILE A 119 3.049 -2.723 5.802 1.00 98.73 C +ATOM 1827 HG21 ILE A 119 3.002 -2.427 6.850 1.00 98.73 H +ATOM 1828 HG22 ILE A 119 2.187 -3.341 5.553 1.00 98.73 H +ATOM 1829 HG23 ILE A 119 3.956 -3.315 5.679 1.00 98.73 H +ATOM 1830 CD1 ILE A 119 4.367 -2.852 3.070 1.00 98.73 C +ATOM 1831 HD11 ILE A 119 5.319 -2.501 3.469 1.00 98.73 H +ATOM 1832 HD12 ILE A 119 4.140 -3.840 3.470 1.00 98.73 H +ATOM 1833 HD13 ILE A 119 4.454 -2.939 1.987 1.00 98.73 H +ATOM 1834 N PRO A 120 1.849 0.498 7.300 1.00 98.82 N +ATOM 1835 CA PRO A 120 1.272 0.852 8.598 1.00 98.82 C +ATOM 1836 HA PRO A 120 1.425 0.019 9.285 1.00 98.82 H +ATOM 1837 C PRO A 120 -0.224 1.189 8.560 1.00 98.82 C +ATOM 1838 CB PRO A 120 2.089 2.052 9.075 1.00 98.82 C +ATOM 1839 HB2 PRO A 120 2.092 2.147 10.161 1.00 98.82 H +ATOM 1840 HB3 PRO A 120 1.719 2.971 8.620 1.00 98.82 H +ATOM 1841 O PRO A 120 -0.967 0.747 9.438 1.00 98.82 O +ATOM 1842 CG PRO A 120 3.470 1.737 8.515 1.00 98.82 C +ATOM 1843 HG2 PRO A 120 3.954 0.972 9.122 1.00 98.82 H +ATOM 1844 HG3 PRO A 120 4.086 2.634 8.467 1.00 98.82 H +ATOM 1845 CD PRO A 120 3.140 1.164 7.137 1.00 98.82 C +ATOM 1846 HD2 PRO A 120 3.064 1.970 6.407 1.00 98.82 H +ATOM 1847 HD3 PRO A 120 3.923 0.467 6.841 1.00 98.82 H +ATOM 1848 N CYS A 121 -0.689 1.921 7.541 1.00 98.82 N +ATOM 1849 H CYS A 121 -0.037 2.263 6.851 1.00 98.82 H +ATOM 1850 CA CYS A 121 -2.108 2.258 7.392 1.00 98.82 C +ATOM 1851 HA CYS A 121 -2.462 2.707 8.320 1.00 98.82 H +ATOM 1852 C CYS A 121 -2.971 1.012 7.139 1.00 98.82 C +ATOM 1853 CB CYS A 121 -2.285 3.281 6.261 1.00 98.82 C +ATOM 1854 HB2 CYS A 121 -1.864 2.895 5.332 1.00 98.82 H +ATOM 1855 HB3 CYS A 121 -3.349 3.459 6.106 1.00 98.82 H +ATOM 1856 O CYS A 121 -3.992 0.826 7.808 1.00 98.82 O +ATOM 1857 SG CYS A 121 -1.490 4.857 6.682 1.00 98.82 S +ATOM 1858 HG CYS A 121 -0.224 4.472 6.497 1.00 98.82 H +ATOM 1859 N LEU A 122 -2.529 0.133 6.230 1.00 98.85 N +ATOM 1860 H LEU A 122 -1.682 0.361 5.728 1.00 98.85 H +ATOM 1861 CA LEU A 122 -3.190 -1.138 5.921 1.00 98.85 C +ATOM 1862 HA LEU A 122 -4.206 -0.935 5.583 1.00 98.85 H +ATOM 1863 C LEU A 122 -3.284 -2.038 7.161 1.00 98.85 C +ATOM 1864 CB LEU A 122 -2.417 -1.868 4.804 1.00 98.85 C +ATOM 1865 HB2 LEU A 122 -1.373 -1.949 5.104 1.00 98.85 H +ATOM 1866 HB3 LEU A 122 -2.809 -2.882 4.716 1.00 98.85 H +ATOM 1867 O LEU A 122 -4.335 -2.622 7.424 1.00 98.85 O +ATOM 1868 CG LEU A 122 -2.484 -1.208 3.415 1.00 98.85 C +ATOM 1869 HG LEU A 122 -2.232 -0.149 3.484 1.00 98.85 H +ATOM 1870 CD1 LEU A 122 -1.487 -1.890 2.476 1.00 98.85 C +ATOM 1871 HD11 LEU A 122 -1.755 -2.938 2.341 1.00 98.85 H +ATOM 1872 HD12 LEU A 122 -1.499 -1.393 1.506 1.00 98.85 H +ATOM 1873 HD13 LEU A 122 -0.480 -1.821 2.888 1.00 98.85 H +ATOM 1874 CD2 LEU A 122 -3.874 -1.325 2.799 1.00 98.85 C +ATOM 1875 HD21 LEU A 122 -4.604 -0.770 3.389 1.00 98.85 H +ATOM 1876 HD22 LEU A 122 -4.157 -2.376 2.741 1.00 98.85 H +ATOM 1877 HD23 LEU A 122 -3.865 -0.919 1.787 1.00 98.85 H +ATOM 1878 N LEU A 123 -2.217 -2.120 7.956 1.00 98.85 N +ATOM 1879 H LEU A 123 -1.375 -1.641 7.671 1.00 98.85 H +ATOM 1880 CA LEU A 123 -2.198 -2.902 9.194 1.00 98.85 C +ATOM 1881 HA LEU A 123 -2.590 -3.897 8.987 1.00 98.85 H +ATOM 1882 C LEU A 123 -3.113 -2.286 10.257 1.00 98.85 C +ATOM 1883 CB LEU A 123 -0.746 -3.026 9.696 1.00 98.85 C +ATOM 1884 HB2 LEU A 123 -0.743 -3.462 10.695 1.00 98.85 H +ATOM 1885 HB3 LEU A 123 -0.319 -2.026 9.766 1.00 98.85 H +ATOM 1886 O LEU A 123 -3.880 -3.001 10.894 1.00 98.85 O +ATOM 1887 CG LEU A 123 0.134 -3.888 8.772 1.00 98.85 C +ATOM 1888 HG LEU A 123 -0.021 -3.572 7.740 1.00 98.85 H +ATOM 1889 CD1 LEU A 123 1.617 -3.710 9.085 1.00 98.85 C +ATOM 1890 HD11 LEU A 123 1.874 -2.651 9.121 1.00 98.85 H +ATOM 1891 HD12 LEU A 123 1.880 -4.193 10.026 1.00 98.85 H +ATOM 1892 HD13 LEU A 123 2.205 -4.181 8.297 1.00 98.85 H +ATOM 1893 CD2 LEU A 123 -0.211 -5.376 8.882 1.00 98.85 C +ATOM 1894 HD21 LEU A 123 -1.210 -5.561 8.488 1.00 98.85 H +ATOM 1895 HD22 LEU A 123 0.499 -5.964 8.300 1.00 98.85 H +ATOM 1896 HD23 LEU A 123 -0.160 -5.701 9.922 1.00 98.85 H +ATOM 1897 N LEU A 124 -3.095 -0.964 10.438 1.00 98.86 N +ATOM 1898 H LEU A 124 -2.449 -0.408 9.897 1.00 98.86 H +ATOM 1899 CA LEU A 124 -3.905 -0.305 11.462 1.00 98.86 C +ATOM 1900 HA LEU A 124 -3.695 -0.800 12.410 1.00 98.86 H +ATOM 1901 C LEU A 124 -5.412 -0.447 11.201 1.00 98.86 C +ATOM 1902 CB LEU A 124 -3.463 1.163 11.572 1.00 98.86 C +ATOM 1903 HB2 LEU A 124 -2.396 1.189 11.790 1.00 98.86 H +ATOM 1904 HB3 LEU A 124 -3.616 1.648 10.608 1.00 98.86 H +ATOM 1905 O LEU A 124 -6.164 -0.723 12.139 1.00 98.86 O +ATOM 1906 CG LEU A 124 -4.206 1.966 12.654 1.00 98.86 C +ATOM 1907 HG LEU A 124 -5.270 1.994 12.419 1.00 98.86 H +ATOM 1908 CD1 LEU A 124 -4.024 1.373 14.055 1.00 98.86 C +ATOM 1909 HD11 LEU A 124 -2.963 1.274 14.283 1.00 98.86 H +ATOM 1910 HD12 LEU A 124 -4.505 0.396 14.107 1.00 98.86 H +ATOM 1911 HD13 LEU A 124 -4.494 2.025 14.792 1.00 98.86 H +ATOM 1912 CD2 LEU A 124 -3.686 3.402 12.675 1.00 98.86 C +ATOM 1913 HD21 LEU A 124 -3.778 3.845 11.683 1.00 98.86 H +ATOM 1914 HD22 LEU A 124 -2.635 3.416 12.964 1.00 98.86 H +ATOM 1915 HD23 LEU A 124 -4.264 3.998 13.381 1.00 98.86 H +ATOM 1916 N GLN A 125 -5.863 -0.327 9.946 1.00 98.71 N +ATOM 1917 H GLN A 125 -5.214 -0.084 9.211 1.00 98.71 H +ATOM 1918 CA GLN A 125 -7.283 -0.515 9.623 1.00 98.71 C +ATOM 1919 HA GLN A 125 -7.852 0.132 10.290 1.00 98.71 H +ATOM 1920 C GLN A 125 -7.771 -1.945 9.909 1.00 98.71 C +ATOM 1921 CB GLN A 125 -7.605 -0.047 8.195 1.00 98.71 C +ATOM 1922 HB2 GLN A 125 -8.686 -0.058 8.062 1.00 98.71 H +ATOM 1923 HB3 GLN A 125 -7.269 0.985 8.085 1.00 98.71 H +ATOM 1924 O GLN A 125 -8.909 -2.101 10.356 1.00 98.71 O +ATOM 1925 CG GLN A 125 -6.974 -0.885 7.081 1.00 98.71 C +ATOM 1926 HG2 GLN A 125 -7.293 -1.924 7.156 1.00 98.71 H +ATOM 1927 HG3 GLN A 125 -5.890 -0.822 7.186 1.00 98.71 H +ATOM 1928 CD GLN A 125 -7.323 -0.339 5.704 1.00 98.71 C +ATOM 1929 NE2 GLN A 125 -8.233 -0.943 4.976 1.00 98.71 N +ATOM 1930 HE21 GLN A 125 -8.672 -1.803 5.270 1.00 98.71 H +ATOM 1931 HE22 GLN A 125 -8.473 -0.489 4.106 1.00 98.71 H +ATOM 1932 OE1 GLN A 125 -6.788 0.658 5.260 1.00 98.71 O +ATOM 1933 N LEU A 126 -6.910 -2.965 9.759 1.00 98.85 N +ATOM 1934 H LEU A 126 -5.988 -2.771 9.396 1.00 98.85 H +ATOM 1935 CA LEU A 126 -7.202 -4.336 10.198 1.00 98.85 C +ATOM 1936 HA LEU A 126 -8.108 -4.674 9.695 1.00 98.85 H +ATOM 1937 C LEU A 126 -7.439 -4.391 11.709 1.00 98.85 C +ATOM 1938 CB LEU A 126 -6.040 -5.281 9.831 1.00 98.85 C +ATOM 1939 HB2 LEU A 126 -5.119 -4.911 10.283 1.00 98.85 H +ATOM 1940 HB3 LEU A 126 -5.886 -5.297 8.752 1.00 98.85 H +ATOM 1941 O LEU A 126 -8.443 -4.935 12.163 1.00 98.85 O +ATOM 1942 CG LEU A 126 -6.213 -6.732 10.290 1.00 98.85 C +ATOM 1943 HG LEU A 126 -6.377 -6.758 11.367 1.00 98.85 H +ATOM 1944 CD1 LEU A 126 -7.388 -7.405 9.589 1.00 98.85 C +ATOM 1945 HD11 LEU A 126 -7.236 -7.392 8.510 1.00 98.85 H +ATOM 1946 HD12 LEU A 126 -8.308 -6.871 9.830 1.00 98.85 H +ATOM 1947 HD13 LEU A 126 -7.477 -8.437 9.929 1.00 98.85 H +ATOM 1948 CD2 LEU A 126 -4.938 -7.513 10.001 1.00 98.85 C +ATOM 1949 HD21 LEU A 126 -4.795 -7.614 8.925 1.00 98.85 H +ATOM 1950 HD22 LEU A 126 -5.016 -8.499 10.461 1.00 98.85 H +ATOM 1951 HD23 LEU A 126 -4.077 -6.999 10.429 1.00 98.85 H +ATOM 1952 N LEU A 127 -6.520 -3.827 12.499 1.00 98.80 N +ATOM 1953 H LEU A 127 -5.725 -3.382 12.062 1.00 98.80 H +ATOM 1954 CA LEU A 127 -6.598 -3.887 13.963 1.00 98.80 C +ATOM 1955 HA LEU A 127 -6.658 -4.932 14.266 1.00 98.80 H +ATOM 1956 C LEU A 127 -7.855 -3.193 14.506 1.00 98.80 C +ATOM 1957 CB LEU A 127 -5.347 -3.263 14.598 1.00 98.80 C +ATOM 1958 HB2 LEU A 127 -5.330 -2.200 14.360 1.00 98.80 H +ATOM 1959 HB3 LEU A 127 -5.453 -3.361 15.678 1.00 98.80 H +ATOM 1960 O LEU A 127 -8.450 -3.671 15.474 1.00 98.80 O +ATOM 1961 CG LEU A 127 -3.990 -3.865 14.197 1.00 98.80 C +ATOM 1962 HG LEU A 127 -3.771 -3.595 13.164 1.00 98.80 H +ATOM 1963 CD1 LEU A 127 -2.907 -3.237 15.071 1.00 98.80 C +ATOM 1964 HD11 LEU A 127 -1.924 -3.559 14.727 1.00 98.80 H +ATOM 1965 HD12 LEU A 127 -2.957 -2.152 14.980 1.00 98.80 H +ATOM 1966 HD13 LEU A 127 -3.044 -3.523 16.114 1.00 98.80 H +ATOM 1967 CD2 LEU A 127 -3.926 -5.390 14.306 1.00 98.80 C +ATOM 1968 HD21 LEU A 127 -4.621 -5.838 13.597 1.00 98.80 H +ATOM 1969 HD22 LEU A 127 -2.922 -5.727 14.046 1.00 98.80 H +ATOM 1970 HD23 LEU A 127 -4.167 -5.717 15.318 1.00 98.80 H +ATOM 1971 N ILE A 128 -8.275 -2.098 13.865 1.00 98.81 N +ATOM 1972 H ILE A 128 -7.706 -1.754 13.106 1.00 98.81 H +ATOM 1973 CA ILE A 128 -9.501 -1.369 14.214 1.00 98.81 C +ATOM 1974 HA ILE A 128 -9.465 -1.112 15.272 1.00 98.81 H +ATOM 1975 C ILE A 128 -10.735 -2.255 14.013 1.00 98.81 C +ATOM 1976 CB ILE A 128 -9.591 -0.058 13.396 1.00 98.81 C +ATOM 1977 HB ILE A 128 -9.419 -0.295 12.347 1.00 98.81 H +ATOM 1978 O ILE A 128 -11.565 -2.366 14.919 1.00 98.81 O +ATOM 1979 CG1 ILE A 128 -8.506 0.938 13.865 1.00 98.81 C +ATOM 1980 HG12 ILE A 128 -7.555 0.422 13.996 1.00 98.81 H +ATOM 1981 HG13 ILE A 128 -8.788 1.350 14.834 1.00 98.81 H +ATOM 1982 CG2 ILE A 128 -10.987 0.588 13.523 1.00 98.81 C +ATOM 1983 HG21 ILE A 128 -11.744 -0.053 13.070 1.00 98.81 H +ATOM 1984 HG22 ILE A 128 -11.022 1.543 13.000 1.00 98.81 H +ATOM 1985 HG23 ILE A 128 -11.233 0.750 14.572 1.00 98.81 H +ATOM 1986 CD1 ILE A 128 -8.269 2.090 12.882 1.00 98.81 C +ATOM 1987 HD11 ILE A 128 -7.971 1.696 11.910 1.00 98.81 H +ATOM 1988 HD12 ILE A 128 -7.471 2.728 13.262 1.00 98.81 H +ATOM 1989 HD13 ILE A 128 -9.169 2.694 12.767 1.00 98.81 H +ATOM 1990 N VAL A 129 -10.865 -2.914 12.854 1.00 98.76 N +ATOM 1991 H VAL A 129 -10.153 -2.817 12.144 1.00 98.76 H +ATOM 1992 CA VAL A 129 -12.019 -3.794 12.600 1.00 98.76 C +ATOM 1993 HA VAL A 129 -12.907 -3.286 12.977 1.00 98.76 H +ATOM 1994 C VAL A 129 -11.955 -5.111 13.378 1.00 98.76 C +ATOM 1995 CB VAL A 129 -12.279 -4.042 11.107 1.00 98.76 C +ATOM 1996 HB VAL A 129 -13.182 -4.649 11.046 1.00 98.76 H +ATOM 1997 O VAL A 129 -12.997 -5.710 13.624 1.00 98.76 O +ATOM 1998 CG1 VAL A 129 -12.565 -2.729 10.369 1.00 98.76 C +ATOM 1999 HG11 VAL A 129 -12.920 -2.951 9.363 1.00 98.76 H +ATOM 2000 HG12 VAL A 129 -13.340 -2.169 10.892 1.00 98.76 H +ATOM 2001 HG13 VAL A 129 -11.660 -2.125 10.305 1.00 98.76 H +ATOM 2002 CG2 VAL A 129 -11.166 -4.811 10.395 1.00 98.76 C +ATOM 2003 HG21 VAL A 129 -10.255 -4.213 10.365 1.00 98.76 H +ATOM 2004 HG22 VAL A 129 -10.962 -5.753 10.904 1.00 98.76 H +ATOM 2005 HG23 VAL A 129 -11.479 -5.030 9.375 1.00 98.76 H +ATOM 2006 N LEU A 130 -10.772 -5.518 13.849 1.00 98.76 N +ATOM 2007 H LEU A 130 -9.948 -5.031 13.527 1.00 98.76 H +ATOM 2008 CA LEU A 130 -10.584 -6.606 14.820 1.00 98.76 C +ATOM 2009 HA LEU A 130 -11.245 -7.430 14.548 1.00 98.76 H +ATOM 2010 C LEU A 130 -10.979 -6.235 16.257 1.00 98.76 C +ATOM 2011 CB LEU A 130 -9.121 -7.088 14.787 1.00 98.76 C +ATOM 2012 HB2 LEU A 130 -8.920 -7.691 15.671 1.00 98.76 H +ATOM 2013 HB3 LEU A 130 -8.468 -6.216 14.838 1.00 98.76 H +ATOM 2014 O LEU A 130 -10.769 -7.031 17.168 1.00 98.76 O +ATOM 2015 CG LEU A 130 -8.735 -7.935 13.570 1.00 98.76 C +ATOM 2016 HG LEU A 130 -8.917 -7.386 12.646 1.00 98.76 H +ATOM 2017 CD1 LEU A 130 -7.246 -8.268 13.676 1.00 98.76 C +ATOM 2018 HD11 LEU A 130 -7.057 -8.872 14.563 1.00 98.76 H +ATOM 2019 HD12 LEU A 130 -6.928 -8.813 12.787 1.00 98.76 H +ATOM 2020 HD13 LEU A 130 -6.669 -7.345 13.735 1.00 98.76 H +ATOM 2021 CD2 LEU A 130 -9.513 -9.249 13.523 1.00 98.76 C +ATOM 2022 HD21 LEU A 130 -9.140 -9.855 12.697 1.00 98.76 H +ATOM 2023 HD22 LEU A 130 -10.571 -9.054 13.345 1.00 98.76 H +ATOM 2024 HD23 LEU A 130 -9.398 -9.799 14.457 1.00 98.76 H +ATOM 2025 N ASN A 131 -11.538 -5.043 16.482 1.00 98.64 N +ATOM 2026 H ASN A 131 -11.639 -4.418 15.694 1.00 98.64 H +ATOM 2027 CA ASN A 131 -11.985 -4.564 17.790 1.00 98.64 C +ATOM 2028 HA ASN A 131 -12.399 -3.571 17.615 1.00 98.64 H +ATOM 2029 C ASN A 131 -10.872 -4.344 18.827 1.00 98.64 C +ATOM 2030 CB ASN A 131 -13.128 -5.459 18.316 1.00 98.64 C +ATOM 2031 HB2 ASN A 131 -13.482 -5.084 19.277 1.00 98.64 H +ATOM 2032 HB3 ASN A 131 -12.776 -6.477 18.480 1.00 98.64 H +ATOM 2033 O ASN A 131 -11.182 -4.126 20.006 1.00 98.64 O +ATOM 2034 CG ASN A 131 -14.295 -5.466 17.365 1.00 98.64 C +ATOM 2035 ND2 ASN A 131 -14.712 -6.590 16.850 1.00 98.64 N +ATOM 2036 HD21 ASN A 131 -14.276 -7.461 17.115 1.00 98.64 H +ATOM 2037 HD22 ASN A 131 -15.460 -6.555 16.172 1.00 98.64 H +ATOM 2038 OD1 ASN A 131 -14.862 -4.413 17.135 1.00 98.64 O +ATOM 2039 N LEU A 132 -9.601 -4.328 18.406 1.00 98.50 N +ATOM 2040 H LEU A 132 -9.413 -4.438 17.419 1.00 98.50 H +ATOM 2041 CA LEU A 132 -8.491 -4.005 19.297 1.00 98.50 C +ATOM 2042 HA LEU A 132 -8.595 -4.614 20.195 1.00 98.50 H +ATOM 2043 C LEU A 132 -8.562 -2.538 19.722 1.00 98.50 C +ATOM 2044 CB LEU A 132 -7.130 -4.320 18.655 1.00 98.50 C +ATOM 2045 HB2 LEU A 132 -6.358 -4.054 19.377 1.00 98.50 H +ATOM 2046 HB3 LEU A 132 -6.999 -3.687 17.778 1.00 98.50 H +ATOM 2047 O LEU A 132 -8.870 -1.648 18.930 1.00 98.50 O +ATOM 2048 CG LEU A 132 -6.914 -5.784 18.237 1.00 98.50 C +ATOM 2049 HG LEU A 132 -7.492 -5.993 17.337 1.00 98.50 H +ATOM 2050 CD1 LEU A 132 -5.429 -5.992 17.929 1.00 98.50 C +ATOM 2051 HD11 LEU A 132 -4.846 -5.960 18.849 1.00 98.50 H +ATOM 2052 HD12 LEU A 132 -5.294 -6.957 17.441 1.00 98.50 H +ATOM 2053 HD13 LEU A 132 -5.086 -5.200 17.262 1.00 98.50 H +ATOM 2054 CD2 LEU A 132 -7.310 -6.774 19.328 1.00 98.50 C +ATOM 2055 HD21 LEU A 132 -6.910 -6.468 20.294 1.00 98.50 H +ATOM 2056 HD22 LEU A 132 -8.396 -6.841 19.396 1.00 98.50 H +ATOM 2057 HD23 LEU A 132 -6.929 -7.767 19.089 1.00 98.50 H +ATOM 2058 N LYS A 133 -8.254 -2.274 20.992 1.00 97.94 N +ATOM 2059 H LYS A 133 -7.976 -3.045 21.583 1.00 97.94 H +ATOM 2060 CA LYS A 133 -8.288 -0.927 21.579 1.00 97.94 C +ATOM 2061 HA LYS A 133 -8.045 -0.208 20.797 1.00 97.94 H +ATOM 2062 C LYS A 133 -7.239 -0.763 22.678 1.00 97.94 C +ATOM 2063 CB LYS A 133 -9.721 -0.631 22.063 1.00 97.94 C +ATOM 2064 HB2 LYS A 133 -9.790 0.413 22.368 1.00 97.94 H +ATOM 2065 HB3 LYS A 133 -10.404 -0.777 21.225 1.00 97.94 H +ATOM 2066 O LYS A 133 -6.661 -1.742 23.150 1.00 97.94 O +ATOM 2067 CG LYS A 133 -10.152 -1.526 23.237 1.00 97.94 C +ATOM 2068 HG2 LYS A 133 -9.944 -2.572 23.013 1.00 97.94 H +ATOM 2069 HG3 LYS A 133 -9.567 -1.250 24.114 1.00 97.94 H +ATOM 2070 CD LYS A 133 -11.637 -1.391 23.592 1.00 97.94 C +ATOM 2071 HD2 LYS A 133 -11.777 -1.852 24.570 1.00 97.94 H +ATOM 2072 HD3 LYS A 133 -11.909 -0.338 23.665 1.00 97.94 H +ATOM 2073 CE LYS A 133 -12.529 -2.108 22.569 1.00 97.94 C +ATOM 2074 HE2 LYS A 133 -12.073 -3.068 22.329 1.00 97.94 H +ATOM 2075 HE3 LYS A 133 -12.559 -1.526 21.648 1.00 97.94 H +ATOM 2076 NZ LYS A 133 -13.891 -2.324 23.121 1.00 97.94 N +ATOM 2077 HZ1 LYS A 133 -13.827 -2.854 23.979 1.00 97.94 H +ATOM 2078 HZ2 LYS A 133 -14.451 -2.865 22.478 1.00 97.94 H +ATOM 2079 HZ3 LYS A 133 -14.345 -1.445 23.327 1.00 97.94 H +ATOM 2080 N GLY A 134 -7.008 0.482 23.097 1.00 98.27 N +ATOM 2081 H GLY A 134 -7.482 1.238 22.625 1.00 98.27 H +ATOM 2082 CA GLY A 134 -6.139 0.813 24.229 1.00 98.27 C +ATOM 2083 HA2 GLY A 134 -6.059 1.896 24.321 1.00 98.27 H +ATOM 2084 HA3 GLY A 134 -6.593 0.430 25.143 1.00 98.27 H +ATOM 2085 C GLY A 134 -4.724 0.242 24.093 1.00 98.27 C +ATOM 2086 O GLY A 134 -4.118 0.294 23.021 1.00 98.27 O +ATOM 2087 N LYS A 135 -4.203 -0.325 25.188 1.00 98.01 N +ATOM 2088 H LYS A 135 -4.761 -0.335 26.029 1.00 98.01 H +ATOM 2089 CA LYS A 135 -2.836 -0.859 25.252 1.00 98.01 C +ATOM 2090 HA LYS A 135 -2.152 -0.045 25.012 1.00 98.01 H +ATOM 2091 C LYS A 135 -2.576 -1.962 24.229 1.00 98.01 C +ATOM 2092 CB LYS A 135 -2.554 -1.359 26.681 1.00 98.01 C +ATOM 2093 HB2 LYS A 135 -2.681 -0.531 27.378 1.00 98.01 H +ATOM 2094 HB3 LYS A 135 -3.285 -2.125 26.939 1.00 98.01 H +ATOM 2095 O LYS A 135 -1.485 -1.990 23.664 1.00 98.01 O +ATOM 2096 CG LYS A 135 -1.148 -1.956 26.880 1.00 98.01 C +ATOM 2097 HG2 LYS A 135 -1.070 -2.294 27.913 1.00 98.01 H +ATOM 2098 HG3 LYS A 135 -1.026 -2.829 26.239 1.00 98.01 H +ATOM 2099 CD LYS A 135 -0.020 -0.945 26.611 1.00 98.01 C +ATOM 2100 HD2 LYS A 135 -0.154 -0.091 27.275 1.00 98.01 H +ATOM 2101 HD3 LYS A 135 -0.058 -0.587 25.583 1.00 98.01 H +ATOM 2102 CE LYS A 135 1.358 -1.558 26.884 1.00 98.01 C +ATOM 2103 HE2 LYS A 135 2.094 -0.755 26.903 1.00 98.01 H +ATOM 2104 HE3 LYS A 135 1.348 -2.018 27.872 1.00 98.01 H +ATOM 2105 NZ LYS A 135 1.729 -2.554 25.849 1.00 98.01 N +ATOM 2106 HZ1 LYS A 135 1.037 -3.287 25.789 1.00 98.01 H +ATOM 2107 HZ2 LYS A 135 2.626 -2.967 26.061 1.00 98.01 H +ATOM 2108 HZ3 LYS A 135 1.776 -2.110 24.943 1.00 98.01 H +ATOM 2109 N GLU A 136 -3.542 -2.853 24.000 1.00 98.31 N +ATOM 2110 H GLU A 136 -4.433 -2.747 24.462 1.00 98.31 H +ATOM 2111 CA GLU A 136 -3.365 -3.959 23.058 1.00 98.31 C +ATOM 2112 HA GLU A 136 -2.437 -4.474 23.306 1.00 98.31 H +ATOM 2113 C GLU A 136 -3.230 -3.450 21.623 1.00 98.31 C +ATOM 2114 CB GLU A 136 -4.509 -4.977 23.172 1.00 98.31 C +ATOM 2115 HB2 GLU A 136 -4.564 -5.336 24.200 1.00 98.31 H +ATOM 2116 HB3 GLU A 136 -5.452 -4.504 22.901 1.00 98.31 H +ATOM 2117 O GLU A 136 -2.305 -3.878 20.929 1.00 98.31 O +ATOM 2118 CG GLU A 136 -4.222 -6.160 22.230 1.00 98.31 C +ATOM 2119 HG2 GLU A 136 -4.203 -5.805 21.200 1.00 98.31 H +ATOM 2120 HG3 GLU A 136 -3.233 -6.555 22.460 1.00 98.31 H +ATOM 2121 CD GLU A 136 -5.235 -7.301 22.299 1.00 98.31 C +ATOM 2122 OE1 GLU A 136 -4.897 -8.336 21.669 1.00 98.31 O +ATOM 2123 OE2 GLU A 136 -6.290 -7.119 22.938 1.00 98.31 O +ATOM 2124 N LEU A 137 -4.094 -2.514 21.204 1.00 98.55 N +ATOM 2125 H LEU A 137 -4.815 -2.208 21.842 1.00 98.55 H +ATOM 2126 CA LEU A 137 -3.996 -1.872 19.891 1.00 98.55 C +ATOM 2127 HA LEU A 137 -4.089 -2.638 19.121 1.00 98.55 H +ATOM 2128 C LEU A 137 -2.631 -1.209 19.720 1.00 98.55 C +ATOM 2129 CB LEU A 137 -5.132 -0.848 19.717 1.00 98.55 C +ATOM 2130 HB2 LEU A 137 -5.115 -0.156 20.559 1.00 98.55 H +ATOM 2131 HB3 LEU A 137 -6.079 -1.388 19.733 1.00 98.55 H +ATOM 2132 O LEU A 137 -1.943 -1.501 18.747 1.00 98.55 O +ATOM 2133 CG LEU A 137 -5.070 -0.024 18.415 1.00 98.55 C +ATOM 2134 HG LEU A 137 -4.128 0.523 18.368 1.00 98.55 H +ATOM 2135 CD1 LEU A 137 -5.197 -0.906 17.176 1.00 98.55 C +ATOM 2136 HD11 LEU A 137 -6.126 -1.475 17.214 1.00 98.55 H +ATOM 2137 HD12 LEU A 137 -5.206 -0.280 16.284 1.00 98.55 H +ATOM 2138 HD13 LEU A 137 -4.344 -1.581 17.108 1.00 98.55 H +ATOM 2139 CD2 LEU A 137 -6.208 0.995 18.400 1.00 98.55 C +ATOM 2140 HD21 LEU A 137 -7.170 0.484 18.412 1.00 98.55 H +ATOM 2141 HD22 LEU A 137 -6.128 1.655 19.264 1.00 98.55 H +ATOM 2142 HD23 LEU A 137 -6.142 1.600 17.495 1.00 98.55 H +ATOM 2143 N PHE A 138 -2.222 -0.385 20.691 1.00 98.59 N +ATOM 2144 H PHE A 138 -2.846 -0.196 21.462 1.00 98.59 H +ATOM 2145 CA PHE A 138 -0.946 0.324 20.637 1.00 98.59 C +ATOM 2146 HA PHE A 138 -0.938 0.956 19.750 1.00 98.59 H +ATOM 2147 C PHE A 138 0.232 -0.645 20.498 1.00 98.59 C +ATOM 2148 CB PHE A 138 -0.796 1.229 21.866 1.00 98.59 C +ATOM 2149 HB2 PHE A 138 -1.640 1.918 21.899 1.00 98.59 H +ATOM 2150 HB3 PHE A 138 -0.833 0.623 22.772 1.00 98.59 H +ATOM 2151 O PHE A 138 0.965 -0.563 19.521 1.00 98.59 O +ATOM 2152 CG PHE A 138 0.489 2.035 21.857 1.00 98.59 C +ATOM 2153 CD1 PHE A 138 1.638 1.550 22.512 1.00 98.59 C +ATOM 2154 HD1 PHE A 138 1.609 0.603 23.030 1.00 98.59 H +ATOM 2155 CD2 PHE A 138 0.548 3.257 21.161 1.00 98.59 C +ATOM 2156 HD2 PHE A 138 -0.322 3.633 20.644 1.00 98.59 H +ATOM 2157 CE1 PHE A 138 2.837 2.284 22.474 1.00 98.59 C +ATOM 2158 HE1 PHE A 138 3.725 1.910 22.961 1.00 98.59 H +ATOM 2159 CE2 PHE A 138 1.746 3.992 21.126 1.00 98.59 C +ATOM 2160 HE2 PHE A 138 1.792 4.928 20.590 1.00 98.59 H +ATOM 2161 CZ PHE A 138 2.889 3.507 21.783 1.00 98.59 C +ATOM 2162 HZ PHE A 138 3.810 4.070 21.748 1.00 98.59 H +ATOM 2163 N SER A 139 0.385 -1.624 21.401 1.00 98.43 N +ATOM 2164 H SER A 139 -0.286 -1.721 22.150 1.00 98.43 H +ATOM 2165 CA SER A 139 1.528 -2.547 21.311 1.00 98.43 C +ATOM 2166 HA SER A 139 2.436 -1.949 21.234 1.00 98.43 H +ATOM 2167 C SER A 139 1.499 -3.432 20.073 1.00 98.43 C +ATOM 2168 CB SER A 139 1.665 -3.442 22.540 1.00 98.43 C +ATOM 2169 HB2 SER A 139 2.408 -4.213 22.337 1.00 98.43 H +ATOM 2170 HB3 SER A 139 2.043 -2.825 23.356 1.00 98.43 H +ATOM 2171 O SER A 139 2.554 -3.734 19.528 1.00 98.43 O +ATOM 2172 OG SER A 139 0.453 -4.054 22.943 1.00 98.43 O +ATOM 2173 HG SER A 139 -0.043 -4.314 22.163 1.00 98.43 H +ATOM 2174 N THR A 140 0.314 -3.861 19.631 1.00 98.61 N +ATOM 2175 H THR A 140 -0.531 -3.517 20.064 1.00 98.61 H +ATOM 2176 CA THR A 140 0.196 -4.691 18.426 1.00 98.61 C +ATOM 2177 HA THR A 140 0.886 -5.531 18.499 1.00 98.61 H +ATOM 2178 C THR A 140 0.589 -3.888 17.190 1.00 98.61 C +ATOM 2179 CB THR A 140 -1.224 -5.250 18.272 1.00 98.61 C +ATOM 2180 HB THR A 140 -1.926 -4.426 18.145 1.00 98.61 H +ATOM 2181 O THR A 140 1.372 -4.376 16.380 1.00 98.61 O +ATOM 2182 CG2 THR A 140 -1.358 -6.194 17.084 1.00 98.61 C +ATOM 2183 HG21 THR A 140 -0.655 -7.022 17.177 1.00 98.61 H +ATOM 2184 HG22 THR A 140 -2.382 -6.566 17.044 1.00 98.61 H +ATOM 2185 HG23 THR A 140 -1.158 -5.661 16.154 1.00 98.61 H +ATOM 2186 OG1 THR A 140 -1.587 -5.978 19.428 1.00 98.61 O +ATOM 2187 HG1 THR A 140 -1.916 -5.311 20.036 1.00 98.61 H +ATOM 2188 N ALA A 141 0.105 -2.646 17.074 1.00 98.59 N +ATOM 2189 H ALA A 141 -0.515 -2.283 17.784 1.00 98.59 H +ATOM 2190 CA ALA A 141 0.479 -1.739 15.997 1.00 98.59 C +ATOM 2191 HA ALA A 141 0.255 -2.216 15.042 1.00 98.59 H +ATOM 2192 C ALA A 141 1.983 -1.434 16.016 1.00 98.59 C +ATOM 2193 CB ALA A 141 -0.359 -0.460 16.104 1.00 98.59 C +ATOM 2194 HB1 ALA A 141 -1.421 -0.702 16.066 1.00 98.59 H +ATOM 2195 HB2 ALA A 141 -0.143 0.054 17.041 1.00 98.59 H +ATOM 2196 HB3 ALA A 141 -0.118 0.202 15.273 1.00 98.59 H +ATOM 2197 O ALA A 141 2.615 -1.520 14.972 1.00 98.59 O +ATOM 2198 N THR A 142 2.578 -1.159 17.183 1.00 98.66 N +ATOM 2199 H THR A 142 2.008 -1.030 18.007 1.00 98.66 H +ATOM 2200 CA THR A 142 4.025 -0.914 17.305 1.00 98.66 C +ATOM 2201 HA THR A 142 4.280 -0.032 16.717 1.00 98.66 H +ATOM 2202 C THR A 142 4.847 -2.075 16.750 1.00 98.66 C +ATOM 2203 CB THR A 142 4.431 -0.661 18.766 1.00 98.66 C +ATOM 2204 HB THR A 142 4.209 -1.548 19.359 1.00 98.66 H +ATOM 2205 O THR A 142 5.692 -1.856 15.889 1.00 98.66 O +ATOM 2206 CG2 THR A 142 5.912 -0.322 18.925 1.00 98.66 C +ATOM 2207 HG21 THR A 142 6.116 -0.038 19.957 1.00 98.66 H +ATOM 2208 HG22 THR A 142 6.524 -1.190 18.682 1.00 98.66 H +ATOM 2209 HG23 THR A 142 6.185 0.501 18.264 1.00 98.66 H +ATOM 2210 OG1 THR A 142 3.717 0.422 19.309 1.00 98.66 O +ATOM 2211 HG1 THR A 142 3.956 1.215 18.823 1.00 98.66 H +ATOM 2212 N TRP A 143 4.589 -3.312 17.189 1.00 98.65 N +ATOM 2213 H TRP A 143 3.877 -3.453 17.891 1.00 98.65 H +ATOM 2214 CA TRP A 143 5.350 -4.474 16.713 1.00 98.65 C +ATOM 2215 HA TRP A 143 6.414 -4.275 16.845 1.00 98.65 H +ATOM 2216 C TRP A 143 5.153 -4.746 15.221 1.00 98.65 C +ATOM 2217 CB TRP A 143 4.983 -5.711 17.538 1.00 98.65 C +ATOM 2218 HB2 TRP A 143 5.344 -6.595 17.013 1.00 98.65 H +ATOM 2219 HB3 TRP A 143 3.898 -5.792 17.615 1.00 98.65 H +ATOM 2220 O TRP A 143 6.116 -5.065 14.527 1.00 98.65 O +ATOM 2221 CG TRP A 143 5.595 -5.734 18.901 1.00 98.65 C +ATOM 2222 CD1 TRP A 143 4.935 -5.725 20.080 1.00 98.65 C +ATOM 2223 HD1 TRP A 143 3.859 -5.704 20.175 1.00 98.65 H +ATOM 2224 CD2 TRP A 143 7.015 -5.785 19.237 1.00 98.65 C +ATOM 2225 CE2 TRP A 143 7.140 -5.792 20.657 1.00 98.65 C +ATOM 2226 CE3 TRP A 143 8.207 -5.836 18.483 1.00 98.65 C +ATOM 2227 HE3 TRP A 143 8.157 -5.845 17.404 1.00 98.65 H +ATOM 2228 NE1 TRP A 143 5.843 -5.755 21.120 1.00 98.65 N +ATOM 2229 HE1 TRP A 143 5.588 -5.786 22.097 1.00 98.65 H +ATOM 2230 CH2 TRP A 143 9.552 -5.887 20.524 1.00 98.65 C +ATOM 2231 HH2 TRP A 143 10.521 -5.927 20.998 1.00 98.65 H +ATOM 2232 CZ2 TRP A 143 8.383 -5.842 21.303 1.00 98.65 C +ATOM 2233 HZ2 TRP A 143 8.447 -5.851 22.381 1.00 98.65 H +ATOM 2234 CZ3 TRP A 143 9.462 -5.884 19.120 1.00 98.65 C +ATOM 2235 HZ3 TRP A 143 10.364 -5.923 18.528 1.00 98.65 H +ATOM 2236 N LEU A 144 3.928 -4.580 14.720 1.00 98.76 N +ATOM 2237 H LEU A 144 3.180 -4.312 15.343 1.00 98.76 H +ATOM 2238 CA LEU A 144 3.629 -4.717 13.296 1.00 98.76 C +ATOM 2239 HA LEU A 144 4.003 -5.678 12.945 1.00 98.76 H +ATOM 2240 C LEU A 144 4.341 -3.658 12.447 1.00 98.76 C +ATOM 2241 CB LEU A 144 2.106 -4.642 13.106 1.00 98.76 C +ATOM 2242 HB2 LEU A 144 1.888 -4.339 12.082 1.00 98.76 H +ATOM 2243 HB3 LEU A 144 1.704 -3.862 13.752 1.00 98.76 H +ATOM 2244 O LEU A 144 4.903 -3.999 11.413 1.00 98.76 O +ATOM 2245 CG LEU A 144 1.374 -5.964 13.376 1.00 98.76 C +ATOM 2246 HG LEU A 144 1.613 -6.311 14.382 1.00 98.76 H +ATOM 2247 CD1 LEU A 144 -0.132 -5.734 13.289 1.00 98.76 C +ATOM 2248 HD11 LEU A 144 -0.410 -4.969 14.013 1.00 98.76 H +ATOM 2249 HD12 LEU A 144 -0.660 -6.660 13.519 1.00 98.76 H +ATOM 2250 HD13 LEU A 144 -0.405 -5.400 12.288 1.00 98.76 H +ATOM 2251 CD2 LEU A 144 1.732 -7.056 12.368 1.00 98.76 C +ATOM 2252 HD21 LEU A 144 1.095 -7.926 12.523 1.00 98.76 H +ATOM 2253 HD22 LEU A 144 2.767 -7.371 12.498 1.00 98.76 H +ATOM 2254 HD23 LEU A 144 1.594 -6.690 11.350 1.00 98.76 H +ATOM 2255 N ILE A 145 4.356 -2.397 12.885 1.00 98.71 N +ATOM 2256 H ILE A 145 3.867 -2.180 13.742 1.00 98.71 H +ATOM 2257 CA ILE A 145 5.022 -1.299 12.171 1.00 98.71 C +ATOM 2258 HA ILE A 145 4.715 -1.327 11.126 1.00 98.71 H +ATOM 2259 C ILE A 145 6.541 -1.488 12.180 1.00 98.71 C +ATOM 2260 CB ILE A 145 4.597 0.066 12.757 1.00 98.71 C +ATOM 2261 HB ILE A 145 4.717 0.034 13.840 1.00 98.71 H +ATOM 2262 O ILE A 145 7.170 -1.319 11.142 1.00 98.71 O +ATOM 2263 CG1 ILE A 145 3.110 0.324 12.418 1.00 98.71 C +ATOM 2264 HG12 ILE A 145 2.513 -0.557 12.654 1.00 98.71 H +ATOM 2265 HG13 ILE A 145 3.015 0.484 11.344 1.00 98.71 H +ATOM 2266 CG2 ILE A 145 5.469 1.213 12.209 1.00 98.71 C +ATOM 2267 HG21 ILE A 145 5.435 1.230 11.119 1.00 98.71 H +ATOM 2268 HG22 ILE A 145 6.508 1.094 12.519 1.00 98.71 H +ATOM 2269 HG23 ILE A 145 5.136 2.178 12.591 1.00 98.71 H +ATOM 2270 CD1 ILE A 145 2.491 1.511 13.168 1.00 98.71 C +ATOM 2271 HD11 ILE A 145 2.637 1.389 14.241 1.00 98.71 H +ATOM 2272 HD12 ILE A 145 2.937 2.449 12.840 1.00 98.71 H +ATOM 2273 HD13 ILE A 145 1.421 1.546 12.959 1.00 98.71 H +ATOM 2274 N LEU A 146 7.131 -1.895 13.308 1.00 98.70 N +ATOM 2275 H LEU A 146 6.568 -2.002 14.140 1.00 98.70 H +ATOM 2276 CA LEU A 146 8.565 -2.192 13.380 1.00 98.70 C +ATOM 2277 HA LEU A 146 9.125 -1.323 13.034 1.00 98.70 H +ATOM 2278 C LEU A 146 8.954 -3.349 12.451 1.00 98.70 C +ATOM 2279 CB LEU A 146 8.959 -2.515 14.832 1.00 98.70 C +ATOM 2280 HB2 LEU A 146 8.290 -3.289 15.208 1.00 98.70 H +ATOM 2281 HB3 LEU A 146 9.969 -2.925 14.830 1.00 98.70 H +ATOM 2282 O LEU A 146 9.948 -3.246 11.736 1.00 98.70 O +ATOM 2283 CG LEU A 146 8.933 -1.314 15.794 1.00 98.70 C +ATOM 2284 HG LEU A 146 7.951 -0.840 15.781 1.00 98.70 H +ATOM 2285 CD1 LEU A 146 9.214 -1.811 17.214 1.00 98.70 C +ATOM 2286 HD11 LEU A 146 9.172 -0.974 17.911 1.00 98.70 H +ATOM 2287 HD12 LEU A 146 8.464 -2.548 17.501 1.00 98.70 H +ATOM 2288 HD13 LEU A 146 10.202 -2.268 17.261 1.00 98.70 H +ATOM 2289 CD2 LEU A 146 9.971 -0.250 15.437 1.00 98.70 C +ATOM 2290 HD21 LEU A 146 9.726 0.207 14.478 1.00 98.70 H +ATOM 2291 HD22 LEU A 146 10.964 -0.697 15.381 1.00 98.70 H +ATOM 2292 HD23 LEU A 146 9.972 0.534 16.194 1.00 98.70 H +ATOM 2293 N ALA A 147 8.158 -4.423 12.420 1.00 98.60 N +ATOM 2294 H ALA A 147 7.363 -4.468 13.042 1.00 98.60 H +ATOM 2295 CA ALA A 147 8.385 -5.532 11.497 1.00 98.60 C +ATOM 2296 HA ALA A 147 9.412 -5.874 11.621 1.00 98.60 H +ATOM 2297 C ALA A 147 8.227 -5.092 10.031 1.00 98.60 C +ATOM 2298 CB ALA A 147 7.444 -6.687 11.860 1.00 98.60 C +ATOM 2299 HB1 ALA A 147 7.596 -6.976 12.900 1.00 98.60 H +ATOM 2300 HB2 ALA A 147 7.663 -7.543 11.222 1.00 98.60 H +ATOM 2301 HB3 ALA A 147 6.406 -6.385 11.717 1.00 98.60 H +ATOM 2302 O ALA A 147 9.073 -5.419 9.202 1.00 98.60 O +ATOM 2303 N ALA A 148 7.198 -4.297 9.719 1.00 98.61 N +ATOM 2304 H ALA A 148 6.516 -4.082 10.432 1.00 98.61 H +ATOM 2305 CA ALA A 148 6.984 -3.747 8.384 1.00 98.61 C +ATOM 2306 HA ALA A 148 6.904 -4.573 7.676 1.00 98.61 H +ATOM 2307 C ALA A 148 8.154 -2.862 7.934 1.00 98.61 C +ATOM 2308 CB ALA A 148 5.666 -2.965 8.367 1.00 98.61 C +ATOM 2309 HB1 ALA A 148 5.704 -2.143 9.083 1.00 98.61 H +ATOM 2310 HB2 ALA A 148 4.837 -3.625 8.621 1.00 98.61 H +ATOM 2311 HB3 ALA A 148 5.507 -2.554 7.370 1.00 98.61 H +ATOM 2312 O ALA A 148 8.666 -3.042 6.835 1.00 98.61 O +ATOM 2313 N TRP A 149 8.623 -1.938 8.773 1.00 98.79 N +ATOM 2314 H TRP A 149 8.161 -1.801 9.660 1.00 98.79 H +ATOM 2315 CA TRP A 149 9.773 -1.092 8.449 1.00 98.79 C +ATOM 2316 HA TRP A 149 9.606 -0.604 7.489 1.00 98.79 H +ATOM 2317 C TRP A 149 11.058 -1.901 8.286 1.00 98.79 C +ATOM 2318 CB TRP A 149 9.933 -0.011 9.518 1.00 98.79 C +ATOM 2319 HB2 TRP A 149 9.929 -0.480 10.502 1.00 98.79 H +ATOM 2320 HB3 TRP A 149 10.910 0.453 9.385 1.00 98.79 H +ATOM 2321 O TRP A 149 11.790 -1.661 7.332 1.00 98.79 O +ATOM 2322 CG TRP A 149 8.920 1.094 9.507 1.00 98.79 C +ATOM 2323 CD1 TRP A 149 7.959 1.319 8.577 1.00 98.79 C +ATOM 2324 HD1 TRP A 149 7.786 0.708 7.703 1.00 98.79 H +ATOM 2325 CD2 TRP A 149 8.809 2.191 10.459 1.00 98.79 C +ATOM 2326 CE2 TRP A 149 7.761 3.059 10.031 1.00 98.79 C +ATOM 2327 CE3 TRP A 149 9.514 2.548 11.629 1.00 98.79 C +ATOM 2328 HE3 TRP A 149 10.323 1.918 11.967 1.00 98.79 H +ATOM 2329 NE1 TRP A 149 7.278 2.482 8.875 1.00 98.79 N +ATOM 2330 HE1 TRP A 149 6.578 2.886 8.269 1.00 98.79 H +ATOM 2331 CH2 TRP A 149 8.147 4.555 11.894 1.00 98.79 C +ATOM 2332 HH2 TRP A 149 7.912 5.459 12.437 1.00 98.79 H +ATOM 2333 CZ2 TRP A 149 7.428 4.227 10.731 1.00 98.79 C +ATOM 2334 HZ2 TRP A 149 6.640 4.870 10.368 1.00 98.79 H +ATOM 2335 CZ3 TRP A 149 9.185 3.717 12.341 1.00 98.79 C +ATOM 2336 HZ3 TRP A 149 9.744 3.982 13.226 1.00 98.79 H +ATOM 2337 N GLY A 150 11.308 -2.898 9.142 1.00 98.66 N +ATOM 2338 H GLY A 150 10.682 -3.042 9.922 1.00 98.66 H +ATOM 2339 CA GLY A 150 12.430 -3.825 8.970 1.00 98.66 C +ATOM 2340 HA2 GLY A 150 12.391 -4.583 9.752 1.00 98.66 H +ATOM 2341 HA3 GLY A 150 13.371 -3.280 9.051 1.00 98.66 H +ATOM 2342 C GLY A 150 12.390 -4.534 7.613 1.00 98.66 C +ATOM 2343 O GLY A 150 13.382 -4.524 6.884 1.00 98.66 O +ATOM 2344 N MET A 151 11.223 -5.063 7.229 1.00 98.84 N +ATOM 2345 H MET A 151 10.455 -5.034 7.883 1.00 98.84 H +ATOM 2346 CA MET A 151 10.980 -5.685 5.920 1.00 98.84 C +ATOM 2347 HA MET A 151 11.652 -6.535 5.798 1.00 98.84 H +ATOM 2348 C MET A 151 11.241 -4.713 4.759 1.00 98.84 C +ATOM 2349 CB MET A 151 9.530 -6.199 5.884 1.00 98.84 C +ATOM 2350 HB2 MET A 151 8.855 -5.367 6.085 1.00 98.84 H +ATOM 2351 HB3 MET A 151 9.382 -6.935 6.674 1.00 98.84 H +ATOM 2352 O MET A 151 11.955 -5.055 3.818 1.00 98.84 O +ATOM 2353 CG MET A 151 9.117 -6.841 4.557 1.00 98.84 C +ATOM 2354 HG2 MET A 151 9.376 -6.188 3.724 1.00 98.84 H +ATOM 2355 HG3 MET A 151 9.666 -7.775 4.436 1.00 98.84 H +ATOM 2356 SD MET A 151 7.341 -7.196 4.459 1.00 98.84 S +ATOM 2357 CE MET A 151 6.666 -5.526 4.255 1.00 98.84 C +ATOM 2358 HE1 MET A 151 6.872 -4.925 5.141 1.00 98.84 H +ATOM 2359 HE2 MET A 151 7.117 -5.054 3.382 1.00 98.84 H +ATOM 2360 HE3 MET A 151 5.588 -5.591 4.109 1.00 98.84 H +ATOM 2361 N ILE A 152 10.682 -3.503 4.816 1.00 98.72 N +ATOM 2362 H ILE A 152 10.105 -3.282 5.615 1.00 98.72 H +ATOM 2363 CA ILE A 152 10.766 -2.525 3.723 1.00 98.72 C +ATOM 2364 HA ILE A 152 10.509 -3.021 2.787 1.00 98.72 H +ATOM 2365 C ILE A 152 12.188 -1.984 3.572 1.00 98.72 C +ATOM 2366 CB ILE A 152 9.766 -1.377 3.953 1.00 98.72 C +ATOM 2367 HB ILE A 152 9.988 -0.945 4.928 1.00 98.72 H +ATOM 2368 O ILE A 152 12.683 -1.914 2.454 1.00 98.72 O +ATOM 2369 CG1 ILE A 152 8.299 -1.866 3.943 1.00 98.72 C +ATOM 2370 HG12 ILE A 152 8.219 -2.864 4.375 1.00 98.72 H +ATOM 2371 HG13 ILE A 152 7.928 -1.927 2.919 1.00 98.72 H +ATOM 2372 CG2 ILE A 152 9.929 -0.279 2.885 1.00 98.72 C +ATOM 2373 HG21 ILE A 152 10.898 0.212 2.975 1.00 98.72 H +ATOM 2374 HG22 ILE A 152 9.836 -0.702 1.885 1.00 98.72 H +ATOM 2375 HG23 ILE A 152 9.167 0.489 3.012 1.00 98.72 H +ATOM 2376 CD1 ILE A 152 7.412 -0.921 4.761 1.00 98.72 C +ATOM 2377 HD11 ILE A 152 7.362 0.050 4.268 1.00 98.72 H +ATOM 2378 HD12 ILE A 152 7.827 -0.781 5.759 1.00 98.72 H +ATOM 2379 HD13 ILE A 152 6.406 -1.326 4.869 1.00 98.72 H +ATOM 2380 N ILE A 153 12.860 -1.629 4.672 1.00 98.72 N +ATOM 2381 H ILE A 153 12.398 -1.714 5.567 1.00 98.72 H +ATOM 2382 CA ILE A 153 14.223 -1.079 4.644 1.00 98.72 C +ATOM 2383 HA ILE A 153 14.246 -0.225 3.968 1.00 98.72 H +ATOM 2384 C ILE A 153 15.199 -2.116 4.087 1.00 98.72 C +ATOM 2385 CB ILE A 153 14.648 -0.599 6.053 1.00 98.72 C +ATOM 2386 HB ILE A 153 14.450 -1.402 6.763 1.00 98.72 H +ATOM 2387 O ILE A 153 15.981 -1.804 3.197 1.00 98.72 O +ATOM 2388 CG1 ILE A 153 13.827 0.647 6.461 1.00 98.72 C +ATOM 2389 HG12 ILE A 153 12.772 0.484 6.237 1.00 98.72 H +ATOM 2390 HG13 ILE A 153 14.153 1.506 5.873 1.00 98.72 H +ATOM 2391 CG2 ILE A 153 16.155 -0.275 6.109 1.00 98.72 C +ATOM 2392 HG21 ILE A 153 16.405 0.477 5.360 1.00 98.72 H +ATOM 2393 HG22 ILE A 153 16.753 -1.168 5.924 1.00 98.72 H +ATOM 2394 HG23 ILE A 153 16.435 0.096 7.094 1.00 98.72 H +ATOM 2395 CD1 ILE A 153 13.930 0.991 7.953 1.00 98.72 C +ATOM 2396 HD11 ILE A 153 13.657 0.125 8.555 1.00 98.72 H +ATOM 2397 HD12 ILE A 153 14.941 1.310 8.207 1.00 98.72 H +ATOM 2398 HD13 ILE A 153 13.246 1.809 8.181 1.00 98.72 H +ATOM 2399 N THR A 154 15.136 -3.356 4.573 1.00 98.58 N +ATOM 2400 H THR A 154 14.448 -3.567 5.281 1.00 98.58 H +ATOM 2401 CA THR A 154 16.016 -4.436 4.094 1.00 98.58 C +ATOM 2402 HA THR A 154 17.053 -4.105 4.158 1.00 98.58 H +ATOM 2403 C THR A 154 15.753 -4.760 2.624 1.00 98.58 C +ATOM 2404 CB THR A 154 15.869 -5.697 4.956 1.00 98.58 C +ATOM 2405 HB THR A 154 16.420 -6.519 4.500 1.00 98.58 H +ATOM 2406 O THR A 154 16.700 -4.868 1.850 1.00 98.58 O +ATOM 2407 CG2 THR A 154 16.377 -5.484 6.385 1.00 98.58 C +ATOM 2408 HG21 THR A 154 16.269 -4.444 6.695 1.00 98.58 H +ATOM 2409 HG22 THR A 154 17.429 -5.766 6.435 1.00 98.58 H +ATOM 2410 HG23 THR A 154 15.822 -6.111 7.082 1.00 98.58 H +ATOM 2411 OG1 THR A 154 14.523 -6.076 5.062 1.00 98.58 O +ATOM 2412 HG1 THR A 154 14.123 -5.524 5.738 1.00 98.58 H +ATOM 2413 N GLY A 155 14.485 -4.808 2.201 1.00 98.56 N +ATOM 2414 H GLY A 155 13.745 -4.733 2.885 1.00 98.56 H +ATOM 2415 CA GLY A 155 14.123 -4.974 0.791 1.00 98.56 C +ATOM 2416 HA2 GLY A 155 14.571 -5.891 0.408 1.00 98.56 H +ATOM 2417 HA3 GLY A 155 13.039 -5.057 0.716 1.00 98.56 H +ATOM 2418 C GLY A 155 14.582 -3.805 -0.090 1.00 98.56 C +ATOM 2419 O GLY A 155 15.076 -4.030 -1.192 1.00 98.56 O +ATOM 2420 N TYR A 156 14.480 -2.568 0.407 1.00 98.37 N +ATOM 2421 H TYR A 156 14.042 -2.444 1.308 1.00 98.37 H +ATOM 2422 CA TYR A 156 14.960 -1.369 -0.284 1.00 98.37 C +ATOM 2423 HA TYR A 156 14.507 -1.329 -1.274 1.00 98.37 H +ATOM 2424 C TYR A 156 16.479 -1.384 -0.463 1.00 98.37 C +ATOM 2425 CB TYR A 156 14.546 -0.104 0.479 1.00 98.37 C +ATOM 2426 HB2 TYR A 156 13.461 -0.009 0.450 1.00 98.37 H +ATOM 2427 HB3 TYR A 156 14.835 -0.202 1.525 1.00 98.37 H +ATOM 2428 O TYR A 156 16.962 -1.054 -1.541 1.00 98.37 O +ATOM 2429 CG TYR A 156 15.175 1.160 -0.080 1.00 98.37 C +ATOM 2430 CD1 TYR A 156 16.309 1.716 0.544 1.00 98.37 C +ATOM 2431 HD1 TYR A 156 16.715 1.255 1.433 1.00 98.37 H +ATOM 2432 CD2 TYR A 156 14.676 1.733 -1.266 1.00 98.37 C +ATOM 2433 HD2 TYR A 156 13.842 1.278 -1.779 1.00 98.37 H +ATOM 2434 CE1 TYR A 156 16.934 2.852 -0.004 1.00 98.37 C +ATOM 2435 HE1 TYR A 156 17.811 3.268 0.470 1.00 98.37 H +ATOM 2436 CE2 TYR A 156 15.290 2.878 -1.810 1.00 98.37 C +ATOM 2437 HE2 TYR A 156 14.919 3.321 -2.722 1.00 98.37 H +ATOM 2438 OH TYR A 156 17.018 4.538 -1.707 1.00 98.37 O +ATOM 2439 HH TYR A 156 17.790 4.795 -1.199 1.00 98.37 H +ATOM 2440 CZ TYR A 156 16.420 3.438 -1.181 1.00 98.37 C +ATOM 2441 N VAL A 157 17.235 -1.782 0.565 1.00 98.25 N +ATOM 2442 H VAL A 157 16.786 -2.010 1.440 1.00 98.25 H +ATOM 2443 CA VAL A 157 18.692 -1.934 0.448 1.00 98.25 C +ATOM 2444 HA VAL A 157 19.111 -1.006 0.060 1.00 98.25 H +ATOM 2445 C VAL A 157 19.022 -3.023 -0.569 1.00 98.25 C +ATOM 2446 CB VAL A 157 19.347 -2.226 1.810 1.00 98.25 C +ATOM 2447 HB VAL A 157 18.864 -3.087 2.273 1.00 98.25 H +ATOM 2448 O VAL A 157 19.863 -2.805 -1.431 1.00 98.25 O +ATOM 2449 CG1 VAL A 157 20.845 -2.513 1.668 1.00 98.25 C +ATOM 2450 HG11 VAL A 157 20.998 -3.434 1.105 1.00 98.25 H +ATOM 2451 HG12 VAL A 157 21.338 -1.694 1.144 1.00 98.25 H +ATOM 2452 HG13 VAL A 157 21.296 -2.636 2.653 1.00 98.25 H +ATOM 2453 CG2 VAL A 157 19.222 -1.018 2.749 1.00 98.25 C +ATOM 2454 HG21 VAL A 157 18.179 -0.723 2.863 1.00 98.25 H +ATOM 2455 HG22 VAL A 157 19.779 -0.173 2.343 1.00 98.25 H +ATOM 2456 HG23 VAL A 157 19.621 -1.275 3.730 1.00 98.25 H +ATOM 2457 N GLY A 158 18.331 -4.162 -0.521 1.00 98.31 N +ATOM 2458 H GLY A 158 17.667 -4.299 0.227 1.00 98.31 H +ATOM 2459 CA GLY A 158 18.577 -5.263 -1.445 1.00 98.31 C +ATOM 2460 HA2 GLY A 158 17.954 -6.102 -1.135 1.00 98.31 H +ATOM 2461 HA3 GLY A 158 19.621 -5.568 -1.370 1.00 98.31 H +ATOM 2462 C GLY A 158 18.282 -4.941 -2.913 1.00 98.31 C +ATOM 2463 O GLY A 158 19.037 -5.379 -3.772 1.00 98.31 O +ATOM 2464 N GLN A 159 17.231 -4.166 -3.222 1.00 96.99 N +ATOM 2465 H GLN A 159 16.622 -3.832 -2.490 1.00 96.99 H +ATOM 2466 CA GLN A 159 16.944 -3.792 -4.622 1.00 96.99 C +ATOM 2467 HA GLN A 159 17.014 -4.700 -5.221 1.00 96.99 H +ATOM 2468 C GLN A 159 17.990 -2.843 -5.219 1.00 96.99 C +ATOM 2469 CB GLN A 159 15.507 -3.268 -4.825 1.00 96.99 C +ATOM 2470 HB2 GLN A 159 15.314 -3.205 -5.896 1.00 96.99 H +ATOM 2471 HB3 GLN A 159 14.810 -4.007 -4.431 1.00 96.99 H +ATOM 2472 O GLN A 159 18.097 -2.757 -6.431 1.00 96.99 O +ATOM 2473 CG GLN A 159 15.158 -1.918 -4.192 1.00 96.99 C +ATOM 2474 HG2 GLN A 159 15.489 -1.930 -3.153 1.00 96.99 H +ATOM 2475 HG3 GLN A 159 14.072 -1.825 -4.176 1.00 96.99 H +ATOM 2476 CD GLN A 159 15.688 -0.691 -4.929 1.00 96.99 C +ATOM 2477 NE2 GLN A 159 16.325 0.224 -4.238 1.00 96.99 N +ATOM 2478 HE21 GLN A 159 16.603 0.019 -3.289 1.00 96.99 H +ATOM 2479 HE22 GLN A 159 16.728 0.973 -4.782 1.00 96.99 H +ATOM 2480 OE1 GLN A 159 15.462 -0.479 -6.105 1.00 96.99 O +ATOM 2481 N LEU A 160 18.819 -2.180 -4.399 1.00 97.40 N +ATOM 2482 H LEU A 160 18.751 -2.327 -3.403 1.00 97.40 H +ATOM 2483 CA LEU A 160 19.939 -1.378 -4.912 1.00 97.40 C +ATOM 2484 HA LEU A 160 19.564 -0.723 -5.699 1.00 97.40 H +ATOM 2485 C LEU A 160 21.035 -2.227 -5.571 1.00 97.40 C +ATOM 2486 CB LEU A 160 20.563 -0.531 -3.788 1.00 97.40 C +ATOM 2487 HB2 LEU A 160 21.418 0.010 -4.193 1.00 97.40 H +ATOM 2488 HB3 LEU A 160 20.949 -1.206 -3.024 1.00 97.40 H +ATOM 2489 O LEU A 160 21.925 -1.644 -6.182 1.00 97.40 O +ATOM 2490 CG LEU A 160 19.618 0.487 -3.140 1.00 97.40 C +ATOM 2491 HG LEU A 160 18.718 -0.021 -2.796 1.00 97.40 H +ATOM 2492 CD1 LEU A 160 20.293 1.137 -1.930 1.00 97.40 C +ATOM 2493 HD11 LEU A 160 21.179 1.687 -2.248 1.00 97.40 H +ATOM 2494 HD12 LEU A 160 20.585 0.360 -1.224 1.00 97.40 H +ATOM 2495 HD13 LEU A 160 19.590 1.813 -1.445 1.00 97.40 H +ATOM 2496 CD2 LEU A 160 19.215 1.598 -4.110 1.00 97.40 C +ATOM 2497 HD21 LEU A 160 18.523 2.285 -3.623 1.00 97.40 H +ATOM 2498 HD22 LEU A 160 20.100 2.146 -4.431 1.00 97.40 H +ATOM 2499 HD23 LEU A 160 18.738 1.177 -4.994 1.00 97.40 H +ATOM 2500 N TYR A 161 20.977 -3.553 -5.418 1.00 97.62 N +ATOM 2501 H TYR A 161 20.211 -3.942 -4.888 1.00 97.62 H +ATOM 2502 CA TYR A 161 21.950 -4.503 -5.953 1.00 97.62 C +ATOM 2503 HA TYR A 161 22.781 -3.930 -6.365 1.00 97.62 H +ATOM 2504 C TYR A 161 21.394 -5.360 -7.098 1.00 97.62 C +ATOM 2505 CB TYR A 161 22.502 -5.361 -4.811 1.00 97.62 C +ATOM 2506 HB2 TYR A 161 21.690 -5.923 -4.350 1.00 97.62 H +ATOM 2507 HB3 TYR A 161 23.203 -6.083 -5.229 1.00 97.62 H +ATOM 2508 O TYR A 161 21.982 -6.374 -7.470 1.00 97.62 O +ATOM 2509 CG TYR A 161 23.238 -4.560 -3.762 1.00 97.62 C +ATOM 2510 CD1 TYR A 161 24.557 -4.138 -4.011 1.00 97.62 C +ATOM 2511 HD1 TYR A 161 25.028 -4.386 -4.951 1.00 97.62 H +ATOM 2512 CD2 TYR A 161 22.589 -4.192 -2.570 1.00 97.62 C +ATOM 2513 HD2 TYR A 161 21.565 -4.495 -2.408 1.00 97.62 H +ATOM 2514 CE1 TYR A 161 25.241 -3.362 -3.057 1.00 97.62 C +ATOM 2515 HE1 TYR A 161 26.255 -3.043 -3.248 1.00 97.62 H +ATOM 2516 CE2 TYR A 161 23.266 -3.415 -1.613 1.00 97.62 C +ATOM 2517 HE2 TYR A 161 22.765 -3.139 -0.697 1.00 97.62 H +ATOM 2518 OH TYR A 161 25.270 -2.304 -0.904 1.00 97.62 O +ATOM 2519 HH TYR A 161 24.809 -2.392 -0.066 1.00 97.62 H +ATOM 2520 CZ TYR A 161 24.597 -3.004 -1.856 1.00 97.62 C +ATOM 2521 N GLU A 162 20.224 -5.011 -7.649 1.00 97.91 N +ATOM 2522 H GLU A 162 19.778 -4.149 -7.370 1.00 97.91 H +ATOM 2523 CA GLU A 162 19.540 -5.878 -8.617 1.00 97.91 C +ATOM 2524 HA GLU A 162 19.577 -6.892 -8.217 1.00 97.91 H +ATOM 2525 C GLU A 162 20.230 -5.988 -9.983 1.00 97.91 C +ATOM 2526 CB GLU A 162 18.058 -5.498 -8.743 1.00 97.91 C +ATOM 2527 HB2 GLU A 162 17.571 -6.308 -9.285 1.00 97.91 H +ATOM 2528 HB3 GLU A 162 17.612 -5.433 -7.750 1.00 97.91 H +ATOM 2529 O GLU A 162 19.915 -6.898 -10.749 1.00 97.91 O +ATOM 2530 CG GLU A 162 17.754 -4.196 -9.477 1.00 97.91 C +ATOM 2531 HG2 GLU A 162 18.267 -4.194 -10.438 1.00 97.91 H +ATOM 2532 HG3 GLU A 162 18.117 -3.359 -8.881 1.00 97.91 H +ATOM 2533 CD GLU A 162 16.246 -4.037 -9.703 1.00 97.91 C +ATOM 2534 OE1 GLU A 162 15.827 -3.957 -10.882 1.00 97.91 O +ATOM 2535 OE2 GLU A 162 15.457 -4.084 -8.735 1.00 97.91 O +ATOM 2536 N VAL A 163 21.178 -5.094 -10.271 1.00 97.30 N +ATOM 2537 H VAL A 163 21.349 -4.372 -9.586 1.00 97.30 H +ATOM 2538 CA VAL A 163 21.998 -5.103 -11.491 1.00 97.30 C +ATOM 2539 HA VAL A 163 21.524 -5.733 -12.243 1.00 97.30 H +ATOM 2540 C VAL A 163 23.391 -5.685 -11.241 1.00 97.30 C +ATOM 2541 CB VAL A 163 22.096 -3.674 -12.065 1.00 97.30 C +ATOM 2542 HB VAL A 163 22.440 -3.001 -11.279 1.00 97.30 H +ATOM 2543 O VAL A 163 23.872 -6.480 -12.046 1.00 97.30 O +ATOM 2544 CG1 VAL A 163 23.075 -3.567 -13.241 1.00 97.30 C +ATOM 2545 HG11 VAL A 163 24.094 -3.741 -12.898 1.00 97.30 H +ATOM 2546 HG12 VAL A 163 22.827 -4.300 -14.009 1.00 97.30 H +ATOM 2547 HG13 VAL A 163 23.032 -2.562 -13.661 1.00 97.30 H +ATOM 2548 CG2 VAL A 163 20.727 -3.184 -12.548 1.00 97.30 C +ATOM 2549 HG21 VAL A 163 20.012 -3.201 -11.725 1.00 97.30 H +ATOM 2550 HG22 VAL A 163 20.809 -2.163 -12.920 1.00 97.30 H +ATOM 2551 HG23 VAL A 163 20.355 -3.826 -13.346 1.00 97.30 H +ATOM 2552 N ASP A 164 24.055 -5.281 -10.155 1.00 96.38 N +ATOM 2553 H ASP A 164 23.589 -4.710 -9.464 1.00 96.38 H +ATOM 2554 CA ASP A 164 25.491 -5.491 -9.934 1.00 96.38 C +ATOM 2555 HA ASP A 164 25.945 -5.774 -10.884 1.00 96.38 H +ATOM 2556 C ASP A 164 25.829 -6.639 -8.963 1.00 96.38 C +ATOM 2557 CB ASP A 164 26.147 -4.154 -9.520 1.00 96.38 C +ATOM 2558 HB2 ASP A 164 26.015 -3.443 -10.335 1.00 96.38 H +ATOM 2559 HB3 ASP A 164 27.218 -4.317 -9.400 1.00 96.38 H +ATOM 2560 O ASP A 164 26.918 -7.205 -9.065 1.00 96.38 O +ATOM 2561 CG ASP A 164 25.599 -3.516 -8.233 1.00 96.38 C +ATOM 2562 OD1 ASP A 164 24.609 -4.046 -7.687 1.00 96.38 O +ATOM 2563 OD2 ASP A 164 26.154 -2.472 -7.817 1.00 96.38 O +ATOM 2564 N ASP A 165 24.917 -7.033 -8.064 1.00 97.79 N +ATOM 2565 H ASP A 165 24.077 -6.481 -7.978 1.00 97.79 H +ATOM 2566 CA ASP A 165 25.152 -8.094 -7.074 1.00 97.79 C +ATOM 2567 HA ASP A 165 25.808 -8.838 -7.525 1.00 97.79 H +ATOM 2568 C ASP A 165 23.854 -8.832 -6.672 1.00 97.79 C +ATOM 2569 CB ASP A 165 25.920 -7.507 -5.873 1.00 97.79 C +ATOM 2570 HB2 ASP A 165 26.801 -6.983 -6.242 1.00 97.79 H +ATOM 2571 HB3 ASP A 165 25.296 -6.774 -5.360 1.00 97.79 H +ATOM 2572 O ASP A 165 23.262 -8.630 -5.605 1.00 97.79 O +ATOM 2573 CG ASP A 165 26.391 -8.553 -4.856 1.00 97.79 C +ATOM 2574 OD1 ASP A 165 26.018 -9.748 -4.978 1.00 97.79 O +ATOM 2575 OD2 ASP A 165 27.087 -8.141 -3.895 1.00 97.79 O +ATOM 2576 N ILE A 166 23.425 -9.774 -7.523 1.00 98.00 N +ATOM 2577 H ILE A 166 23.895 -9.830 -8.415 1.00 98.00 H +ATOM 2578 CA ILE A 166 22.247 -10.628 -7.275 1.00 98.00 C +ATOM 2579 HA ILE A 166 21.387 -9.971 -7.141 1.00 98.00 H +ATOM 2580 C ILE A 166 22.377 -11.449 -5.980 1.00 98.00 C +ATOM 2581 CB ILE A 166 21.983 -11.546 -8.496 1.00 98.00 C +ATOM 2582 HB ILE A 166 22.917 -12.054 -8.734 1.00 98.00 H +ATOM 2583 O ILE A 166 21.366 -11.743 -5.337 1.00 98.00 O +ATOM 2584 CG1 ILE A 166 21.564 -10.750 -9.752 1.00 98.00 C +ATOM 2585 HG12 ILE A 166 21.512 -11.438 -10.597 1.00 98.00 H +ATOM 2586 HG13 ILE A 166 22.334 -10.015 -9.988 1.00 98.00 H +ATOM 2587 CG2 ILE A 166 20.939 -12.645 -8.212 1.00 98.00 C +ATOM 2588 HG21 ILE A 166 20.680 -13.161 -9.137 1.00 98.00 H +ATOM 2589 HG22 ILE A 166 20.040 -12.208 -7.778 1.00 98.00 H +ATOM 2590 HG23 ILE A 166 21.349 -13.379 -7.518 1.00 98.00 H +ATOM 2591 CD1 ILE A 166 20.218 -10.019 -9.655 1.00 98.00 C +ATOM 2592 HD11 ILE A 166 19.410 -10.717 -9.438 1.00 98.00 H +ATOM 2593 HD12 ILE A 166 20.256 -9.245 -8.887 1.00 98.00 H +ATOM 2594 HD13 ILE A 166 20.009 -9.545 -10.614 1.00 98.00 H +ATOM 2595 N ALA A 167 23.593 -11.813 -5.556 1.00 98.17 N +ATOM 2596 H ALA A 167 24.402 -11.399 -5.995 1.00 98.17 H +ATOM 2597 CA ALA A 167 23.781 -12.530 -4.296 1.00 98.17 C +ATOM 2598 HA ALA A 167 23.116 -13.394 -4.282 1.00 98.17 H +ATOM 2599 C ALA A 167 23.401 -11.634 -3.109 1.00 98.17 C +ATOM 2600 CB ALA A 167 25.226 -13.033 -4.203 1.00 98.17 C +ATOM 2601 HB1 ALA A 167 25.920 -12.193 -4.202 1.00 98.17 H +ATOM 2602 HB2 ALA A 167 25.358 -13.601 -3.282 1.00 98.17 H +ATOM 2603 HB3 ALA A 167 25.449 -13.677 -5.055 1.00 98.17 H +ATOM 2604 O ALA A 167 22.666 -12.063 -2.216 1.00 98.17 O +ATOM 2605 N GLN A 168 23.826 -10.371 -3.127 1.00 98.19 N +ATOM 2606 H GLN A 168 24.439 -10.076 -3.873 1.00 98.19 H +ATOM 2607 CA GLN A 168 23.447 -9.392 -2.117 1.00 98.19 C +ATOM 2608 HA GLN A 168 23.648 -9.831 -1.140 1.00 98.19 H +ATOM 2609 C GLN A 168 21.951 -9.056 -2.153 1.00 98.19 C +ATOM 2610 CB GLN A 168 24.358 -8.178 -2.271 1.00 98.19 C +ATOM 2611 HB2 GLN A 168 24.218 -7.709 -3.245 1.00 98.19 H +ATOM 2612 HB3 GLN A 168 25.374 -8.561 -2.181 1.00 98.19 H +ATOM 2613 O GLN A 168 21.336 -8.973 -1.085 1.00 98.19 O +ATOM 2614 CG GLN A 168 24.134 -7.147 -1.169 1.00 98.19 C +ATOM 2615 HG2 GLN A 168 23.997 -7.665 -0.220 1.00 98.19 H +ATOM 2616 HG3 GLN A 168 23.229 -6.589 -1.408 1.00 98.19 H +ATOM 2617 CD GLN A 168 25.268 -6.149 -0.980 1.00 98.19 C +ATOM 2618 NE2 GLN A 168 26.436 -6.312 -1.563 1.00 98.19 N +ATOM 2619 HE21 GLN A 168 26.563 -7.002 -2.290 1.00 98.19 H +ATOM 2620 HE22 GLN A 168 27.090 -5.546 -1.488 1.00 98.19 H +ATOM 2621 OE1 GLN A 168 25.123 -5.228 -0.193 1.00 98.19 O +ATOM 2622 N LEU A 169 21.336 -8.978 -3.340 1.00 98.36 N +ATOM 2623 H LEU A 169 21.906 -8.980 -4.173 1.00 98.36 H +ATOM 2624 CA LEU A 169 19.876 -8.917 -3.482 1.00 98.36 C +ATOM 2625 HA LEU A 169 19.523 -8.000 -3.010 1.00 98.36 H +ATOM 2626 C LEU A 169 19.199 -10.092 -2.758 1.00 98.36 C +ATOM 2627 CB LEU A 169 19.513 -8.850 -4.978 1.00 98.36 C +ATOM 2628 HB2 LEU A 169 19.932 -9.707 -5.507 1.00 98.36 H +ATOM 2629 HB3 LEU A 169 19.988 -7.956 -5.381 1.00 98.36 H +ATOM 2630 O LEU A 169 18.311 -9.890 -1.933 1.00 98.36 O +ATOM 2631 CG LEU A 169 17.998 -8.790 -5.261 1.00 98.36 C +ATOM 2632 HG LEU A 169 17.511 -8.241 -4.455 1.00 98.36 H +ATOM 2633 CD1 LEU A 169 17.732 -8.020 -6.538 1.00 98.36 C +ATOM 2634 HD11 LEU A 169 16.659 -7.914 -6.694 1.00 98.36 H +ATOM 2635 HD12 LEU A 169 18.188 -8.522 -7.391 1.00 98.36 H +ATOM 2636 HD13 LEU A 169 18.160 -7.025 -6.412 1.00 98.36 H +ATOM 2637 CD2 LEU A 169 17.332 -10.162 -5.425 1.00 98.36 C +ATOM 2638 HD21 LEU A 169 17.349 -10.716 -4.486 1.00 98.36 H +ATOM 2639 HD22 LEU A 169 16.291 -10.023 -5.716 1.00 98.36 H +ATOM 2640 HD23 LEU A 169 17.847 -10.733 -6.198 1.00 98.36 H +ATOM 2641 N MET A 170 19.637 -11.331 -2.996 1.00 98.53 N +ATOM 2642 H MET A 170 20.369 -11.455 -3.681 1.00 98.53 H +ATOM 2643 CA MET A 170 19.038 -12.513 -2.363 1.00 98.53 C +ATOM 2644 HA MET A 170 17.966 -12.508 -2.563 1.00 98.53 H +ATOM 2645 C MET A 170 19.202 -12.521 -0.839 1.00 98.53 C +ATOM 2646 CB MET A 170 19.633 -13.797 -2.952 1.00 98.53 C +ATOM 2647 HB2 MET A 170 19.330 -14.641 -2.332 1.00 98.53 H +ATOM 2648 HB3 MET A 170 20.721 -13.741 -2.946 1.00 98.53 H +ATOM 2649 O MET A 170 18.258 -12.868 -0.127 1.00 98.53 O +ATOM 2650 CG MET A 170 19.146 -14.067 -4.377 1.00 98.53 C +ATOM 2651 HG2 MET A 170 19.458 -13.253 -5.031 1.00 98.53 H +ATOM 2652 HG3 MET A 170 18.057 -14.104 -4.377 1.00 98.53 H +ATOM 2653 SD MET A 170 19.778 -15.630 -5.040 1.00 98.53 S +ATOM 2654 CE MET A 170 19.038 -15.572 -6.690 1.00 98.53 C +ATOM 2655 HE1 MET A 170 19.357 -14.665 -7.203 1.00 98.53 H +ATOM 2656 HE2 MET A 170 17.951 -15.572 -6.606 1.00 98.53 H +ATOM 2657 HE3 MET A 170 19.357 -16.441 -7.265 1.00 98.53 H +ATOM 2658 N ILE A 171 20.366 -12.121 -0.318 1.00 98.64 N +ATOM 2659 H ILE A 171 21.108 -11.866 -0.954 1.00 98.64 H +ATOM 2660 CA ILE A 171 20.618 -12.075 1.130 1.00 98.64 C +ATOM 2661 HA ILE A 171 20.318 -13.030 1.560 1.00 98.64 H +ATOM 2662 C ILE A 171 19.739 -11.021 1.811 1.00 98.64 C +ATOM 2663 CB ILE A 171 22.123 -11.863 1.412 1.00 98.64 C +ATOM 2664 HB ILE A 171 22.457 -11.001 0.835 1.00 98.64 H +ATOM 2665 O ILE A 171 19.075 -11.328 2.805 1.00 98.64 O +ATOM 2666 CG1 ILE A 171 22.975 -13.078 0.969 1.00 98.64 C +ATOM 2667 HG12 ILE A 171 24.027 -12.834 1.114 1.00 98.64 H +ATOM 2668 HG13 ILE A 171 22.832 -13.250 -0.098 1.00 98.64 H +ATOM 2669 CG2 ILE A 171 22.390 -11.550 2.897 1.00 98.64 C +ATOM 2670 HG21 ILE A 171 21.996 -10.566 3.149 1.00 98.64 H +ATOM 2671 HG22 ILE A 171 21.922 -12.298 3.537 1.00 98.64 H +ATOM 2672 HG23 ILE A 171 23.464 -11.535 3.082 1.00 98.64 H +ATOM 2673 CD1 ILE A 171 22.685 -14.408 1.678 1.00 98.64 C +ATOM 2674 HD11 ILE A 171 21.661 -14.731 1.490 1.00 98.64 H +ATOM 2675 HD12 ILE A 171 22.850 -14.313 2.752 1.00 98.64 H +ATOM 2676 HD13 ILE A 171 23.361 -15.170 1.291 1.00 98.64 H +ATOM 2677 N TRP A 172 19.661 -9.804 1.269 1.00 98.70 N +ATOM 2678 H TRP A 172 20.206 -9.593 0.445 1.00 98.70 H +ATOM 2679 CA TRP A 172 18.752 -8.780 1.791 1.00 98.70 C +ATOM 2680 HA TRP A 172 18.936 -8.654 2.858 1.00 98.70 H +ATOM 2681 C TRP A 172 17.281 -9.180 1.641 1.00 98.70 C +ATOM 2682 CB TRP A 172 19.030 -7.450 1.097 1.00 98.70 C +ATOM 2683 HB2 TRP A 172 18.161 -6.804 1.227 1.00 98.70 H +ATOM 2684 HB3 TRP A 172 19.154 -7.628 0.029 1.00 98.70 H +ATOM 2685 O TRP A 172 16.488 -8.953 2.558 1.00 98.70 O +ATOM 2686 CG TRP A 172 20.218 -6.711 1.626 1.00 98.70 C +ATOM 2687 CD1 TRP A 172 21.352 -6.456 0.942 1.00 98.70 C +ATOM 2688 HD1 TRP A 172 21.524 -6.754 -0.082 1.00 98.70 H +ATOM 2689 CD2 TRP A 172 20.408 -6.116 2.944 1.00 98.70 C +ATOM 2690 CE2 TRP A 172 21.710 -5.532 2.991 1.00 98.70 C +ATOM 2691 CE3 TRP A 172 19.610 -6.013 4.105 1.00 98.70 C +ATOM 2692 HE3 TRP A 172 18.626 -6.458 4.094 1.00 98.70 H +ATOM 2693 NE1 TRP A 172 22.248 -5.777 1.743 1.00 98.70 N +ATOM 2694 HE1 TRP A 172 23.162 -5.496 1.419 1.00 98.70 H +ATOM 2695 CH2 TRP A 172 21.370 -4.776 5.265 1.00 98.70 C +ATOM 2696 HH2 TRP A 172 21.730 -4.269 6.148 1.00 98.70 H +ATOM 2697 CZ2 TRP A 172 22.191 -4.871 4.130 1.00 98.70 C +ATOM 2698 HZ2 TRP A 172 23.182 -4.440 4.123 1.00 98.70 H +ATOM 2699 CZ3 TRP A 172 20.087 -5.348 5.253 1.00 98.70 C +ATOM 2700 HZ3 TRP A 172 19.479 -5.276 6.143 1.00 98.70 H +ATOM 2701 N GLY A 173 16.925 -9.852 0.544 1.00 98.62 N +ATOM 2702 H GLY A 173 17.595 -9.927 -0.208 1.00 98.62 H +ATOM 2703 CA GLY A 173 15.613 -10.461 0.341 1.00 98.62 C +ATOM 2704 HA2 GLY A 173 14.847 -9.685 0.344 1.00 98.62 H +ATOM 2705 HA3 GLY A 173 15.610 -10.952 -0.632 1.00 98.62 H +ATOM 2706 C GLY A 173 15.270 -11.513 1.399 1.00 98.62 C +ATOM 2707 O GLY A 173 14.149 -11.530 1.910 1.00 98.62 O +ATOM 2708 N ALA A 174 16.230 -12.351 1.802 1.00 98.68 N +ATOM 2709 H ALA A 174 17.114 -12.333 1.315 1.00 98.68 H +ATOM 2710 CA ALA A 174 16.048 -13.333 2.870 1.00 98.68 C +ATOM 2711 HA ALA A 174 15.161 -13.925 2.647 1.00 98.68 H +ATOM 2712 C ALA A 174 15.824 -12.660 4.236 1.00 98.68 C +ATOM 2713 CB ALA A 174 17.256 -14.279 2.889 1.00 98.68 C +ATOM 2714 HB1 ALA A 174 18.166 -13.730 3.130 1.00 98.68 H +ATOM 2715 HB2 ALA A 174 17.101 -15.056 3.638 1.00 98.68 H +ATOM 2716 HB3 ALA A 174 17.373 -14.747 1.912 1.00 98.68 H +ATOM 2717 O ALA A 174 14.918 -13.051 4.977 1.00 98.68 O +ATOM 2718 N VAL A 175 16.585 -11.603 4.548 1.00 98.71 N +ATOM 2719 H VAL A 175 17.322 -11.346 3.907 1.00 98.71 H +ATOM 2720 CA VAL A 175 16.381 -10.798 5.766 1.00 98.71 C +ATOM 2721 HA VAL A 175 16.408 -11.464 6.628 1.00 98.71 H +ATOM 2722 C VAL A 175 14.997 -10.136 5.756 1.00 98.71 C +ATOM 2723 CB VAL A 175 17.501 -9.750 5.939 1.00 98.71 C +ATOM 2724 HB VAL A 175 17.543 -9.111 5.057 1.00 98.71 H +ATOM 2725 O VAL A 175 14.261 -10.238 6.738 1.00 98.71 O +ATOM 2726 CG1 VAL A 175 17.264 -8.869 7.171 1.00 98.71 C +ATOM 2727 HG11 VAL A 175 16.334 -8.311 7.057 1.00 98.71 H +ATOM 2728 HG12 VAL A 175 17.202 -9.486 8.068 1.00 98.71 H +ATOM 2729 HG13 VAL A 175 18.083 -8.157 7.277 1.00 98.71 H +ATOM 2730 CG2 VAL A 175 18.870 -10.416 6.135 1.00 98.71 C +ATOM 2731 HG21 VAL A 175 18.871 -11.019 7.042 1.00 98.71 H +ATOM 2732 HG22 VAL A 175 19.109 -11.059 5.288 1.00 98.71 H +ATOM 2733 HG23 VAL A 175 19.644 -9.652 6.206 1.00 98.71 H +ATOM 2734 N SER A 176 14.600 -9.522 4.638 1.00 98.68 N +ATOM 2735 H SER A 176 15.258 -9.449 3.875 1.00 98.68 H +ATOM 2736 CA SER A 176 13.268 -8.927 4.458 1.00 98.68 C +ATOM 2737 HA SER A 176 13.125 -8.149 5.208 1.00 98.68 H +ATOM 2738 C SER A 176 12.150 -9.958 4.640 1.00 98.68 C +ATOM 2739 CB SER A 176 13.187 -8.290 3.066 1.00 98.68 C +ATOM 2740 HB2 SER A 176 14.015 -7.595 2.927 1.00 98.68 H +ATOM 2741 HB3 SER A 176 13.257 -9.067 2.305 1.00 98.68 H +ATOM 2742 O SER A 176 11.169 -9.715 5.349 1.00 98.68 O +ATOM 2743 OG SER A 176 11.966 -7.599 2.911 1.00 98.68 O +ATOM 2744 HG SER A 176 12.096 -6.689 3.190 1.00 98.68 H +ATOM 2745 N THR A 177 12.343 -11.161 4.097 1.00 98.75 N +ATOM 2746 H THR A 177 13.162 -11.287 3.518 1.00 98.75 H +ATOM 2747 CA THR A 177 11.405 -12.283 4.225 1.00 98.75 C +ATOM 2748 HA THR A 177 10.431 -11.953 3.862 1.00 98.75 H +ATOM 2749 C THR A 177 11.236 -12.728 5.679 1.00 98.75 C +ATOM 2750 CB THR A 177 11.844 -13.466 3.351 1.00 98.75 C +ATOM 2751 HB THR A 177 12.834 -13.807 3.651 1.00 98.75 H +ATOM 2752 O THR A 177 10.117 -13.026 6.094 1.00 98.75 O +ATOM 2753 CG2 THR A 177 10.868 -14.641 3.413 1.00 98.75 C +ATOM 2754 HG21 THR A 177 9.860 -14.299 3.183 1.00 98.75 H +ATOM 2755 HG22 THR A 177 10.886 -15.097 4.403 1.00 98.75 H +ATOM 2756 HG23 THR A 177 11.166 -15.393 2.682 1.00 98.75 H +ATOM 2757 OG1 THR A 177 11.881 -13.064 2.003 1.00 98.75 O +ATOM 2758 HG1 THR A 177 12.646 -12.497 1.879 1.00 98.75 H +ATOM 2759 N ALA A 178 12.295 -12.723 6.494 1.00 98.73 N +ATOM 2760 H ALA A 178 13.203 -12.488 6.119 1.00 98.73 H +ATOM 2761 CA ALA A 178 12.178 -13.043 7.918 1.00 98.73 C +ATOM 2762 HA ALA A 178 11.742 -14.037 8.011 1.00 98.73 H +ATOM 2763 C ALA A 178 11.242 -12.060 8.650 1.00 98.73 C +ATOM 2764 CB ALA A 178 13.579 -13.077 8.541 1.00 98.73 C +ATOM 2765 HB1 ALA A 178 14.033 -12.087 8.513 1.00 98.73 H +ATOM 2766 HB2 ALA A 178 14.211 -13.774 7.990 1.00 98.73 H +ATOM 2767 HB3 ALA A 178 13.509 -13.404 9.578 1.00 98.73 H +ATOM 2768 O ALA A 178 10.350 -12.485 9.389 1.00 98.73 O +ATOM 2769 N PHE A 179 11.375 -10.755 8.387 1.00 98.74 N +ATOM 2770 H PHE A 179 12.110 -10.464 7.757 1.00 98.74 H +ATOM 2771 CA PHE A 179 10.451 -9.745 8.913 1.00 98.74 C +ATOM 2772 HA PHE A 179 10.410 -9.836 9.999 1.00 98.74 H +ATOM 2773 C PHE A 179 9.020 -9.936 8.392 1.00 98.74 C +ATOM 2774 CB PHE A 179 10.948 -8.340 8.563 1.00 98.74 C +ATOM 2775 HB2 PHE A 179 10.126 -7.645 8.734 1.00 98.74 H +ATOM 2776 HB3 PHE A 179 11.201 -8.294 7.504 1.00 98.74 H +ATOM 2777 O PHE A 179 8.072 -9.853 9.177 1.00 98.74 O +ATOM 2778 CG PHE A 179 12.120 -7.854 9.384 1.00 98.74 C +ATOM 2779 CD1 PHE A 179 11.912 -7.438 10.711 1.00 98.74 C +ATOM 2780 HD1 PHE A 179 10.922 -7.484 11.140 1.00 98.74 H +ATOM 2781 CD2 PHE A 179 13.407 -7.790 8.822 1.00 98.74 C +ATOM 2782 HD2 PHE A 179 13.569 -8.088 7.797 1.00 98.74 H +ATOM 2783 CE1 PHE A 179 12.990 -6.964 11.479 1.00 98.74 C +ATOM 2784 HE1 PHE A 179 12.830 -6.642 12.498 1.00 98.74 H +ATOM 2785 CE2 PHE A 179 14.487 -7.330 9.595 1.00 98.74 C +ATOM 2786 HE2 PHE A 179 15.478 -7.293 9.167 1.00 98.74 H +ATOM 2787 CZ PHE A 179 14.279 -6.915 10.921 1.00 98.74 C +ATOM 2788 HZ PHE A 179 15.112 -6.559 11.510 1.00 98.74 H +ATOM 2789 N PHE A 180 8.858 -10.241 7.101 1.00 98.73 N +ATOM 2790 H PHE A 180 9.675 -10.249 6.507 1.00 98.73 H +ATOM 2791 CA PHE A 180 7.557 -10.523 6.487 1.00 98.73 C +ATOM 2792 HA PHE A 180 6.924 -9.642 6.597 1.00 98.73 H +ATOM 2793 C PHE A 180 6.841 -11.699 7.166 1.00 98.73 C +ATOM 2794 CB PHE A 180 7.754 -10.797 4.989 1.00 98.73 C +ATOM 2795 HB2 PHE A 180 8.463 -11.617 4.873 1.00 98.73 H +ATOM 2796 HB3 PHE A 180 8.205 -9.923 4.520 1.00 98.73 H +ATOM 2797 O PHE A 180 5.674 -11.583 7.545 1.00 98.73 O +ATOM 2798 CG PHE A 180 6.490 -11.155 4.231 1.00 98.73 C +ATOM 2799 CD1 PHE A 180 6.406 -12.373 3.526 1.00 98.73 C +ATOM 2800 HD1 PHE A 180 7.240 -13.058 3.529 1.00 98.73 H +ATOM 2801 CD2 PHE A 180 5.403 -10.264 4.199 1.00 98.73 C +ATOM 2802 HD2 PHE A 180 5.458 -9.322 4.723 1.00 98.73 H +ATOM 2803 CE1 PHE A 180 5.255 -12.683 2.778 1.00 98.73 C +ATOM 2804 HE1 PHE A 180 5.209 -13.601 2.210 1.00 98.73 H +ATOM 2805 CE2 PHE A 180 4.254 -10.582 3.455 1.00 98.73 C +ATOM 2806 HE2 PHE A 180 3.424 -9.891 3.418 1.00 98.73 H +ATOM 2807 CZ PHE A 180 4.182 -11.781 2.730 1.00 98.73 C +ATOM 2808 HZ PHE A 180 3.312 -12.010 2.133 1.00 98.73 H +ATOM 2809 N VAL A 181 7.546 -12.810 7.397 1.00 98.71 N +ATOM 2810 H VAL A 181 8.497 -12.843 7.057 1.00 98.71 H +ATOM 2811 CA VAL A 181 6.999 -14.000 8.068 1.00 98.71 C +ATOM 2812 HA VAL A 181 6.100 -14.314 7.537 1.00 98.71 H +ATOM 2813 C VAL A 181 6.576 -13.684 9.504 1.00 98.71 C +ATOM 2814 CB VAL A 181 8.012 -15.162 8.017 1.00 98.71 C +ATOM 2815 HB VAL A 181 8.984 -14.808 8.362 1.00 98.71 H +ATOM 2816 O VAL A 181 5.471 -14.049 9.909 1.00 98.71 O +ATOM 2817 CG1 VAL A 181 7.591 -16.350 8.894 1.00 98.71 C +ATOM 2818 HG11 VAL A 181 8.288 -17.176 8.750 1.00 98.71 H +ATOM 2819 HG12 VAL A 181 6.587 -16.678 8.626 1.00 98.71 H +ATOM 2820 HG13 VAL A 181 7.616 -16.073 9.948 1.00 98.71 H +ATOM 2821 CG2 VAL A 181 8.153 -15.688 6.582 1.00 98.71 C +ATOM 2822 HG21 VAL A 181 8.422 -14.883 5.899 1.00 98.71 H +ATOM 2823 HG22 VAL A 181 7.214 -16.129 6.247 1.00 98.71 H +ATOM 2824 HG23 VAL A 181 8.938 -16.443 6.542 1.00 98.71 H +ATOM 2825 N VAL A 182 7.403 -12.962 10.268 1.00 98.68 N +ATOM 2826 H VAL A 182 8.297 -12.690 9.885 1.00 98.68 H +ATOM 2827 CA VAL A 182 7.065 -12.554 11.645 1.00 98.68 C +ATOM 2828 HA VAL A 182 6.792 -13.443 12.213 1.00 98.68 H +ATOM 2829 C VAL A 182 5.851 -11.621 11.668 1.00 98.68 C +ATOM 2830 CB VAL A 182 8.280 -11.903 12.336 1.00 98.68 C +ATOM 2831 HB VAL A 182 8.683 -11.119 11.695 1.00 98.68 H +ATOM 2832 O VAL A 182 4.940 -11.812 12.477 1.00 98.68 O +ATOM 2833 CG1 VAL A 182 7.922 -11.283 13.695 1.00 98.68 C +ATOM 2834 HG11 VAL A 182 8.827 -10.922 14.182 1.00 98.68 H +ATOM 2835 HG12 VAL A 182 7.253 -10.433 13.560 1.00 98.68 H +ATOM 2836 HG13 VAL A 182 7.444 -12.027 14.332 1.00 98.68 H +ATOM 2837 CG2 VAL A 182 9.374 -12.949 12.590 1.00 98.68 C +ATOM 2838 HG21 VAL A 182 10.256 -12.466 13.010 1.00 98.68 H +ATOM 2839 HG22 VAL A 182 9.015 -13.711 13.282 1.00 98.68 H +ATOM 2840 HG23 VAL A 182 9.665 -13.433 11.658 1.00 98.68 H +ATOM 2841 N MET A 183 5.788 -10.643 10.763 1.00 98.73 N +ATOM 2842 H MET A 183 6.560 -10.530 10.121 1.00 98.73 H +ATOM 2843 CA MET A 183 4.642 -9.741 10.630 1.00 98.73 C +ATOM 2844 HA MET A 183 4.496 -9.213 11.573 1.00 98.73 H +ATOM 2845 C MET A 183 3.355 -10.520 10.317 1.00 98.73 C +ATOM 2846 CB MET A 183 4.960 -8.716 9.537 1.00 98.73 C +ATOM 2847 HB2 MET A 183 5.124 -9.251 8.602 1.00 98.73 H +ATOM 2848 HB3 MET A 183 5.879 -8.188 9.792 1.00 98.73 H +ATOM 2849 O MET A 183 2.336 -10.320 10.982 1.00 98.73 O +ATOM 2850 CG MET A 183 3.845 -7.684 9.348 1.00 98.73 C +ATOM 2851 HG2 MET A 183 3.705 -7.147 10.286 1.00 98.73 H +ATOM 2852 HG3 MET A 183 2.916 -8.197 9.099 1.00 98.73 H +ATOM 2853 SD MET A 183 4.172 -6.465 8.051 1.00 98.73 S +ATOM 2854 CE MET A 183 4.491 -7.567 6.644 1.00 98.73 C +ATOM 2855 HE1 MET A 183 3.748 -8.363 6.605 1.00 98.73 H +ATOM 2856 HE2 MET A 183 5.484 -8.004 6.748 1.00 98.73 H +ATOM 2857 HE3 MET A 183 4.464 -6.994 5.717 1.00 98.73 H +ATOM 2858 N ASN A 184 3.408 -11.459 9.369 1.00 98.58 N +ATOM 2859 H ASN A 184 4.261 -11.551 8.836 1.00 98.58 H +ATOM 2860 CA ASN A 184 2.272 -12.305 8.996 1.00 98.58 C +ATOM 2861 HA ASN A 184 1.424 -11.666 8.750 1.00 98.58 H +ATOM 2862 C ASN A 184 1.831 -13.227 10.137 1.00 98.58 C +ATOM 2863 CB ASN A 184 2.643 -13.125 7.754 1.00 98.58 C +ATOM 2864 HB2 ASN A 184 3.586 -13.644 7.926 1.00 98.58 H +ATOM 2865 HB3 ASN A 184 1.871 -13.871 7.567 1.00 98.58 H +ATOM 2866 O ASN A 184 0.632 -13.439 10.329 1.00 98.58 O +ATOM 2867 CG ASN A 184 2.762 -12.278 6.504 1.00 98.58 C +ATOM 2868 ND2 ASN A 184 3.369 -12.822 5.481 1.00 98.58 N +ATOM 2869 HD21 ASN A 184 3.564 -12.221 4.693 1.00 98.58 H +ATOM 2870 HD22 ASN A 184 3.796 -13.734 5.551 1.00 98.58 H +ATOM 2871 OD1 ASN A 184 2.283 -11.156 6.424 1.00 98.58 O +ATOM 2872 N TRP A 185 2.772 -13.733 10.936 1.00 98.71 N +ATOM 2873 H TRP A 185 3.741 -13.585 10.694 1.00 98.71 H +ATOM 2874 CA TRP A 185 2.462 -14.496 12.143 1.00 98.71 C +ATOM 2875 HA TRP A 185 1.821 -15.335 11.872 1.00 98.71 H +ATOM 2876 C TRP A 185 1.689 -13.657 13.171 1.00 98.71 C +ATOM 2877 CB TRP A 185 3.755 -15.062 12.737 1.00 98.71 C +ATOM 2878 HB2 TRP A 185 4.505 -14.274 12.797 1.00 98.71 H +ATOM 2879 HB3 TRP A 185 4.144 -15.832 12.070 1.00 98.71 H +ATOM 2880 O TRP A 185 0.693 -14.135 13.728 1.00 98.71 O +ATOM 2881 CG TRP A 185 3.584 -15.641 14.104 1.00 98.71 C +ATOM 2882 CD1 TRP A 185 2.956 -16.802 14.392 1.00 98.71 C +ATOM 2883 HD1 TRP A 185 2.532 -17.470 13.657 1.00 98.71 H +ATOM 2884 CD2 TRP A 185 3.993 -15.073 15.385 1.00 98.71 C +ATOM 2885 CE2 TRP A 185 3.568 -15.957 16.421 1.00 98.71 C +ATOM 2886 CE3 TRP A 185 4.685 -13.907 15.775 1.00 98.71 C +ATOM 2887 HE3 TRP A 185 5.045 -13.233 15.011 1.00 98.71 H +ATOM 2888 NE1 TRP A 185 2.946 -16.993 15.759 1.00 98.71 N +ATOM 2889 HE1 TRP A 185 2.552 -17.812 16.199 1.00 98.71 H +ATOM 2890 CH2 TRP A 185 4.512 -14.530 18.132 1.00 98.71 C +ATOM 2891 HH2 TRP A 185 4.739 -14.326 19.168 1.00 98.71 H +ATOM 2892 CZ2 TRP A 185 3.818 -15.700 17.777 1.00 98.71 C +ATOM 2893 HZ2 TRP A 185 3.505 -16.406 18.532 1.00 98.71 H +ATOM 2894 CZ3 TRP A 185 4.940 -13.636 17.133 1.00 98.71 C +ATOM 2895 HZ3 TRP A 185 5.493 -12.749 17.406 1.00 98.71 H +ATOM 2896 N ILE A 186 2.077 -12.393 13.387 1.00 98.71 N +ATOM 2897 H ILE A 186 2.908 -12.066 12.915 1.00 98.71 H +ATOM 2898 CA ILE A 186 1.340 -11.470 14.265 1.00 98.71 C +ATOM 2899 HA ILE A 186 1.213 -11.954 15.233 1.00 98.71 H +ATOM 2900 C ILE A 186 -0.061 -11.204 13.700 1.00 98.71 C +ATOM 2901 CB ILE A 186 2.117 -10.150 14.493 1.00 98.71 C +ATOM 2902 HB ILE A 186 2.319 -9.695 13.523 1.00 98.71 H +ATOM 2903 O ILE A 186 -1.044 -11.334 14.435 1.00 98.71 O +ATOM 2904 CG1 ILE A 186 3.466 -10.395 15.204 1.00 98.71 C +ATOM 2905 HG12 ILE A 186 3.291 -10.664 16.245 1.00 98.71 H +ATOM 2906 HG13 ILE A 186 3.979 -11.234 14.732 1.00 98.71 H +ATOM 2907 CG2 ILE A 186 1.266 -9.173 15.335 1.00 98.71 C +ATOM 2908 HG21 ILE A 186 0.374 -8.871 14.787 1.00 98.71 H +ATOM 2909 HG22 ILE A 186 0.974 -9.648 16.272 1.00 98.71 H +ATOM 2910 HG23 ILE A 186 1.832 -8.269 15.558 1.00 98.71 H +ATOM 2911 CD1 ILE A 186 4.423 -9.196 15.143 1.00 98.71 C +ATOM 2912 HD11 ILE A 186 4.029 -8.351 15.708 1.00 98.71 H +ATOM 2913 HD12 ILE A 186 5.383 -9.482 15.573 1.00 98.71 H +ATOM 2914 HD13 ILE A 186 4.580 -8.898 14.106 1.00 98.71 H +ATOM 2915 N VAL A 187 -0.170 -10.881 12.405 1.00 98.71 N +ATOM 2916 H VAL A 187 0.683 -10.795 11.870 1.00 98.71 H +ATOM 2917 CA VAL A 187 -1.451 -10.653 11.710 1.00 98.71 C +ATOM 2918 HA VAL A 187 -1.955 -9.801 12.166 1.00 98.71 H +ATOM 2919 C VAL A 187 -2.378 -11.858 11.870 1.00 98.71 C +ATOM 2920 CB VAL A 187 -1.218 -10.332 10.216 1.00 98.71 C +ATOM 2921 HB VAL A 187 -0.506 -11.047 9.804 1.00 98.71 H +ATOM 2922 O VAL A 187 -3.496 -11.708 12.364 1.00 98.71 O +ATOM 2923 CG1 VAL A 187 -2.497 -10.411 9.375 1.00 98.71 C +ATOM 2924 HG11 VAL A 187 -3.254 -9.736 9.774 1.00 98.71 H +ATOM 2925 HG12 VAL A 187 -2.884 -11.430 9.363 1.00 98.71 H +ATOM 2926 HG13 VAL A 187 -2.275 -10.137 8.344 1.00 98.71 H +ATOM 2927 CG2 VAL A 187 -0.650 -8.919 10.043 1.00 98.71 C +ATOM 2928 HG21 VAL A 187 -0.469 -8.721 8.986 1.00 98.71 H +ATOM 2929 HG22 VAL A 187 0.304 -8.833 10.563 1.00 98.71 H +ATOM 2930 HG23 VAL A 187 -1.345 -8.176 10.434 1.00 98.71 H +ATOM 2931 N GLY A 188 -1.909 -13.058 11.521 1.00 98.53 N +ATOM 2932 H GLY A 188 -0.978 -13.114 11.132 1.00 98.53 H +ATOM 2933 CA GLY A 188 -2.684 -14.291 11.627 1.00 98.53 C +ATOM 2934 HA2 GLY A 188 -2.073 -15.126 11.284 1.00 98.53 H +ATOM 2935 HA3 GLY A 188 -3.571 -14.223 10.998 1.00 98.53 H +ATOM 2936 C GLY A 188 -3.118 -14.560 13.064 1.00 98.53 C +ATOM 2937 O GLY A 188 -4.306 -14.744 13.330 1.00 98.53 O +ATOM 2938 N THR A 189 -2.189 -14.484 14.020 1.00 98.71 N +ATOM 2939 H THR A 189 -1.233 -14.302 13.747 1.00 98.71 H +ATOM 2940 CA THR A 189 -2.491 -14.678 15.447 1.00 98.71 C +ATOM 2941 HA THR A 189 -2.852 -15.697 15.590 1.00 98.71 H +ATOM 2942 C THR A 189 -3.584 -13.724 15.926 1.00 98.71 C +ATOM 2943 CB THR A 189 -1.232 -14.491 16.307 1.00 98.71 C +ATOM 2944 HB THR A 189 -0.812 -13.498 16.147 1.00 98.71 H +ATOM 2945 O THR A 189 -4.512 -14.148 16.619 1.00 98.71 O +ATOM 2946 CG2 THR A 189 -1.505 -14.687 17.801 1.00 98.71 C +ATOM 2947 HG21 THR A 189 -2.128 -13.876 18.178 1.00 98.71 H +ATOM 2948 HG22 THR A 189 -0.556 -14.678 18.338 1.00 98.71 H +ATOM 2949 HG23 THR A 189 -2.000 -15.645 17.958 1.00 98.71 H +ATOM 2950 OG1 THR A 189 -0.275 -15.460 15.965 1.00 98.71 O +ATOM 2951 HG1 THR A 189 0.205 -15.138 15.199 1.00 98.71 H +ATOM 2952 N LYS A 190 -3.506 -12.440 15.559 1.00 98.62 N +ATOM 2953 H LYS A 190 -2.742 -12.155 14.964 1.00 98.62 H +ATOM 2954 CA LYS A 190 -4.488 -11.430 15.972 1.00 98.62 C +ATOM 2955 HA LYS A 190 -4.708 -11.576 17.030 1.00 98.62 H +ATOM 2956 C LYS A 190 -5.832 -11.605 15.284 1.00 98.62 C +ATOM 2957 CB LYS A 190 -3.921 -10.020 15.755 1.00 98.62 C +ATOM 2958 HB2 LYS A 190 -4.714 -9.286 15.896 1.00 98.62 H +ATOM 2959 HB3 LYS A 190 -3.561 -9.929 14.731 1.00 98.62 H +ATOM 2960 O LYS A 190 -6.840 -11.497 15.980 1.00 98.62 O +ATOM 2961 CG LYS A 190 -2.773 -9.692 16.724 1.00 98.62 C +ATOM 2962 HG2 LYS A 190 -2.365 -8.722 16.440 1.00 98.62 H +ATOM 2963 HG3 LYS A 190 -1.976 -10.429 16.629 1.00 98.62 H +ATOM 2964 CD LYS A 190 -3.234 -9.651 18.188 1.00 98.62 C +ATOM 2965 HD2 LYS A 190 -4.090 -8.981 18.277 1.00 98.62 H +ATOM 2966 HD3 LYS A 190 -3.527 -10.648 18.515 1.00 98.62 H +ATOM 2967 CE LYS A 190 -2.115 -9.153 19.101 1.00 98.62 C +ATOM 2968 HE2 LYS A 190 -1.831 -8.154 18.769 1.00 98.62 H +ATOM 2969 HE3 LYS A 190 -1.244 -9.801 18.999 1.00 98.62 H +ATOM 2970 NZ LYS A 190 -2.567 -9.095 20.515 1.00 98.62 N +ATOM 2971 HZ1 LYS A 190 -1.921 -8.568 21.086 1.00 98.62 H +ATOM 2972 HZ2 LYS A 190 -3.461 -8.636 20.617 1.00 98.62 H +ATOM 2973 HZ3 LYS A 190 -2.716 -10.010 20.916 1.00 98.62 H +ATOM 2974 N ILE A 191 -5.861 -11.937 13.993 1.00 98.55 N +ATOM 2975 H ILE A 191 -4.989 -11.991 13.486 1.00 98.55 H +ATOM 2976 CA ILE A 191 -7.104 -12.265 13.289 1.00 98.55 C +ATOM 2977 HA ILE A 191 -7.791 -11.426 13.401 1.00 98.55 H +ATOM 2978 C ILE A 191 -7.778 -13.456 13.966 1.00 98.55 C +ATOM 2979 CB ILE A 191 -6.866 -12.486 11.774 1.00 98.55 C +ATOM 2980 HB ILE A 191 -5.995 -13.128 11.639 1.00 98.55 H +ATOM 2981 O ILE A 191 -8.895 -13.319 14.457 1.00 98.55 O +ATOM 2982 CG1 ILE A 191 -6.591 -11.120 11.105 1.00 98.55 C +ATOM 2983 HG12 ILE A 191 -7.473 -10.488 11.202 1.00 98.55 H +ATOM 2984 HG13 ILE A 191 -5.765 -10.630 11.620 1.00 98.55 H +ATOM 2985 CG2 ILE A 191 -8.079 -13.180 11.118 1.00 98.55 C +ATOM 2986 HG21 ILE A 191 -8.184 -14.201 11.485 1.00 98.55 H +ATOM 2987 HG22 ILE A 191 -7.951 -13.247 10.038 1.00 98.55 H +ATOM 2988 HG23 ILE A 191 -8.987 -12.618 11.335 1.00 98.55 H +ATOM 2989 CD1 ILE A 191 -6.225 -11.199 9.621 1.00 98.55 C +ATOM 2990 HD11 ILE A 191 -5.439 -11.941 9.483 1.00 98.55 H +ATOM 2991 HD12 ILE A 191 -7.103 -11.454 9.027 1.00 98.55 H +ATOM 2992 HD13 ILE A 191 -5.860 -10.233 9.272 1.00 98.55 H +ATOM 2993 N PHE A 192 -7.097 -14.601 14.063 1.00 98.43 N +ATOM 2994 H PHE A 192 -6.164 -14.645 13.681 1.00 98.43 H +ATOM 2995 CA PHE A 192 -7.717 -15.840 14.533 1.00 98.43 C +ATOM 2996 HA PHE A 192 -8.624 -15.996 13.949 1.00 98.43 H +ATOM 2997 C PHE A 192 -8.164 -15.782 15.997 1.00 98.43 C +ATOM 2998 CB PHE A 192 -6.792 -17.036 14.264 1.00 98.43 C +ATOM 2999 HB2 PHE A 192 -5.806 -16.829 14.679 1.00 98.43 H +ATOM 3000 HB3 PHE A 192 -7.190 -17.909 14.781 1.00 98.43 H +ATOM 3001 O PHE A 192 -9.228 -16.322 16.305 1.00 98.43 O +ATOM 3002 CG PHE A 192 -6.677 -17.388 12.791 1.00 98.43 C +ATOM 3003 CD1 PHE A 192 -7.812 -17.825 12.080 1.00 98.43 C +ATOM 3004 HD1 PHE A 192 -8.758 -17.939 12.587 1.00 98.43 H +ATOM 3005 CD2 PHE A 192 -5.442 -17.290 12.123 1.00 98.43 C +ATOM 3006 HD2 PHE A 192 -4.547 -17.028 12.666 1.00 98.43 H +ATOM 3007 CE1 PHE A 192 -7.719 -18.120 10.708 1.00 98.43 C +ATOM 3008 HE1 PHE A 192 -8.587 -18.460 10.163 1.00 98.43 H +ATOM 3009 CE2 PHE A 192 -5.355 -17.553 10.746 1.00 98.43 C +ATOM 3010 HE2 PHE A 192 -4.409 -17.457 10.233 1.00 98.43 H +ATOM 3011 CZ PHE A 192 -6.493 -17.968 10.037 1.00 98.43 C +ATOM 3012 HZ PHE A 192 -6.417 -18.183 8.982 1.00 98.43 H +ATOM 3013 N LYS A 193 -7.418 -15.095 16.876 1.00 98.38 N +ATOM 3014 H LYS A 193 -6.547 -14.696 16.555 1.00 98.38 H +ATOM 3015 CA LYS A 193 -7.797 -14.924 18.290 1.00 98.38 C +ATOM 3016 HA LYS A 193 -8.168 -15.876 18.671 1.00 98.38 H +ATOM 3017 C LYS A 193 -8.951 -13.943 18.508 1.00 98.38 C +ATOM 3018 CB LYS A 193 -6.582 -14.505 19.136 1.00 98.38 C +ATOM 3019 HB2 LYS A 193 -6.074 -13.662 18.667 1.00 98.38 H +ATOM 3020 HB3 LYS A 193 -6.944 -14.177 20.111 1.00 98.38 H +ATOM 3021 O LYS A 193 -9.699 -14.123 19.460 1.00 98.38 O +ATOM 3022 CG LYS A 193 -5.603 -15.668 19.360 1.00 98.38 C +ATOM 3023 HG2 LYS A 193 -6.154 -16.511 19.776 1.00 98.38 H +ATOM 3024 HG3 LYS A 193 -5.163 -15.976 18.411 1.00 98.38 H +ATOM 3025 CD LYS A 193 -4.490 -15.273 20.341 1.00 98.38 C +ATOM 3026 HD2 LYS A 193 -4.946 -14.895 21.257 1.00 98.38 H +ATOM 3027 HD3 LYS A 193 -3.876 -14.491 19.895 1.00 98.38 H +ATOM 3028 CE LYS A 193 -3.632 -16.502 20.669 1.00 98.38 C +ATOM 3029 HE2 LYS A 193 -4.295 -17.306 20.989 1.00 98.38 H +ATOM 3030 HE3 LYS A 193 -3.133 -16.832 19.758 1.00 98.38 H +ATOM 3031 NZ LYS A 193 -2.634 -16.224 21.734 1.00 98.38 N +ATOM 3032 HZ1 LYS A 193 -2.106 -17.061 21.939 1.00 98.38 H +ATOM 3033 HZ2 LYS A 193 -3.093 -15.931 22.585 1.00 98.38 H +ATOM 3034 HZ3 LYS A 193 -1.984 -15.509 21.440 1.00 98.38 H +ATOM 3035 N ASN A 194 -9.119 -12.933 17.649 1.00 98.43 N +ATOM 3036 H ASN A 194 -8.476 -12.834 16.877 1.00 98.43 H +ATOM 3037 CA ASN A 194 -10.146 -11.899 17.837 1.00 98.43 C +ATOM 3038 HA ASN A 194 -10.482 -11.929 18.873 1.00 98.43 H +ATOM 3039 C ASN A 194 -11.424 -12.120 17.016 1.00 98.43 C +ATOM 3040 CB ASN A 194 -9.545 -10.501 17.634 1.00 98.43 C +ATOM 3041 HB2 ASN A 194 -9.046 -10.431 16.667 1.00 98.43 H +ATOM 3042 HB3 ASN A 194 -10.338 -9.753 17.654 1.00 98.43 H +ATOM 3043 O ASN A 194 -12.364 -11.341 17.168 1.00 98.43 O +ATOM 3044 CG ASN A 194 -8.591 -10.155 18.754 1.00 98.43 C +ATOM 3045 ND2 ASN A 194 -7.308 -10.339 18.559 1.00 98.43 N +ATOM 3046 HD21 ASN A 194 -7.001 -10.675 17.657 1.00 98.43 H +ATOM 3047 HD22 ASN A 194 -6.720 -10.058 19.331 1.00 98.43 H +ATOM 3048 OD1 ASN A 194 -8.985 -9.770 19.836 1.00 98.43 O +ATOM 3049 N ARG A 195 -11.517 -13.189 16.208 1.00 98.28 N +ATOM 3050 H ARG A 195 -10.683 -13.740 16.064 1.00 98.28 H +ATOM 3051 CA ARG A 195 -12.726 -13.502 15.415 1.00 98.28 C +ATOM 3052 HA ARG A 195 -12.872 -12.728 14.662 1.00 98.28 H +ATOM 3053 C ARG A 195 -14.005 -13.514 16.246 1.00 98.28 C +ATOM 3054 CB ARG A 195 -12.610 -14.864 14.721 1.00 98.28 C +ATOM 3055 HB2 ARG A 195 -12.398 -15.639 15.457 1.00 98.28 H +ATOM 3056 HB3 ARG A 195 -13.570 -15.090 14.255 1.00 98.28 H +ATOM 3057 O ARG A 195 -14.996 -12.938 15.827 1.00 98.28 O +ATOM 3058 CG ARG A 195 -11.541 -14.877 13.633 1.00 98.28 C +ATOM 3059 HG2 ARG A 195 -10.564 -14.933 14.113 1.00 98.28 H +ATOM 3060 HG3 ARG A 195 -11.608 -13.968 13.036 1.00 98.28 H +ATOM 3061 CD ARG A 195 -11.684 -16.086 12.716 1.00 98.28 C +ATOM 3062 HD2 ARG A 195 -12.691 -16.091 12.297 1.00 98.28 H +ATOM 3063 HD3 ARG A 195 -10.964 -15.973 11.906 1.00 98.28 H +ATOM 3064 NE ARG A 195 -11.405 -17.343 13.436 1.00 98.28 N +ATOM 3065 HE ARG A 195 -10.936 -17.263 14.326 1.00 98.28 H +ATOM 3066 NH1 ARG A 195 -12.425 -18.754 11.943 1.00 98.28 N +ATOM 3067 HH11 ARG A 195 -12.802 -17.948 11.466 1.00 98.28 H +ATOM 3068 HH12 ARG A 195 -12.744 -19.679 11.693 1.00 98.28 H +ATOM 3069 NH2 ARG A 195 -11.394 -19.596 13.737 1.00 98.28 N +ATOM 3070 HH21 ARG A 195 -11.673 -20.521 13.442 1.00 98.28 H +ATOM 3071 HH22 ARG A 195 -10.898 -19.479 14.608 1.00 98.28 H +ATOM 3072 CZ ARG A 195 -11.742 -18.555 13.035 1.00 98.28 C +ATOM 3073 N ALA A 196 -13.962 -14.104 17.440 1.00 97.77 N +ATOM 3074 H ALA A 196 -13.098 -14.539 17.730 1.00 97.77 H +ATOM 3075 CA ALA A 196 -15.125 -14.212 18.324 1.00 97.77 C +ATOM 3076 HA ALA A 196 -15.937 -14.688 17.774 1.00 97.77 H +ATOM 3077 C ALA A 196 -15.663 -12.853 18.819 1.00 97.77 C +ATOM 3078 CB ALA A 196 -14.738 -15.118 19.499 1.00 97.77 C +ATOM 3079 HB1 ALA A 196 -13.932 -14.665 20.076 1.00 97.77 H +ATOM 3080 HB2 ALA A 196 -15.603 -15.255 20.149 1.00 97.77 H +ATOM 3081 HB3 ALA A 196 -14.423 -16.094 19.131 1.00 97.77 H +ATOM 3082 O ALA A 196 -16.772 -12.785 19.334 1.00 97.77 O +ATOM 3083 N THR A 197 -14.893 -11.769 18.672 1.00 98.09 N +ATOM 3084 H THR A 197 -14.002 -11.870 18.209 1.00 98.09 H +ATOM 3085 CA THR A 197 -15.331 -10.410 19.032 1.00 98.09 C +ATOM 3086 HA THR A 197 -16.005 -10.472 19.886 1.00 98.09 H +ATOM 3087 C THR A 197 -16.101 -9.712 17.911 1.00 98.09 C +ATOM 3088 CB THR A 197 -14.144 -9.520 19.437 1.00 98.09 C +ATOM 3089 HB THR A 197 -14.546 -8.623 19.908 1.00 98.09 H +ATOM 3090 O THR A 197 -16.662 -8.638 18.130 1.00 98.09 O +ATOM 3091 CG2 THR A 197 -13.190 -10.187 20.431 1.00 98.09 C +ATOM 3092 HG21 THR A 197 -12.689 -11.042 19.976 1.00 98.09 H +ATOM 3093 HG22 THR A 197 -12.434 -9.466 20.741 1.00 98.09 H +ATOM 3094 HG23 THR A 197 -13.747 -10.518 21.307 1.00 98.09 H +ATOM 3095 OG1 THR A 197 -13.399 -9.112 18.309 1.00 98.09 O +ATOM 3096 HG1 THR A 197 -12.964 -9.882 17.935 1.00 98.09 H +ATOM 3097 N MET A 198 -16.075 -10.271 16.699 1.00 98.51 N +ATOM 3098 H MET A 198 -15.703 -11.205 16.596 1.00 98.51 H +ATOM 3099 CA MET A 198 -16.583 -9.624 15.498 1.00 98.51 C +ATOM 3100 HA MET A 198 -16.414 -8.552 15.598 1.00 98.51 H +ATOM 3101 C MET A 198 -18.088 -9.833 15.340 1.00 98.51 C +ATOM 3102 CB MET A 198 -15.807 -10.097 14.269 1.00 98.51 C +ATOM 3103 HB2 MET A 198 -15.924 -11.173 14.138 1.00 98.51 H +ATOM 3104 HB3 MET A 198 -16.224 -9.597 13.395 1.00 98.51 H +ATOM 3105 O MET A 198 -18.626 -10.897 15.630 1.00 98.51 O +ATOM 3106 CG MET A 198 -14.322 -9.740 14.364 1.00 98.51 C +ATOM 3107 HG2 MET A 198 -13.871 -10.329 15.162 1.00 98.51 H +ATOM 3108 HG3 MET A 198 -14.225 -8.686 14.625 1.00 98.51 H +ATOM 3109 SD MET A 198 -13.384 -10.035 12.848 1.00 98.51 S +ATOM 3110 CE MET A 198 -14.079 -8.745 11.786 1.00 98.51 C +ATOM 3111 HE1 MET A 198 -15.113 -8.991 11.546 1.00 98.51 H +ATOM 3112 HE2 MET A 198 -14.041 -7.786 12.302 1.00 98.51 H +ATOM 3113 HE3 MET A 198 -13.507 -8.678 10.861 1.00 98.51 H +ATOM 3114 N LEU A 199 -18.777 -8.790 14.883 1.00 97.76 N +ATOM 3115 H LEU A 199 -18.253 -7.961 14.640 1.00 97.76 H +ATOM 3116 CA LEU A 199 -20.240 -8.726 14.863 1.00 97.76 C +ATOM 3117 HA LEU A 199 -20.638 -9.493 15.527 1.00 97.76 H +ATOM 3118 C LEU A 199 -20.802 -8.992 13.457 1.00 97.76 C +ATOM 3119 CB LEU A 199 -20.684 -7.353 15.399 1.00 97.76 C +ATOM 3120 HB2 LEU A 199 -21.773 -7.315 15.409 1.00 97.76 H +ATOM 3121 HB3 LEU A 199 -20.337 -6.596 14.696 1.00 97.76 H +ATOM 3122 O LEU A 199 -20.130 -8.750 12.452 1.00 97.76 O +ATOM 3123 CG LEU A 199 -20.169 -6.988 16.806 1.00 97.76 C +ATOM 3124 HG LEU A 199 -19.131 -7.293 16.932 1.00 97.76 H +ATOM 3125 CD1 LEU A 199 -20.221 -5.470 16.981 1.00 97.76 C +ATOM 3126 HD11 LEU A 199 -19.572 -4.999 16.243 1.00 97.76 H +ATOM 3127 HD12 LEU A 199 -21.244 -5.121 16.842 1.00 97.76 H +ATOM 3128 HD13 LEU A 199 -19.881 -5.209 17.983 1.00 97.76 H +ATOM 3129 CD2 LEU A 199 -21.017 -7.637 17.898 1.00 97.76 C +ATOM 3130 HD21 LEU A 199 -20.973 -8.722 17.798 1.00 97.76 H +ATOM 3131 HD22 LEU A 199 -22.054 -7.309 17.825 1.00 97.76 H +ATOM 3132 HD23 LEU A 199 -20.622 -7.370 18.879 1.00 97.76 H +ATOM 3133 N GLY A 200 -22.057 -9.443 13.372 1.00 96.67 N +ATOM 3134 H GLY A 200 -22.551 -9.652 14.227 1.00 96.67 H +ATOM 3135 CA GLY A 200 -22.801 -9.515 12.107 1.00 96.67 C +ATOM 3136 HA2 GLY A 200 -22.866 -8.516 11.676 1.00 96.67 H +ATOM 3137 HA3 GLY A 200 -23.812 -9.863 12.315 1.00 96.67 H +ATOM 3138 C GLY A 200 -22.197 -10.452 11.051 1.00 96.67 C +ATOM 3139 O GLY A 200 -22.217 -10.109 9.874 1.00 96.67 O +ATOM 3140 N GLY A 201 -21.614 -11.586 11.462 1.00 96.14 N +ATOM 3141 H GLY A 201 -21.608 -11.797 12.450 1.00 96.14 H +ATOM 3142 CA GLY A 201 -21.027 -12.596 10.562 1.00 96.14 C +ATOM 3143 HA2 GLY A 201 -21.701 -12.766 9.723 1.00 96.14 H +ATOM 3144 HA3 GLY A 201 -20.924 -13.532 11.111 1.00 96.14 H +ATOM 3145 C GLY A 201 -19.645 -12.239 9.996 1.00 96.14 C +ATOM 3146 O GLY A 201 -19.105 -12.944 9.139 1.00 96.14 O +ATOM 3147 N THR A 202 -19.048 -11.131 10.447 1.00 98.40 N +ATOM 3148 H THR A 202 -19.531 -10.582 11.144 1.00 98.40 H +ATOM 3149 CA THR A 202 -17.744 -10.667 9.944 1.00 98.40 C +ATOM 3150 HA THR A 202 -17.747 -10.798 8.862 1.00 98.40 H +ATOM 3151 C THR A 202 -16.551 -11.483 10.451 1.00 98.40 C +ATOM 3152 CB THR A 202 -17.526 -9.176 10.205 1.00 98.40 C +ATOM 3153 HB THR A 202 -16.533 -8.910 9.844 1.00 98.40 H +ATOM 3154 O THR A 202 -15.466 -11.395 9.873 1.00 98.40 O +ATOM 3155 CG2 THR A 202 -18.546 -8.311 9.481 1.00 98.40 C +ATOM 3156 HG21 THR A 202 -19.555 -8.546 9.819 1.00 98.40 H +ATOM 3157 HG22 THR A 202 -18.334 -7.262 9.688 1.00 98.40 H +ATOM 3158 HG23 THR A 202 -18.481 -8.482 8.406 1.00 98.40 H +ATOM 3159 OG1 THR A 202 -17.619 -8.848 11.566 1.00 98.40 O +ATOM 3160 HG1 THR A 202 -18.547 -8.834 11.809 1.00 98.40 H +ATOM 3161 N ASP A 203 -16.759 -12.348 11.445 1.00 97.76 N +ATOM 3162 H ASP A 203 -17.698 -12.439 11.806 1.00 97.76 H +ATOM 3163 CA ASP A 203 -15.823 -13.382 11.899 1.00 97.76 C +ATOM 3164 HA ASP A 203 -14.904 -12.906 12.243 1.00 97.76 H +ATOM 3165 C ASP A 203 -15.468 -14.387 10.783 1.00 97.76 C +ATOM 3166 CB ASP A 203 -16.474 -14.118 13.082 1.00 97.76 C +ATOM 3167 HB2 ASP A 203 -16.739 -13.399 13.857 1.00 97.76 H +ATOM 3168 HB3 ASP A 203 -15.757 -14.823 13.501 1.00 97.76 H +ATOM 3169 O ASP A 203 -14.341 -14.889 10.715 1.00 97.76 O +ATOM 3170 CG ASP A 203 -17.736 -14.865 12.645 1.00 97.76 C +ATOM 3171 OD1 ASP A 203 -18.723 -14.166 12.316 1.00 97.76 O +ATOM 3172 OD2 ASP A 203 -17.645 -16.104 12.513 1.00 97.76 O +ATOM 3173 N SER A 204 -16.397 -14.633 9.853 1.00 97.78 N +ATOM 3174 H SER A 204 -17.325 -14.270 10.015 1.00 97.78 H +ATOM 3175 CA SER A 204 -16.142 -15.428 8.652 1.00 97.78 C +ATOM 3176 HA SER A 204 -15.542 -16.296 8.927 1.00 97.78 H +ATOM 3177 C SER A 204 -15.371 -14.619 7.612 1.00 97.78 C +ATOM 3178 CB SER A 204 -17.464 -15.934 8.075 1.00 97.78 C +ATOM 3179 HB2 SER A 204 -17.964 -16.549 8.824 1.00 97.78 H +ATOM 3180 HB3 SER A 204 -18.107 -15.087 7.838 1.00 97.78 H +ATOM 3181 O SER A 204 -14.384 -15.110 7.057 1.00 97.78 O +ATOM 3182 OG SER A 204 -17.248 -16.703 6.898 1.00 97.78 O +ATOM 3183 HG SER A 204 -18.117 -17.033 6.662 1.00 97.78 H +ATOM 3184 N THR A 205 -15.776 -13.374 7.358 1.00 98.18 N +ATOM 3185 H THR A 205 -16.612 -13.042 7.816 1.00 98.18 H +ATOM 3186 CA THR A 205 -15.173 -12.502 6.336 1.00 98.18 C +ATOM 3187 HA THR A 205 -15.226 -13.004 5.370 1.00 98.18 H +ATOM 3188 C THR A 205 -13.709 -12.191 6.630 1.00 98.18 C +ATOM 3189 CB THR A 205 -15.948 -11.183 6.228 1.00 98.18 C +ATOM 3190 HB THR A 205 -15.752 -10.570 7.108 1.00 98.18 H +ATOM 3191 O THR A 205 -12.877 -12.231 5.724 1.00 98.18 O +ATOM 3192 CG2 THR A 205 -15.577 -10.408 4.966 1.00 98.18 C +ATOM 3193 HG21 THR A 205 -16.096 -9.450 4.968 1.00 98.18 H +ATOM 3194 HG22 THR A 205 -14.505 -10.212 4.934 1.00 98.18 H +ATOM 3195 HG23 THR A 205 -15.864 -10.974 4.080 1.00 98.18 H +ATOM 3196 OG1 THR A 205 -17.325 -11.461 6.163 1.00 98.18 O +ATOM 3197 HG1 THR A 205 -17.810 -10.640 6.271 1.00 98.18 H +ATOM 3198 N ILE A 206 -13.353 -11.954 7.895 1.00 98.45 N +ATOM 3199 H ILE A 206 -14.071 -11.921 8.605 1.00 98.45 H +ATOM 3200 CA ILE A 206 -11.981 -11.594 8.281 1.00 98.45 C +ATOM 3201 HA ILE A 206 -11.701 -10.727 7.683 1.00 98.45 H +ATOM 3202 C ILE A 206 -10.958 -12.699 7.975 1.00 98.45 C +ATOM 3203 CB ILE A 206 -11.961 -11.187 9.766 1.00 98.45 C +ATOM 3204 HB ILE A 206 -12.842 -10.572 9.950 1.00 98.45 H +ATOM 3205 O ILE A 206 -9.786 -12.418 7.742 1.00 98.45 O +ATOM 3206 CG1 ILE A 206 -10.733 -10.350 10.151 1.00 98.45 C +ATOM 3207 HG12 ILE A 206 -10.772 -10.185 11.228 1.00 98.45 H +ATOM 3208 HG13 ILE A 206 -9.814 -10.889 9.920 1.00 98.45 H +ATOM 3209 CG2 ILE A 206 -12.052 -12.411 10.689 1.00 98.45 C +ATOM 3210 HG21 ILE A 206 -12.987 -12.932 10.486 1.00 98.45 H +ATOM 3211 HG22 ILE A 206 -12.059 -12.095 11.732 1.00 98.45 H +ATOM 3212 HG23 ILE A 206 -11.207 -13.086 10.551 1.00 98.45 H +ATOM 3213 CD1 ILE A 206 -10.687 -8.973 9.485 1.00 98.45 C +ATOM 3214 HD11 ILE A 206 -9.897 -8.389 9.959 1.00 98.45 H +ATOM 3215 HD12 ILE A 206 -10.479 -9.059 8.418 1.00 98.45 H +ATOM 3216 HD13 ILE A 206 -11.627 -8.445 9.642 1.00 98.45 H +ATOM 3217 N THR A 207 -11.387 -13.965 7.907 1.00 98.34 N +ATOM 3218 H THR A 207 -12.356 -14.152 8.118 1.00 98.34 H +ATOM 3219 CA THR A 207 -10.498 -15.062 7.482 1.00 98.34 C +ATOM 3220 HA THR A 207 -9.554 -14.971 8.018 1.00 98.34 H +ATOM 3221 C THR A 207 -10.159 -14.989 5.996 1.00 98.34 C +ATOM 3222 CB THR A 207 -11.068 -16.452 7.794 1.00 98.34 C +ATOM 3223 HB THR A 207 -10.327 -17.194 7.496 1.00 98.34 H +ATOM 3224 O THR A 207 -9.050 -15.338 5.606 1.00 98.34 O +ATOM 3225 CG2 THR A 207 -11.345 -16.639 9.281 1.00 98.34 C +ATOM 3226 HG21 THR A 207 -12.109 -15.940 9.620 1.00 98.34 H +ATOM 3227 HG22 THR A 207 -10.418 -16.475 9.832 1.00 98.34 H +ATOM 3228 HG23 THR A 207 -11.683 -17.661 9.449 1.00 98.34 H +ATOM 3229 OG1 THR A 207 -12.263 -16.725 7.094 1.00 98.34 O +ATOM 3230 HG1 THR A 207 -12.927 -16.073 7.328 1.00 98.34 H +ATOM 3231 N LYS A 208 -11.075 -14.488 5.158 1.00 98.59 N +ATOM 3232 H LYS A 208 -11.935 -14.130 5.547 1.00 98.59 H +ATOM 3233 CA LYS A 208 -10.811 -14.259 3.729 1.00 98.59 C +ATOM 3234 HA LYS A 208 -10.266 -15.107 3.315 1.00 98.59 H +ATOM 3235 C LYS A 208 -9.893 -13.053 3.555 1.00 98.59 C +ATOM 3236 CB LYS A 208 -12.107 -14.071 2.919 1.00 98.59 C +ATOM 3237 HB2 LYS A 208 -11.828 -13.710 1.929 1.00 98.59 H +ATOM 3238 HB3 LYS A 208 -12.723 -13.300 3.381 1.00 98.59 H +ATOM 3239 O LYS A 208 -9.022 -13.092 2.699 1.00 98.59 O +ATOM 3240 CG LYS A 208 -12.958 -15.332 2.700 1.00 98.59 C +ATOM 3241 HG2 LYS A 208 -13.796 -15.060 2.058 1.00 98.59 H +ATOM 3242 HG3 LYS A 208 -12.366 -16.090 2.187 1.00 98.59 H +ATOM 3243 CD LYS A 208 -13.507 -15.911 4.006 1.00 98.59 C +ATOM 3244 HD2 LYS A 208 -12.701 -16.436 4.519 1.00 98.59 H +ATOM 3245 HD3 LYS A 208 -13.863 -15.085 4.621 1.00 98.59 H +ATOM 3246 CE LYS A 208 -14.662 -16.887 3.783 1.00 98.59 C +ATOM 3247 HE2 LYS A 208 -15.476 -16.366 3.280 1.00 98.59 H +ATOM 3248 HE3 LYS A 208 -14.319 -17.691 3.132 1.00 98.59 H +ATOM 3249 NZ LYS A 208 -15.126 -17.439 5.081 1.00 98.59 N +ATOM 3250 HZ1 LYS A 208 -15.842 -18.138 4.948 1.00 98.59 H +ATOM 3251 HZ2 LYS A 208 -14.354 -17.842 5.593 1.00 98.59 H +ATOM 3252 HZ3 LYS A 208 -15.524 -16.720 5.668 1.00 98.59 H +ATOM 3253 N VAL A 209 -10.028 -12.035 4.413 1.00 98.74 N +ATOM 3254 H VAL A 209 -10.804 -12.056 5.059 1.00 98.74 H +ATOM 3255 CA VAL A 209 -9.079 -10.910 4.471 1.00 98.74 C +ATOM 3256 HA VAL A 209 -9.044 -10.436 3.490 1.00 98.74 H +ATOM 3257 C VAL A 209 -7.664 -11.407 4.773 1.00 98.74 C +ATOM 3258 CB VAL A 209 -9.515 -9.844 5.495 1.00 98.74 C +ATOM 3259 HB VAL A 209 -9.626 -10.301 6.479 1.00 98.74 H +ATOM 3260 O VAL A 209 -6.736 -11.012 4.077 1.00 98.74 O +ATOM 3261 CG1 VAL A 209 -8.499 -8.708 5.618 1.00 98.74 C +ATOM 3262 HG11 VAL A 209 -7.549 -9.078 6.004 1.00 98.74 H +ATOM 3263 HG12 VAL A 209 -8.338 -8.254 4.641 1.00 98.74 H +ATOM 3264 HG13 VAL A 209 -8.868 -7.949 6.309 1.00 98.74 H +ATOM 3265 CG2 VAL A 209 -10.855 -9.219 5.097 1.00 98.74 C +ATOM 3266 HG21 VAL A 209 -10.769 -8.783 4.102 1.00 98.74 H +ATOM 3267 HG22 VAL A 209 -11.125 -8.436 5.805 1.00 98.74 H +ATOM 3268 HG23 VAL A 209 -11.642 -9.974 5.097 1.00 98.74 H +ATOM 3269 N PHE A 210 -7.492 -12.320 5.738 1.00 98.72 N +ATOM 3270 H PHE A 210 -8.280 -12.573 6.317 1.00 98.72 H +ATOM 3271 CA PHE A 210 -6.186 -12.936 6.006 1.00 98.72 C +ATOM 3272 HA PHE A 210 -5.486 -12.155 6.303 1.00 98.72 H +ATOM 3273 C PHE A 210 -5.598 -13.609 4.757 1.00 98.72 C +ATOM 3274 CB PHE A 210 -6.300 -13.955 7.149 1.00 98.72 C +ATOM 3275 HB2 PHE A 210 -7.085 -14.675 6.918 1.00 98.72 H +ATOM 3276 HB3 PHE A 210 -6.599 -13.445 8.065 1.00 98.72 H +ATOM 3277 O PHE A 210 -4.459 -13.333 4.390 1.00 98.72 O +ATOM 3278 CG PHE A 210 -5.016 -14.718 7.409 1.00 98.72 C +ATOM 3279 CD1 PHE A 210 -4.895 -16.058 6.993 1.00 98.72 C +ATOM 3280 HD1 PHE A 210 -5.715 -16.553 6.496 1.00 98.72 H +ATOM 3281 CD2 PHE A 210 -3.916 -14.070 8.000 1.00 98.72 C +ATOM 3282 HD2 PHE A 210 -3.983 -13.024 8.260 1.00 98.72 H +ATOM 3283 CE1 PHE A 210 -3.685 -16.747 7.187 1.00 98.72 C +ATOM 3284 HE1 PHE A 210 -3.583 -17.765 6.839 1.00 98.72 H +ATOM 3285 CE2 PHE A 210 -2.709 -14.760 8.200 1.00 98.72 C +ATOM 3286 HE2 PHE A 210 -1.854 -14.252 8.620 1.00 98.72 H +ATOM 3287 CZ PHE A 210 -2.595 -16.101 7.796 1.00 98.72 C +ATOM 3288 HZ PHE A 210 -1.656 -16.621 7.914 1.00 98.72 H +ATOM 3289 N TRP A 211 -6.376 -14.452 4.074 1.00 98.64 N +ATOM 3290 H TRP A 211 -7.297 -14.667 4.427 1.00 98.64 H +ATOM 3291 CA TRP A 211 -5.905 -15.141 2.869 1.00 98.64 C +ATOM 3292 HA TRP A 211 -4.952 -15.618 3.098 1.00 98.64 H +ATOM 3293 C TRP A 211 -5.628 -14.194 1.700 1.00 98.64 C +ATOM 3294 CB TRP A 211 -6.901 -16.233 2.478 1.00 98.64 C +ATOM 3295 HB2 TRP A 211 -6.649 -16.591 1.480 1.00 98.64 H +ATOM 3296 HB3 TRP A 211 -7.907 -15.815 2.435 1.00 98.64 H +ATOM 3297 O TRP A 211 -4.639 -14.387 0.997 1.00 98.64 O +ATOM 3298 CG TRP A 211 -6.878 -17.416 3.393 1.00 98.64 C +ATOM 3299 CD1 TRP A 211 -7.905 -17.867 4.147 1.00 98.64 C +ATOM 3300 HD1 TRP A 211 -8.887 -17.418 4.175 1.00 98.64 H +ATOM 3301 CD2 TRP A 211 -5.761 -18.318 3.655 1.00 98.64 C +ATOM 3302 CE2 TRP A 211 -6.189 -19.302 4.595 1.00 98.64 C +ATOM 3303 CE3 TRP A 211 -4.432 -18.409 3.186 1.00 98.64 C +ATOM 3304 HE3 TRP A 211 -4.075 -17.697 2.456 1.00 98.64 H +ATOM 3305 NE1 TRP A 211 -7.503 -18.981 4.858 1.00 98.64 N +ATOM 3306 HE1 TRP A 211 -8.117 -19.521 5.451 1.00 98.64 H +ATOM 3307 CH2 TRP A 211 -4.028 -20.385 4.564 1.00 98.64 C +ATOM 3308 HH2 TRP A 211 -3.364 -21.172 4.890 1.00 98.64 H +ATOM 3309 CZ2 TRP A 211 -5.345 -20.325 5.049 1.00 98.64 C +ATOM 3310 HZ2 TRP A 211 -5.704 -21.064 5.750 1.00 98.64 H +ATOM 3311 CZ3 TRP A 211 -3.575 -19.429 3.638 1.00 98.64 C +ATOM 3312 HZ3 TRP A 211 -2.565 -19.489 3.258 1.00 98.64 H +ATOM 3313 N LEU A 212 -6.431 -13.140 1.531 1.00 98.64 N +ATOM 3314 H LEU A 212 -7.250 -13.056 2.116 1.00 98.64 H +ATOM 3315 CA LEU A 212 -6.162 -12.078 0.564 1.00 98.64 C +ATOM 3316 HA LEU A 212 -6.084 -12.524 -0.428 1.00 98.64 H +ATOM 3317 C LEU A 212 -4.829 -11.384 0.863 1.00 98.64 C +ATOM 3318 CB LEU A 212 -7.325 -11.069 0.567 1.00 98.64 C +ATOM 3319 HB2 LEU A 212 -8.232 -11.574 0.234 1.00 98.64 H +ATOM 3320 HB3 LEU A 212 -7.487 -10.725 1.588 1.00 98.64 H +ATOM 3321 O LEU A 212 -4.054 -11.160 -0.060 1.00 98.64 O +ATOM 3322 CG LEU A 212 -7.078 -9.831 -0.320 1.00 98.64 C +ATOM 3323 HG LEU A 212 -6.174 -9.315 0.002 1.00 98.64 H +ATOM 3324 CD1 LEU A 212 -6.946 -10.189 -1.801 1.00 98.64 C +ATOM 3325 HD11 LEU A 212 -7.822 -10.744 -2.136 1.00 98.64 H +ATOM 3326 HD12 LEU A 212 -6.856 -9.277 -2.391 1.00 98.64 H +ATOM 3327 HD13 LEU A 212 -6.051 -10.790 -1.964 1.00 98.64 H +ATOM 3328 CD2 LEU A 212 -8.235 -8.853 -0.164 1.00 98.64 C +ATOM 3329 HD21 LEU A 212 -8.029 -7.958 -0.750 1.00 98.64 H +ATOM 3330 HD22 LEU A 212 -9.156 -9.313 -0.522 1.00 98.64 H +ATOM 3331 HD23 LEU A 212 -8.349 -8.573 0.884 1.00 98.64 H +ATOM 3332 N MET A 213 -4.543 -11.069 2.132 1.00 98.74 N +ATOM 3333 H MET A 213 -5.230 -11.260 2.847 1.00 98.74 H +ATOM 3334 CA MET A 213 -3.256 -10.486 2.523 1.00 98.74 C +ATOM 3335 HA MET A 213 -3.092 -9.573 1.951 1.00 98.74 H +ATOM 3336 C MET A 213 -2.102 -11.433 2.193 1.00 98.74 C +ATOM 3337 CB MET A 213 -3.229 -10.133 4.017 1.00 98.74 C +ATOM 3338 HB2 MET A 213 -2.209 -9.855 4.284 1.00 98.74 H +ATOM 3339 HB3 MET A 213 -3.504 -11.007 4.608 1.00 98.74 H +ATOM 3340 O MET A 213 -1.137 -10.997 1.578 1.00 98.74 O +ATOM 3341 CG MET A 213 -4.155 -8.971 4.384 1.00 98.74 C +ATOM 3342 HG2 MET A 213 -3.788 -8.060 3.909 1.00 98.74 H +ATOM 3343 HG3 MET A 213 -5.153 -9.167 3.992 1.00 98.74 H +ATOM 3344 SD MET A 213 -4.292 -8.692 6.173 1.00 98.74 S +ATOM 3345 CE MET A 213 -2.643 -8.007 6.503 1.00 98.74 C +ATOM 3346 HE1 MET A 213 -2.571 -7.716 7.551 1.00 98.74 H +ATOM 3347 HE2 MET A 213 -1.875 -8.749 6.284 1.00 98.74 H +ATOM 3348 HE3 MET A 213 -2.479 -7.129 5.878 1.00 98.74 H +ATOM 3349 N MET A 214 -2.209 -12.724 2.533 1.00 98.64 N +ATOM 3350 H MET A 214 -3.028 -13.027 3.040 1.00 98.64 H +ATOM 3351 CA MET A 214 -1.162 -13.706 2.212 1.00 98.64 C +ATOM 3352 HA MET A 214 -0.219 -13.376 2.648 1.00 98.64 H +ATOM 3353 C MET A 214 -0.923 -13.809 0.703 1.00 98.64 C +ATOM 3354 CB MET A 214 -1.502 -15.092 2.781 1.00 98.64 C +ATOM 3355 HB2 MET A 214 -0.734 -15.792 2.453 1.00 98.64 H +ATOM 3356 HB3 MET A 214 -2.455 -15.428 2.372 1.00 98.64 H +ATOM 3357 O MET A 214 0.224 -13.791 0.266 1.00 98.64 O +ATOM 3358 CG MET A 214 -1.572 -15.167 4.311 1.00 98.64 C +ATOM 3359 HG2 MET A 214 -2.440 -14.610 4.666 1.00 98.64 H +ATOM 3360 HG3 MET A 214 -1.741 -16.211 4.575 1.00 98.64 H +ATOM 3361 SD MET A 214 -0.111 -14.604 5.233 1.00 98.64 S +ATOM 3362 CE MET A 214 -0.510 -12.845 5.450 1.00 98.64 C +ATOM 3363 HE1 MET A 214 0.056 -12.442 6.290 1.00 98.64 H +ATOM 3364 HE2 MET A 214 -1.574 -12.730 5.660 1.00 98.64 H +ATOM 3365 HE3 MET A 214 -0.251 -12.285 4.552 1.00 98.64 H +ATOM 3366 N PHE A 215 -1.991 -13.867 -0.094 1.00 98.63 N +ATOM 3367 H PHE A 215 -2.908 -13.889 0.327 1.00 98.63 H +ATOM 3368 CA PHE A 215 -1.905 -13.908 -1.553 1.00 98.63 C +ATOM 3369 HA PHE A 215 -1.259 -14.733 -1.851 1.00 98.63 H +ATOM 3370 C PHE A 215 -1.279 -12.629 -2.121 1.00 98.63 C +ATOM 3371 CB PHE A 215 -3.308 -14.158 -2.128 1.00 98.63 C +ATOM 3372 HB2 PHE A 215 -4.025 -13.515 -1.617 1.00 98.63 H +ATOM 3373 HB3 PHE A 215 -3.594 -15.190 -1.927 1.00 98.63 H +ATOM 3374 O PHE A 215 -0.233 -12.682 -2.762 1.00 98.63 O +ATOM 3375 CG PHE A 215 -3.410 -13.896 -3.618 1.00 98.63 C +ATOM 3376 CD1 PHE A 215 -4.044 -12.729 -4.090 1.00 98.63 C +ATOM 3377 HD1 PHE A 215 -4.486 -12.031 -3.395 1.00 98.63 H +ATOM 3378 CD2 PHE A 215 -2.819 -14.788 -4.533 1.00 98.63 C +ATOM 3379 HD2 PHE A 215 -2.316 -15.676 -4.180 1.00 98.63 H +ATOM 3380 CE1 PHE A 215 -4.088 -12.456 -5.468 1.00 98.63 C +ATOM 3381 HE1 PHE A 215 -4.564 -11.557 -5.829 1.00 98.63 H +ATOM 3382 CE2 PHE A 215 -2.867 -14.516 -5.911 1.00 98.63 C +ATOM 3383 HE2 PHE A 215 -2.406 -15.195 -6.613 1.00 98.63 H +ATOM 3384 CZ PHE A 215 -3.500 -13.351 -6.378 1.00 98.63 C +ATOM 3385 HZ PHE A 215 -3.527 -13.139 -7.437 1.00 98.63 H +ATOM 3386 N ALA A 216 -1.890 -11.473 -1.854 1.00 98.36 N +ATOM 3387 H ALA A 216 -2.710 -11.485 -1.266 1.00 98.36 H +ATOM 3388 CA ALA A 216 -1.501 -10.210 -2.466 1.00 98.36 C +ATOM 3389 HA ALA A 216 -1.463 -10.343 -3.547 1.00 98.36 H +ATOM 3390 C ALA A 216 -0.114 -9.749 -2.008 1.00 98.36 C +ATOM 3391 CB ALA A 216 -2.570 -9.161 -2.139 1.00 98.36 C +ATOM 3392 HB1 ALA A 216 -3.544 -9.515 -2.476 1.00 98.36 H +ATOM 3393 HB2 ALA A 216 -2.609 -8.985 -1.064 1.00 98.36 H +ATOM 3394 HB3 ALA A 216 -2.326 -8.229 -2.650 1.00 98.36 H +ATOM 3395 O ALA A 216 0.656 -9.238 -2.815 1.00 98.36 O +ATOM 3396 N TRP A 217 0.227 -9.930 -0.726 1.00 98.58 N +ATOM 3397 H TRP A 217 -0.413 -10.383 -0.089 1.00 98.58 H +ATOM 3398 CA TRP A 217 1.511 -9.457 -0.206 1.00 98.58 C +ATOM 3399 HA TRP A 217 1.685 -8.467 -0.626 1.00 98.58 H +ATOM 3400 C TRP A 217 2.681 -10.337 -0.657 1.00 98.58 C +ATOM 3401 CB TRP A 217 1.494 -9.276 1.316 1.00 98.58 C +ATOM 3402 HB2 TRP A 217 2.520 -9.048 1.606 1.00 98.58 H +ATOM 3403 HB3 TRP A 217 1.225 -10.212 1.803 1.00 98.58 H +ATOM 3404 O TRP A 217 3.796 -9.839 -0.765 1.00 98.58 O +ATOM 3405 CG TRP A 217 0.657 -8.152 1.863 1.00 98.58 C +ATOM 3406 CD1 TRP A 217 -0.388 -7.552 1.245 1.00 98.58 C +ATOM 3407 HD1 TRP A 217 -0.770 -7.824 0.272 1.00 98.58 H +ATOM 3408 CD2 TRP A 217 0.818 -7.441 3.132 1.00 98.58 C +ATOM 3409 CE2 TRP A 217 -0.144 -6.387 3.179 1.00 98.58 C +ATOM 3410 CE3 TRP A 217 1.663 -7.567 4.256 1.00 98.58 C +ATOM 3411 HE3 TRP A 217 2.391 -8.364 4.300 1.00 98.58 H +ATOM 3412 NE1 TRP A 217 -0.868 -6.520 2.022 1.00 98.58 N +ATOM 3413 HE1 TRP A 217 -1.636 -5.922 1.752 1.00 98.58 H +ATOM 3414 CH2 TRP A 217 0.631 -5.630 5.327 1.00 98.58 C +ATOM 3415 HH2 TRP A 217 0.579 -4.943 6.158 1.00 98.58 H +ATOM 3416 CZ2 TRP A 217 -0.235 -5.481 4.240 1.00 98.58 C +ATOM 3417 HZ2 TRP A 217 -0.968 -4.688 4.222 1.00 98.58 H +ATOM 3418 CZ3 TRP A 217 1.552 -6.682 5.343 1.00 98.58 C +ATOM 3419 HZ3 TRP A 217 2.164 -6.807 6.225 1.00 98.58 H +ATOM 3420 N THR A 218 2.436 -11.609 -0.991 1.00 98.75 N +ATOM 3421 H THR A 218 1.496 -11.965 -0.894 1.00 98.75 H +ATOM 3422 CA THR A 218 3.468 -12.513 -1.534 1.00 98.75 C +ATOM 3423 HA THR A 218 4.379 -12.386 -0.949 1.00 98.75 H +ATOM 3424 C THR A 218 3.831 -12.187 -2.989 1.00 98.75 C +ATOM 3425 CB THR A 218 3.032 -13.979 -1.385 1.00 98.75 C +ATOM 3426 HB THR A 218 2.103 -14.143 -1.931 1.00 98.75 H +ATOM 3427 O THR A 218 4.907 -12.551 -3.452 1.00 98.75 O +ATOM 3428 CG2 THR A 218 4.073 -14.992 -1.858 1.00 98.75 C +ATOM 3429 HG21 THR A 218 5.046 -14.761 -1.424 1.00 98.75 H +ATOM 3430 HG22 THR A 218 4.146 -14.971 -2.945 1.00 98.75 H +ATOM 3431 HG23 THR A 218 3.773 -15.995 -1.555 1.00 98.75 H +ATOM 3432 OG1 THR A 218 2.813 -14.260 -0.020 1.00 98.75 O +ATOM 3433 HG1 THR A 218 1.876 -14.121 0.137 1.00 98.75 H +ATOM 3434 N LEU A 219 3.003 -11.430 -3.714 1.00 98.63 N +ATOM 3435 H LEU A 219 2.124 -11.135 -3.314 1.00 98.63 H +ATOM 3436 CA LEU A 219 3.343 -10.983 -5.070 1.00 98.63 C +ATOM 3437 HA LEU A 219 3.675 -11.841 -5.656 1.00 98.63 H +ATOM 3438 C LEU A 219 4.511 -9.981 -5.092 1.00 98.63 C +ATOM 3439 CB LEU A 219 2.097 -10.391 -5.742 1.00 98.63 C +ATOM 3440 HB2 LEU A 219 1.755 -9.554 -5.133 1.00 98.63 H +ATOM 3441 HB3 LEU A 219 2.383 -10.000 -6.718 1.00 98.63 H +ATOM 3442 O LEU A 219 5.280 -9.975 -6.050 1.00 98.63 O +ATOM 3443 CG LEU A 219 0.925 -11.370 -5.933 1.00 98.63 C +ATOM 3444 HG LEU A 219 0.618 -11.761 -4.963 1.00 98.63 H +ATOM 3445 CD1 LEU A 219 -0.264 -10.625 -6.537 1.00 98.63 C +ATOM 3446 HD11 LEU A 219 -0.555 -9.808 -5.877 1.00 98.63 H +ATOM 3447 HD12 LEU A 219 -1.107 -11.306 -6.647 1.00 98.63 H +ATOM 3448 HD13 LEU A 219 0.009 -10.220 -7.512 1.00 98.63 H +ATOM 3449 CD2 LEU A 219 1.275 -12.544 -6.848 1.00 98.63 C +ATOM 3450 HD21 LEU A 219 0.391 -13.161 -7.006 1.00 98.63 H +ATOM 3451 HD22 LEU A 219 1.634 -12.177 -7.809 1.00 98.63 H +ATOM 3452 HD23 LEU A 219 2.042 -13.164 -6.383 1.00 98.63 H +ATOM 3453 N TYR A 220 4.695 -9.176 -4.039 1.00 98.73 N +ATOM 3454 H TYR A 220 4.047 -9.234 -3.266 1.00 98.73 H +ATOM 3455 CA TYR A 220 5.806 -8.218 -3.951 1.00 98.73 C +ATOM 3456 HA TYR A 220 5.788 -7.616 -4.859 1.00 98.73 H +ATOM 3457 C TYR A 220 7.196 -8.884 -3.912 1.00 98.73 C +ATOM 3458 CB TYR A 220 5.618 -7.255 -2.769 1.00 98.73 C +ATOM 3459 HB2 TYR A 220 6.495 -6.612 -2.707 1.00 98.73 H +ATOM 3460 HB3 TYR A 220 5.566 -7.821 -1.839 1.00 98.73 H +ATOM 3461 O TYR A 220 8.046 -8.473 -4.700 1.00 98.73 O +ATOM 3462 CG TYR A 220 4.394 -6.368 -2.880 1.00 98.73 C +ATOM 3463 CD1 TYR A 220 4.420 -5.222 -3.693 1.00 98.73 C +ATOM 3464 HD1 TYR A 220 5.323 -4.963 -4.226 1.00 98.73 H +ATOM 3465 CD2 TYR A 220 3.230 -6.688 -2.164 1.00 98.73 C +ATOM 3466 HD2 TYR A 220 3.245 -7.556 -1.523 1.00 98.73 H +ATOM 3467 CE1 TYR A 220 3.273 -4.415 -3.817 1.00 98.73 C +ATOM 3468 HE1 TYR A 220 3.284 -3.550 -4.463 1.00 98.73 H +ATOM 3469 CE2 TYR A 220 2.082 -5.880 -2.266 1.00 98.73 C +ATOM 3470 HE2 TYR A 220 1.181 -6.128 -1.724 1.00 98.73 H +ATOM 3471 OH TYR A 220 1.005 -3.960 -3.236 1.00 98.73 O +ATOM 3472 HH TYR A 220 1.135 -3.317 -3.936 1.00 98.73 H +ATOM 3473 CZ TYR A 220 2.104 -4.745 -3.103 1.00 98.73 C +ATOM 3474 N PRO A 221 7.471 -9.913 -3.081 1.00 98.56 N +ATOM 3475 CA PRO A 221 8.746 -10.627 -3.141 1.00 98.56 C +ATOM 3476 HA PRO A 221 9.559 -9.904 -3.075 1.00 98.56 H +ATOM 3477 C PRO A 221 8.933 -11.429 -4.439 1.00 98.56 C +ATOM 3478 CB PRO A 221 8.802 -11.510 -1.891 1.00 98.56 C +ATOM 3479 HB2 PRO A 221 9.294 -12.464 -2.080 1.00 98.56 H +ATOM 3480 HB3 PRO A 221 9.320 -10.974 -1.096 1.00 98.56 H +ATOM 3481 O PRO A 221 10.066 -11.608 -4.874 1.00 98.56 O +ATOM 3482 CG PRO A 221 7.340 -11.696 -1.503 1.00 98.56 C +ATOM 3483 HG2 PRO A 221 6.930 -12.534 -2.067 1.00 98.56 H +ATOM 3484 HG3 PRO A 221 7.224 -11.865 -0.432 1.00 98.56 H +ATOM 3485 CD PRO A 221 6.702 -10.378 -1.937 1.00 98.56 C +ATOM 3486 HD2 PRO A 221 5.652 -10.536 -2.184 1.00 98.56 H +ATOM 3487 HD3 PRO A 221 6.786 -9.654 -1.127 1.00 98.56 H +ATOM 3488 N ILE A 222 7.857 -11.867 -5.108 1.00 98.71 N +ATOM 3489 H ILE A 222 6.939 -11.730 -4.710 1.00 98.71 H +ATOM 3490 CA ILE A 222 7.971 -12.463 -6.452 1.00 98.71 C +ATOM 3491 HA ILE A 222 8.743 -13.233 -6.425 1.00 98.71 H +ATOM 3492 C ILE A 222 8.445 -11.403 -7.458 1.00 98.71 C +ATOM 3493 CB ILE A 222 6.648 -13.136 -6.888 1.00 98.71 C +ATOM 3494 HB ILE A 222 5.845 -12.401 -6.833 1.00 98.71 H +ATOM 3495 O ILE A 222 9.390 -11.651 -8.204 1.00 98.71 O +ATOM 3496 CG1 ILE A 222 6.307 -14.326 -5.961 1.00 98.71 C +ATOM 3497 HG12 ILE A 222 6.973 -15.159 -6.186 1.00 98.71 H +ATOM 3498 HG13 ILE A 222 6.476 -14.051 -4.920 1.00 98.71 H +ATOM 3499 CG2 ILE A 222 6.750 -13.641 -8.342 1.00 98.71 C +ATOM 3500 HG21 ILE A 222 7.557 -14.368 -8.431 1.00 98.71 H +ATOM 3501 HG22 ILE A 222 5.815 -14.103 -8.660 1.00 98.71 H +ATOM 3502 HG23 ILE A 222 6.953 -12.820 -9.029 1.00 98.71 H +ATOM 3503 CD1 ILE A 222 4.854 -14.807 -6.074 1.00 98.71 C +ATOM 3504 HD11 ILE A 222 4.178 -14.012 -5.759 1.00 98.71 H +ATOM 3505 HD12 ILE A 222 4.615 -15.105 -7.094 1.00 98.71 H +ATOM 3506 HD13 ILE A 222 4.710 -15.667 -5.419 1.00 98.71 H +ATOM 3507 N ALA A 223 7.846 -10.206 -7.439 1.00 98.69 N +ATOM 3508 H ALA A 223 7.061 -10.067 -6.820 1.00 98.69 H +ATOM 3509 CA ALA A 223 8.259 -9.081 -8.281 1.00 98.69 C +ATOM 3510 HA ALA A 223 8.208 -9.389 -9.325 1.00 98.69 H +ATOM 3511 C ALA A 223 9.709 -8.640 -7.996 1.00 98.69 C +ATOM 3512 CB ALA A 223 7.263 -7.933 -8.070 1.00 98.69 C +ATOM 3513 HB1 ALA A 223 6.247 -8.282 -8.257 1.00 98.69 H +ATOM 3514 HB2 ALA A 223 7.328 -7.564 -7.047 1.00 98.69 H +ATOM 3515 HB3 ALA A 223 7.485 -7.116 -8.756 1.00 98.69 H +ATOM 3516 O ALA A 223 10.459 -8.344 -8.924 1.00 98.69 O +ATOM 3517 N TYR A 224 10.121 -8.663 -6.726 1.00 98.74 N +ATOM 3518 H TYR A 224 9.431 -8.857 -6.014 1.00 98.74 H +ATOM 3519 CA TYR A 224 11.493 -8.389 -6.288 1.00 98.74 C +ATOM 3520 HA TYR A 224 11.780 -7.384 -6.600 1.00 98.74 H +ATOM 3521 C TYR A 224 12.529 -9.363 -6.864 1.00 98.74 C +ATOM 3522 CB TYR A 224 11.520 -8.464 -4.760 1.00 98.74 C +ATOM 3523 HB2 TYR A 224 10.853 -7.702 -4.356 1.00 98.74 H +ATOM 3524 HB3 TYR A 224 11.139 -9.437 -4.451 1.00 98.74 H +ATOM 3525 O TYR A 224 13.654 -8.962 -7.138 1.00 98.74 O +ATOM 3526 CG TYR A 224 12.885 -8.293 -4.139 1.00 98.74 C +ATOM 3527 CD1 TYR A 224 13.613 -9.410 -3.680 1.00 98.74 C +ATOM 3528 HD1 TYR A 224 13.218 -10.407 -3.809 1.00 98.74 H +ATOM 3529 CD2 TYR A 224 13.431 -7.005 -4.036 1.00 98.74 C +ATOM 3530 HD2 TYR A 224 12.936 -6.175 -4.519 1.00 98.74 H +ATOM 3531 CE1 TYR A 224 14.863 -9.221 -3.063 1.00 98.74 C +ATOM 3532 HE1 TYR A 224 15.454 -10.059 -2.723 1.00 98.74 H +ATOM 3533 CE2 TYR A 224 14.649 -6.808 -3.374 1.00 98.74 C +ATOM 3534 HE2 TYR A 224 15.059 -5.815 -3.267 1.00 98.74 H +ATOM 3535 OH TYR A 224 16.519 -7.705 -2.230 1.00 98.74 O +ATOM 3536 HH TYR A 224 16.803 -6.796 -2.352 1.00 98.74 H +ATOM 3537 CZ TYR A 224 15.358 -7.916 -2.882 1.00 98.74 C +ATOM 3538 N LEU A 225 12.165 -10.634 -7.065 1.00 98.68 N +ATOM 3539 H LEU A 225 11.228 -10.910 -6.808 1.00 98.68 H +ATOM 3540 CA LEU A 225 13.070 -11.665 -7.585 1.00 98.68 C +ATOM 3541 HA LEU A 225 14.085 -11.423 -7.271 1.00 98.68 H +ATOM 3542 C LEU A 225 13.140 -11.719 -9.116 1.00 98.68 C +ATOM 3543 CB LEU A 225 12.687 -13.032 -6.994 1.00 98.68 C +ATOM 3544 HB2 LEU A 225 13.209 -13.816 -7.543 1.00 98.68 H +ATOM 3545 HB3 LEU A 225 11.617 -13.184 -7.138 1.00 98.68 H +ATOM 3546 O LEU A 225 13.966 -12.459 -9.645 1.00 98.68 O +ATOM 3547 CG LEU A 225 13.028 -13.196 -5.503 1.00 98.68 C +ATOM 3548 HG LEU A 225 12.563 -12.398 -4.924 1.00 98.68 H +ATOM 3549 CD1 LEU A 225 12.476 -14.535 -5.011 1.00 98.68 C +ATOM 3550 HD11 LEU A 225 12.933 -15.354 -5.566 1.00 98.68 H +ATOM 3551 HD12 LEU A 225 12.689 -14.651 -3.949 1.00 98.68 H +ATOM 3552 HD13 LEU A 225 11.396 -14.554 -5.155 1.00 98.68 H +ATOM 3553 CD2 LEU A 225 14.537 -13.176 -5.235 1.00 98.68 C +ATOM 3554 HD21 LEU A 225 14.943 -12.187 -5.449 1.00 98.68 H +ATOM 3555 HD22 LEU A 225 15.040 -13.914 -5.860 1.00 98.68 H +ATOM 3556 HD23 LEU A 225 14.731 -13.397 -4.186 1.00 98.68 H +ATOM 3557 N VAL A 226 12.346 -10.919 -9.835 1.00 98.71 N +ATOM 3558 H VAL A 226 11.699 -10.324 -9.339 1.00 98.71 H +ATOM 3559 CA VAL A 226 12.402 -10.821 -11.307 1.00 98.71 C +ATOM 3560 HA VAL A 226 12.048 -11.764 -11.725 1.00 98.71 H +ATOM 3561 C VAL A 226 13.824 -10.637 -11.869 1.00 98.71 C +ATOM 3562 CB VAL A 226 11.455 -9.721 -11.812 1.00 98.71 C +ATOM 3563 HB VAL A 226 11.639 -8.807 -11.248 1.00 98.71 H +ATOM 3564 O VAL A 226 14.149 -11.377 -12.798 1.00 98.71 O +ATOM 3565 CG1 VAL A 226 11.655 -9.397 -13.292 1.00 98.71 C +ATOM 3566 HG11 VAL A 226 10.970 -8.594 -13.565 1.00 98.71 H +ATOM 3567 HG12 VAL A 226 12.663 -9.034 -13.496 1.00 98.71 H +ATOM 3568 HG13 VAL A 226 11.460 -10.272 -13.911 1.00 98.71 H +ATOM 3569 CG2 VAL A 226 9.989 -10.139 -11.624 1.00 98.71 C +ATOM 3570 HG21 VAL A 226 9.754 -10.969 -12.289 1.00 98.71 H +ATOM 3571 HG22 VAL A 226 9.332 -9.302 -11.862 1.00 98.71 H +ATOM 3572 HG23 VAL A 226 9.812 -10.448 -10.594 1.00 98.71 H +ATOM 3573 N PRO A 227 14.710 -9.763 -11.329 1.00 98.45 N +ATOM 3574 CA PRO A 227 16.094 -9.671 -11.810 1.00 98.45 C +ATOM 3575 HA PRO A 227 16.104 -9.285 -12.830 1.00 98.45 H +ATOM 3576 C PRO A 227 16.853 -11.004 -11.777 1.00 98.45 C +ATOM 3577 CB PRO A 227 16.827 -8.695 -10.883 1.00 98.45 C +ATOM 3578 HB2 PRO A 227 17.538 -9.225 -10.249 1.00 98.45 H +ATOM 3579 HB3 PRO A 227 17.363 -7.935 -11.452 1.00 98.45 H +ATOM 3580 O PRO A 227 17.756 -11.219 -12.574 1.00 98.45 O +ATOM 3581 CG PRO A 227 15.776 -8.068 -9.987 1.00 98.45 C +ATOM 3582 HG2 PRO A 227 15.639 -7.026 -10.276 1.00 98.45 H +ATOM 3583 HG3 PRO A 227 16.103 -8.088 -8.947 1.00 98.45 H +ATOM 3584 CD PRO A 227 14.534 -8.937 -10.142 1.00 98.45 C +ATOM 3585 HD2 PRO A 227 14.521 -9.599 -9.276 1.00 98.45 H +ATOM 3586 HD3 PRO A 227 13.618 -8.346 -10.159 1.00 98.45 H +ATOM 3587 N ALA A 228 16.514 -11.908 -10.854 1.00 98.20 N +ATOM 3588 H ALA A 228 15.723 -11.724 -10.253 1.00 98.20 H +ATOM 3589 CA ALA A 228 17.222 -13.172 -10.689 1.00 98.20 C +ATOM 3590 HA ALA A 228 18.280 -13.007 -10.890 1.00 98.20 H +ATOM 3591 C ALA A 228 16.749 -14.268 -11.659 1.00 98.20 C +ATOM 3592 CB ALA A 228 17.090 -13.616 -9.227 1.00 98.20 C +ATOM 3593 HB1 ALA A 228 17.460 -12.831 -8.567 1.00 98.20 H +ATOM 3594 HB2 ALA A 228 17.684 -14.517 -9.075 1.00 98.20 H +ATOM 3595 HB3 ALA A 228 16.050 -13.834 -8.987 1.00 98.20 H +ATOM 3596 O ALA A 228 17.528 -15.168 -11.966 1.00 98.20 O +ATOM 3597 N PHE A 229 15.495 -14.226 -12.131 1.00 98.20 N +ATOM 3598 H PHE A 229 14.902 -13.460 -11.844 1.00 98.20 H +ATOM 3599 CA PHE A 229 14.932 -15.285 -12.986 1.00 98.20 C +ATOM 3600 HA PHE A 229 15.704 -16.034 -13.165 1.00 98.20 H +ATOM 3601 C PHE A 229 14.509 -14.832 -14.393 1.00 98.20 C +ATOM 3602 CB PHE A 229 13.800 -16.016 -12.243 1.00 98.20 C +ATOM 3603 HB2 PHE A 229 14.162 -16.313 -11.259 1.00 98.20 H +ATOM 3604 HB3 PHE A 229 13.578 -16.934 -12.787 1.00 98.20 H +ATOM 3605 O PHE A 229 14.308 -15.681 -15.259 1.00 98.20 O +ATOM 3606 CG PHE A 229 12.505 -15.239 -12.089 1.00 98.20 C +ATOM 3607 CD1 PHE A 229 12.180 -14.630 -10.864 1.00 98.20 C +ATOM 3608 HD1 PHE A 229 12.859 -14.709 -10.028 1.00 98.20 H +ATOM 3609 CD2 PHE A 229 11.604 -15.150 -13.167 1.00 98.20 C +ATOM 3610 HD2 PHE A 229 11.833 -15.638 -14.103 1.00 98.20 H +ATOM 3611 CE1 PHE A 229 10.975 -13.917 -10.724 1.00 98.20 C +ATOM 3612 HE1 PHE A 229 10.731 -13.442 -9.785 1.00 98.20 H +ATOM 3613 CE2 PHE A 229 10.411 -14.418 -13.037 1.00 98.20 C +ATOM 3614 HE2 PHE A 229 9.737 -14.331 -13.877 1.00 98.20 H +ATOM 3615 CZ PHE A 229 10.096 -13.802 -11.815 1.00 98.20 C +ATOM 3616 HZ PHE A 229 9.178 -13.242 -11.710 1.00 98.20 H +ATOM 3617 N MET A 230 14.366 -13.528 -14.647 1.00 98.29 N +ATOM 3618 H MET A 230 14.500 -12.871 -13.892 1.00 98.29 H +ATOM 3619 CA MET A 230 13.964 -12.971 -15.945 1.00 98.29 C +ATOM 3620 HA MET A 230 14.369 -13.605 -16.735 1.00 98.29 H +ATOM 3621 C MET A 230 14.564 -11.566 -16.134 1.00 98.29 C +ATOM 3622 CB MET A 230 12.426 -12.999 -16.052 1.00 98.29 C +ATOM 3623 HB2 MET A 230 11.990 -12.260 -15.379 1.00 98.29 H +ATOM 3624 HB3 MET A 230 12.079 -13.984 -15.740 1.00 98.29 H +ATOM 3625 O MET A 230 13.852 -10.568 -16.152 1.00 98.29 O +ATOM 3626 CG MET A 230 11.916 -12.764 -17.478 1.00 98.29 C +ATOM 3627 HG2 MET A 230 12.379 -13.490 -18.147 1.00 98.29 H +ATOM 3628 HG3 MET A 230 12.223 -11.769 -17.801 1.00 98.29 H +ATOM 3629 SD MET A 230 10.111 -12.880 -17.659 1.00 98.29 S +ATOM 3630 CE MET A 230 9.837 -14.651 -17.394 1.00 98.29 C +ATOM 3631 HE1 MET A 230 10.109 -14.922 -16.374 1.00 98.29 H +ATOM 3632 HE2 MET A 230 8.783 -14.878 -17.557 1.00 98.29 H +ATOM 3633 HE3 MET A 230 10.441 -15.223 -18.098 1.00 98.29 H +ATOM 3634 N ASN A 231 15.894 -11.474 -16.240 1.00 98.39 N +ATOM 3635 H ASN A 231 16.447 -12.316 -16.174 1.00 98.39 H +ATOM 3636 CA ASN A 231 16.607 -10.201 -16.420 1.00 98.39 C +ATOM 3637 HA ASN A 231 16.076 -9.438 -15.850 1.00 98.39 H +ATOM 3638 C ASN A 231 16.607 -9.738 -17.891 1.00 98.39 C +ATOM 3639 CB ASN A 231 18.027 -10.311 -15.834 1.00 98.39 C +ATOM 3640 HB2 ASN A 231 17.994 -10.857 -14.892 1.00 98.39 H +ATOM 3641 HB3 ASN A 231 18.678 -10.859 -16.515 1.00 98.39 H +ATOM 3642 O ASN A 231 17.605 -9.868 -18.599 1.00 98.39 O +ATOM 3643 CG ASN A 231 18.635 -8.944 -15.566 1.00 98.39 C +ATOM 3644 ND2 ASN A 231 19.826 -8.888 -15.021 1.00 98.39 N +ATOM 3645 HD21 ASN A 231 20.300 -9.728 -14.719 1.00 98.39 H +ATOM 3646 HD22 ASN A 231 20.170 -7.964 -14.804 1.00 98.39 H +ATOM 3647 OD1 ASN A 231 18.039 -7.912 -15.809 1.00 98.39 O +ATOM 3648 N ASN A 232 15.451 -9.286 -18.373 1.00 98.38 N +ATOM 3649 H ASN A 232 14.670 -9.223 -17.736 1.00 98.38 H +ATOM 3650 CA ASN A 232 15.237 -8.736 -19.715 1.00 98.38 C +ATOM 3651 HA ASN A 232 16.109 -8.151 -20.007 1.00 98.38 H +ATOM 3652 C ASN A 232 14.026 -7.775 -19.711 1.00 98.38 C +ATOM 3653 CB ASN A 232 15.096 -9.898 -20.720 1.00 98.38 C +ATOM 3654 HB2 ASN A 232 16.033 -10.456 -20.733 1.00 98.38 H +ATOM 3655 HB3 ASN A 232 14.937 -9.502 -21.723 1.00 98.38 H +ATOM 3656 O ASN A 232 13.328 -7.655 -18.699 1.00 98.38 O +ATOM 3657 CG ASN A 232 13.956 -10.845 -20.402 1.00 98.38 C +ATOM 3658 ND2 ASN A 232 14.170 -12.136 -20.488 1.00 98.38 N +ATOM 3659 HD21 ASN A 232 13.351 -12.716 -20.377 1.00 98.38 H +ATOM 3660 HD22 ASN A 232 15.070 -12.481 -20.793 1.00 98.38 H +ATOM 3661 OD1 ASN A 232 12.854 -10.449 -20.083 1.00 98.38 O +ATOM 3662 N ALA A 233 13.748 -7.118 -20.842 1.00 98.43 N +ATOM 3663 H ALA A 233 14.387 -7.192 -21.621 1.00 98.43 H +ATOM 3664 CA ALA A 233 12.631 -6.175 -20.971 1.00 98.43 C +ATOM 3665 HA ALA A 233 12.772 -5.375 -20.245 1.00 98.43 H +ATOM 3666 C ALA A 233 11.246 -6.808 -20.692 1.00 98.43 C +ATOM 3667 CB ALA A 233 12.684 -5.556 -22.373 1.00 98.43 C +ATOM 3668 HB1 ALA A 233 13.636 -5.046 -22.522 1.00 98.43 H +ATOM 3669 HB2 ALA A 233 11.884 -4.823 -22.480 1.00 98.43 H +ATOM 3670 HB3 ALA A 233 12.562 -6.326 -23.134 1.00 98.43 H +ATOM 3671 O ALA A 233 10.386 -6.163 -20.092 1.00 98.43 O +ATOM 3672 N ASP A 234 11.025 -8.081 -21.042 1.00 98.66 N +ATOM 3673 H ASP A 234 11.757 -8.603 -21.504 1.00 98.66 H +ATOM 3674 CA ASP A 234 9.773 -8.785 -20.711 1.00 98.66 C +ATOM 3675 HA ASP A 234 8.931 -8.156 -20.999 1.00 98.66 H +ATOM 3676 C ASP A 234 9.643 -9.055 -19.204 1.00 98.66 C +ATOM 3677 CB ASP A 234 9.670 -10.101 -21.494 1.00 98.66 C +ATOM 3678 HB2 ASP A 234 10.535 -10.728 -21.276 1.00 98.66 H +ATOM 3679 HB3 ASP A 234 8.779 -10.636 -21.164 1.00 98.66 H +ATOM 3680 O ASP A 234 8.546 -9.007 -18.643 1.00 98.66 O +ATOM 3681 CG ASP A 234 9.556 -9.871 -23.000 1.00 98.66 C +ATOM 3682 OD1 ASP A 234 8.703 -9.044 -23.401 1.00 98.66 O +ATOM 3683 OD2 ASP A 234 10.336 -10.508 -23.740 1.00 98.66 O +ATOM 3684 N GLY A 235 10.765 -9.271 -18.515 1.00 98.67 N +ATOM 3685 H GLY A 235 11.628 -9.338 -19.034 1.00 98.67 H +ATOM 3686 CA GLY A 235 10.826 -9.333 -17.059 1.00 98.67 C +ATOM 3687 HA2 GLY A 235 11.855 -9.544 -16.767 1.00 98.67 H +ATOM 3688 HA3 GLY A 235 10.177 -10.129 -16.694 1.00 98.67 H +ATOM 3689 C GLY A 235 10.426 -8.017 -16.402 1.00 98.67 C +ATOM 3690 O GLY A 235 9.646 -8.020 -15.449 1.00 98.67 O +ATOM 3691 N VAL A 236 10.877 -6.881 -16.938 1.00 98.71 N +ATOM 3692 H VAL A 236 11.520 -6.945 -17.715 1.00 98.71 H +ATOM 3693 CA VAL A 236 10.439 -5.551 -16.481 1.00 98.71 C +ATOM 3694 HA VAL A 236 10.685 -5.442 -15.424 1.00 98.71 H +ATOM 3695 C VAL A 236 8.921 -5.403 -16.606 1.00 98.71 C +ATOM 3696 CB VAL A 236 11.169 -4.437 -17.253 1.00 98.71 C +ATOM 3697 HB VAL A 236 11.087 -4.615 -18.325 1.00 98.71 H +ATOM 3698 O VAL A 236 8.255 -5.014 -15.641 1.00 98.71 O +ATOM 3699 CG1 VAL A 236 10.555 -3.067 -16.959 1.00 98.71 C +ATOM 3700 HG11 VAL A 236 9.558 -3.002 -17.394 1.00 98.71 H +ATOM 3701 HG12 VAL A 236 10.481 -2.908 -15.883 1.00 98.71 H +ATOM 3702 HG13 VAL A 236 11.158 -2.283 -17.418 1.00 98.71 H +ATOM 3703 CG2 VAL A 236 12.654 -4.432 -16.881 1.00 98.71 C +ATOM 3704 HG21 VAL A 236 12.766 -4.205 -15.821 1.00 98.71 H +ATOM 3705 HG22 VAL A 236 13.174 -3.673 -17.466 1.00 98.71 H +ATOM 3706 HG23 VAL A 236 13.111 -5.397 -17.102 1.00 98.71 H +ATOM 3707 N VAL A 237 8.352 -5.793 -17.751 1.00 98.83 N +ATOM 3708 H VAL A 237 8.955 -6.086 -18.507 1.00 98.83 H +ATOM 3709 CA VAL A 237 6.896 -5.814 -17.959 1.00 98.83 C +ATOM 3710 HA VAL A 237 6.511 -4.804 -17.823 1.00 98.83 H +ATOM 3711 C VAL A 237 6.200 -6.705 -16.922 1.00 98.83 C +ATOM 3712 CB VAL A 237 6.557 -6.267 -19.393 1.00 98.83 C +ATOM 3713 HB VAL A 237 7.067 -7.204 -19.617 1.00 98.83 H +ATOM 3714 O VAL A 237 5.241 -6.273 -16.274 1.00 98.83 O +ATOM 3715 CG1 VAL A 237 5.052 -6.497 -19.553 1.00 98.83 C +ATOM 3716 HG11 VAL A 237 4.766 -7.434 -19.075 1.00 98.83 H +ATOM 3717 HG12 VAL A 237 4.515 -5.675 -19.078 1.00 98.83 H +ATOM 3718 HG13 VAL A 237 4.787 -6.560 -20.608 1.00 98.83 H +ATOM 3719 CG2 VAL A 237 6.995 -5.229 -20.429 1.00 98.83 C +ATOM 3720 HG21 VAL A 237 6.439 -4.300 -20.300 1.00 98.83 H +ATOM 3721 HG22 VAL A 237 6.800 -5.618 -21.429 1.00 98.83 H +ATOM 3722 HG23 VAL A 237 8.062 -5.025 -20.343 1.00 98.83 H +ATOM 3723 N LEU A 238 6.702 -7.926 -16.705 1.00 98.81 N +ATOM 3724 H LEU A 238 7.474 -8.228 -17.282 1.00 98.81 H +ATOM 3725 CA LEU A 238 6.174 -8.858 -15.705 1.00 98.81 C +ATOM 3726 HA LEU A 238 5.134 -9.066 -15.955 1.00 98.81 H +ATOM 3727 C LEU A 238 6.201 -8.255 -14.294 1.00 98.81 C +ATOM 3728 CB LEU A 238 6.974 -10.174 -15.772 1.00 98.81 C +ATOM 3729 HB2 LEU A 238 6.829 -10.624 -16.754 1.00 98.81 H +ATOM 3730 HB3 LEU A 238 8.035 -9.945 -15.672 1.00 98.81 H +ATOM 3731 O LEU A 238 5.224 -8.378 -13.554 1.00 98.81 O +ATOM 3732 CG LEU A 238 6.610 -11.200 -14.682 1.00 98.81 C +ATOM 3733 HG LEU A 238 6.760 -10.760 -13.696 1.00 98.81 H +ATOM 3734 CD1 LEU A 238 5.158 -11.673 -14.793 1.00 98.81 C +ATOM 3735 HD11 LEU A 238 4.481 -10.836 -14.624 1.00 98.81 H +ATOM 3736 HD12 LEU A 238 4.961 -12.435 -14.039 1.00 98.81 H +ATOM 3737 HD13 LEU A 238 4.981 -12.088 -15.785 1.00 98.81 H +ATOM 3738 CD2 LEU A 238 7.529 -12.417 -14.780 1.00 98.81 C +ATOM 3739 HD21 LEU A 238 7.294 -13.128 -13.988 1.00 98.81 H +ATOM 3740 HD22 LEU A 238 7.408 -12.896 -15.752 1.00 98.81 H +ATOM 3741 HD23 LEU A 238 8.565 -12.097 -14.675 1.00 98.81 H +ATOM 3742 N ARG A 239 7.288 -7.577 -13.913 1.00 98.76 N +ATOM 3743 H ARG A 239 8.054 -7.519 -14.568 1.00 98.76 H +ATOM 3744 CA ARG A 239 7.417 -6.921 -12.607 1.00 98.76 C +ATOM 3745 HA ARG A 239 7.287 -7.668 -11.823 1.00 98.76 H +ATOM 3746 C ARG A 239 6.337 -5.861 -12.400 1.00 98.76 C +ATOM 3747 CB ARG A 239 8.818 -6.309 -12.490 1.00 98.76 C +ATOM 3748 HB2 ARG A 239 8.932 -5.511 -13.223 1.00 98.76 H +ATOM 3749 HB3 ARG A 239 9.564 -7.075 -12.703 1.00 98.76 H +ATOM 3750 O ARG A 239 5.678 -5.862 -11.358 1.00 98.76 O +ATOM 3751 CG ARG A 239 9.066 -5.741 -11.088 1.00 98.76 C +ATOM 3752 HG2 ARG A 239 9.093 -6.553 -10.361 1.00 98.76 H +ATOM 3753 HG3 ARG A 239 8.263 -5.054 -10.823 1.00 98.76 H +ATOM 3754 CD ARG A 239 10.374 -4.960 -11.035 1.00 98.76 C +ATOM 3755 HD2 ARG A 239 10.472 -4.502 -10.051 1.00 98.76 H +ATOM 3756 HD3 ARG A 239 10.346 -4.165 -11.779 1.00 98.76 H +ATOM 3757 NE ARG A 239 11.538 -5.817 -11.274 1.00 98.76 N +ATOM 3758 HE ARG A 239 11.409 -6.819 -11.282 1.00 98.76 H +ATOM 3759 NH1 ARG A 239 13.090 -4.107 -11.230 1.00 98.76 N +ATOM 3760 HH11 ARG A 239 14.065 -3.866 -11.127 1.00 98.76 H +ATOM 3761 HH12 ARG A 239 12.528 -3.421 -11.713 1.00 98.76 H +ATOM 3762 NH2 ARG A 239 13.767 -6.162 -11.400 1.00 98.76 N +ATOM 3763 HH21 ARG A 239 14.669 -5.710 -11.347 1.00 98.76 H +ATOM 3764 HH22 ARG A 239 13.665 -7.152 -11.569 1.00 98.76 H +ATOM 3765 CZ ARG A 239 12.773 -5.360 -11.296 1.00 98.76 C +ATOM 3766 N GLN A 240 6.124 -4.979 -13.378 1.00 98.80 N +ATOM 3767 H GLN A 240 6.691 -5.040 -14.212 1.00 98.80 H +ATOM 3768 CA GLN A 240 5.106 -3.925 -13.275 1.00 98.80 C +ATOM 3769 HA GLN A 240 5.227 -3.427 -12.313 1.00 98.80 H +ATOM 3770 C GLN A 240 3.680 -4.498 -13.286 1.00 98.80 C +ATOM 3771 CB GLN A 240 5.298 -2.872 -14.380 1.00 98.80 C +ATOM 3772 HB2 GLN A 240 4.511 -2.124 -14.290 1.00 98.80 H +ATOM 3773 HB3 GLN A 240 5.196 -3.352 -15.354 1.00 98.80 H +ATOM 3774 O GLN A 240 2.805 -3.997 -12.570 1.00 98.80 O +ATOM 3775 CG GLN A 240 6.660 -2.152 -14.322 1.00 98.80 C +ATOM 3776 HG2 GLN A 240 7.449 -2.866 -14.558 1.00 98.80 H +ATOM 3777 HG3 GLN A 240 6.692 -1.384 -15.095 1.00 98.80 H +ATOM 3778 CD GLN A 240 6.983 -1.489 -12.978 1.00 98.80 C +ATOM 3779 NE2 GLN A 240 8.229 -1.547 -12.551 1.00 98.80 N +ATOM 3780 HE21 GLN A 240 8.956 -1.922 -13.145 1.00 98.80 H +ATOM 3781 HE22 GLN A 240 8.476 -1.096 -11.682 1.00 98.80 H +ATOM 3782 OE1 GLN A 240 6.136 -0.936 -12.275 1.00 98.80 O +ATOM 3783 N LEU A 241 3.450 -5.601 -14.005 1.00 98.80 N +ATOM 3784 H LEU A 241 4.174 -5.930 -14.628 1.00 98.80 H +ATOM 3785 CA LEU A 241 2.190 -6.343 -13.948 1.00 98.80 C +ATOM 3786 HA LEU A 241 1.379 -5.645 -14.155 1.00 98.80 H +ATOM 3787 C LEU A 241 1.941 -6.937 -12.553 1.00 98.80 C +ATOM 3788 CB LEU A 241 2.202 -7.420 -15.047 1.00 98.80 C +ATOM 3789 HB2 LEU A 241 3.055 -8.079 -14.888 1.00 98.80 H +ATOM 3790 HB3 LEU A 241 2.337 -6.934 -16.013 1.00 98.80 H +ATOM 3791 O LEU A 241 0.856 -6.763 -11.993 1.00 98.80 O +ATOM 3792 CG LEU A 241 0.928 -8.281 -15.092 1.00 98.80 C +ATOM 3793 HG LEU A 241 0.790 -8.780 -14.133 1.00 98.80 H +ATOM 3794 CD1 LEU A 241 -0.321 -7.452 -15.401 1.00 98.80 C +ATOM 3795 HD11 LEU A 241 -0.180 -6.902 -16.332 1.00 98.80 H +ATOM 3796 HD12 LEU A 241 -1.184 -8.110 -15.501 1.00 98.80 H +ATOM 3797 HD13 LEU A 241 -0.518 -6.749 -14.592 1.00 98.80 H +ATOM 3798 CD2 LEU A 241 1.075 -9.360 -16.162 1.00 98.80 C +ATOM 3799 HD21 LEU A 241 1.205 -8.898 -17.141 1.00 98.80 H +ATOM 3800 HD22 LEU A 241 1.946 -9.978 -15.945 1.00 98.80 H +ATOM 3801 HD23 LEU A 241 0.188 -9.993 -16.177 1.00 98.80 H +ATOM 3802 N LEU A 242 2.945 -7.589 -11.958 1.00 98.77 N +ATOM 3803 H LEU A 242 3.805 -7.707 -12.474 1.00 98.77 H +ATOM 3804 CA LEU A 242 2.859 -8.140 -10.603 1.00 98.77 C +ATOM 3805 HA LEU A 242 2.022 -8.836 -10.559 1.00 98.77 H +ATOM 3806 C LEU A 242 2.575 -7.047 -9.569 1.00 98.77 C +ATOM 3807 CB LEU A 242 4.160 -8.879 -10.246 1.00 98.77 C +ATOM 3808 HB2 LEU A 242 5.003 -8.231 -10.486 1.00 98.77 H +ATOM 3809 HB3 LEU A 242 4.176 -9.054 -9.170 1.00 98.77 H +ATOM 3810 O LEU A 242 1.676 -7.219 -8.745 1.00 98.77 O +ATOM 3811 CG LEU A 242 4.356 -10.231 -10.950 1.00 98.77 C +ATOM 3812 HG LEU A 242 4.202 -10.128 -12.024 1.00 98.77 H +ATOM 3813 CD1 LEU A 242 5.782 -10.716 -10.695 1.00 98.77 C +ATOM 3814 HD11 LEU A 242 6.487 -10.011 -11.135 1.00 98.77 H +ATOM 3815 HD12 LEU A 242 5.933 -11.687 -11.165 1.00 98.77 H +ATOM 3816 HD13 LEU A 242 5.965 -10.789 -9.623 1.00 98.77 H +ATOM 3817 CD2 LEU A 242 3.387 -11.293 -10.423 1.00 98.77 C +ATOM 3818 HD21 LEU A 242 2.359 -11.006 -10.643 1.00 98.77 H +ATOM 3819 HD22 LEU A 242 3.590 -12.243 -10.916 1.00 98.77 H +ATOM 3820 HD23 LEU A 242 3.514 -11.412 -9.347 1.00 98.77 H +ATOM 3821 N PHE A 243 3.279 -5.910 -9.631 1.00 98.79 N +ATOM 3822 H PHE A 243 4.027 -5.837 -10.306 1.00 98.79 H +ATOM 3823 CA PHE A 243 3.007 -4.776 -8.744 1.00 98.79 C +ATOM 3824 HA PHE A 243 3.055 -5.127 -7.714 1.00 98.79 H +ATOM 3825 C PHE A 243 1.591 -4.232 -8.917 1.00 98.79 C +ATOM 3826 CB PHE A 243 4.033 -3.650 -8.952 1.00 98.79 C +ATOM 3827 HB2 PHE A 243 3.657 -2.754 -8.458 1.00 98.79 H +ATOM 3828 HB3 PHE A 243 4.097 -3.428 -10.017 1.00 98.79 H +ATOM 3829 O PHE A 243 0.927 -3.963 -7.919 1.00 98.79 O +ATOM 3830 CG PHE A 243 5.427 -3.899 -8.402 1.00 98.79 C +ATOM 3831 CD1 PHE A 243 5.621 -4.559 -7.169 1.00 98.79 C +ATOM 3832 HD1 PHE A 243 4.781 -4.937 -6.605 1.00 98.79 H +ATOM 3833 CD2 PHE A 243 6.544 -3.402 -9.100 1.00 98.79 C +ATOM 3834 HD2 PHE A 243 6.414 -2.885 -10.040 1.00 98.79 H +ATOM 3835 CE1 PHE A 243 6.918 -4.748 -6.661 1.00 98.79 C +ATOM 3836 HE1 PHE A 243 7.073 -5.288 -5.739 1.00 98.79 H +ATOM 3837 CE2 PHE A 243 7.837 -3.570 -8.577 1.00 98.79 C +ATOM 3838 HE2 PHE A 243 8.688 -3.181 -9.118 1.00 98.79 H +ATOM 3839 CZ PHE A 243 8.027 -4.255 -7.366 1.00 98.79 C +ATOM 3840 HZ PHE A 243 9.026 -4.404 -6.982 1.00 98.79 H +ATOM 3841 N THR A 244 1.091 -4.133 -10.147 1.00 98.75 N +ATOM 3842 H THR A 244 1.696 -4.333 -10.931 1.00 98.75 H +ATOM 3843 CA THR A 244 -0.276 -3.674 -10.420 1.00 98.75 C +ATOM 3844 HA THR A 244 -0.409 -2.689 -9.970 1.00 98.75 H +ATOM 3845 C THR A 244 -1.328 -4.602 -9.798 1.00 98.75 C +ATOM 3846 CB THR A 244 -0.483 -3.532 -11.933 1.00 98.75 C +ATOM 3847 HB THR A 244 -0.288 -4.480 -12.436 1.00 98.75 H +ATOM 3848 O THR A 244 -2.223 -4.138 -9.083 1.00 98.75 O +ATOM 3849 CG2 THR A 244 -1.895 -3.075 -12.270 1.00 98.75 C +ATOM 3850 HG21 THR A 244 -2.602 -3.883 -12.080 1.00 98.75 H +ATOM 3851 HG22 THR A 244 -1.948 -2.812 -13.327 1.00 98.75 H +ATOM 3852 HG23 THR A 244 -2.163 -2.204 -11.672 1.00 98.75 H +ATOM 3853 OG1 THR A 244 0.408 -2.566 -12.442 1.00 98.75 O +ATOM 3854 HG1 THR A 244 1.254 -2.987 -12.608 1.00 98.75 H +ATOM 3855 N ILE A 245 -1.199 -5.921 -9.995 1.00 98.75 N +ATOM 3856 H ILE A 245 -0.441 -6.242 -10.580 1.00 98.75 H +ATOM 3857 CA ILE A 245 -2.098 -6.923 -9.391 1.00 98.75 C +ATOM 3858 HA ILE A 245 -3.124 -6.689 -9.675 1.00 98.75 H +ATOM 3859 C ILE A 245 -2.020 -6.856 -7.861 1.00 98.75 C +ATOM 3860 CB ILE A 245 -1.757 -8.344 -9.908 1.00 98.75 C +ATOM 3861 HB ILE A 245 -0.697 -8.526 -9.735 1.00 98.75 H +ATOM 3862 O ILE A 245 -3.051 -6.866 -7.177 1.00 98.75 O +ATOM 3863 CG1 ILE A 245 -2.039 -8.453 -11.425 1.00 98.75 C +ATOM 3864 HG12 ILE A 245 -1.613 -7.595 -11.944 1.00 98.75 H +ATOM 3865 HG13 ILE A 245 -3.115 -8.436 -11.599 1.00 98.75 H +ATOM 3866 CG2 ILE A 245 -2.564 -9.424 -9.154 1.00 98.75 C +ATOM 3867 HG21 ILE A 245 -2.294 -10.417 -9.513 1.00 98.75 H +ATOM 3868 HG22 ILE A 245 -2.348 -9.402 -8.086 1.00 98.75 H +ATOM 3869 HG23 ILE A 245 -3.632 -9.267 -9.306 1.00 98.75 H +ATOM 3870 CD1 ILE A 245 -1.447 -9.711 -12.075 1.00 98.75 C +ATOM 3871 HD11 ILE A 245 -1.587 -9.654 -13.154 1.00 98.75 H +ATOM 3872 HD12 ILE A 245 -1.945 -10.609 -11.709 1.00 98.75 H +ATOM 3873 HD13 ILE A 245 -0.379 -9.770 -11.863 1.00 98.75 H +ATOM 3874 N ALA A 246 -0.804 -6.765 -7.318 1.00 98.69 N +ATOM 3875 H ALA A 246 -0.001 -6.771 -7.930 1.00 98.69 H +ATOM 3876 CA ALA A 246 -0.562 -6.694 -5.886 1.00 98.69 C +ATOM 3877 HA ALA A 246 -1.044 -7.549 -5.410 1.00 98.69 H +ATOM 3878 C ALA A 246 -1.147 -5.419 -5.266 1.00 98.69 C +ATOM 3879 CB ALA A 246 0.945 -6.797 -5.641 1.00 98.69 C +ATOM 3880 HB1 ALA A 246 1.132 -6.968 -4.581 1.00 98.69 H +ATOM 3881 HB2 ALA A 246 1.445 -5.882 -5.958 1.00 98.69 H +ATOM 3882 HB3 ALA A 246 1.358 -7.632 -6.207 1.00 98.69 H +ATOM 3883 O ALA A 246 -1.780 -5.492 -4.214 1.00 98.69 O +ATOM 3884 N ASP A 247 -0.996 -4.261 -5.911 1.00 98.75 N +ATOM 3885 H ASP A 247 -0.448 -4.261 -6.760 1.00 98.75 H +ATOM 3886 CA ASP A 247 -1.485 -2.971 -5.421 1.00 98.75 C +ATOM 3887 HA ASP A 247 -1.157 -2.846 -4.389 1.00 98.75 H +ATOM 3888 C ASP A 247 -3.014 -2.931 -5.372 1.00 98.75 C +ATOM 3889 CB ASP A 247 -0.899 -1.815 -6.263 1.00 98.75 C +ATOM 3890 HB2 ASP A 247 -1.477 -0.916 -6.052 1.00 98.75 H +ATOM 3891 HB3 ASP A 247 -1.009 -2.040 -7.324 1.00 98.75 H +ATOM 3892 O ASP A 247 -3.583 -2.620 -4.323 1.00 98.75 O +ATOM 3893 CG ASP A 247 0.572 -1.493 -5.941 1.00 98.75 C +ATOM 3894 OD1 ASP A 247 1.007 -1.845 -4.812 1.00 98.75 O +ATOM 3895 OD2 ASP A 247 1.230 -0.770 -6.722 1.00 98.75 O +ATOM 3896 N ILE A 248 -3.693 -3.343 -6.445 1.00 98.76 N +ATOM 3897 H ILE A 248 -3.176 -3.611 -7.271 1.00 98.76 H +ATOM 3898 CA ILE A 248 -5.161 -3.408 -6.466 1.00 98.76 C +ATOM 3899 HA ILE A 248 -5.553 -2.431 -6.183 1.00 98.76 H +ATOM 3900 C ILE A 248 -5.671 -4.412 -5.424 1.00 98.76 C +ATOM 3901 CB ILE A 248 -5.662 -3.728 -7.893 1.00 98.76 C +ATOM 3902 HB ILE A 248 -5.145 -4.618 -8.254 1.00 98.76 H +ATOM 3903 O ILE A 248 -6.590 -4.107 -4.662 1.00 98.76 O +ATOM 3904 CG1 ILE A 248 -5.323 -2.539 -8.820 1.00 98.76 C +ATOM 3905 HG12 ILE A 248 -5.875 -1.657 -8.495 1.00 98.76 H +ATOM 3906 HG13 ILE A 248 -4.261 -2.306 -8.746 1.00 98.76 H +ATOM 3907 CG2 ILE A 248 -7.178 -4.009 -7.901 1.00 98.76 C +ATOM 3908 HG21 ILE A 248 -7.415 -4.876 -7.286 1.00 98.76 H +ATOM 3909 HG22 ILE A 248 -7.514 -4.243 -8.911 1.00 98.76 H +ATOM 3910 HG23 ILE A 248 -7.726 -3.140 -7.536 1.00 98.76 H +ATOM 3911 CD1 ILE A 248 -5.618 -2.789 -10.300 1.00 98.76 C +ATOM 3912 HD11 ILE A 248 -5.075 -3.668 -10.648 1.00 98.76 H +ATOM 3913 HD12 ILE A 248 -6.686 -2.917 -10.473 1.00 98.76 H +ATOM 3914 HD13 ILE A 248 -5.287 -1.915 -10.860 1.00 98.76 H +ATOM 3915 N SER A 249 -5.050 -5.588 -5.322 1.00 98.78 N +ATOM 3916 H SER A 249 -4.299 -5.794 -5.965 1.00 98.78 H +ATOM 3917 CA SER A 249 -5.477 -6.621 -4.372 1.00 98.78 C +ATOM 3918 HA SER A 249 -6.545 -6.794 -4.503 1.00 98.78 H +ATOM 3919 C SER A 249 -5.253 -6.203 -2.913 1.00 98.78 C +ATOM 3920 CB SER A 249 -4.753 -7.939 -4.656 1.00 98.78 C +ATOM 3921 HB2 SER A 249 -3.679 -7.810 -4.521 1.00 98.78 H +ATOM 3922 HB3 SER A 249 -5.115 -8.700 -3.964 1.00 98.78 H +ATOM 3923 O SER A 249 -6.155 -6.315 -2.080 1.00 98.78 O +ATOM 3924 OG SER A 249 -5.002 -8.373 -5.975 1.00 98.78 O +ATOM 3925 HG SER A 249 -4.392 -7.911 -6.555 1.00 98.78 H +ATOM 3926 N SER A 250 -4.061 -5.692 -2.596 1.00 98.75 N +ATOM 3927 H SER A 250 -3.385 -5.574 -3.337 1.00 98.75 H +ATOM 3928 CA SER A 250 -3.640 -5.364 -1.228 1.00 98.75 C +ATOM 3929 HA SER A 250 -4.004 -6.146 -0.562 1.00 98.75 H +ATOM 3930 C SER A 250 -4.187 -4.041 -0.702 1.00 98.75 C +ATOM 3931 CB SER A 250 -2.112 -5.332 -1.114 1.00 98.75 C +ATOM 3932 HB2 SER A 250 -1.844 -5.200 -0.066 1.00 98.75 H +ATOM 3933 HB3 SER A 250 -1.689 -6.271 -1.470 1.00 98.75 H +ATOM 3934 O SER A 250 -4.193 -3.848 0.513 1.00 98.75 O +ATOM 3935 OG SER A 250 -1.564 -4.257 -1.848 1.00 98.75 O +ATOM 3936 HG SER A 250 -1.436 -4.579 -2.743 1.00 98.75 H +ATOM 3937 N LYS A 251 -4.636 -3.134 -1.579 1.00 98.73 N +ATOM 3938 H LYS A 251 -4.484 -3.320 -2.560 1.00 98.73 H +ATOM 3939 CA LYS A 251 -5.120 -1.800 -1.193 1.00 98.73 C +ATOM 3940 HA LYS A 251 -5.027 -1.683 -0.113 1.00 98.73 H +ATOM 3941 C LYS A 251 -6.601 -1.625 -1.497 1.00 98.73 C +ATOM 3942 CB LYS A 251 -4.263 -0.701 -1.850 1.00 98.73 C +ATOM 3943 HB2 LYS A 251 -4.576 0.264 -1.452 1.00 98.73 H +ATOM 3944 HB3 LYS A 251 -4.429 -0.694 -2.927 1.00 98.73 H +ATOM 3945 O LYS A 251 -7.364 -1.294 -0.593 1.00 98.73 O +ATOM 3946 CG LYS A 251 -2.766 -0.857 -1.560 1.00 98.73 C +ATOM 3947 HG2 LYS A 251 -2.601 -0.769 -0.486 1.00 98.73 H +ATOM 3948 HG3 LYS A 251 -2.434 -1.842 -1.890 1.00 98.73 H +ATOM 3949 CD LYS A 251 -1.932 0.196 -2.294 1.00 98.73 C +ATOM 3950 HD2 LYS A 251 -2.289 1.187 -2.014 1.00 98.73 H +ATOM 3951 HD3 LYS A 251 -2.053 0.076 -3.371 1.00 98.73 H +ATOM 3952 CE LYS A 251 -0.447 0.070 -1.924 1.00 98.73 C +ATOM 3953 HE2 LYS A 251 0.101 0.882 -2.402 1.00 98.73 H +ATOM 3954 HE3 LYS A 251 -0.351 0.182 -0.844 1.00 98.73 H +ATOM 3955 NZ LYS A 251 0.126 -1.233 -2.350 1.00 98.73 N +ATOM 3956 HZ1 LYS A 251 1.044 -1.403 -1.965 1.00 98.73 H +ATOM 3957 HZ2 LYS A 251 0.255 -1.277 -3.350 1.00 98.73 H +ATOM 3958 HZ3 LYS A 251 -0.461 -2.018 -2.103 1.00 98.73 H +ATOM 3959 N VAL A 252 -7.023 -1.880 -2.735 1.00 98.81 N +ATOM 3960 H VAL A 252 -6.352 -2.211 -3.413 1.00 98.81 H +ATOM 3961 CA VAL A 252 -8.401 -1.625 -3.187 1.00 98.81 C +ATOM 3962 HA VAL A 252 -8.752 -0.707 -2.715 1.00 98.81 H +ATOM 3963 C VAL A 252 -9.333 -2.741 -2.728 1.00 98.81 C +ATOM 3964 CB VAL A 252 -8.476 -1.403 -4.710 1.00 98.81 C +ATOM 3965 HB VAL A 252 -8.145 -2.302 -5.230 1.00 98.81 H +ATOM 3966 O VAL A 252 -10.231 -2.483 -1.930 1.00 98.81 O +ATOM 3967 CG1 VAL A 252 -9.912 -1.111 -5.161 1.00 98.81 C +ATOM 3968 HG11 VAL A 252 -10.322 -0.280 -4.586 1.00 98.81 H +ATOM 3969 HG12 VAL A 252 -10.542 -1.990 -5.022 1.00 98.81 H +ATOM 3970 HG13 VAL A 252 -9.919 -0.850 -6.219 1.00 98.81 H +ATOM 3971 CG2 VAL A 252 -7.570 -0.245 -5.144 1.00 98.81 C +ATOM 3972 HG21 VAL A 252 -6.568 -0.335 -4.724 1.00 98.81 H +ATOM 3973 HG22 VAL A 252 -8.002 0.710 -4.844 1.00 98.81 H +ATOM 3974 HG23 VAL A 252 -7.453 -0.264 -6.228 1.00 98.81 H +ATOM 3975 N ILE A 253 -9.098 -3.988 -3.154 1.00 98.82 N +ATOM 3976 H ILE A 253 -8.313 -4.139 -3.771 1.00 98.82 H +ATOM 3977 CA ILE A 253 -9.940 -5.139 -2.771 1.00 98.82 C +ATOM 3978 HA ILE A 253 -10.970 -4.924 -3.055 1.00 98.82 H +ATOM 3979 C ILE A 253 -9.919 -5.315 -1.250 1.00 98.82 C +ATOM 3980 CB ILE A 253 -9.500 -6.432 -3.499 1.00 98.82 C +ATOM 3981 HB ILE A 253 -8.462 -6.642 -3.238 1.00 98.82 H +ATOM 3982 O ILE A 253 -10.968 -5.429 -0.615 1.00 98.82 O +ATOM 3983 CG1 ILE A 253 -9.592 -6.248 -5.033 1.00 98.82 C +ATOM 3984 HG12 ILE A 253 -10.612 -5.978 -5.304 1.00 98.82 H +ATOM 3985 HG13 ILE A 253 -8.940 -5.427 -5.333 1.00 98.82 H +ATOM 3986 CG2 ILE A 253 -10.354 -7.632 -3.045 1.00 98.82 C +ATOM 3987 HG21 ILE A 253 -10.319 -7.758 -1.963 1.00 98.82 H +ATOM 3988 HG22 ILE A 253 -9.974 -8.554 -3.485 1.00 98.82 H +ATOM 3989 HG23 ILE A 253 -11.391 -7.489 -3.350 1.00 98.82 H +ATOM 3990 CD1 ILE A 253 -9.178 -7.476 -5.856 1.00 98.82 C +ATOM 3991 HD11 ILE A 253 -9.921 -8.267 -5.759 1.00 98.82 H +ATOM 3992 HD12 ILE A 253 -8.207 -7.847 -5.527 1.00 98.82 H +ATOM 3993 HD13 ILE A 253 -9.111 -7.196 -6.907 1.00 98.82 H +ATOM 3994 N TYR A 254 -8.732 -5.252 -0.648 1.00 98.87 N +ATOM 3995 H TYR A 254 -7.903 -5.233 -1.225 1.00 98.87 H +ATOM 3996 CA TYR A 254 -8.571 -5.259 0.801 1.00 98.87 C +ATOM 3997 HA TYR A 254 -8.938 -6.205 1.198 1.00 98.87 H +ATOM 3998 C TYR A 254 -9.360 -4.132 1.493 1.00 98.87 C +ATOM 3999 CB TYR A 254 -7.080 -5.145 1.104 1.00 98.87 C +ATOM 4000 HB2 TYR A 254 -6.567 -6.038 0.748 1.00 98.87 H +ATOM 4001 HB3 TYR A 254 -6.689 -4.289 0.553 1.00 98.87 H +ATOM 4002 O TYR A 254 -10.115 -4.400 2.428 1.00 98.87 O +ATOM 4003 CG TYR A 254 -6.788 -4.953 2.571 1.00 98.87 C +ATOM 4004 CD1 TYR A 254 -6.526 -3.661 3.063 1.00 98.87 C +ATOM 4005 HD1 TYR A 254 -6.497 -2.822 2.384 1.00 98.87 H +ATOM 4006 CD2 TYR A 254 -6.810 -6.058 3.441 1.00 98.87 C +ATOM 4007 HD2 TYR A 254 -6.999 -7.047 3.052 1.00 98.87 H +ATOM 4008 CE1 TYR A 254 -6.257 -3.474 4.427 1.00 98.87 C +ATOM 4009 HE1 TYR A 254 -5.996 -2.493 4.797 1.00 98.87 H +ATOM 4010 CE2 TYR A 254 -6.589 -5.864 4.815 1.00 98.87 C +ATOM 4011 HE2 TYR A 254 -6.593 -6.697 5.502 1.00 98.87 H +ATOM 4012 OH TYR A 254 -6.107 -4.399 6.621 1.00 98.87 O +ATOM 4013 HH TYR A 254 -5.584 -3.617 6.816 1.00 98.87 H +ATOM 4014 CZ TYR A 254 -6.316 -4.573 5.301 1.00 98.87 C +ATOM 4015 N GLY A 255 -9.240 -2.885 1.025 1.00 98.76 N +ATOM 4016 H GLY A 255 -8.620 -2.704 0.248 1.00 98.76 H +ATOM 4017 CA GLY A 255 -9.974 -1.744 1.574 1.00 98.76 C +ATOM 4018 HA2 GLY A 255 -9.700 -1.599 2.619 1.00 98.76 H +ATOM 4019 HA3 GLY A 255 -9.703 -0.848 1.015 1.00 98.76 H +ATOM 4020 C GLY A 255 -11.490 -1.928 1.487 1.00 98.76 C +ATOM 4021 O GLY A 255 -12.191 -1.696 2.470 1.00 98.76 O +ATOM 4022 N LEU A 256 -11.998 -2.436 0.357 1.00 98.80 N +ATOM 4023 H LEU A 256 -11.366 -2.612 -0.410 1.00 98.80 H +ATOM 4024 CA LEU A 256 -13.418 -2.759 0.176 1.00 98.80 C +ATOM 4025 HA LEU A 256 -14.014 -1.862 0.340 1.00 98.80 H +ATOM 4026 C LEU A 256 -13.893 -3.791 1.207 1.00 98.80 C +ATOM 4027 CB LEU A 256 -13.664 -3.272 -1.257 1.00 98.80 C +ATOM 4028 HB2 LEU A 256 -12.980 -4.097 -1.456 1.00 98.80 H +ATOM 4029 HB3 LEU A 256 -14.677 -3.672 -1.311 1.00 98.80 H +ATOM 4030 O LEU A 256 -14.932 -3.592 1.838 1.00 98.80 O +ATOM 4031 CG LEU A 256 -13.507 -2.225 -2.376 1.00 98.80 C +ATOM 4032 HG LEU A 256 -12.531 -1.745 -2.312 1.00 98.80 H +ATOM 4033 CD1 LEU A 256 -13.624 -2.909 -3.738 1.00 98.80 C +ATOM 4034 HD11 LEU A 256 -13.489 -2.172 -4.530 1.00 98.80 H +ATOM 4035 HD12 LEU A 256 -14.604 -3.374 -3.845 1.00 98.80 H +ATOM 4036 HD13 LEU A 256 -12.848 -3.668 -3.838 1.00 98.80 H +ATOM 4037 CD2 LEU A 256 -14.567 -1.132 -2.291 1.00 98.80 C +ATOM 4038 HD21 LEU A 256 -15.567 -1.567 -2.283 1.00 98.80 H +ATOM 4039 HD22 LEU A 256 -14.408 -0.541 -1.389 1.00 98.80 H +ATOM 4040 HD23 LEU A 256 -14.477 -0.464 -3.147 1.00 98.80 H +ATOM 4041 N MET A 257 -13.115 -4.853 1.442 1.00 98.83 N +ATOM 4042 H MET A 257 -12.275 -4.962 0.890 1.00 98.83 H +ATOM 4043 CA MET A 257 -13.438 -5.858 2.461 1.00 98.83 C +ATOM 4044 HA MET A 257 -14.449 -6.223 2.280 1.00 98.83 H +ATOM 4045 C MET A 257 -13.412 -5.278 3.882 1.00 98.83 C +ATOM 4046 CB MET A 257 -12.475 -7.048 2.379 1.00 98.83 C +ATOM 4047 HB2 MET A 257 -11.446 -6.702 2.475 1.00 98.83 H +ATOM 4048 HB3 MET A 257 -12.693 -7.709 3.218 1.00 98.83 H +ATOM 4049 O MET A 257 -14.295 -5.587 4.685 1.00 98.83 O +ATOM 4050 CG MET A 257 -12.614 -7.856 1.088 1.00 98.83 C +ATOM 4051 HG2 MET A 257 -12.331 -7.231 0.241 1.00 98.83 H +ATOM 4052 HG3 MET A 257 -13.655 -8.149 0.952 1.00 98.83 H +ATOM 4053 SD MET A 257 -11.579 -9.344 1.068 1.00 98.83 S +ATOM 4054 CE MET A 257 -12.599 -10.455 2.063 1.00 98.83 C +ATOM 4055 HE1 MET A 257 -12.789 -10.016 3.043 1.00 98.83 H +ATOM 4056 HE2 MET A 257 -12.067 -11.399 2.184 1.00 98.83 H +ATOM 4057 HE3 MET A 257 -13.546 -10.634 1.553 1.00 98.83 H +ATOM 4058 N ILE A 258 -12.438 -4.422 4.204 1.00 98.85 N +ATOM 4059 H ILE A 258 -11.736 -4.221 3.507 1.00 98.85 H +ATOM 4060 CA ILE A 258 -12.347 -3.752 5.510 1.00 98.85 C +ATOM 4061 HA ILE A 258 -12.414 -4.510 6.291 1.00 98.85 H +ATOM 4062 C ILE A 258 -13.536 -2.808 5.729 1.00 98.85 C +ATOM 4063 CB ILE A 258 -10.988 -3.028 5.646 1.00 98.85 C +ATOM 4064 HB ILE A 258 -10.839 -2.422 4.752 1.00 98.85 H +ATOM 4065 O ILE A 258 -14.149 -2.843 6.797 1.00 98.85 O +ATOM 4066 CG1 ILE A 258 -9.808 -4.027 5.730 1.00 98.85 C +ATOM 4067 HG12 ILE A 258 -8.874 -3.472 5.644 1.00 98.85 H +ATOM 4068 HG13 ILE A 258 -9.847 -4.714 4.885 1.00 98.85 H +ATOM 4069 CG2 ILE A 258 -10.961 -2.073 6.853 1.00 98.85 C +ATOM 4070 HG21 ILE A 258 -9.950 -1.698 7.012 1.00 98.85 H +ATOM 4071 HG22 ILE A 258 -11.286 -2.593 7.754 1.00 98.85 H +ATOM 4072 HG23 ILE A 258 -11.613 -1.218 6.672 1.00 98.85 H +ATOM 4073 CD1 ILE A 258 -9.721 -4.874 7.005 1.00 98.85 C +ATOM 4074 HD11 ILE A 258 -10.615 -5.488 7.118 1.00 98.85 H +ATOM 4075 HD12 ILE A 258 -8.855 -5.533 6.937 1.00 98.85 H +ATOM 4076 HD13 ILE A 258 -9.593 -4.233 7.877 1.00 98.85 H +ATOM 4077 N THR A 259 -13.911 -2.005 4.730 1.00 98.80 N +ATOM 4078 H THR A 259 -13.346 -1.975 3.894 1.00 98.80 H +ATOM 4079 CA THR A 259 -15.082 -1.118 4.801 1.00 98.80 C +ATOM 4080 HA THR A 259 -15.007 -0.524 5.712 1.00 98.80 H +ATOM 4081 C THR A 259 -16.386 -1.908 4.901 1.00 98.80 C +ATOM 4082 CB THR A 259 -15.096 -0.140 3.617 1.00 98.80 C +ATOM 4083 HB THR A 259 -14.934 -0.682 2.686 1.00 98.80 H +ATOM 4084 O THR A 259 -17.233 -1.551 5.719 1.00 98.80 O +ATOM 4085 CG2 THR A 259 -16.374 0.689 3.505 1.00 98.80 C +ATOM 4086 HG21 THR A 259 -17.202 0.048 3.203 1.00 98.80 H +ATOM 4087 HG22 THR A 259 -16.609 1.160 4.460 1.00 98.80 H +ATOM 4088 HG23 THR A 259 -16.247 1.457 2.742 1.00 98.80 H +ATOM 4089 OG1 THR A 259 -14.066 0.797 3.807 1.00 98.80 O +ATOM 4090 HG1 THR A 259 -14.407 1.486 4.382 1.00 98.80 H +ATOM 4091 N TYR A 260 -16.535 -3.018 4.172 1.00 98.71 N +ATOM 4092 H TYR A 260 -15.833 -3.252 3.484 1.00 98.71 H +ATOM 4093 CA TYR A 260 -17.677 -3.923 4.333 1.00 98.71 C +ATOM 4094 HA TYR A 260 -18.595 -3.380 4.110 1.00 98.71 H +ATOM 4095 C TYR A 260 -17.794 -4.436 5.776 1.00 98.71 C +ATOM 4096 CB TYR A 260 -17.558 -5.091 3.344 1.00 98.71 C +ATOM 4097 HB2 TYR A 260 -17.762 -4.726 2.337 1.00 98.71 H +ATOM 4098 HB3 TYR A 260 -16.537 -5.472 3.353 1.00 98.71 H +ATOM 4099 O TYR A 260 -18.839 -4.282 6.409 1.00 98.71 O +ATOM 4100 CG TYR A 260 -18.507 -6.229 3.661 1.00 98.71 C +ATOM 4101 CD1 TYR A 260 -18.014 -7.437 4.188 1.00 98.71 C +ATOM 4102 HD1 TYR A 260 -16.947 -7.560 4.303 1.00 98.71 H +ATOM 4103 CD2 TYR A 260 -19.892 -6.044 3.508 1.00 98.71 C +ATOM 4104 HD2 TYR A 260 -20.282 -5.109 3.134 1.00 98.71 H +ATOM 4105 CE1 TYR A 260 -18.903 -8.479 4.525 1.00 98.71 C +ATOM 4106 HE1 TYR A 260 -18.529 -9.430 4.875 1.00 98.71 H +ATOM 4107 CE2 TYR A 260 -20.781 -7.063 3.889 1.00 98.71 C +ATOM 4108 HE2 TYR A 260 -21.847 -6.899 3.839 1.00 98.71 H +ATOM 4109 OH TYR A 260 -21.165 -9.284 4.689 1.00 98.71 O +ATOM 4110 HH TYR A 260 -20.742 -10.099 4.969 1.00 98.71 H +ATOM 4111 CZ TYR A 260 -20.293 -8.292 4.373 1.00 98.71 C +ATOM 4112 N ILE A 261 -16.700 -4.967 6.336 1.00 98.75 N +ATOM 4113 H ILE A 261 -15.870 -5.053 5.767 1.00 98.75 H +ATOM 4114 CA ILE A 261 -16.654 -5.425 7.731 1.00 98.75 C +ATOM 4115 HA ILE A 261 -17.413 -6.196 7.862 1.00 98.75 H +ATOM 4116 C ILE A 261 -17.009 -4.281 8.694 1.00 98.75 C +ATOM 4117 CB ILE A 261 -15.265 -6.036 8.034 1.00 98.75 C +ATOM 4118 HB ILE A 261 -14.501 -5.355 7.658 1.00 98.75 H +ATOM 4119 O ILE A 261 -17.748 -4.490 9.657 1.00 98.75 O +ATOM 4120 CG1 ILE A 261 -15.112 -7.392 7.308 1.00 98.75 C +ATOM 4121 HG12 ILE A 261 -15.797 -8.120 7.743 1.00 98.75 H +ATOM 4122 HG13 ILE A 261 -15.386 -7.275 6.259 1.00 98.75 H +ATOM 4123 CG2 ILE A 261 -15.033 -6.202 9.546 1.00 98.75 C +ATOM 4124 HG21 ILE A 261 -15.807 -6.830 9.987 1.00 98.75 H +ATOM 4125 HG22 ILE A 261 -14.052 -6.638 9.734 1.00 98.75 H +ATOM 4126 HG23 ILE A 261 -15.046 -5.224 10.026 1.00 98.75 H +ATOM 4127 CD1 ILE A 261 -13.688 -7.958 7.351 1.00 98.75 C +ATOM 4128 HD11 ILE A 261 -13.611 -8.799 6.662 1.00 98.75 H +ATOM 4129 HD12 ILE A 261 -13.462 -8.319 8.354 1.00 98.75 H +ATOM 4130 HD13 ILE A 261 -12.970 -7.192 7.057 1.00 98.75 H +ATOM 4131 N ALA A 262 -16.510 -3.069 8.445 1.00 98.78 N +ATOM 4132 H ALA A 262 -15.891 -2.958 7.655 1.00 98.78 H +ATOM 4133 CA ALA A 262 -16.774 -1.905 9.282 1.00 98.78 C +ATOM 4134 HA ALA A 262 -16.505 -2.155 10.308 1.00 98.78 H +ATOM 4135 C ALA A 262 -18.262 -1.505 9.283 1.00 98.78 C +ATOM 4136 CB ALA A 262 -15.868 -0.757 8.822 1.00 98.78 C +ATOM 4137 HB1 ALA A 262 -15.971 0.088 9.502 1.00 98.78 H +ATOM 4138 HB2 ALA A 262 -14.827 -1.081 8.822 1.00 98.78 H +ATOM 4139 HB3 ALA A 262 -16.143 -0.435 7.818 1.00 98.78 H +ATOM 4140 O ALA A 262 -18.817 -1.260 10.357 1.00 98.78 O +ATOM 4141 N ILE A 263 -18.929 -1.470 8.123 1.00 98.64 N +ATOM 4142 H ILE A 263 -18.423 -1.681 7.275 1.00 98.64 H +ATOM 4143 CA ILE A 263 -20.371 -1.172 8.020 1.00 98.64 C +ATOM 4144 HA ILE A 263 -20.584 -0.244 8.551 1.00 98.64 H +ATOM 4145 C ILE A 263 -21.194 -2.282 8.675 1.00 98.64 C +ATOM 4146 CB ILE A 263 -20.811 -0.991 6.551 1.00 98.64 C +ATOM 4147 HB ILE A 263 -20.559 -1.902 6.009 1.00 98.64 H +ATOM 4148 O ILE A 263 -22.074 -1.990 9.482 1.00 98.64 O +ATOM 4149 CG1 ILE A 263 -20.087 0.199 5.898 1.00 98.64 C +ATOM 4150 HG12 ILE A 263 -19.015 0.125 6.080 1.00 98.64 H +ATOM 4151 HG13 ILE A 263 -20.436 1.139 6.326 1.00 98.64 H +ATOM 4152 CG2 ILE A 263 -22.330 -0.756 6.437 1.00 98.64 C +ATOM 4153 HG21 ILE A 263 -22.613 0.155 6.964 1.00 98.64 H +ATOM 4154 HG22 ILE A 263 -22.627 -0.665 5.392 1.00 98.64 H +ATOM 4155 HG23 ILE A 263 -22.889 -1.594 6.853 1.00 98.64 H +ATOM 4156 CD1 ILE A 263 -20.292 0.219 4.385 1.00 98.64 C +ATOM 4157 HD11 ILE A 263 -21.176 0.802 4.126 1.00 98.64 H +ATOM 4158 HD12 ILE A 263 -20.393 -0.794 3.993 1.00 98.64 H +ATOM 4159 HD13 ILE A 263 -19.399 0.651 3.933 1.00 98.64 H +ATOM 4160 N GLN A 264 -20.874 -3.547 8.398 1.00 98.42 N +ATOM 4161 H GLN A 264 -20.159 -3.729 7.708 1.00 98.42 H +ATOM 4162 CA GLN A 264 -21.605 -4.692 8.940 1.00 98.42 C +ATOM 4163 HA GLN A 264 -22.652 -4.602 8.649 1.00 98.42 H +ATOM 4164 C GLN A 264 -21.546 -4.727 10.474 1.00 98.42 C +ATOM 4165 CB GLN A 264 -21.028 -5.971 8.316 1.00 98.42 C +ATOM 4166 HB2 GLN A 264 -20.013 -6.118 8.686 1.00 98.42 H +ATOM 4167 HB3 GLN A 264 -20.967 -5.851 7.234 1.00 98.42 H +ATOM 4168 O GLN A 264 -22.573 -4.859 11.143 1.00 98.42 O +ATOM 4169 CG GLN A 264 -21.875 -7.215 8.624 1.00 98.42 C +ATOM 4170 HG2 GLN A 264 -21.366 -8.094 8.228 1.00 98.42 H +ATOM 4171 HG3 GLN A 264 -21.975 -7.336 9.702 1.00 98.42 H +ATOM 4172 CD GLN A 264 -23.255 -7.152 7.978 1.00 98.42 C +ATOM 4173 NE2 GLN A 264 -24.279 -7.685 8.602 1.00 98.42 N +ATOM 4174 HE21 GLN A 264 -25.148 -7.662 8.088 1.00 98.42 H +ATOM 4175 HE22 GLN A 264 -24.128 -8.297 9.391 1.00 98.42 H +ATOM 4176 OE1 GLN A 264 -23.438 -6.608 6.906 1.00 98.42 O +ATOM 4177 N GLN A 265 -20.359 -4.519 11.057 1.00 98.59 N +ATOM 4178 H GLN A 265 -19.539 -4.434 10.474 1.00 98.59 H +ATOM 4179 CA GLN A 265 -20.218 -4.409 12.510 1.00 98.59 C +ATOM 4180 HA GLN A 265 -20.726 -5.259 12.966 1.00 98.59 H +ATOM 4181 C GLN A 265 -20.880 -3.145 13.075 1.00 98.59 C +ATOM 4182 CB GLN A 265 -18.741 -4.445 12.918 1.00 98.59 C +ATOM 4183 HB2 GLN A 265 -18.183 -3.680 12.378 1.00 98.59 H +ATOM 4184 HB3 GLN A 265 -18.685 -4.223 13.984 1.00 98.59 H +ATOM 4185 O GLN A 265 -21.345 -3.165 14.213 1.00 98.59 O +ATOM 4186 CG GLN A 265 -18.096 -5.816 12.696 1.00 98.59 C +ATOM 4187 HG2 GLN A 265 -18.747 -6.596 13.090 1.00 98.59 H +ATOM 4188 HG3 GLN A 265 -17.959 -6.003 11.631 1.00 98.59 H +ATOM 4189 CD GLN A 265 -16.756 -5.915 13.405 1.00 98.59 C +ATOM 4190 NE2 GLN A 265 -15.687 -5.489 12.775 1.00 98.59 N +ATOM 4191 HE21 GLN A 265 -14.798 -5.610 13.239 1.00 98.59 H +ATOM 4192 HE22 GLN A 265 -15.764 -5.172 11.820 1.00 98.59 H +ATOM 4193 OE1 GLN A 265 -16.670 -6.340 14.549 1.00 98.59 O +ATOM 4194 N SER A 266 -20.937 -2.050 12.309 1.00 98.66 N +ATOM 4195 H SER A 266 -20.542 -2.097 11.381 1.00 98.66 H +ATOM 4196 CA SER A 266 -21.649 -0.827 12.705 1.00 98.66 C +ATOM 4197 HA SER A 266 -21.303 -0.517 13.691 1.00 98.66 H +ATOM 4198 C SER A 266 -23.157 -1.061 12.799 1.00 98.66 C +ATOM 4199 CB SER A 266 -21.380 0.318 11.722 1.00 98.66 C +ATOM 4200 HB2 SER A 266 -21.704 0.048 10.717 1.00 98.66 H +ATOM 4201 HB3 SER A 266 -21.946 1.196 12.033 1.00 98.66 H +ATOM 4202 O SER A 266 -23.769 -0.678 13.794 1.00 98.66 O +ATOM 4203 OG SER A 266 -20.006 0.641 11.702 1.00 98.66 O +ATOM 4204 HG SER A 266 -19.561 -0.068 11.232 1.00 98.66 H +ATOM 4205 N ALA A 267 -23.748 -1.727 11.805 1.00 98.30 N +ATOM 4206 H ALA A 267 -23.193 -2.007 11.009 1.00 98.30 H +ATOM 4207 CA ALA A 267 -25.173 -2.049 11.778 1.00 98.30 C +ATOM 4208 HA ALA A 267 -25.743 -1.132 11.925 1.00 98.30 H +ATOM 4209 C ALA A 267 -25.558 -3.023 12.900 1.00 98.30 C +ATOM 4210 CB ALA A 267 -25.512 -2.622 10.399 1.00 98.30 C +ATOM 4211 HB1 ALA A 267 -24.931 -3.525 10.210 1.00 98.30 H +ATOM 4212 HB2 ALA A 267 -26.573 -2.870 10.352 1.00 98.30 H +ATOM 4213 HB3 ALA A 267 -25.291 -1.890 9.623 1.00 98.30 H +ATOM 4214 O ALA A 267 -26.532 -2.781 13.618 1.00 98.30 O +ATOM 4215 N ALA A 268 -24.750 -4.070 13.105 1.00 97.98 N +ATOM 4216 H ALA A 268 -24.005 -4.237 12.444 1.00 97.98 H +ATOM 4217 CA ALA A 268 -24.930 -5.033 14.192 1.00 97.98 C +ATOM 4218 HA ALA A 268 -25.937 -5.444 14.131 1.00 97.98 H +ATOM 4219 C ALA A 268 -24.778 -4.398 15.589 1.00 97.98 C +ATOM 4220 CB ALA A 268 -23.927 -6.171 13.981 1.00 97.98 C +ATOM 4221 HB1 ALA A 268 -22.911 -5.778 14.020 1.00 97.98 H +ATOM 4222 HB2 ALA A 268 -24.063 -6.922 14.759 1.00 97.98 H +ATOM 4223 HB3 ALA A 268 -24.096 -6.634 13.009 1.00 97.98 H +ATOM 4224 O ALA A 268 -25.391 -4.862 16.545 1.00 97.98 O +ATOM 4225 N ALA A 269 -24.002 -3.315 15.707 1.00 98.01 N +ATOM 4226 H ALA A 269 -23.476 -3.016 14.898 1.00 98.01 H +ATOM 4227 CA ALA A 269 -23.871 -2.519 16.928 1.00 98.01 C +ATOM 4228 HA ALA A 269 -24.003 -3.181 17.784 1.00 98.01 H +ATOM 4229 C ALA A 269 -24.936 -1.409 17.073 1.00 98.01 C +ATOM 4230 CB ALA A 269 -22.444 -1.959 16.990 1.00 98.01 C +ATOM 4231 HB1 ALA A 269 -22.283 -1.270 16.161 1.00 98.01 H +ATOM 4232 HB2 ALA A 269 -21.723 -2.774 16.929 1.00 98.01 H +ATOM 4233 HB3 ALA A 269 -22.300 -1.428 17.931 1.00 98.01 H +ATOM 4234 O ALA A 269 -24.838 -0.596 17.990 1.00 98.01 O +ATOM 4235 N GLY A 270 -25.935 -1.343 16.184 1.00 97.72 N +ATOM 4236 H GLY A 270 -25.969 -2.029 15.443 1.00 97.72 H +ATOM 4237 CA GLY A 270 -27.052 -0.398 16.290 1.00 97.72 C +ATOM 4238 HA2 GLY A 270 -27.926 -0.844 15.816 1.00 97.72 H +ATOM 4239 HA3 GLY A 270 -27.293 -0.241 17.342 1.00 97.72 H +ATOM 4240 C GLY A 270 -26.828 0.978 15.654 1.00 97.72 C +ATOM 4241 O GLY A 270 -27.584 1.906 15.934 1.00 97.72 O +ATOM 4242 N TYR A 271 -25.811 1.159 14.805 1.00 98.27 N +ATOM 4243 H TYR A 271 -25.206 0.379 14.589 1.00 98.27 H +ATOM 4244 CA TYR A 271 -25.603 2.433 14.109 1.00 98.27 C +ATOM 4245 HA TYR A 271 -25.781 3.233 14.827 1.00 98.27 H +ATOM 4246 C TYR A 271 -26.612 2.600 12.962 1.00 98.27 C +ATOM 4247 CB TYR A 271 -24.148 2.550 13.635 1.00 98.27 C +ATOM 4248 HB2 TYR A 271 -23.973 1.804 12.861 1.00 98.27 H +ATOM 4249 HB3 TYR A 271 -23.495 2.319 14.477 1.00 98.27 H +ATOM 4250 O TYR A 271 -26.452 2.010 11.894 1.00 98.27 O +ATOM 4251 CG TYR A 271 -23.763 3.922 13.105 1.00 98.27 C +ATOM 4252 CD1 TYR A 271 -23.240 4.069 11.804 1.00 98.27 C +ATOM 4253 HD1 TYR A 271 -23.107 3.207 11.166 1.00 98.27 H +ATOM 4254 CD2 TYR A 271 -23.917 5.061 13.921 1.00 98.27 C +ATOM 4255 HD2 TYR A 271 -24.314 4.959 14.921 1.00 98.27 H +ATOM 4256 CE1 TYR A 271 -22.873 5.339 11.324 1.00 98.27 C +ATOM 4257 HE1 TYR A 271 -22.477 5.463 10.327 1.00 98.27 H +ATOM 4258 CE2 TYR A 271 -23.581 6.338 13.433 1.00 98.27 C +ATOM 4259 HE2 TYR A 271 -23.731 7.209 14.054 1.00 98.27 H +ATOM 4260 OH TYR A 271 -22.707 7.702 11.665 1.00 98.27 O +ATOM 4261 HH TYR A 271 -23.147 8.415 12.134 1.00 98.27 H +ATOM 4262 CZ TYR A 271 -23.053 6.476 12.133 1.00 98.27 C +ATOM 4263 N VAL A 272 -27.641 3.425 13.180 1.00 97.94 N +ATOM 4264 H VAL A 272 -27.760 3.766 14.123 1.00 97.94 H +ATOM 4265 CA VAL A 272 -28.771 3.624 12.249 1.00 97.94 C +ATOM 4266 HA VAL A 272 -29.312 2.679 12.189 1.00 97.94 H +ATOM 4267 C VAL A 272 -28.341 3.953 10.807 1.00 97.94 C +ATOM 4268 CB VAL A 272 -29.765 4.671 12.800 1.00 97.94 C +ATOM 4269 HB VAL A 272 -29.246 5.609 12.996 1.00 97.94 H +ATOM 4270 O VAL A 272 -28.866 3.312 9.896 1.00 97.94 O +ATOM 4271 CG1 VAL A 272 -30.913 4.962 11.826 1.00 97.94 C +ATOM 4272 HG11 VAL A 272 -31.631 5.640 12.288 1.00 97.94 H +ATOM 4273 HG12 VAL A 272 -31.420 4.035 11.560 1.00 97.94 H +ATOM 4274 HG13 VAL A 272 -30.536 5.440 10.921 1.00 97.94 H +ATOM 4275 CG2 VAL A 272 -30.372 4.195 14.125 1.00 97.94 C +ATOM 4276 HG21 VAL A 272 -30.892 3.248 13.976 1.00 97.94 H +ATOM 4277 HG22 VAL A 272 -31.084 4.933 14.495 1.00 97.94 H +ATOM 4278 HG23 VAL A 272 -29.599 4.058 14.882 1.00 97.94 H +ATOM 4279 N PRO A 273 -27.357 4.843 10.543 1.00 98.25 N +ATOM 4280 CA PRO A 273 -26.907 5.092 9.171 1.00 98.25 C +ATOM 4281 HA PRO A 273 -27.751 5.474 8.596 1.00 98.25 H +ATOM 4282 C PRO A 273 -26.363 3.842 8.460 1.00 98.25 C +ATOM 4283 CB PRO A 273 -25.843 6.191 9.276 1.00 98.25 C +ATOM 4284 HB2 PRO A 273 -25.854 6.846 8.406 1.00 98.25 H +ATOM 4285 HB3 PRO A 273 -24.855 5.751 9.407 1.00 98.25 H +ATOM 4286 O PRO A 273 -26.581 3.681 7.262 1.00 98.25 O +ATOM 4287 CG PRO A 273 -26.245 6.935 10.547 1.00 98.25 C +ATOM 4288 HG2 PRO A 273 -25.410 7.482 10.986 1.00 98.25 H +ATOM 4289 HG3 PRO A 273 -27.072 7.610 10.330 1.00 98.25 H +ATOM 4290 CD PRO A 273 -26.730 5.801 11.446 1.00 98.25 C +ATOM 4291 HD2 PRO A 273 -25.879 5.329 11.937 1.00 98.25 H +ATOM 4292 HD3 PRO A 273 -27.422 6.197 12.189 1.00 98.25 H +ATOM 4293 N ALA A 274 -25.701 2.927 9.182 1.00 98.20 N +ATOM 4294 H ALA A 274 -25.639 3.048 10.182 1.00 98.20 H +ATOM 4295 CA ALA A 274 -25.248 1.653 8.615 1.00 98.20 C +ATOM 4296 HA ALA A 274 -24.689 1.848 7.699 1.00 98.20 H +ATOM 4297 C ALA A 274 -26.427 0.738 8.263 1.00 98.20 C +ATOM 4298 CB ALA A 274 -24.327 0.925 9.602 1.00 98.20 C +ATOM 4299 HB1 ALA A 274 -24.883 0.624 10.490 1.00 98.20 H +ATOM 4300 HB2 ALA A 274 -23.493 1.557 9.905 1.00 98.20 H +ATOM 4301 HB3 ALA A 274 -23.925 0.033 9.121 1.00 98.20 H +ATOM 4302 O ALA A 274 -26.442 0.137 7.193 1.00 98.20 O +ATOM 4303 N GLN A 275 -27.422 0.646 9.151 1.00 97.51 N +ATOM 4304 H GLN A 275 -27.363 1.197 9.995 1.00 97.51 H +ATOM 4305 CA GLN A 275 -28.618 -0.177 8.940 1.00 97.51 C +ATOM 4306 HA GLN A 275 -28.321 -1.209 8.751 1.00 97.51 H +ATOM 4307 C GLN A 275 -29.407 0.299 7.718 1.00 97.51 C +ATOM 4308 CB GLN A 275 -29.506 -0.139 10.191 1.00 97.51 C +ATOM 4309 HB2 GLN A 275 -30.439 -0.663 9.980 1.00 97.51 H +ATOM 4310 HB3 GLN A 275 -29.744 0.896 10.433 1.00 97.51 H +ATOM 4311 O GLN A 275 -29.746 -0.504 6.858 1.00 97.51 O +ATOM 4312 CG GLN A 275 -28.834 -0.811 11.396 1.00 97.51 C +ATOM 4313 HG2 GLN A 275 -28.702 -1.871 11.180 1.00 97.51 H +ATOM 4314 HG3 GLN A 275 -27.853 -0.368 11.570 1.00 97.51 H +ATOM 4315 CD GLN A 275 -29.633 -0.666 12.683 1.00 97.51 C +ATOM 4316 NE2 GLN A 275 -29.323 -1.451 13.691 1.00 97.51 N +ATOM 4317 HE21 GLN A 275 -28.563 -2.111 13.613 1.00 97.51 H +ATOM 4318 HE22 GLN A 275 -29.873 -1.321 14.528 1.00 97.51 H +ATOM 4319 OE1 GLN A 275 -30.504 0.172 12.839 1.00 97.51 O +ATOM 4320 N GLN A 276 -29.609 1.613 7.583 1.00 97.25 N +ATOM 4321 H GLN A 276 -29.312 2.223 8.331 1.00 97.25 H +ATOM 4322 CA GLN A 276 -30.246 2.208 6.404 1.00 97.25 C +ATOM 4323 HA GLN A 276 -31.246 1.792 6.283 1.00 97.25 H +ATOM 4324 C GLN A 276 -29.461 1.910 5.119 1.00 97.25 C +ATOM 4325 CB GLN A 276 -30.348 3.726 6.603 1.00 97.25 C +ATOM 4326 HB2 GLN A 276 -30.648 4.188 5.662 1.00 97.25 H +ATOM 4327 HB3 GLN A 276 -29.367 4.113 6.876 1.00 97.25 H +ATOM 4328 O GLN A 276 -30.051 1.561 4.096 1.00 97.25 O +ATOM 4329 CG GLN A 276 -31.374 4.117 7.677 1.00 97.25 C +ATOM 4330 HG2 GLN A 276 -32.367 3.817 7.343 1.00 97.25 H +ATOM 4331 HG3 GLN A 276 -31.161 3.598 8.612 1.00 97.25 H +ATOM 4332 CD GLN A 276 -31.379 5.617 7.960 1.00 97.25 C +ATOM 4333 NE2 GLN A 276 -32.396 6.123 8.621 1.00 97.25 N +ATOM 4334 HE21 GLN A 276 -33.173 5.541 8.899 1.00 97.25 H +ATOM 4335 HE22 GLN A 276 -32.381 7.123 8.761 1.00 97.25 H +ATOM 4336 OE1 GLN A 276 -30.475 6.360 7.617 1.00 97.25 O +ATOM 4337 N ALA A 277 -28.129 2.019 5.170 1.00 97.31 N +ATOM 4338 H ALA A 277 -27.698 2.336 6.026 1.00 97.31 H +ATOM 4339 CA ALA A 277 -27.269 1.766 4.020 1.00 97.31 C +ATOM 4340 HA ALA A 277 -27.647 2.357 3.186 1.00 97.31 H +ATOM 4341 C ALA A 277 -27.257 0.298 3.572 1.00 97.31 C +ATOM 4342 CB ALA A 277 -25.856 2.251 4.342 1.00 97.31 C +ATOM 4343 HB1 ALA A 277 -25.899 3.307 4.605 1.00 97.31 H +ATOM 4344 HB2 ALA A 277 -25.446 1.686 5.179 1.00 97.31 H +ATOM 4345 HB3 ALA A 277 -25.211 2.122 3.473 1.00 97.31 H +ATOM 4346 O ALA A 277 -27.193 0.061 2.367 1.00 97.31 O +ATOM 4347 N LEU A 278 -27.325 -0.660 4.504 1.00 97.00 N +ATOM 4348 H LEU A 278 -27.314 -0.382 5.474 1.00 97.00 H +ATOM 4349 CA LEU A 278 -27.431 -2.093 4.199 1.00 97.00 C +ATOM 4350 HA LEU A 278 -26.791 -2.328 3.349 1.00 97.00 H +ATOM 4351 C LEU A 278 -28.856 -2.501 3.794 1.00 97.00 C +ATOM 4352 CB LEU A 278 -26.961 -2.925 5.406 1.00 97.00 C +ATOM 4353 HB2 LEU A 278 -27.541 -2.628 6.280 1.00 97.00 H +ATOM 4354 HB3 LEU A 278 -27.189 -3.972 5.204 1.00 97.00 H +ATOM 4355 O LEU A 278 -29.024 -3.306 2.880 1.00 97.00 O +ATOM 4356 CG LEU A 278 -25.463 -2.820 5.742 1.00 97.00 C +ATOM 4357 HG LEU A 278 -25.219 -1.794 6.017 1.00 97.00 H +ATOM 4358 CD1 LEU A 278 -25.167 -3.725 6.936 1.00 97.00 C +ATOM 4359 HD11 LEU A 278 -25.823 -3.462 7.765 1.00 97.00 H +ATOM 4360 HD12 LEU A 278 -24.127 -3.612 7.240 1.00 97.00 H +ATOM 4361 HD13 LEU A 278 -25.346 -4.765 6.662 1.00 97.00 H +ATOM 4362 CD2 LEU A 278 -24.549 -3.238 4.589 1.00 97.00 C +ATOM 4363 HD21 LEU A 278 -24.824 -4.232 4.235 1.00 97.00 H +ATOM 4364 HD22 LEU A 278 -23.513 -3.264 4.926 1.00 97.00 H +ATOM 4365 HD23 LEU A 278 -24.628 -2.523 3.770 1.00 97.00 H +ATOM 4366 N GLY A 279 -29.881 -1.918 4.422 1.00 95.63 N +ATOM 4367 H GLY A 279 -29.685 -1.317 5.210 1.00 95.63 H +ATOM 4368 CA GLY A 279 -31.288 -2.186 4.115 1.00 95.63 C +ATOM 4369 HA2 GLY A 279 -31.500 -3.244 4.264 1.00 95.63 H +ATOM 4370 HA3 GLY A 279 -31.917 -1.608 4.792 1.00 95.63 H +ATOM 4371 C GLY A 279 -31.653 -1.817 2.677 1.00 95.63 C +ATOM 4372 O GLY A 279 -32.261 -2.617 1.973 1.00 95.63 O +ATOM 4373 N ARG A 280 -31.185 -0.661 2.182 1.00 95.61 N +ATOM 4374 H ARG A 280 -30.704 -0.039 2.816 1.00 95.61 H +ATOM 4375 CA ARG A 280 -31.434 -0.219 0.792 1.00 95.61 C +ATOM 4376 HA ARG A 280 -32.503 -0.320 0.601 1.00 95.61 H +ATOM 4377 C ARG A 280 -30.764 -1.080 -0.292 1.00 95.61 C +ATOM 4378 CB ARG A 280 -31.068 1.266 0.626 1.00 95.61 C +ATOM 4379 HB2 ARG A 280 -31.421 1.611 -0.345 1.00 95.61 H +ATOM 4380 HB3 ARG A 280 -31.565 1.851 1.400 1.00 95.61 H +ATOM 4381 O ARG A 280 -31.092 -0.912 -1.460 1.00 95.61 O +ATOM 4382 CG ARG A 280 -29.555 1.480 0.712 1.00 95.61 C +ATOM 4383 HG2 ARG A 280 -29.226 1.154 1.699 1.00 95.61 H +ATOM 4384 HG3 ARG A 280 -29.059 0.884 -0.054 1.00 95.61 H +ATOM 4385 CD ARG A 280 -29.134 2.932 0.519 1.00 95.61 C +ATOM 4386 HD2 ARG A 280 -29.589 3.536 1.304 1.00 95.61 H +ATOM 4387 HD3 ARG A 280 -29.489 3.273 -0.454 1.00 95.61 H +ATOM 4388 NE ARG A 280 -27.664 3.038 0.583 1.00 95.61 N +ATOM 4389 HE ARG A 280 -27.169 2.170 0.727 1.00 95.61 H +ATOM 4390 NH1 ARG A 280 -27.521 5.310 0.318 1.00 95.61 N +ATOM 4391 HH11 ARG A 280 -26.968 6.149 0.212 1.00 95.61 H +ATOM 4392 HH12 ARG A 280 -28.527 5.344 0.237 1.00 95.61 H +ATOM 4393 NH2 ARG A 280 -25.659 4.102 0.585 1.00 95.61 N +ATOM 4394 HH21 ARG A 280 -25.202 3.211 0.714 1.00 95.61 H +ATOM 4395 HH22 ARG A 280 -25.122 4.957 0.606 1.00 95.61 H +ATOM 4396 CZ ARG A 280 -26.957 4.147 0.493 1.00 95.61 C +ATOM 4397 N ILE A 281 -29.815 -1.949 0.071 1.00 95.10 N +ATOM 4398 H ILE A 281 -29.610 -2.036 1.056 1.00 95.10 H +ATOM 4399 CA ILE A 281 -29.127 -2.874 -0.851 1.00 95.10 C +ATOM 4400 HA ILE A 281 -29.504 -2.697 -1.859 1.00 95.10 H +ATOM 4401 C ILE A 281 -29.466 -4.350 -0.576 1.00 95.10 C +ATOM 4402 CB ILE A 281 -27.599 -2.625 -0.904 1.00 95.10 C +ATOM 4403 HB ILE A 281 -27.171 -3.335 -1.612 1.00 95.10 H +ATOM 4404 O ILE A 281 -28.821 -5.234 -1.130 1.00 95.10 O +ATOM 4405 CG1 ILE A 281 -26.939 -2.865 0.469 1.00 95.10 C +ATOM 4406 HG12 ILE A 281 -27.198 -3.863 0.822 1.00 95.10 H +ATOM 4407 HG13 ILE A 281 -27.340 -2.143 1.181 1.00 95.10 H +ATOM 4408 CG2 ILE A 281 -27.283 -1.217 -1.441 1.00 95.10 C +ATOM 4409 HG21 ILE A 281 -26.238 -1.169 -1.748 1.00 95.10 H +ATOM 4410 HG22 ILE A 281 -27.462 -0.473 -0.665 1.00 95.10 H +ATOM 4411 HG23 ILE A 281 -27.906 -1.006 -2.310 1.00 95.10 H +ATOM 4412 CD1 ILE A 281 -25.412 -2.748 0.470 1.00 95.10 C +ATOM 4413 HD11 ILE A 281 -25.107 -1.723 0.260 1.00 95.10 H +ATOM 4414 HD12 ILE A 281 -24.990 -3.420 -0.278 1.00 95.10 H +ATOM 4415 HD13 ILE A 281 -25.032 -3.032 1.452 1.00 95.10 H +ATOM 4416 N GLY A 282 -30.458 -4.632 0.280 1.00 88.27 N +ATOM 4417 H GLY A 282 -30.974 -3.871 0.697 1.00 88.27 H +ATOM 4418 CA GLY A 282 -30.922 -5.998 0.550 1.00 88.27 C +ATOM 4419 HA2 GLY A 282 -31.889 -5.942 1.049 1.00 88.27 H +ATOM 4420 HA3 GLY A 282 -31.059 -6.524 -0.395 1.00 88.27 H +ATOM 4421 C GLY A 282 -29.992 -6.842 1.430 1.00 88.27 C +ATOM 4422 O GLY A 282 -30.054 -8.065 1.374 1.00 88.27 O +ATOM 4423 N MET A 283 -29.130 -6.217 2.240 1.00 78.05 N +ATOM 4424 H MET A 283 -29.124 -5.207 2.235 1.00 78.05 H +ATOM 4425 CA MET A 283 -28.188 -6.912 3.137 1.00 78.05 C +ATOM 4426 HA MET A 283 -28.163 -7.967 2.866 1.00 78.05 H +ATOM 4427 C MET A 283 -28.605 -6.891 4.618 1.00 78.05 C +ATOM 4428 CB MET A 283 -26.765 -6.368 2.940 1.00 78.05 C +ATOM 4429 HB2 MET A 283 -26.105 -6.830 3.674 1.00 78.05 H +ATOM 4430 HB3 MET A 283 -26.758 -5.290 3.101 1.00 78.05 H +ATOM 4431 O MET A 283 -27.836 -7.314 5.483 1.00 78.05 O +ATOM 4432 CG MET A 283 -26.214 -6.677 1.545 1.00 78.05 C +ATOM 4433 HG2 MET A 283 -26.380 -7.730 1.318 1.00 78.05 H +ATOM 4434 HG3 MET A 283 -26.766 -6.091 0.810 1.00 78.05 H +ATOM 4435 SD MET A 283 -24.445 -6.317 1.361 1.00 78.05 S +ATOM 4436 CE MET A 283 -23.766 -7.760 2.219 1.00 78.05 C +ATOM 4437 HE1 MET A 283 -22.694 -7.822 2.030 1.00 78.05 H +ATOM 4438 HE2 MET A 283 -23.954 -7.683 3.290 1.00 78.05 H +ATOM 4439 HE3 MET A 283 -24.237 -8.666 1.837 1.00 78.05 H +ATOM 4440 N ASP A 284 -29.809 -6.408 4.940 1.00 68.30 N +ATOM 4441 H ASP A 284 -30.433 -6.123 4.199 1.00 68.30 H +ATOM 4442 CA ASP A 284 -30.335 -6.495 6.302 1.00 68.30 C +ATOM 4443 HA ASP A 284 -29.515 -6.288 6.990 1.00 68.30 H +ATOM 4444 C ASP A 284 -30.848 -7.914 6.597 1.00 68.30 C +ATOM 4445 CB ASP A 284 -31.398 -5.415 6.568 1.00 68.30 C +ATOM 4446 HB2 ASP A 284 -31.012 -4.459 6.215 1.00 68.30 H +ATOM 4447 HB3 ASP A 284 -32.306 -5.646 6.011 1.00 68.30 H +ATOM 4448 O ASP A 284 -31.834 -8.378 6.025 1.00 68.30 O +ATOM 4449 CG ASP A 284 -31.727 -5.274 8.064 1.00 68.30 C +ATOM 4450 OD1 ASP A 284 -31.293 -6.143 8.863 1.00 68.30 O +ATOM 4451 OD2 ASP A 284 -32.394 -4.283 8.420 1.00 68.30 O +ATOM 4452 N SER A 285 -30.196 -8.595 7.543 1.00 58.16 N +ATOM 4453 H SER A 285 -29.378 -8.159 7.943 1.00 58.16 H +ATOM 4454 CA SER A 285 -30.619 -9.900 8.066 1.00 58.16 C +ATOM 4455 HA SER A 285 -30.599 -10.621 7.249 1.00 58.16 H +ATOM 4456 C SER A 285 -32.047 -9.912 8.635 1.00 58.16 C +ATOM 4457 CB SER A 285 -29.627 -10.365 9.139 1.00 58.16 C +ATOM 4458 HB2 SER A 285 -30.008 -11.264 9.624 1.00 58.16 H +ATOM 4459 HB3 SER A 285 -28.676 -10.607 8.663 1.00 58.16 H +ATOM 4460 O SER A 285 -32.627 -10.988 8.764 1.00 58.16 O +ATOM 4461 OG SER A 285 -29.405 -9.354 10.112 1.00 58.16 O +ATOM 4462 HG SER A 285 -30.046 -8.652 9.975 1.00 58.16 H +ATOM 4463 N LYS A 286 -32.637 -8.749 8.961 1.00 53.98 N +ATOM 4464 H LYS A 286 -32.122 -7.889 8.831 1.00 53.98 H +ATOM 4465 CA LYS A 286 -34.031 -8.652 9.426 1.00 53.98 C +ATOM 4466 HA LYS A 286 -34.251 -9.508 10.064 1.00 53.98 H +ATOM 4467 C LYS A 286 -35.065 -8.737 8.298 1.00 53.98 C +ATOM 4468 CB LYS A 286 -34.226 -7.379 10.259 1.00 53.98 C +ATOM 4469 HB2 LYS A 286 -35.294 -7.245 10.428 1.00 53.98 H +ATOM 4470 HB3 LYS A 286 -33.860 -6.511 9.709 1.00 53.98 H +ATOM 4471 O LYS A 286 -36.120 -9.324 8.515 1.00 53.98 O +ATOM 4472 CG LYS A 286 -33.524 -7.483 11.620 1.00 53.98 C +ATOM 4473 HG2 LYS A 286 -32.444 -7.525 11.480 1.00 53.98 H +ATOM 4474 HG3 LYS A 286 -33.856 -8.390 12.126 1.00 53.98 H +ATOM 4475 CD LYS A 286 -33.885 -6.268 12.476 1.00 53.98 C +ATOM 4476 HD2 LYS A 286 -33.494 -5.371 11.997 1.00 53.98 H +ATOM 4477 HD3 LYS A 286 -34.971 -6.192 12.534 1.00 53.98 H +ATOM 4478 CE LYS A 286 -33.307 -6.411 13.885 1.00 53.98 C +ATOM 4479 HE2 LYS A 286 -33.640 -7.364 14.297 1.00 53.98 H +ATOM 4480 HE3 LYS A 286 -32.220 -6.428 13.814 1.00 53.98 H +ATOM 4481 NZ LYS A 286 -33.767 -5.292 14.740 1.00 53.98 N +ATOM 4482 HZ1 LYS A 286 -33.402 -5.377 15.678 1.00 53.98 H +ATOM 4483 HZ2 LYS A 286 -34.776 -5.293 14.778 1.00 53.98 H +ATOM 4484 HZ3 LYS A 286 -33.478 -4.412 14.336 1.00 53.98 H +ATOM 4485 N ALA A 287 -34.751 -8.278 7.084 1.00 46.81 N +ATOM 4486 H ALA A 287 -33.840 -7.868 6.934 1.00 46.81 H +ATOM 4487 CA ALA A 287 -35.664 -8.390 5.938 1.00 46.81 C +ATOM 4488 HA ALA A 287 -36.648 -8.030 6.238 1.00 46.81 H +ATOM 4489 C ALA A 287 -35.840 -9.848 5.461 1.00 46.81 C +ATOM 4490 CB ALA A 287 -35.147 -7.480 4.818 1.00 46.81 C +ATOM 4491 HB1 ALA A 287 -34.163 -7.812 4.487 1.00 46.81 H +ATOM 4492 HB2 ALA A 287 -35.082 -6.452 5.177 1.00 46.81 H +ATOM 4493 HB3 ALA A 287 -35.838 -7.514 3.976 1.00 46.81 H +ATOM 4494 O ALA A 287 -36.889 -10.215 4.935 1.00 46.81 O +ATOM 4495 N ALA A 288 -34.845 -10.708 5.710 1.00 43.13 N +ATOM 4496 H ALA A 288 -33.991 -10.345 6.109 1.00 43.13 H +ATOM 4497 CA ALA A 288 -34.927 -12.143 5.433 1.00 43.13 C +ATOM 4498 HA ALA A 288 -35.341 -12.282 4.434 1.00 43.13 H +ATOM 4499 C ALA A 288 -35.849 -12.908 6.409 1.00 43.13 C +ATOM 4500 CB ALA A 288 -33.501 -12.708 5.442 1.00 43.13 C +ATOM 4501 HB1 ALA A 288 -32.888 -12.181 4.711 1.00 43.13 H +ATOM 4502 HB2 ALA A 288 -33.062 -12.597 6.434 1.00 43.13 H +ATOM 4503 HB3 ALA A 288 -33.530 -13.766 5.182 1.00 43.13 H +ATOM 4504 O ALA A 288 -36.315 -13.996 6.079 1.00 43.13 O +ATOM 4505 N LEU A 289 -36.130 -12.346 7.592 1.00 44.15 N +ATOM 4506 H LEU A 289 -35.753 -11.430 7.788 1.00 44.15 H +ATOM 4507 CA LEU A 289 -37.014 -12.947 8.598 1.00 44.15 C +ATOM 4508 HA LEU A 289 -37.020 -14.029 8.467 1.00 44.15 H +ATOM 4509 C LEU A 289 -38.478 -12.507 8.429 1.00 44.15 C +ATOM 4510 CB LEU A 289 -36.458 -12.634 10.001 1.00 44.15 C +ATOM 4511 HB2 LEU A 289 -37.243 -12.788 10.741 1.00 44.15 H +ATOM 4512 HB3 LEU A 289 -36.178 -11.582 10.037 1.00 44.15 H +ATOM 4513 O LEU A 289 -39.377 -13.295 8.703 1.00 44.15 O +ATOM 4514 CG LEU A 289 -35.246 -13.513 10.374 1.00 44.15 C +ATOM 4515 HG LEU A 289 -34.600 -13.641 9.505 1.00 44.15 H +ATOM 4516 CD1 LEU A 289 -34.419 -12.851 11.478 1.00 44.15 C +ATOM 4517 HD11 LEU A 289 -34.040 -11.896 11.116 1.00 44.15 H +ATOM 4518 HD12 LEU A 289 -33.574 -13.489 11.734 1.00 44.15 H +ATOM 4519 HD13 LEU A 289 -35.040 -12.690 12.359 1.00 44.15 H +ATOM 4520 CD2 LEU A 289 -35.687 -14.890 10.877 1.00 44.15 C +ATOM 4521 HD21 LEU A 289 -36.314 -14.786 11.762 1.00 44.15 H +ATOM 4522 HD22 LEU A 289 -34.813 -15.495 11.118 1.00 44.15 H +ATOM 4523 HD23 LEU A 289 -36.258 -15.402 10.101 1.00 44.15 H +ATOM 4524 N GLU A 290 -38.741 -11.302 7.915 1.00 46.47 N +ATOM 4525 H GLU A 290 -37.978 -10.656 7.770 1.00 46.47 H +ATOM 4526 CA GLU A 290 -40.113 -10.820 7.670 1.00 46.47 C +ATOM 4527 HA GLU A 290 -40.755 -11.159 8.484 1.00 46.47 H +ATOM 4528 C GLU A 290 -40.739 -11.403 6.388 1.00 46.47 C +ATOM 4529 CB GLU A 290 -40.136 -9.282 7.689 1.00 46.47 C +ATOM 4530 HB2 GLU A 290 -39.339 -8.903 7.050 1.00 46.47 H +ATOM 4531 HB3 GLU A 290 -41.094 -8.936 7.301 1.00 46.47 H +ATOM 4532 O GLU A 290 -41.950 -11.617 6.335 1.00 46.47 O +ATOM 4533 CG GLU A 290 -39.969 -8.752 9.127 1.00 46.47 C +ATOM 4534 HG2 GLU A 290 -40.788 -9.139 9.733 1.00 46.47 H +ATOM 4535 HG3 GLU A 290 -39.040 -9.143 9.541 1.00 46.47 H +ATOM 4536 CD GLU A 290 -39.941 -7.218 9.244 1.00 46.47 C +ATOM 4537 OE1 GLU A 290 -39.961 -6.737 10.401 1.00 46.47 O +ATOM 4538 OE2 GLU A 290 -39.841 -6.534 8.200 1.00 46.47 O +ATOM 4539 N HIS A 291 -39.933 -11.781 5.388 1.00 49.01 N +ATOM 4540 H HIS A 291 -38.952 -11.549 5.448 1.00 49.01 H +ATOM 4541 CA HIS A 291 -40.437 -12.419 4.162 1.00 49.01 C +ATOM 4542 HA HIS A 291 -41.368 -11.918 3.894 1.00 49.01 H +ATOM 4543 C HIS A 291 -40.820 -13.905 4.315 1.00 49.01 C +ATOM 4544 CB HIS A 291 -39.448 -12.194 3.006 1.00 49.01 C +ATOM 4545 HB2 HIS A 291 -38.460 -11.940 3.391 1.00 49.01 H +ATOM 4546 HB3 HIS A 291 -39.345 -13.112 2.428 1.00 49.01 H +ATOM 4547 O HIS A 291 -41.509 -14.443 3.450 1.00 49.01 O +ATOM 4548 CG HIS A 291 -39.922 -11.115 2.069 1.00 49.01 C +ATOM 4549 CD2 HIS A 291 -39.463 -9.828 1.988 1.00 49.01 C +ATOM 4550 HD2 HIS A 291 -38.674 -9.398 2.587 1.00 49.01 H +ATOM 4551 ND1 HIS A 291 -40.948 -11.240 1.160 1.00 49.01 N +ATOM 4552 HD1 HIS A 291 -41.511 -12.066 1.013 1.00 49.01 H +ATOM 4553 CE1 HIS A 291 -41.099 -10.059 0.539 1.00 49.01 C +ATOM 4554 HE1 HIS A 291 -41.836 -9.847 -0.222 1.00 49.01 H +ATOM 4555 NE2 HIS A 291 -40.209 -9.168 1.003 1.00 49.01 N +ATOM 4556 N HIS A 292 -40.433 -14.566 5.413 1.00 48.14 N +ATOM 4557 H HIS A 292 -39.881 -14.072 6.099 1.00 48.14 H +ATOM 4558 CA HIS A 292 -40.768 -15.974 5.671 1.00 48.14 C +ATOM 4559 HA HIS A 292 -40.995 -16.444 4.715 1.00 48.14 H +ATOM 4560 C HIS A 292 -42.045 -16.184 6.506 1.00 48.14 C +ATOM 4561 CB HIS A 292 -39.542 -16.709 6.245 1.00 48.14 C +ATOM 4562 HB2 HIS A 292 -39.861 -17.395 7.029 1.00 48.14 H +ATOM 4563 HB3 HIS A 292 -38.850 -15.999 6.698 1.00 48.14 H +ATOM 4564 O HIS A 292 -42.485 -17.322 6.652 1.00 48.14 O +ATOM 4565 CG HIS A 292 -38.825 -17.520 5.194 1.00 48.14 C +ATOM 4566 CD2 HIS A 292 -37.590 -17.277 4.654 1.00 48.14 C +ATOM 4567 HD2 HIS A 292 -36.937 -16.457 4.913 1.00 48.14 H +ATOM 4568 ND1 HIS A 292 -39.325 -18.644 4.575 1.00 48.14 N +ATOM 4569 HD1 HIS A 292 -40.228 -19.061 4.752 1.00 48.14 H +ATOM 4570 CE1 HIS A 292 -38.415 -19.068 3.683 1.00 48.14 C +ATOM 4571 HE1 HIS A 292 -38.531 -19.928 3.040 1.00 48.14 H +ATOM 4572 NE2 HIS A 292 -37.335 -18.272 3.700 1.00 48.14 N +ATOM 4573 N HIS A 293 -42.683 -15.116 7.002 1.00 49.54 N +ATOM 4574 H HIS A 293 -42.277 -14.203 6.854 1.00 49.54 H +ATOM 4575 CA HIS A 293 -43.890 -15.202 7.840 1.00 49.54 C +ATOM 4576 HA HIS A 293 -44.036 -16.245 8.119 1.00 49.54 H +ATOM 4577 C HIS A 293 -45.210 -14.834 7.130 1.00 49.54 C +ATOM 4578 CB HIS A 293 -43.651 -14.437 9.155 1.00 49.54 C +ATOM 4579 HB2 HIS A 293 -44.608 -14.188 9.613 1.00 49.54 H +ATOM 4580 HB3 HIS A 293 -43.130 -13.501 8.952 1.00 49.54 H +ATOM 4581 O HIS A 293 -46.255 -14.824 7.776 1.00 49.54 O +ATOM 4582 CG HIS A 293 -42.875 -15.256 10.159 1.00 49.54 C +ATOM 4583 CD2 HIS A 293 -41.615 -15.018 10.640 1.00 49.54 C +ATOM 4584 HD2 HIS A 293 -40.981 -14.187 10.367 1.00 49.54 H +ATOM 4585 ND1 HIS A 293 -43.326 -16.407 10.767 1.00 49.54 N +ATOM 4586 HD1 HIS A 293 -44.218 -16.851 10.601 1.00 49.54 H +ATOM 4587 CE1 HIS A 293 -42.361 -16.853 11.587 1.00 49.54 C +ATOM 4588 HE1 HIS A 293 -42.424 -17.747 12.189 1.00 49.54 H +ATOM 4589 NE2 HIS A 293 -41.299 -16.035 11.551 1.00 49.54 N +ATOM 4590 N HIS A 294 -45.203 -14.602 5.810 1.00 47.83 N +ATOM 4591 H HIS A 294 -44.312 -14.614 5.333 1.00 47.83 H +ATOM 4592 CA HIS A 294 -46.399 -14.218 5.035 1.00 47.83 C +ATOM 4593 HA HIS A 294 -47.245 -14.181 5.721 1.00 47.83 H +ATOM 4594 C HIS A 294 -46.870 -15.239 3.977 1.00 47.83 C +ATOM 4595 CB HIS A 294 -46.224 -12.786 4.498 1.00 47.83 C +ATOM 4596 HB2 HIS A 294 -46.885 -12.621 3.646 1.00 47.83 H +ATOM 4597 HB3 HIS A 294 -45.201 -12.637 4.154 1.00 47.83 H +ATOM 4598 O HIS A 294 -47.702 -14.912 3.134 1.00 47.83 O +ATOM 4599 CG HIS A 294 -46.578 -11.750 5.534 1.00 47.83 C +ATOM 4600 CD2 HIS A 294 -45.740 -10.848 6.135 1.00 47.83 C +ATOM 4601 HD2 HIS A 294 -44.681 -10.743 5.953 1.00 47.83 H +ATOM 4602 ND1 HIS A 294 -47.833 -11.555 6.068 1.00 47.83 N +ATOM 4603 HD1 HIS A 294 -48.659 -12.094 5.849 1.00 47.83 H +ATOM 4604 CE1 HIS A 294 -47.754 -10.563 6.967 1.00 47.83 C +ATOM 4605 HE1 HIS A 294 -48.578 -10.194 7.561 1.00 47.83 H +ATOM 4606 NE2 HIS A 294 -46.501 -10.094 7.037 1.00 47.83 N +ATOM 4607 N HIS A 295 -46.408 -16.491 4.047 1.00 41.74 N +ATOM 4608 H HIS A 295 -45.753 -16.720 4.781 1.00 41.74 H +ATOM 4609 CA HIS A 295 -46.913 -17.593 3.217 1.00 41.74 C +ATOM 4610 HA HIS A 295 -47.823 -17.277 2.707 1.00 41.74 H +ATOM 4611 C HIS A 295 -47.323 -18.795 4.083 1.00 41.74 C +ATOM 4612 CB HIS A 295 -45.882 -17.954 2.132 1.00 41.74 C +ATOM 4613 HB2 HIS A 295 -46.173 -18.901 1.676 1.00 41.74 H +ATOM 4614 HB3 HIS A 295 -44.904 -18.095 2.592 1.00 41.74 H +ATOM 4615 O HIS A 295 -46.617 -19.799 4.131 1.00 41.74 O +ATOM 4616 CG HIS A 295 -45.780 -16.938 1.021 1.00 41.74 C +ATOM 4617 CD2 HIS A 295 -44.693 -16.171 0.699 1.00 41.74 C +ATOM 4618 HD2 HIS A 295 -43.742 -16.172 1.212 1.00 41.74 H +ATOM 4619 ND1 HIS A 295 -46.771 -16.632 0.117 1.00 41.74 N +ATOM 4620 HD1 HIS A 295 -47.719 -16.982 0.138 1.00 41.74 H +ATOM 4621 CE1 HIS A 295 -46.295 -15.702 -0.726 1.00 41.74 C +ATOM 4622 HE1 HIS A 295 -46.856 -15.245 -1.527 1.00 41.74 H +ATOM 4623 NE2 HIS A 295 -45.026 -15.394 -0.418 1.00 41.74 N +ATOM 4624 N HIS A 296 -48.459 -18.673 4.773 1.00 37.36 N +ATOM 4625 H HIS A 296 -48.976 -17.808 4.720 1.00 37.36 H +ATOM 4626 CA HIS A 296 -49.227 -19.774 5.363 1.00 37.36 C +ATOM 4627 HA HIS A 296 -49.089 -20.672 4.761 1.00 37.36 H +ATOM 4628 C HIS A 296 -50.719 -19.457 5.288 1.00 37.36 C +ATOM 4629 CB HIS A 296 -48.788 -20.061 6.808 1.00 37.36 C +ATOM 4630 HB2 HIS A 296 -49.633 -20.484 7.351 1.00 37.36 H +ATOM 4631 HB3 HIS A 296 -48.508 -19.131 7.302 1.00 37.36 H +ATOM 4632 O HIS A 296 -51.064 -18.264 5.446 1.00 37.36 O +ATOM 4633 CG HIS A 296 -47.662 -21.056 6.886 1.00 37.36 C +ATOM 4634 CD2 HIS A 296 -46.403 -20.856 7.380 1.00 37.36 C +ATOM 4635 HD2 HIS A 296 -46.027 -19.931 7.790 1.00 37.36 H +ATOM 4636 ND1 HIS A 296 -47.720 -22.353 6.438 1.00 37.36 N +ATOM 4637 HD1 HIS A 296 -48.508 -22.754 5.951 1.00 37.36 H +ATOM 4638 CE1 HIS A 296 -46.522 -22.921 6.652 1.00 37.36 C +ATOM 4639 HE1 HIS A 296 -46.258 -23.931 6.375 1.00 37.36 H +ATOM 4640 NE2 HIS A 296 -45.687 -22.055 7.247 1.00 37.36 N +ATOM 4641 OXT HIS A 296 -51.461 -20.429 5.040 1.00 37.36 O +TER 4642 HIS A 296 +END diff --git a/modules/mol/alg/tests/testfiles/6jyf_trg.cif b/modules/mol/alg/tests/testfiles/6jyf_trg.cif new file mode 100644 index 0000000000000000000000000000000000000000..cb2ec7fa482d436c3944238cfeeb41213c690d87 --- /dev/null +++ b/modules/mol/alg/tests/testfiles/6jyf_trg.cif @@ -0,0 +1,4338 @@ +data_6JYF +# +_entry.id 6JYF +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.323 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +PDB 6JYF +WWPDB D_1300011511 +# +_pdbx_database_status.status_code REL +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.entry_id 6JYF +_pdbx_database_status.recvd_initial_deposition_date 2019-04-26 +_pdbx_database_status.SG_entry N +_pdbx_database_status.deposit_site PDBJ +_pdbx_database_status.process_site PDBJ +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.pdb_format_compatible Y +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +_audit_author.identifier_ORCID +'Yun, J.H.' 1 ? +'Ohki, M.' 2 ? +'Park, S.Y.' 3 ? +'Lee, W.' 4 ? +# +_citation.abstract ? +_citation.abstract_id_CAS ? +_citation.book_id_ISBN ? +_citation.book_publisher ? +_citation.book_publisher_city ? +_citation.book_title ? +_citation.coordinate_linkage ? +_citation.country US +_citation.database_id_Medline ? +_citation.details ? +_citation.id primary +_citation.journal_abbrev 'Sci Adv' +_citation.journal_id_ASTM ? +_citation.journal_id_CSD ? +_citation.journal_id_ISSN 2375-2548 +_citation.journal_full ? +_citation.journal_issue ? +_citation.journal_volume 6 +_citation.language ? +_citation.page_first eaay2042 +_citation.page_last eaay2042 +_citation.title +'Pumping mechanism of NM-R3, a light-driven bacterial chloride importer in the rhodopsin family.' +_citation.year 2020 +_citation.database_id_CSD ? +_citation.pdbx_database_id_DOI 10.1126/sciadv.aay2042 +_citation.pdbx_database_id_PubMed 32083178 +_citation.unpublished_flag ? +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Yun, J.H.' 1 0000-0001-7570-369X +primary 'Ohki, M.' 2 0000-0002-7653-7782 +primary 'Park, J.H.' 3 0000-0001-5690-9705 +primary 'Ishimoto, N.' 4 0000-0001-8976-8582 +primary 'Sato-Tomita, A.' 5 0000-0002-1173-1058 +primary 'Lee, W.' 6 ? +primary 'Jin, Z.' 7 0000-0002-6478-2967 +primary 'Tame, J.R.H.' 8 0000-0002-9341-7280 +primary 'Shibayama, N.' 9 0000-0002-2208-1126 +primary 'Park, S.Y.' 10 0000-0001-6164-8896 +primary 'Lee, W.' 11 0000-0003-2347-1262 +# +_cell.angle_alpha 90.00 +_cell.angle_alpha_esd ? +_cell.angle_beta 109.98 +_cell.angle_beta_esd ? +_cell.angle_gamma 90.00 +_cell.angle_gamma_esd ? +_cell.entry_id 6JYF +_cell.details ? +_cell.formula_units_Z ? +_cell.length_a 102.918 +_cell.length_a_esd ? +_cell.length_b 49.289 +_cell.length_b_esd ? +_cell.length_c 69.466 +_cell.length_c_esd ? +_cell.volume ? +_cell.volume_esd ? +_cell.Z_PDB 4 +_cell.reciprocal_angle_alpha ? +_cell.reciprocal_angle_beta ? +_cell.reciprocal_angle_gamma ? +_cell.reciprocal_angle_alpha_esd ? +_cell.reciprocal_angle_beta_esd ? +_cell.reciprocal_angle_gamma_esd ? +_cell.reciprocal_length_a ? +_cell.reciprocal_length_b ? +_cell.reciprocal_length_c ? +_cell.reciprocal_length_a_esd ? +_cell.reciprocal_length_b_esd ? +_cell.reciprocal_length_c_esd ? +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 6JYF +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 5 +_symmetry.space_group_name_Hall ? +_symmetry.space_group_name_H-M 'C 1 2 1' +_symmetry.pdbx_full_space_group_name_H-M ? +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'Chloride pumping rhodopsin' 32913.434 1 ? ? ? ? +2 non-polymer syn RETINAL 284.436 1 ? ? ? ? +3 non-polymer syn 'CHLORIDE ION' 35.453 2 ? ? ? ? +4 non-polymer nat 'OLEIC ACID' 282.461 11 ? ? ? ? +5 water nat water 18.015 85 ? ? ? ? +# +_entity_poly.entity_id 1 +_entity_poly.type 'polypeptide(L)' +_entity_poly.nstd_linkage no +_entity_poly.nstd_monomer no +_entity_poly.pdbx_seq_one_letter_code +;MASMTGGQQMGRDPNSMKNIESLFDYSAGQFEFIDHLLTMGVGVHFAALIFFLVVSQFVAPKYRIATALSCIVMVSAGLI +LNSQAVMWTDAYAYVDGSYQLQDLTFSNGYRYVNWMATIPCLLLQLLIVLNLKGKELFSTATWLILAAWGMIITGYVGQL +YEVDDIAQLMIWGAVSTAFFVVMNWIVGTKIFKNRATMLGGTDSTITKVFWLMMFAWTLYPIAYLVPAFMNNADGVVLRQ +LLFTIADISSKVIYGLMITYIAIQQSAAAGYVPAQQALGRIGMDSKAALEHHHHHH +; +_entity_poly.pdbx_seq_one_letter_code_can +;MASMTGGQQMGRDPNSMKNIESLFDYSAGQFEFIDHLLTMGVGVHFAALIFFLVVSQFVAPKYRIATALSCIVMVSAGLI +LNSQAVMWTDAYAYVDGSYQLQDLTFSNGYRYVNWMATIPCLLLQLLIVLNLKGKELFSTATWLILAAWGMIITGYVGQL +YEVDDIAQLMIWGAVSTAFFVVMNWIVGTKIFKNRATMLGGTDSTITKVFWLMMFAWTLYPIAYLVPAFMNNADGVVLRQ +LLFTIADISSKVIYGLMITYIAIQQSAAAGYVPAQQALGRIGMDSKAALEHHHHHH +; +_entity_poly.pdbx_strand_id A +_entity_poly.pdbx_target_identifier ? +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MET n +1 2 ALA n +1 3 SER n +1 4 MET n +1 5 THR n +1 6 GLY n +1 7 GLY n +1 8 GLN n +1 9 GLN n +1 10 MET n +1 11 GLY n +1 12 ARG n +1 13 ASP n +1 14 PRO n +1 15 ASN n +1 16 SER n +1 17 MET n +1 18 LYS n +1 19 ASN n +1 20 ILE n +1 21 GLU n +1 22 SER n +1 23 LEU n +1 24 PHE n +1 25 ASP n +1 26 TYR n +1 27 SER n +1 28 ALA n +1 29 GLY n +1 30 GLN n +1 31 PHE n +1 32 GLU n +1 33 PHE n +1 34 ILE n +1 35 ASP n +1 36 HIS n +1 37 LEU n +1 38 LEU n +1 39 THR n +1 40 MET n +1 41 GLY n +1 42 VAL n +1 43 GLY n +1 44 VAL n +1 45 HIS n +1 46 PHE n +1 47 ALA n +1 48 ALA n +1 49 LEU n +1 50 ILE n +1 51 PHE n +1 52 PHE n +1 53 LEU n +1 54 VAL n +1 55 VAL n +1 56 SER n +1 57 GLN n +1 58 PHE n +1 59 VAL n +1 60 ALA n +1 61 PRO n +1 62 LYS n +1 63 TYR n +1 64 ARG n +1 65 ILE n +1 66 ALA n +1 67 THR n +1 68 ALA n +1 69 LEU n +1 70 SER n +1 71 CYS n +1 72 ILE n +1 73 VAL n +1 74 MET n +1 75 VAL n +1 76 SER n +1 77 ALA n +1 78 GLY n +1 79 LEU n +1 80 ILE n +1 81 LEU n +1 82 ASN n +1 83 SER n +1 84 GLN n +1 85 ALA n +1 86 VAL n +1 87 MET n +1 88 TRP n +1 89 THR n +1 90 ASP n +1 91 ALA n +1 92 TYR n +1 93 ALA n +1 94 TYR n +1 95 VAL n +1 96 ASP n +1 97 GLY n +1 98 SER n +1 99 TYR n +1 100 GLN n +1 101 LEU n +1 102 GLN n +1 103 ASP n +1 104 LEU n +1 105 THR n +1 106 PHE n +1 107 SER n +1 108 ASN n +1 109 GLY n +1 110 TYR n +1 111 ARG n +1 112 TYR n +1 113 VAL n +1 114 ASN n +1 115 TRP n +1 116 MET n +1 117 ALA n +1 118 THR n +1 119 ILE n +1 120 PRO n +1 121 CYS n +1 122 LEU n +1 123 LEU n +1 124 LEU n +1 125 GLN n +1 126 LEU n +1 127 LEU n +1 128 ILE n +1 129 VAL n +1 130 LEU n +1 131 ASN n +1 132 LEU n +1 133 LYS n +1 134 GLY n +1 135 LYS n +1 136 GLU n +1 137 LEU n +1 138 PHE n +1 139 SER n +1 140 THR n +1 141 ALA n +1 142 THR n +1 143 TRP n +1 144 LEU n +1 145 ILE n +1 146 LEU n +1 147 ALA n +1 148 ALA n +1 149 TRP n +1 150 GLY n +1 151 MET n +1 152 ILE n +1 153 ILE n +1 154 THR n +1 155 GLY n +1 156 TYR n +1 157 VAL n +1 158 GLY n +1 159 GLN n +1 160 LEU n +1 161 TYR n +1 162 GLU n +1 163 VAL n +1 164 ASP n +1 165 ASP n +1 166 ILE n +1 167 ALA n +1 168 GLN n +1 169 LEU n +1 170 MET n +1 171 ILE n +1 172 TRP n +1 173 GLY n +1 174 ALA n +1 175 VAL n +1 176 SER n +1 177 THR n +1 178 ALA n +1 179 PHE n +1 180 PHE n +1 181 VAL n +1 182 VAL n +1 183 MET n +1 184 ASN n +1 185 TRP n +1 186 ILE n +1 187 VAL n +1 188 GLY n +1 189 THR n +1 190 LYS n +1 191 ILE n +1 192 PHE n +1 193 LYS n +1 194 ASN n +1 195 ARG n +1 196 ALA n +1 197 THR n +1 198 MET n +1 199 LEU n +1 200 GLY n +1 201 GLY n +1 202 THR n +1 203 ASP n +1 204 SER n +1 205 THR n +1 206 ILE n +1 207 THR n +1 208 LYS n +1 209 VAL n +1 210 PHE n +1 211 TRP n +1 212 LEU n +1 213 MET n +1 214 MET n +1 215 PHE n +1 216 ALA n +1 217 TRP n +1 218 THR n +1 219 LEU n +1 220 TYR n +1 221 PRO n +1 222 ILE n +1 223 ALA n +1 224 TYR n +1 225 LEU n +1 226 VAL n +1 227 PRO n +1 228 ALA n +1 229 PHE n +1 230 MET n +1 231 ASN n +1 232 ASN n +1 233 ALA n +1 234 ASP n +1 235 GLY n +1 236 VAL n +1 237 VAL n +1 238 LEU n +1 239 ARG n +1 240 GLN n +1 241 LEU n +1 242 LEU n +1 243 PHE n +1 244 THR n +1 245 ILE n +1 246 ALA n +1 247 ASP n +1 248 ILE n +1 249 SER n +1 250 SER n +1 251 LYS n +1 252 VAL n +1 253 ILE n +1 254 TYR n +1 255 GLY n +1 256 LEU n +1 257 MET n +1 258 ILE n +1 259 THR n +1 260 TYR n +1 261 ILE n +1 262 ALA n +1 263 ILE n +1 264 GLN n +1 265 GLN n +1 266 SER n +1 267 ALA n +1 268 ALA n +1 269 ALA n +1 270 GLY n +1 271 TYR n +1 272 VAL n +1 273 PRO n +1 274 ALA n +1 275 GLN n +1 276 GLN n +1 277 ALA n +1 278 LEU n +1 279 GLY n +1 280 ARG n +1 281 ILE n +1 282 GLY n +1 283 MET n +1 284 ASP n +1 285 SER n +1 286 LYS n +1 287 ALA n +1 288 ALA n +1 289 LEU n +1 290 GLU n +1 291 HIS n +1 292 HIS n +1 293 HIS n +1 294 HIS n +1 295 HIS n +1 296 HIS n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type 'Biological sequence' +_entity_src_gen.pdbx_beg_seq_num 1 +_entity_src_gen.pdbx_end_seq_num 296 +_entity_src_gen.gene_src_common_name ? +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene 'ClR, NMS_1267' +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain S1-08 +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'Nonlabens marinus S1-08' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 1454201 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli BL21(DE3)' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain 'BL21(DE3)' +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type ? +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code W8VZW3_9FLAO +_struct_ref.pdbx_db_accession W8VZW3 +_struct_ref.pdbx_db_isoform ? +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code +;MKNIESLFDYSAGQFEFIDHLLTMGVGVHFAALIFFLVVSQFVAPKYRIATALSCIVMVSAGLILNSQAVMWTDAYAYVD +GSYQLQDLTFSNGYRYVNWMATIPCLLLQLLIVLNLKGKELFSTATWLILAAWGMIITGYVGQLYEVDDIAQLMIWGAVS +TAFFVVMNWIVGTKIFKNRATMLGGTDSTITKVFWLMMFAWTLYPIAYLVPAFMNNADGVVLRQLLFTIADISSKVIYGL +MITYIAIQQSAAAGYVPAQQALGRIGMDSKAA +; +_struct_ref.pdbx_align_begin 1 +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 6JYF +_struct_ref_seq.pdbx_strand_id A +_struct_ref_seq.seq_align_beg 17 +_struct_ref_seq.pdbx_seq_align_beg_ins_code ? +_struct_ref_seq.seq_align_end 288 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession W8VZW3 +_struct_ref_seq.db_align_beg 1 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 272 +_struct_ref_seq.pdbx_db_align_end_ins_code ? +_struct_ref_seq.pdbx_auth_seq_align_beg 1 +_struct_ref_seq.pdbx_auth_seq_align_end 272 +# +loop_ +_struct_ref_seq_dif.align_id +_struct_ref_seq_dif.pdbx_pdb_id_code +_struct_ref_seq_dif.mon_id +_struct_ref_seq_dif.pdbx_pdb_strand_id +_struct_ref_seq_dif.seq_num +_struct_ref_seq_dif.pdbx_pdb_ins_code +_struct_ref_seq_dif.pdbx_seq_db_name +_struct_ref_seq_dif.pdbx_seq_db_accession_code +_struct_ref_seq_dif.db_mon_id +_struct_ref_seq_dif.pdbx_seq_db_seq_num +_struct_ref_seq_dif.details +_struct_ref_seq_dif.pdbx_auth_seq_num +_struct_ref_seq_dif.pdbx_ordinal +1 6JYF MET A 1 ? UNP W8VZW3 ? ? 'expression tag' -15 1 +1 6JYF ALA A 2 ? UNP W8VZW3 ? ? 'expression tag' -14 2 +1 6JYF SER A 3 ? UNP W8VZW3 ? ? 'expression tag' -13 3 +1 6JYF MET A 4 ? UNP W8VZW3 ? ? 'expression tag' -12 4 +1 6JYF THR A 5 ? UNP W8VZW3 ? ? 'expression tag' -11 5 +1 6JYF GLY A 6 ? UNP W8VZW3 ? ? 'expression tag' -10 6 +1 6JYF GLY A 7 ? UNP W8VZW3 ? ? 'expression tag' -9 7 +1 6JYF GLN A 8 ? UNP W8VZW3 ? ? 'expression tag' -8 8 +1 6JYF GLN A 9 ? UNP W8VZW3 ? ? 'expression tag' -7 9 +1 6JYF MET A 10 ? UNP W8VZW3 ? ? 'expression tag' -6 10 +1 6JYF GLY A 11 ? UNP W8VZW3 ? ? 'expression tag' -5 11 +1 6JYF ARG A 12 ? UNP W8VZW3 ? ? 'expression tag' -4 12 +1 6JYF ASP A 13 ? UNP W8VZW3 ? ? 'expression tag' -3 13 +1 6JYF PRO A 14 ? UNP W8VZW3 ? ? 'expression tag' -2 14 +1 6JYF ASN A 15 ? UNP W8VZW3 ? ? 'expression tag' -1 15 +1 6JYF SER A 16 ? UNP W8VZW3 ? ? 'expression tag' 0 16 +1 6JYF LEU A 289 ? UNP W8VZW3 ? ? 'expression tag' 273 17 +1 6JYF GLU A 290 ? UNP W8VZW3 ? ? 'expression tag' 274 18 +1 6JYF HIS A 291 ? UNP W8VZW3 ? ? 'expression tag' 275 19 +1 6JYF HIS A 292 ? UNP W8VZW3 ? ? 'expression tag' 276 20 +1 6JYF HIS A 293 ? UNP W8VZW3 ? ? 'expression tag' 277 21 +1 6JYF HIS A 294 ? UNP W8VZW3 ? ? 'expression tag' 278 22 +1 6JYF HIS A 295 ? UNP W8VZW3 ? ? 'expression tag' 279 23 +1 6JYF HIS A 296 ? UNP W8VZW3 ? ? 'expression tag' 280 24 +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CL non-polymer . 'CHLORIDE ION' ? 'Cl -1' 35.453 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +OLA non-polymer . 'OLEIC ACID' ? 'C18 H34 O2' 282.461 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +RET non-polymer . RETINAL ? 'C20 H28 O' 284.436 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +_exptl.absorpt_coefficient_mu ? +_exptl.absorpt_correction_T_max ? +_exptl.absorpt_correction_T_min ? +_exptl.absorpt_correction_type ? +_exptl.absorpt_process_details ? +_exptl.entry_id 6JYF +_exptl.crystals_number 1 +_exptl.details ? +_exptl.method 'X-RAY DIFFRACTION' +_exptl.method_details ? +# +_exptl_crystal.colour ? +_exptl_crystal.density_diffrn ? +_exptl_crystal.density_Matthews 2.52 +_exptl_crystal.density_method ? +_exptl_crystal.density_percent_sol 51.10 +_exptl_crystal.description ? +_exptl_crystal.F_000 ? +_exptl_crystal.id 1 +_exptl_crystal.preparation ? +_exptl_crystal.size_max ? +_exptl_crystal.size_mid ? +_exptl_crystal.size_min ? +_exptl_crystal.size_rad ? +_exptl_crystal.colour_lustre ? +_exptl_crystal.colour_modifier ? +_exptl_crystal.colour_primary ? +_exptl_crystal.density_meas ? +_exptl_crystal.density_meas_esd ? +_exptl_crystal.density_meas_gt ? +_exptl_crystal.density_meas_lt ? +_exptl_crystal.density_meas_temp ? +_exptl_crystal.density_meas_temp_esd ? +_exptl_crystal.density_meas_temp_gt ? +_exptl_crystal.density_meas_temp_lt ? +_exptl_crystal.pdbx_crystal_image_url ? +_exptl_crystal.pdbx_crystal_image_format ? +_exptl_crystal.pdbx_mosaicity ? +_exptl_crystal.pdbx_mosaicity_esd ? +# +_exptl_crystal_grow.apparatus ? +_exptl_crystal_grow.atmosphere ? +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.details ? +_exptl_crystal_grow.method 'LIPIDIC CUBIC PHASE' +_exptl_crystal_grow.method_ref ? +_exptl_crystal_grow.pH ? +_exptl_crystal_grow.pressure ? +_exptl_crystal_grow.pressure_esd ? +_exptl_crystal_grow.seeding ? +_exptl_crystal_grow.seeding_ref ? +_exptl_crystal_grow.temp 293 +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.temp_esd ? +_exptl_crystal_grow.time ? +_exptl_crystal_grow.pdbx_details +'30% polyethylene glycol dimethyl ether 500, 0.15 M sodium chloride, 0.15M calcium chloride, and 0.1 M MES (pH 6.0) buffer' +_exptl_crystal_grow.pdbx_pH_range ? +# +_diffrn.ambient_environment ? +_diffrn.ambient_temp 140 +_diffrn.ambient_temp_details ? +_diffrn.ambient_temp_esd ? +_diffrn.crystal_id 1 +_diffrn.crystal_support ? +_diffrn.crystal_treatment ? +_diffrn.details ? +_diffrn.id 1 +_diffrn.ambient_pressure ? +_diffrn.ambient_pressure_esd ? +_diffrn.ambient_pressure_gt ? +_diffrn.ambient_pressure_lt ? +_diffrn.ambient_temp_gt ? +_diffrn.ambient_temp_lt ? +_diffrn.pdbx_serial_crystal_experiment N +# +_diffrn_detector.details ? +_diffrn_detector.detector CCD +_diffrn_detector.diffrn_id 1 +_diffrn_detector.type 'ADSC QUANTUM 270' +_diffrn_detector.area_resol_mean ? +_diffrn_detector.dtime ? +_diffrn_detector.pdbx_frames_total ? +_diffrn_detector.pdbx_collection_time_total ? +_diffrn_detector.pdbx_collection_date 2018-11-24 +_diffrn_detector.pdbx_frequency ? +# +_diffrn_radiation.collimation ? +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.filter_edge ? +_diffrn_radiation.inhomogeneity ? +_diffrn_radiation.monochromator ? +_diffrn_radiation.polarisn_norm ? +_diffrn_radiation.polarisn_ratio ? +_diffrn_radiation.probe ? +_diffrn_radiation.type ? +_diffrn_radiation.xray_symbol ? +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.pdbx_wavelength_list ? +_diffrn_radiation.pdbx_wavelength ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_analyzer ? +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.0 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.current ? +_diffrn_source.details ? +_diffrn_source.diffrn_id 1 +_diffrn_source.power ? +_diffrn_source.size ? +_diffrn_source.source SYNCHROTRON +_diffrn_source.target ? +_diffrn_source.type 'PHOTON FACTORY BEAMLINE AR-NW14A' +_diffrn_source.voltage ? +_diffrn_source.take-off_angle ? +_diffrn_source.pdbx_wavelength_list 1.0 +_diffrn_source.pdbx_wavelength ? +_diffrn_source.pdbx_synchrotron_beamline AR-NW14A +_diffrn_source.pdbx_synchrotron_site 'Photon Factory' +# +_reflns.B_iso_Wilson_estimate ? +_reflns.entry_id 6JYF +_reflns.data_reduction_details ? +_reflns.data_reduction_method ? +_reflns.d_resolution_high 2 +_reflns.d_resolution_low 34.1 +_reflns.details ? +_reflns.limit_h_max ? +_reflns.limit_h_min ? +_reflns.limit_k_max ? +_reflns.limit_k_min ? +_reflns.limit_l_max ? +_reflns.limit_l_min ? +_reflns.number_all ? +_reflns.number_obs 21264 +_reflns.observed_criterion ? +_reflns.observed_criterion_F_max ? +_reflns.observed_criterion_F_min ? +_reflns.observed_criterion_I_max ? +_reflns.observed_criterion_I_min ? +_reflns.observed_criterion_sigma_F ? +_reflns.observed_criterion_sigma_I ? +_reflns.percent_possible_obs 95.9 +_reflns.R_free_details ? +_reflns.Rmerge_F_all ? +_reflns.Rmerge_F_obs ? +_reflns.Friedel_coverage ? +_reflns.number_gt ? +_reflns.threshold_expression ? +_reflns.pdbx_redundancy 2.9 +_reflns.pdbx_Rmerge_I_obs ? +_reflns.pdbx_Rmerge_I_all ? +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_av_sigmaI ? +_reflns.pdbx_netI_over_sigmaI 13.8 +_reflns.pdbx_res_netI_over_av_sigmaI_2 ? +_reflns.pdbx_res_netI_over_sigmaI_2 ? +_reflns.pdbx_chi_squared ? +_reflns.pdbx_scaling_rejects ? +_reflns.pdbx_d_res_high_opt ? +_reflns.pdbx_d_res_low_opt ? +_reflns.pdbx_d_res_opt_method ? +_reflns.phase_calculation_details ? +_reflns.pdbx_Rrim_I_all ? +_reflns.pdbx_Rpim_I_all ? +_reflns.pdbx_d_opt ? +_reflns.pdbx_number_measured_all ? +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.pdbx_CC_half ? +_reflns.pdbx_R_split ? +# +_reflns_shell.d_res_high 2.0 +_reflns_shell.d_res_low 2.03 +_reflns_shell.meanI_over_sigI_all ? +_reflns_shell.meanI_over_sigI_obs ? +_reflns_shell.number_measured_all ? +_reflns_shell.number_measured_obs ? +_reflns_shell.number_possible ? +_reflns_shell.number_unique_all ? +_reflns_shell.number_unique_obs ? +_reflns_shell.percent_possible_all ? +_reflns_shell.percent_possible_obs ? +_reflns_shell.Rmerge_F_all ? +_reflns_shell.Rmerge_F_obs ? +_reflns_shell.Rmerge_I_all ? +_reflns_shell.Rmerge_I_obs ? +_reflns_shell.meanI_over_sigI_gt ? +_reflns_shell.meanI_over_uI_all ? +_reflns_shell.meanI_over_uI_gt ? +_reflns_shell.number_measured_gt ? +_reflns_shell.number_unique_gt ? +_reflns_shell.percent_possible_gt ? +_reflns_shell.Rmerge_F_gt ? +_reflns_shell.Rmerge_I_gt ? +_reflns_shell.pdbx_redundancy ? +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.pdbx_chi_squared ? +_reflns_shell.pdbx_netI_over_sigmaI_all ? +_reflns_shell.pdbx_netI_over_sigmaI_obs ? +_reflns_shell.pdbx_Rrim_I_all ? +_reflns_shell.pdbx_Rpim_I_all ? +_reflns_shell.pdbx_rejects ? +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_CC_half ? +_reflns_shell.pdbx_R_split ? +# +_refine.aniso_B[1][1] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[2][3] ? +_refine.aniso_B[3][3] ? +_refine.B_iso_max ? +_refine.B_iso_mean ? +_refine.B_iso_min ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.details ? +_refine.diff_density_max ? +_refine.diff_density_max_esd ? +_refine.diff_density_min ? +_refine.diff_density_min_esd ? +_refine.diff_density_rms ? +_refine.diff_density_rms_esd ? +_refine.entry_id 6JYF +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.ls_abs_structure_details ? +_refine.ls_abs_structure_Flack ? +_refine.ls_abs_structure_Flack_esd ? +_refine.ls_abs_structure_Rogers ? +_refine.ls_abs_structure_Rogers_esd ? +_refine.ls_d_res_high 2.004 +_refine.ls_d_res_low 34.072 +_refine.ls_extinction_coef ? +_refine.ls_extinction_coef_esd ? +_refine.ls_extinction_expression ? +_refine.ls_extinction_method ? +_refine.ls_goodness_of_fit_all ? +_refine.ls_goodness_of_fit_all_esd ? +_refine.ls_goodness_of_fit_obs ? +_refine.ls_goodness_of_fit_obs_esd ? +_refine.ls_hydrogen_treatment ? +_refine.ls_matrix_type ? +_refine.ls_number_constraints ? +_refine.ls_number_parameters ? +_refine.ls_number_reflns_all ? +_refine.ls_number_reflns_obs 21257 +_refine.ls_number_reflns_R_free 1093 +_refine.ls_number_reflns_R_work ? +_refine.ls_number_restraints ? +_refine.ls_percent_reflns_obs 95.73 +_refine.ls_percent_reflns_R_free 5.14 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_obs 0.1641 +_refine.ls_R_factor_R_free 0.2131 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_R_factor_R_work 0.1615 +_refine.ls_R_Fsqd_factor_obs ? +_refine.ls_R_I_factor_obs ? +_refine.ls_redundancy_reflns_all ? +_refine.ls_redundancy_reflns_obs ? +_refine.ls_restrained_S_all ? +_refine.ls_restrained_S_obs ? +_refine.ls_shift_over_esd_max ? +_refine.ls_shift_over_esd_mean ? +_refine.ls_structure_factor_coef ? +_refine.ls_weighting_details ? +_refine.ls_weighting_scheme ? +_refine.ls_wR_factor_all ? +_refine.ls_wR_factor_obs ? +_refine.ls_wR_factor_R_free ? +_refine.ls_wR_factor_R_work ? +_refine.occupancy_max ? +_refine.occupancy_min ? +_refine.solvent_model_details ? +_refine.solvent_model_param_bsol ? +_refine.solvent_model_param_ksol ? +_refine.ls_R_factor_gt ? +_refine.ls_goodness_of_fit_gt ? +_refine.ls_goodness_of_fit_ref ? +_refine.ls_shift_over_su_max ? +_refine.ls_shift_over_su_max_lt ? +_refine.ls_shift_over_su_mean ? +_refine.ls_shift_over_su_mean_lt ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 1.50 +_refine.pdbx_ls_sigma_Fsqd ? +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_starting_model 5ZTK +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_R_Free_selection_details ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.pdbx_solvent_vdw_probe_radii 1.11 +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii 0.90 +_refine.pdbx_real_space_R ? +_refine.pdbx_density_correlation ? +_refine.pdbx_pd_number_of_powder_patterns ? +_refine.pdbx_pd_number_of_points ? +_refine.pdbx_pd_meas_number_of_points ? +_refine.pdbx_pd_proc_ls_prof_R_factor ? +_refine.pdbx_pd_proc_ls_prof_wR_factor ? +_refine.pdbx_pd_Marquardt_correlation_coeff ? +_refine.pdbx_pd_Fsqrd_R_factor ? +_refine.pdbx_pd_ls_matrix_band_width ? +_refine.pdbx_overall_phase_error 19.29 +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.pdbx_diffrn_id 1 +_refine.overall_SU_B ? +_refine.overall_SU_ML 0.19 +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.overall_SU_R_free ? +_refine.overall_FOM_free_R_set ? +_refine.overall_FOM_work_R_set ? +_refine.pdbx_average_fsc_overall ? +_refine.pdbx_average_fsc_work ? +_refine.pdbx_average_fsc_free ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 2072 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 150 +_refine_hist.number_atoms_solvent 85 +_refine_hist.number_atoms_total 2307 +_refine_hist.d_res_high 2.004 +_refine_hist.d_res_low 34.072 +# +loop_ +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.criterion +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.number +_refine_ls_restr.rejects +_refine_ls_restr.type +_refine_ls_restr.weight +_refine_ls_restr.pdbx_restraint_function +'X-RAY DIFFRACTION' ? 0.003 ? 2262 ? f_bond_d ? ? +'X-RAY DIFFRACTION' ? 0.770 ? 3036 ? f_angle_d ? ? +'X-RAY DIFFRACTION' ? 12.311 ? 818 ? f_dihedral_angle_d ? ? +'X-RAY DIFFRACTION' ? 0.026 ? 342 ? f_chiral_restr ? ? +'X-RAY DIFFRACTION' ? 0.004 ? 362 ? f_plane_restr ? ? +# +loop_ +_refine_ls_shell.pdbx_refine_id +_refine_ls_shell.d_res_high +_refine_ls_shell.d_res_low +_refine_ls_shell.number_reflns_all +_refine_ls_shell.number_reflns_obs +_refine_ls_shell.number_reflns_R_free +_refine_ls_shell.number_reflns_R_work +_refine_ls_shell.percent_reflns_obs +_refine_ls_shell.percent_reflns_R_free +_refine_ls_shell.R_factor_all +_refine_ls_shell.R_factor_obs +_refine_ls_shell.R_factor_R_free +_refine_ls_shell.R_factor_R_free_error +_refine_ls_shell.R_factor_R_work +_refine_ls_shell.redundancy_reflns_all +_refine_ls_shell.redundancy_reflns_obs +_refine_ls_shell.wR_factor_all +_refine_ls_shell.wR_factor_obs +_refine_ls_shell.wR_factor_R_free +_refine_ls_shell.wR_factor_R_work +_refine_ls_shell.pdbx_total_number_of_bins_used +_refine_ls_shell.pdbx_phase_error +_refine_ls_shell.pdbx_fsc_work +_refine_ls_shell.pdbx_fsc_free +'X-RAY DIFFRACTION' 2.0041 2.0953 . . 140 2341 90.00 . . . 0.2695 . 0.2151 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.0953 2.2057 . . 128 2431 94.00 . . . 0.2398 . 0.1780 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.2057 2.3439 . . 137 2480 94.00 . . . 0.2180 . 0.1622 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.3439 2.5248 . . 138 2490 96.00 . . . 0.2177 . 0.1536 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.5248 2.7788 . . 113 2609 97.00 . . . 0.2104 . 0.1486 . . . . . . . . . . +'X-RAY DIFFRACTION' 2.7788 3.1806 . . 150 2548 98.00 . . . 0.2135 . 0.1581 . . . . . . . . . . +'X-RAY DIFFRACTION' 3.1806 4.0062 . . 147 2600 99.00 . . . 0.2026 . 0.1509 . . . . . . . . . . +'X-RAY DIFFRACTION' 4.0062 34.0768 . . 140 2665 98.00 . . . 0.1976 . 0.1630 . . . . . . . . . . +# +_struct.entry_id 6JYF +_struct.title +'Structure of light-state marine bacterial chloride importer, NM-R3, with Pulse laser (ND-1%) at 140K.' +_struct.pdbx_descriptor 'Chloride pumping rhodopsin' +_struct.pdbx_model_details ? +_struct.pdbx_formula_weight ? +_struct.pdbx_formula_weight_method ? +_struct.pdbx_model_type_details ? +_struct.pdbx_CASP_flag N +# +_struct_keywords.entry_id 6JYF +_struct_keywords.text 'Photo-excitation, Chloride pump, Retinal, MEMBRANE PROTEIN' +_struct_keywords.pdbx_keywords 'MEMBRANE PROTEIN' +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 3 ? +D N N 3 ? +E N N 4 ? +F N N 4 ? +G N N 4 ? +H N N 4 ? +I N N 4 ? +J N N 4 ? +K N N 4 ? +L N N 4 ? +M N N 4 ? +N N N 4 ? +O N N 4 ? +P N N 5 ? +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 AA1 ASN A 19 ? PHE A 24 ? ASN A 3 PHE A 8 5 ? 6 +HELX_P HELX_P2 AA2 SER A 27 ? SER A 56 ? SER A 11 SER A 40 1 ? 30 +HELX_P HELX_P3 AA3 GLN A 57 ? VAL A 59 ? GLN A 41 VAL A 43 5 ? 3 +HELX_P HELX_P4 AA4 TYR A 63 ? ALA A 91 ? TYR A 47 ALA A 75 1 ? 29 +HELX_P HELX_P5 AA5 ASN A 108 ? LEU A 130 ? ASN A 92 LEU A 114 1 ? 23 +HELX_P HELX_P6 AA6 LYS A 133 ? LEU A 160 ? LYS A 117 LEU A 144 1 ? 28 +HELX_P HELX_P7 AA7 ASP A 165 ? ARG A 195 ? ASP A 149 ARG A 179 1 ? 31 +HELX_P HELX_P8 AA8 ALA A 196 ? MET A 198 ? ALA A 180 MET A 182 5 ? 3 +HELX_P HELX_P9 AA9 GLY A 201 ? LEU A 225 ? GLY A 185 LEU A 209 1 ? 25 +HELX_P HELX_P10 AB1 LEU A 225 ? MET A 230 ? LEU A 209 MET A 214 1 ? 6 +HELX_P HELX_P11 AB2 ASN A 232 ? ALA A 269 ? ASN A 216 ALA A 253 1 ? 38 +HELX_P HELX_P12 AB3 TYR A 271 ? ILE A 281 ? TYR A 255 ILE A 265 1 ? 11 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +_struct_conn.id covale1 +_struct_conn.conn_type_id covale +_struct_conn.pdbx_leaving_atom_flag one +_struct_conn.pdbx_PDB_id ? +_struct_conn.ptnr1_label_asym_id A +_struct_conn.ptnr1_label_comp_id LYS +_struct_conn.ptnr1_label_seq_id 251 +_struct_conn.ptnr1_label_atom_id NZ +_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 1_555 +_struct_conn.ptnr2_label_asym_id B +_struct_conn.ptnr2_label_comp_id RET +_struct_conn.ptnr2_label_seq_id . +_struct_conn.ptnr2_label_atom_id C15 +_struct_conn.pdbx_ptnr2_label_alt_id ? +_struct_conn.pdbx_ptnr2_PDB_ins_code ? +_struct_conn.ptnr1_auth_asym_id A +_struct_conn.ptnr1_auth_comp_id LYS +_struct_conn.ptnr1_auth_seq_id 235 +_struct_conn.ptnr2_auth_asym_id A +_struct_conn.ptnr2_auth_comp_id RET +_struct_conn.ptnr2_auth_seq_id 301 +_struct_conn.ptnr2_symmetry 1_555 +_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 1.349 +_struct_conn.pdbx_value_order ? +# +_struct_conn_type.id covale +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +_struct_sheet.id AA1 +_struct_sheet.type ? +_struct_sheet.number_strands 2 +_struct_sheet.details ? +# +_struct_sheet_order.sheet_id AA1 +_struct_sheet_order.range_id_1 1 +_struct_sheet_order.range_id_2 2 +_struct_sheet_order.offset ? +_struct_sheet_order.sense anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA1 1 TYR A 92 ? VAL A 95 ? TYR A 76 VAL A 79 +AA1 2 SER A 98 ? LEU A 101 ? SER A 82 LEU A 85 +# +_pdbx_struct_sheet_hbond.sheet_id AA1 +_pdbx_struct_sheet_hbond.range_id_1 1 +_pdbx_struct_sheet_hbond.range_id_2 2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id N +_pdbx_struct_sheet_hbond.range_1_label_comp_id VAL +_pdbx_struct_sheet_hbond.range_1_label_asym_id A +_pdbx_struct_sheet_hbond.range_1_label_seq_id 95 +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code ? +_pdbx_struct_sheet_hbond.range_1_auth_atom_id N +_pdbx_struct_sheet_hbond.range_1_auth_comp_id VAL +_pdbx_struct_sheet_hbond.range_1_auth_asym_id A +_pdbx_struct_sheet_hbond.range_1_auth_seq_id 79 +_pdbx_struct_sheet_hbond.range_2_label_atom_id O +_pdbx_struct_sheet_hbond.range_2_label_comp_id SER +_pdbx_struct_sheet_hbond.range_2_label_asym_id A +_pdbx_struct_sheet_hbond.range_2_label_seq_id 98 +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code ? +_pdbx_struct_sheet_hbond.range_2_auth_atom_id O +_pdbx_struct_sheet_hbond.range_2_auth_comp_id SER +_pdbx_struct_sheet_hbond.range_2_auth_asym_id A +_pdbx_struct_sheet_hbond.range_2_auth_seq_id 82 +# +loop_ +_struct_site.id +_struct_site.pdbx_evidence_code +_struct_site.pdbx_auth_asym_id +_struct_site.pdbx_auth_comp_id +_struct_site.pdbx_auth_seq_id +_struct_site.pdbx_auth_ins_code +_struct_site.pdbx_num_residues +_struct_site.details +AC1 Software A RET 301 ? 11 'binding site for residue RET A 301' +AC2 Software A CL 302 ? 3 'binding site for residue CL A 302' +AC3 Software A CL 303 ? 3 'binding site for residue CL A 303' +AC4 Software A OLA 304 ? 5 'binding site for residue OLA A 304' +AC5 Software A OLA 305 ? 5 'binding site for residue OLA A 305' +AC6 Software A OLA 306 ? 6 'binding site for residue OLA A 306' +AC7 Software A OLA 307 ? 3 'binding site for residue OLA A 307' +AC8 Software A OLA 308 ? 1 'binding site for residue OLA A 308' +AC9 Software A OLA 309 ? 2 'binding site for residue OLA A 309' +AD1 Software A OLA 311 ? 2 'binding site for residue OLA A 311' +AD2 Software A OLA 312 ? 1 'binding site for residue OLA A 312' +AD3 Software A OLA 313 ? 2 'binding site for residue OLA A 313' +AD4 Software A OLA 314 ? 1 'binding site for residue OLA A 314' +# +loop_ +_struct_site_gen.id +_struct_site_gen.site_id +_struct_site_gen.pdbx_num_res +_struct_site_gen.label_comp_id +_struct_site_gen.label_asym_id +_struct_site_gen.label_seq_id +_struct_site_gen.pdbx_auth_ins_code +_struct_site_gen.auth_comp_id +_struct_site_gen.auth_asym_id +_struct_site_gen.auth_seq_id +_struct_site_gen.label_atom_id +_struct_site_gen.label_alt_id +_struct_site_gen.symmetry +_struct_site_gen.details +1 AC1 11 TRP A 115 ? TRP A 99 . ? 1_555 ? +2 AC1 11 ILE A 119 ? ILE A 103 . ? 1_555 ? +3 AC1 11 MET A 151 ? MET A 135 . ? 1_555 ? +4 AC1 11 GLY A 155 ? GLY A 139 . ? 1_555 ? +5 AC1 11 SER A 176 ? SER A 160 . ? 1_555 ? +6 AC1 11 PHE A 180 ? PHE A 164 . ? 1_555 ? +7 AC1 11 TRP A 217 ? TRP A 201 . ? 1_555 ? +8 AC1 11 TYR A 220 ? TYR A 204 . ? 1_555 ? +9 AC1 11 TYR A 224 ? TYR A 208 . ? 1_555 ? +10 AC1 11 SER A 250 ? SER A 234 . ? 1_555 ? +11 AC1 11 LYS A 251 ? LYS A 235 . ? 1_555 ? +12 AC2 3 ASN A 114 ? ASN A 98 . ? 1_555 ? +13 AC2 3 THR A 118 ? THR A 102 . ? 1_555 ? +14 AC2 3 LYS A 251 ? LYS A 235 . ? 1_555 ? +15 AC3 3 PRO A 61 ? PRO A 45 . ? 1_555 ? +16 AC3 3 LYS A 62 ? LYS A 46 . ? 1_555 ? +17 AC3 3 HOH P . ? HOH A 485 . ? 1_555 ? +18 AC4 5 GLN A 168 ? GLN A 152 . ? 1_555 ? +19 AC4 5 TRP A 172 ? TRP A 156 . ? 1_555 ? +20 AC4 5 VAL A 175 ? VAL A 159 . ? 1_555 ? +21 AC4 5 LYS A 208 ? LYS A 192 . ? 4_455 ? +22 AC4 5 TRP A 211 ? TRP A 195 . ? 4_455 ? +23 AC5 5 PHE A 33 ? PHE A 17 . ? 1_555 ? +24 AC5 5 VAL A 181 ? VAL A 165 . ? 4_445 ? +25 AC5 5 THR A 189 ? THR A 173 . ? 4_445 ? +26 AC5 5 LEU A 241 ? LEU A 225 . ? 1_555 ? +27 AC5 5 OLA H . ? OLA A 307 . ? 1_555 ? +28 AC6 6 MET A 170 ? MET A 154 . ? 4_445 ? +29 AC6 6 GLY A 173 ? GLY A 157 . ? 4_445 ? +30 AC6 6 THR A 177 ? THR A 161 . ? 4_445 ? +31 AC6 6 MET A 257 ? MET A 241 . ? 1_555 ? +32 AC6 6 TYR A 260 ? TYR A 244 . ? 1_555 ? +33 AC6 6 OLA L . ? OLA A 311 . ? 1_555 ? +34 AC7 3 PHE A 192 ? PHE A 176 . ? 4_445 ? +35 AC7 3 OLA F . ? OLA A 305 . ? 1_555 ? +36 AC7 3 HOH P . ? HOH A 449 . ? 1_555 ? +37 AC8 1 ASN A 82 ? ASN A 66 . ? 2_555 ? +38 AC9 2 PHE A 179 ? PHE A 163 . ? 4_445 ? +39 AC9 2 PHE A 215 ? PHE A 199 . ? 1_555 ? +40 AD1 2 PHE A 51 ? PHE A 35 . ? 1_555 ? +41 AD1 2 OLA G . ? OLA A 306 . ? 1_555 ? +42 AD2 1 TRP A 211 ? TRP A 195 . ? 1_555 ? +43 AD3 2 HOH P . ? HOH A 406 . ? 2_555 ? +44 AD3 2 HOH P . ? HOH A 460 . ? 1_555 ? +45 AD4 1 GLY A 150 ? GLY A 134 . ? 1_555 ? +# +_atom_sites.entry_id 6JYF +_atom_sites.fract_transf_matrix[1][1] 0.009716 +_atom_sites.fract_transf_matrix[1][2] 0.000000 +_atom_sites.fract_transf_matrix[1][3] 0.003533 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.020289 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.015318 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +CL +N +O +S +# +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_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . LYS A 1 18 ? -17.183 -16.380 22.725 1.00 34.42 ? 2 LYS A N 1 +ATOM 2 C CA . LYS A 1 18 ? -18.028 -15.596 21.833 1.00 41.12 ? 2 LYS A CA 1 +ATOM 3 C C . LYS A 1 18 ? -18.752 -16.485 20.823 1.00 32.33 ? 2 LYS A C 1 +ATOM 4 O O . LYS A 1 18 ? -19.707 -16.049 20.183 1.00 40.88 ? 2 LYS A O 1 +ATOM 5 C CB . LYS A 1 18 ? -17.200 -14.536 21.098 1.00 50.76 ? 2 LYS A CB 1 +ATOM 6 C CG . LYS A 1 18 ? -16.474 -13.568 22.018 1.00 77.01 ? 2 LYS A CG 1 +ATOM 7 C CD . LYS A 1 18 ? -17.446 -12.839 22.935 1.00 62.54 ? 2 LYS A CD 1 +ATOM 8 C CE . LYS A 1 18 ? -16.711 -11.946 23.926 1.00 51.83 ? 2 LYS A CE 1 +ATOM 9 N NZ . LYS A 1 18 ? -17.642 -11.284 24.889 1.00 43.85 ? 2 LYS A NZ 1 +ATOM 10 N N . ASN A 1 19 ? -18.290 -17.725 20.682 1.00 26.04 ? 3 ASN A N 1 +ATOM 11 C CA . ASN A 1 19 ? -18.894 -18.677 19.749 1.00 20.87 ? 3 ASN A CA 1 +ATOM 12 C C . ASN A 1 19 ? -19.851 -19.623 20.466 1.00 24.92 ? 3 ASN A C 1 +ATOM 13 O O . ASN A 1 19 ? -19.659 -19.916 21.645 1.00 22.82 ? 3 ASN A O 1 +ATOM 14 C CB . ASN A 1 19 ? -17.811 -19.478 19.031 1.00 41.28 ? 3 ASN A CB 1 +ATOM 15 C CG . ASN A 1 19 ? -16.921 -20.242 19.992 1.00 34.89 ? 3 ASN A CG 1 +ATOM 16 O OD1 . ASN A 1 19 ? -16.552 -19.734 21.051 1.00 57.74 ? 3 ASN A OD1 1 +ATOM 17 N ND2 . ASN A 1 19 ? -16.582 -21.474 19.633 1.00 69.68 ? 3 ASN A ND2 1 +ATOM 18 N N . ILE A 1 20 ? -20.872 -20.111 19.766 1.00 22.55 ? 4 ILE A N 1 +ATOM 19 C CA . ILE A 1 20 ? -21.881 -20.944 20.418 1.00 21.92 ? 4 ILE A CA 1 +ATOM 20 C C . ILE A 1 20 ? -21.328 -22.302 20.840 1.00 16.32 ? 4 ILE A C 1 +ATOM 21 O O . ILE A 1 20 ? -21.872 -22.938 21.742 1.00 21.24 ? 4 ILE A O 1 +ATOM 22 C CB . ILE A 1 20 ? -23.120 -21.173 19.526 1.00 24.14 ? 4 ILE A CB 1 +ATOM 23 C CG1 . ILE A 1 20 ? -22.756 -21.992 18.286 1.00 28.26 ? 4 ILE A CG1 1 +ATOM 24 C CG2 . ILE A 1 20 ? -23.755 -19.845 19.155 1.00 31.89 ? 4 ILE A CG2 1 +ATOM 25 C CD1 . ILE A 1 20 ? -23.956 -22.553 17.565 1.00 30.64 ? 4 ILE A CD1 1 +ATOM 26 N N . GLU A 1 21 ? -20.250 -22.740 20.194 1.00 20.55 ? 5 GLU A N 1 +ATOM 27 C CA . GLU A 1 21 ? -19.618 -24.004 20.553 1.00 19.20 ? 5 GLU A CA 1 +ATOM 28 C C . GLU A 1 21 ? -19.236 -24.020 22.032 1.00 22.91 ? 5 GLU A C 1 +ATOM 29 O O . GLU A 1 21 ? -19.365 -25.042 22.702 1.00 20.32 ? 5 GLU A O 1 +ATOM 30 C CB . GLU A 1 21 ? -18.382 -24.264 19.688 1.00 20.64 ? 5 GLU A CB 1 +ATOM 31 C CG . GLU A 1 21 ? -18.694 -24.671 18.253 1.00 28.00 ? 5 GLU A CG 1 +ATOM 32 C CD . GLU A 1 21 ? -18.962 -23.487 17.339 1.00 28.57 ? 5 GLU A CD 1 +ATOM 33 O OE1 . GLU A 1 21 ? -18.746 -22.335 17.770 1.00 22.98 ? 5 GLU A OE1 1 +ATOM 34 O OE2 . GLU A 1 21 ? -19.392 -23.708 16.186 1.00 29.51 ? 5 GLU A OE2 1 +ATOM 35 N N . SER A 1 22 ? -18.799 -22.874 22.541 1.00 19.69 ? 6 SER A N 1 +ATOM 36 C CA . SER A 1 22 ? -18.333 -22.774 23.921 1.00 25.48 ? 6 SER A CA 1 +ATOM 37 C C . SER A 1 22 ? -19.462 -22.890 24.946 1.00 26.30 ? 6 SER A C 1 +ATOM 38 O O . SER A 1 22 ? -19.206 -23.106 26.128 1.00 26.42 ? 6 SER A O 1 +ATOM 39 C CB . SER A 1 22 ? -17.589 -21.454 24.136 1.00 28.41 ? 6 SER A CB 1 +ATOM 40 O OG . SER A 1 22 ? -18.459 -20.347 23.964 1.00 30.02 ? 6 SER A OG 1 +ATOM 41 N N . LEU A 1 23 ? -20.707 -22.752 24.497 1.00 20.63 ? 7 LEU A N 1 +ATOM 42 C CA . LEU A 1 23 ? -21.844 -22.728 25.415 1.00 22.01 ? 7 LEU A CA 1 +ATOM 43 C C . LEU A 1 23 ? -22.243 -24.097 25.968 1.00 21.12 ? 7 LEU A C 1 +ATOM 44 O O . LEU A 1 23 ? -22.864 -24.180 27.023 1.00 22.04 ? 7 LEU A O 1 +ATOM 45 C CB . LEU A 1 23 ? -23.065 -22.104 24.728 1.00 23.66 ? 7 LEU A CB 1 +ATOM 46 C CG . LEU A 1 23 ? -22.932 -20.673 24.200 1.00 46.26 ? 7 LEU A CG 1 +ATOM 47 C CD1 . LEU A 1 23 ? -24.247 -20.205 23.588 1.00 28.66 ? 7 LEU A CD1 1 +ATOM 48 C CD2 . LEU A 1 23 ? -22.481 -19.727 25.302 1.00 30.10 ? 7 LEU A CD2 1 +ATOM 49 N N . PHE A 1 24 ? -21.899 -25.169 25.263 1.00 22.63 ? 8 PHE A N 1 +ATOM 50 C CA . PHE A 1 24 ? -22.474 -26.472 25.580 1.00 19.86 ? 8 PHE A CA 1 +ATOM 51 C C . PHE A 1 24 ? -21.466 -27.547 25.959 1.00 30.13 ? 8 PHE A C 1 +ATOM 52 O O . PHE A 1 24 ? -20.292 -27.484 25.595 1.00 21.36 ? 8 PHE A O 1 +ATOM 53 C CB . PHE A 1 24 ? -23.306 -26.965 24.392 1.00 16.83 ? 8 PHE A CB 1 +ATOM 54 C CG . PHE A 1 24 ? -24.168 -25.901 23.788 1.00 39.14 ? 8 PHE A CG 1 +ATOM 55 C CD1 . PHE A 1 24 ? -25.302 -25.456 24.448 1.00 21.13 ? 8 PHE A CD1 1 +ATOM 56 C CD2 . PHE A 1 24 ? -23.840 -25.335 22.567 1.00 24.12 ? 8 PHE A CD2 1 +ATOM 57 C CE1 . PHE A 1 24 ? -26.097 -24.465 23.898 1.00 26.74 ? 8 PHE A CE1 1 +ATOM 58 C CE2 . PHE A 1 24 ? -24.630 -24.346 22.012 1.00 20.93 ? 8 PHE A CE2 1 +ATOM 59 C CZ . PHE A 1 24 ? -25.756 -23.906 22.680 1.00 27.19 ? 8 PHE A CZ 1 +ATOM 60 N N . ASP A 1 25 ? -21.946 -28.526 26.718 1.00 22.47 ? 9 ASP A N 1 +ATOM 61 C CA . ASP A 1 25 ? -21.256 -29.793 26.879 1.00 23.21 ? 9 ASP A CA 1 +ATOM 62 C C . ASP A 1 25 ? -21.714 -30.678 25.737 1.00 22.32 ? 9 ASP A C 1 +ATOM 63 O O . ASP A 1 25 ? -22.793 -30.462 25.187 1.00 25.13 ? 9 ASP A O 1 +ATOM 64 C CB . ASP A 1 25 ? -21.576 -30.439 28.227 1.00 30.65 ? 9 ASP A CB 1 +ATOM 65 C CG . ASP A 1 25 ? -21.214 -29.552 29.400 1.00 19.87 ? 9 ASP A CG 1 +ATOM 66 O OD1 . ASP A 1 25 ? -20.291 -28.722 29.260 1.00 23.93 ? 9 ASP A OD1 1 +ATOM 67 O OD2 . ASP A 1 25 ? -21.849 -29.690 30.464 1.00 39.58 ? 9 ASP A OD2 1 +ATOM 68 N N . TYR A 1 26 ? -20.904 -31.666 25.372 1.00 14.17 ? 10 TYR A N 1 +ATOM 69 C CA . TYR A 1 26 ? -21.254 -32.545 24.263 1.00 13.78 ? 10 TYR A CA 1 +ATOM 70 C C . TYR A 1 26 ? -21.283 -33.995 24.710 1.00 18.69 ? 10 TYR A C 1 +ATOM 71 O O . TYR A 1 26 ? -20.464 -34.416 25.522 1.00 15.88 ? 10 TYR A O 1 +ATOM 72 C CB . TYR A 1 26 ? -20.272 -32.350 23.093 1.00 13.77 ? 10 TYR A CB 1 +ATOM 73 C CG . TYR A 1 26 ? -20.316 -30.935 22.575 1.00 16.13 ? 10 TYR A CG 1 +ATOM 74 C CD1 . TYR A 1 26 ? -21.265 -30.553 21.633 1.00 14.62 ? 10 TYR A CD1 1 +ATOM 75 C CD2 . TYR A 1 26 ? -19.453 -29.967 23.072 1.00 16.27 ? 10 TYR A CD2 1 +ATOM 76 C CE1 . TYR A 1 26 ? -21.336 -29.250 21.183 1.00 14.92 ? 10 TYR A CE1 1 +ATOM 77 C CE2 . TYR A 1 26 ? -19.514 -28.661 22.626 1.00 21.44 ? 10 TYR A CE2 1 +ATOM 78 C CZ . TYR A 1 26 ? -20.457 -28.310 21.681 1.00 23.73 ? 10 TYR A CZ 1 +ATOM 79 O OH . TYR A 1 26 ? -20.525 -27.013 21.239 1.00 18.70 ? 10 TYR A OH 1 +ATOM 80 N N . SER A 1 27 ? -22.246 -34.752 24.196 1.00 14.71 ? 11 SER A N 1 +ATOM 81 C CA . SER A 1 27 ? -22.278 -36.182 24.453 1.00 18.99 ? 11 SER A CA 1 +ATOM 82 C C . SER A 1 27 ? -21.095 -36.824 23.745 1.00 26.22 ? 11 SER A C 1 +ATOM 83 O O . SER A 1 27 ? -20.511 -36.226 22.843 1.00 17.77 ? 11 SER A O 1 +ATOM 84 C CB . SER A 1 27 ? -23.588 -36.798 23.968 1.00 25.75 ? 11 SER A CB 1 +ATOM 85 O OG . SER A 1 27 ? -23.676 -36.728 22.555 1.00 21.39 ? 11 SER A OG 1 +ATOM 86 N N . ALA A 1 28 ? -20.740 -38.036 24.154 1.00 21.90 ? 12 ALA A N 1 +ATOM 87 C CA . ALA A 1 28 ? -19.678 -38.772 23.483 1.00 33.21 ? 12 ALA A CA 1 +ATOM 88 C C . ALA A 1 28 ? -19.970 -38.890 21.984 1.00 36.65 ? 12 ALA A C 1 +ATOM 89 O O . ALA A 1 28 ? -19.079 -38.716 21.161 1.00 25.09 ? 12 ALA A O 1 +ATOM 90 C CB . ALA A 1 28 ? -19.508 -40.145 24.107 1.00 20.86 ? 12 ALA A CB 1 +ATOM 91 N N . GLY A 1 29 ? -21.229 -39.155 21.643 1.00 20.71 ? 13 GLY A N 1 +ATOM 92 C CA . GLY A 1 29 ? -21.645 -39.277 20.255 1.00 16.52 ? 13 GLY A CA 1 +ATOM 93 C C . GLY A 1 29 ? -21.457 -38.010 19.435 1.00 15.56 ? 13 GLY A C 1 +ATOM 94 O O . GLY A 1 29 ? -20.927 -38.057 18.325 1.00 22.99 ? 13 GLY A O 1 +ATOM 95 N N . GLN A 1 30 ? -21.895 -36.880 19.979 1.00 16.69 ? 14 GLN A N 1 +ATOM 96 C CA . GLN A 1 30 ? -21.751 -35.594 19.303 1.00 17.80 ? 14 GLN A CA 1 +ATOM 97 C C . GLN A 1 30 ? -20.278 -35.245 19.109 1.00 18.67 ? 14 GLN A C 1 +ATOM 98 O O . GLN A 1 30 ? -19.853 -34.855 18.016 1.00 14.80 ? 14 GLN A O 1 +ATOM 99 C CB . GLN A 1 30 ? -22.447 -34.484 20.100 1.00 13.81 ? 14 GLN A CB 1 +ATOM 100 C CG . GLN A 1 30 ? -23.974 -34.519 20.054 1.00 20.21 ? 14 GLN A CG 1 +ATOM 101 C CD . GLN A 1 30 ? -24.611 -33.586 21.071 1.00 27.57 ? 14 GLN A CD 1 +ATOM 102 O OE1 . GLN A 1 30 ? -24.069 -33.367 22.154 1.00 18.58 ? 14 GLN A OE1 1 +ATOM 103 N NE2 . GLN A 1 30 ? -25.766 -33.028 20.723 1.00 18.97 ? 14 GLN A NE2 1 +ATOM 104 N N . PHE A 1 31 ? -19.504 -35.389 20.180 1.00 15.81 ? 15 PHE A N 1 +ATOM 105 C CA . PHE A 1 31 ? -18.092 -35.037 20.158 1.00 28.24 ? 15 PHE A CA 1 +ATOM 106 C C . PHE A 1 31 ? -17.314 -35.865 19.147 1.00 22.39 ? 15 PHE A C 1 +ATOM 107 O O . PHE A 1 31 ? -16.498 -35.329 18.396 1.00 17.72 ? 15 PHE A O 1 +ATOM 108 C CB . PHE A 1 31 ? -17.471 -35.208 21.542 1.00 17.11 ? 15 PHE A CB 1 +ATOM 109 C CG . PHE A 1 31 ? -16.017 -34.866 21.588 1.00 15.75 ? 15 PHE A CG 1 +ATOM 110 C CD1 . PHE A 1 31 ? -15.610 -33.548 21.703 1.00 21.11 ? 15 PHE A CD1 1 +ATOM 111 C CD2 . PHE A 1 31 ? -15.054 -35.858 21.504 1.00 17.61 ? 15 PHE A CD2 1 +ATOM 112 C CE1 . PHE A 1 31 ? -14.270 -33.226 21.731 1.00 23.41 ? 15 PHE A CE1 1 +ATOM 113 C CE2 . PHE A 1 31 ? -13.715 -35.541 21.533 1.00 29.19 ? 15 PHE A CE2 1 +ATOM 114 C CZ . PHE A 1 31 ? -13.324 -34.220 21.650 1.00 18.60 ? 15 PHE A CZ 1 +ATOM 115 N N . GLU A 1 32 ? -17.569 -37.169 19.132 1.00 18.64 ? 16 GLU A N 1 +ATOM 116 C CA . GLU A 1 32 ? -16.843 -38.075 18.249 1.00 24.48 ? 16 GLU A CA 1 +ATOM 117 C C . GLU A 1 32 ? -17.251 -37.895 16.791 1.00 20.70 ? 16 GLU A C 1 +ATOM 118 O O . GLU A 1 32 ? -16.428 -38.048 15.889 1.00 23.64 ? 16 GLU A O 1 +ATOM 119 C CB . GLU A 1 32 ? -17.054 -39.527 18.679 1.00 20.83 ? 16 GLU A CB 1 +ATOM 120 C CG . GLU A 1 32 ? -16.348 -39.885 19.981 1.00 56.27 ? 16 GLU A CG 1 +ATOM 121 C CD . GLU A 1 32 ? -16.623 -41.309 20.427 1.00 86.66 ? 16 GLU A CD 1 +ATOM 122 O OE1 . GLU A 1 32 ? -17.221 -42.077 19.643 1.00 77.64 ? 16 GLU A OE1 1 +ATOM 123 O OE2 . GLU A 1 32 ? -16.242 -41.657 21.565 1.00 74.85 ? 16 GLU A OE2 1 +ATOM 124 N N . PHE A 1 33 ? -18.517 -37.560 16.558 1.00 22.16 ? 17 PHE A N 1 +ATOM 125 C CA . PHE A 1 33 ? -18.986 -37.356 15.193 1.00 13.84 ? 17 PHE A CA 1 +ATOM 126 C C . PHE A 1 33 ? -18.312 -36.140 14.566 1.00 14.25 ? 17 PHE A C 1 +ATOM 127 O O . PHE A 1 33 ? -17.898 -36.182 13.410 1.00 16.79 ? 17 PHE A O 1 +ATOM 128 C CB . PHE A 1 33 ? -20.505 -37.196 15.147 1.00 15.24 ? 17 PHE A CB 1 +ATOM 129 C CG . PHE A 1 33 ? -21.051 -37.039 13.752 1.00 26.23 ? 17 PHE A CG 1 +ATOM 130 C CD1 . PHE A 1 33 ? -20.772 -37.985 12.776 1.00 20.84 ? 17 PHE A CD1 1 +ATOM 131 C CD2 . PHE A 1 33 ? -21.841 -35.954 13.418 1.00 22.68 ? 17 PHE A CD2 1 +ATOM 132 C CE1 . PHE A 1 33 ? -21.269 -37.848 11.488 1.00 24.86 ? 17 PHE A CE1 1 +ATOM 133 C CE2 . PHE A 1 33 ? -22.345 -35.810 12.134 1.00 31.02 ? 17 PHE A CE2 1 +ATOM 134 C CZ . PHE A 1 33 ? -22.060 -36.760 11.167 1.00 21.25 ? 17 PHE A CZ 1 +ATOM 135 N N . ILE A 1 34 ? -18.195 -35.062 15.335 1.00 21.13 ? 18 ILE A N 1 +ATOM 136 C CA . ILE A 1 34 ? -17.534 -33.854 14.850 1.00 24.95 ? 18 ILE A CA 1 +ATOM 137 C C . ILE A 1 34 ? -16.046 -34.104 14.607 1.00 14.72 ? 18 ILE A C 1 +ATOM 138 O O . ILE A 1 34 ? -15.480 -33.624 13.623 1.00 17.92 ? 18 ILE A O 1 +ATOM 139 C CB . ILE A 1 34 ? -17.731 -32.687 15.832 1.00 17.24 ? 18 ILE A CB 1 +ATOM 140 C CG1 . ILE A 1 34 ? -19.175 -32.172 15.731 1.00 12.47 ? 18 ILE A CG1 1 +ATOM 141 C CG2 . ILE A 1 34 ? -16.737 -31.564 15.552 1.00 11.25 ? 18 ILE A CG2 1 +ATOM 142 C CD1 . ILE A 1 34 ? -19.493 -31.044 16.689 1.00 16.24 ? 18 ILE A CD1 1 +ATOM 143 N N . ASP A 1 35 ? -15.423 -34.879 15.488 1.00 12.91 ? 19 ASP A N 1 +ATOM 144 C CA . ASP A 1 35 ? -14.030 -35.272 15.301 1.00 18.43 ? 19 ASP A CA 1 +ATOM 145 C C . ASP A 1 35 ? -13.847 -36.069 14.007 1.00 24.10 ? 19 ASP A C 1 +ATOM 146 O O . ASP A 1 35 ? -12.900 -35.842 13.254 1.00 14.39 ? 19 ASP A O 1 +ATOM 147 C CB . ASP A 1 35 ? -13.542 -36.094 16.494 1.00 22.02 ? 19 ASP A CB 1 +ATOM 148 C CG . ASP A 1 35 ? -12.053 -36.385 16.431 1.00 23.86 ? 19 ASP A CG 1 +ATOM 149 O OD1 . ASP A 1 35 ? -11.275 -35.457 16.123 1.00 27.71 ? 19 ASP A OD1 1 +ATOM 150 O OD2 . ASP A 1 35 ? -11.665 -37.544 16.675 1.00 39.50 ? 19 ASP A OD2 1 +ATOM 151 N N . HIS A 1 36 ? -14.762 -37.000 13.756 1.00 12.18 ? 20 HIS A N 1 +ATOM 152 C CA . HIS A 1 36 ? -14.718 -37.826 12.547 1.00 23.42 ? 20 HIS A CA 1 +ATOM 153 C C . HIS A 1 36 ? -14.979 -37.014 11.284 1.00 21.28 ? 20 HIS A C 1 +ATOM 154 O O . HIS A 1 36 ? -14.345 -37.242 10.257 1.00 19.97 ? 20 HIS A O 1 +ATOM 155 C CB . HIS A 1 36 ? -15.733 -38.968 12.639 1.00 20.85 ? 20 HIS A CB 1 +ATOM 156 C CG . HIS A 1 36 ? -15.395 -39.992 13.679 1.00 58.86 ? 20 HIS A CG 1 +ATOM 157 N ND1 . HIS A 1 36 ? -16.335 -40.846 14.216 1.00 49.09 ? 20 HIS A ND1 1 +ATOM 158 C CD2 . HIS A 1 36 ? -14.221 -40.298 14.278 1.00 45.57 ? 20 HIS A CD2 1 +ATOM 159 C CE1 . HIS A 1 36 ? -15.753 -41.633 15.104 1.00 41.81 ? 20 HIS A CE1 1 +ATOM 160 N NE2 . HIS A 1 36 ? -14.472 -41.322 15.161 1.00 45.98 ? 20 HIS A NE2 1 +ATOM 161 N N . LEU A 1 37 ? -15.921 -36.077 11.360 1.00 14.73 ? 21 LEU A N 1 +ATOM 162 C CA . LEU A 1 37 ? -16.209 -35.199 10.230 1.00 19.39 ? 21 LEU A CA 1 +ATOM 163 C C . LEU A 1 37 ? -14.964 -34.435 9.799 1.00 17.49 ? 21 LEU A C 1 +ATOM 164 O O . LEU A 1 37 ? -14.637 -34.382 8.614 1.00 15.82 ? 21 LEU A O 1 +ATOM 165 C CB . LEU A 1 37 ? -17.322 -34.207 10.573 1.00 15.27 ? 21 LEU A CB 1 +ATOM 166 C CG . LEU A 1 37 ? -18.764 -34.702 10.475 1.00 30.65 ? 21 LEU A CG 1 +ATOM 167 C CD1 . LEU A 1 37 ? -19.728 -33.578 10.842 1.00 24.64 ? 21 LEU A CD1 1 +ATOM 168 C CD2 . LEU A 1 37 ? -19.050 -35.229 9.075 1.00 26.54 ? 21 LEU A CD2 1 +ATOM 169 N N . LEU A 1 38 ? -14.277 -33.846 10.773 1.00 17.48 ? 22 LEU A N 1 +ATOM 170 C CA . LEU A 1 38 ? -13.087 -33.044 10.499 1.00 15.53 ? 22 LEU A CA 1 +ATOM 171 C C . LEU A 1 38 ? -11.930 -33.907 10.000 1.00 19.17 ? 22 LEU A C 1 +ATOM 172 O O . LEU A 1 38 ? -11.239 -33.543 9.048 1.00 21.15 ? 22 LEU A O 1 +ATOM 173 C CB . LEU A 1 38 ? -12.672 -32.270 11.752 1.00 11.76 ? 22 LEU A CB 1 +ATOM 174 C CG . LEU A 1 38 ? -13.693 -31.245 12.257 1.00 20.05 ? 22 LEU A CG 1 +ATOM 175 C CD1 . LEU A 1 38 ? -13.302 -30.707 13.623 1.00 13.59 ? 22 LEU A CD1 1 +ATOM 176 C CD2 . LEU A 1 38 ? -13.854 -30.107 11.254 1.00 20.73 ? 22 LEU A CD2 1 +ATOM 177 N N . THR A 1 39 ? -11.725 -35.050 10.648 1.00 19.58 ? 23 THR A N 1 +ATOM 178 C CA . THR A 1 39 ? -10.681 -35.989 10.250 1.00 23.62 ? 23 THR A CA 1 +ATOM 179 C C . THR A 1 39 ? -10.909 -36.506 8.830 1.00 23.69 ? 23 THR A C 1 +ATOM 180 O O . THR A 1 39 ? -9.977 -36.562 8.030 1.00 23.68 ? 23 THR A O 1 +ATOM 181 C CB . THR A 1 39 ? -10.603 -37.185 11.222 1.00 27.32 ? 23 THR A CB 1 +ATOM 182 O OG1 . THR A 1 39 ? -10.354 -36.705 12.548 1.00 28.59 ? 23 THR A OG1 1 +ATOM 183 C CG2 . THR A 1 39 ? -9.483 -38.134 10.819 1.00 26.61 ? 23 THR A CG2 1 +ATOM 184 N N . MET A 1 40 ? -12.150 -36.879 8.523 1.00 19.54 ? 24 MET A N 1 +ATOM 185 C CA . MET A 1 40 ? -12.506 -37.331 7.181 1.00 22.24 ? 24 MET A CA 1 +ATOM 186 C C . MET A 1 40 ? -12.262 -36.235 6.151 1.00 18.49 ? 24 MET A C 1 +ATOM 187 O O . MET A 1 40 ? -11.790 -36.505 5.049 1.00 17.72 ? 24 MET A O 1 +ATOM 188 C CB . MET A 1 40 ? -13.970 -37.771 7.119 1.00 29.65 ? 24 MET A CB 1 +ATOM 189 C CG . MET A 1 40 ? -14.419 -38.207 5.730 1.00 33.23 ? 24 MET A CG 1 +ATOM 190 S SD . MET A 1 40 ? -16.212 -38.312 5.552 1.00 56.71 ? 24 MET A SD 1 +ATOM 191 C CE . MET A 1 40 ? -16.686 -36.592 5.703 1.00 33.47 ? 24 MET A CE 1 +ATOM 192 N N . GLY A 1 41 ? -12.604 -35.002 6.515 1.00 15.44 ? 25 GLY A N 1 +ATOM 193 C CA . GLY A 1 41 ? -12.359 -33.857 5.660 1.00 17.43 ? 25 GLY A CA 1 +ATOM 194 C C . GLY A 1 41 ? -10.887 -33.723 5.307 1.00 23.98 ? 25 GLY A C 1 +ATOM 195 O O . GLY A 1 41 ? -10.540 -33.407 4.174 1.00 20.11 ? 25 GLY A O 1 +ATOM 196 N N . VAL A 1 42 ? -10.020 -33.972 6.281 1.00 19.63 ? 26 VAL A N 1 +ATOM 197 C CA . VAL A 1 42 ? -8.579 -33.891 6.055 1.00 18.21 ? 26 VAL A CA 1 +ATOM 198 C C . VAL A 1 42 ? -8.133 -34.930 5.034 1.00 18.06 ? 26 VAL A C 1 +ATOM 199 O O . VAL A 1 42 ? -7.411 -34.617 4.090 1.00 20.88 ? 26 VAL A O 1 +ATOM 200 C CB . VAL A 1 42 ? -7.790 -34.088 7.363 1.00 23.04 ? 26 VAL A CB 1 +ATOM 201 C CG1 . VAL A 1 42 ? -6.297 -34.168 7.083 1.00 20.32 ? 26 VAL A CG1 1 +ATOM 202 C CG2 . VAL A 1 42 ? -8.090 -32.958 8.334 1.00 16.05 ? 26 VAL A CG2 1 +ATOM 203 N N . GLY A 1 43 ? -8.577 -36.168 5.232 1.00 15.42 ? 27 GLY A N 1 +ATOM 204 C CA . GLY A 1 43 ? -8.220 -37.262 4.351 1.00 25.45 ? 27 GLY A CA 1 +ATOM 205 C C . GLY A 1 43 ? -8.688 -37.055 2.924 1.00 18.03 ? 27 GLY A C 1 +ATOM 206 O O . GLY A 1 43 ? -7.953 -37.343 1.985 1.00 23.27 ? 27 GLY A O 1 +ATOM 207 N N . VAL A 1 44 ? -9.909 -36.554 2.758 1.00 20.74 ? 28 VAL A N 1 +ATOM 208 C CA . VAL A 1 44 ? -10.451 -36.311 1.422 1.00 17.75 ? 28 VAL A CA 1 +ATOM 209 C C . VAL A 1 44 ? -9.630 -35.270 0.660 1.00 19.29 ? 28 VAL A C 1 +ATOM 210 O O . VAL A 1 44 ? -9.330 -35.448 -0.521 1.00 20.57 ? 28 VAL A O 1 +ATOM 211 C CB . VAL A 1 44 ? -11.920 -35.851 1.481 1.00 16.37 ? 28 VAL A CB 1 +ATOM 212 C CG1 . VAL A 1 44 ? -12.383 -35.355 0.122 1.00 19.64 ? 28 VAL A CG1 1 +ATOM 213 C CG2 . VAL A 1 44 ? -12.812 -36.992 1.968 1.00 17.52 ? 28 VAL A CG2 1 +ATOM 214 N N . HIS A 1 45 ? -9.253 -34.190 1.336 1.00 12.57 ? 29 HIS A N 1 +ATOM 215 C CA . HIS A 1 45 ? -8.529 -33.115 0.664 1.00 14.87 ? 29 HIS A CA 1 +ATOM 216 C C . HIS A 1 45 ? -7.109 -33.526 0.282 1.00 19.01 ? 29 HIS A C 1 +ATOM 217 O O . HIS A 1 45 ? -6.649 -33.216 -0.815 1.00 17.84 ? 29 HIS A O 1 +ATOM 218 C CB . HIS A 1 45 ? -8.503 -31.855 1.535 1.00 12.55 ? 29 HIS A CB 1 +ATOM 219 C CG . HIS A 1 45 ? -9.807 -31.119 1.558 1.00 32.52 ? 29 HIS A CG 1 +ATOM 220 N ND1 . HIS A 1 45 ? -10.863 -31.497 2.359 1.00 29.76 ? 29 HIS A ND1 1 +ATOM 221 C CD2 . HIS A 1 45 ? -10.235 -30.040 0.858 1.00 26.84 ? 29 HIS A CD2 1 +ATOM 222 C CE1 . HIS A 1 45 ? -11.880 -30.677 2.162 1.00 31.38 ? 29 HIS A CE1 1 +ATOM 223 N NE2 . HIS A 1 45 ? -11.524 -29.784 1.255 1.00 21.00 ? 29 HIS A NE2 1 +ATOM 224 N N . PHE A 1 46 ? -6.416 -34.236 1.166 1.00 17.54 ? 30 PHE A N 1 +ATOM 225 C CA . PHE A 1 46 ? -5.048 -34.636 0.853 1.00 29.17 ? 30 PHE A CA 1 +ATOM 226 C C . PHE A 1 46 ? -5.018 -35.794 -0.140 1.00 28.28 ? 30 PHE A C 1 +ATOM 227 O O . PHE A 1 46 ? -4.062 -35.939 -0.899 1.00 21.16 ? 30 PHE A O 1 +ATOM 228 C CB . PHE A 1 46 ? -4.280 -34.982 2.129 1.00 20.05 ? 30 PHE A CB 1 +ATOM 229 C CG . PHE A 1 46 ? -3.761 -33.770 2.850 1.00 17.08 ? 30 PHE A CG 1 +ATOM 230 C CD1 . PHE A 1 46 ? -2.571 -33.175 2.458 1.00 25.62 ? 30 PHE A CD1 1 +ATOM 231 C CD2 . PHE A 1 46 ? -4.478 -33.203 3.887 1.00 16.11 ? 30 PHE A CD2 1 +ATOM 232 C CE1 . PHE A 1 46 ? -2.099 -32.048 3.102 1.00 22.51 ? 30 PHE A CE1 1 +ATOM 233 C CE2 . PHE A 1 46 ? -4.010 -32.080 4.537 1.00 21.97 ? 30 PHE A CE2 1 +ATOM 234 C CZ . PHE A 1 46 ? -2.819 -31.500 4.143 1.00 28.54 ? 30 PHE A CZ 1 +ATOM 235 N N . ALA A 1 47 ? -6.071 -36.605 -0.146 1.00 23.97 ? 31 ALA A N 1 +ATOM 236 C CA . ALA A 1 47 ? -6.219 -37.633 -1.171 1.00 27.90 ? 31 ALA A CA 1 +ATOM 237 C C . ALA A 1 47 ? -6.395 -36.980 -2.540 1.00 29.06 ? 31 ALA A C 1 +ATOM 238 O O . ALA A 1 47 ? -5.756 -37.378 -3.516 1.00 20.00 ? 31 ALA A O 1 +ATOM 239 C CB . ALA A 1 47 ? -7.392 -38.539 -0.859 1.00 19.49 ? 31 ALA A CB 1 +ATOM 240 N N . ALA A 1 48 ? -7.261 -35.972 -2.601 1.00 16.51 ? 32 ALA A N 1 +ATOM 241 C CA . ALA A 1 48 ? -7.505 -35.242 -3.843 1.00 20.55 ? 32 ALA A CA 1 +ATOM 242 C C . ALA A 1 48 ? -6.246 -34.511 -4.304 1.00 20.88 ? 32 ALA A C 1 +ATOM 243 O O . ALA A 1 48 ? -5.978 -34.415 -5.500 1.00 19.04 ? 32 ALA A O 1 +ATOM 244 C CB . ALA A 1 48 ? -8.657 -34.259 -3.665 1.00 12.37 ? 32 ALA A CB 1 +ATOM 245 N N . LEU A 1 49 ? -5.477 -34.008 -3.342 1.00 20.18 ? 33 LEU A N 1 +ATOM 246 C CA . LEU A 1 49 ? -4.220 -33.325 -3.626 1.00 21.57 ? 33 LEU A CA 1 +ATOM 247 C C . LEU A 1 49 ? -3.308 -34.180 -4.501 1.00 21.77 ? 33 LEU A C 1 +ATOM 248 O O . LEU A 1 49 ? -2.718 -33.691 -5.461 1.00 21.67 ? 33 LEU A O 1 +ATOM 249 C CB . LEU A 1 49 ? -3.501 -32.966 -2.324 1.00 18.53 ? 33 LEU A CB 1 +ATOM 250 C CG . LEU A 1 49 ? -2.036 -32.541 -2.452 1.00 23.44 ? 33 LEU A CG 1 +ATOM 251 C CD1 . LEU A 1 49 ? -1.909 -31.213 -3.179 1.00 23.77 ? 33 LEU A CD1 1 +ATOM 252 C CD2 . LEU A 1 49 ? -1.388 -32.466 -1.088 1.00 17.15 ? 33 LEU A CD2 1 +ATOM 253 N N . ILE A 1 50 ? -3.208 -35.461 -4.166 1.00 21.48 ? 34 ILE A N 1 +ATOM 254 C CA . ILE A 1 50 ? -2.357 -36.375 -4.914 1.00 27.92 ? 34 ILE A CA 1 +ATOM 255 C C . ILE A 1 50 ? -2.900 -36.583 -6.320 1.00 28.26 ? 34 ILE A C 1 +ATOM 256 O O . ILE A 1 50 ? -2.137 -36.688 -7.273 1.00 22.37 ? 34 ILE A O 1 +ATOM 257 C CB . ILE A 1 50 ? -2.223 -37.733 -4.208 1.00 24.65 ? 34 ILE A CB 1 +ATOM 258 C CG1 . ILE A 1 50 ? -1.721 -37.535 -2.777 1.00 22.08 ? 34 ILE A CG1 1 +ATOM 259 C CG2 . ILE A 1 50 ? -1.282 -38.645 -4.980 1.00 45.09 ? 34 ILE A CG2 1 +ATOM 260 C CD1 . ILE A 1 50 ? -0.409 -36.774 -2.683 1.00 31.16 ? 34 ILE A CD1 1 +ATOM 261 N N . PHE A 1 51 ? -4.222 -36.632 -6.451 1.00 19.48 ? 35 PHE A N 1 +ATOM 262 C CA . PHE A 1 51 ? -4.830 -36.753 -7.770 1.00 16.00 ? 35 PHE A CA 1 +ATOM 263 C C . PHE A 1 51 ? -4.510 -35.553 -8.654 1.00 16.51 ? 35 PHE A C 1 +ATOM 264 O O . PHE A 1 51 ? -4.119 -35.717 -9.812 1.00 16.75 ? 35 PHE A O 1 +ATOM 265 C CB . PHE A 1 51 ? -6.347 -36.912 -7.673 1.00 20.26 ? 35 PHE A CB 1 +ATOM 266 C CG . PHE A 1 51 ? -7.024 -36.969 -9.011 1.00 30.99 ? 35 PHE A CG 1 +ATOM 267 C CD1 . PHE A 1 51 ? -7.083 -38.159 -9.716 1.00 28.15 ? 35 PHE A CD1 1 +ATOM 268 C CD2 . PHE A 1 51 ? -7.582 -35.830 -9.575 1.00 19.79 ? 35 PHE A CD2 1 +ATOM 269 C CE1 . PHE A 1 51 ? -7.696 -38.216 -10.953 1.00 40.10 ? 35 PHE A CE1 1 +ATOM 270 C CE2 . PHE A 1 51 ? -8.193 -35.880 -10.809 1.00 24.68 ? 35 PHE A CE2 1 +ATOM 271 C CZ . PHE A 1 51 ? -8.253 -37.077 -11.499 1.00 35.81 ? 35 PHE A CZ 1 +ATOM 272 N N . PHE A 1 52 ? -4.703 -34.350 -8.119 1.00 16.79 ? 36 PHE A N 1 +ATOM 273 C CA . PHE A 1 52 ? -4.447 -33.134 -8.886 1.00 17.19 ? 36 PHE A CA 1 +ATOM 274 C C . PHE A 1 52 ? -2.976 -33.044 -9.277 1.00 27.70 ? 36 PHE A C 1 +ATOM 275 O O . PHE A 1 52 ? -2.643 -32.599 -10.378 1.00 16.74 ? 36 PHE A O 1 +ATOM 276 C CB . PHE A 1 52 ? -4.857 -31.885 -8.095 1.00 17.38 ? 36 PHE A CB 1 +ATOM 277 C CG . PHE A 1 52 ? -6.345 -31.740 -7.908 1.00 17.05 ? 36 PHE A CG 1 +ATOM 278 C CD1 . PHE A 1 52 ? -7.192 -31.673 -9.004 1.00 20.47 ? 36 PHE A CD1 1 +ATOM 279 C CD2 . PHE A 1 52 ? -6.893 -31.647 -6.639 1.00 22.57 ? 36 PHE A CD2 1 +ATOM 280 C CE1 . PHE A 1 52 ? -8.563 -31.533 -8.837 1.00 21.98 ? 36 PHE A CE1 1 +ATOM 281 C CE2 . PHE A 1 52 ? -8.263 -31.506 -6.464 1.00 19.15 ? 36 PHE A CE2 1 +ATOM 282 C CZ . PHE A 1 52 ? -9.098 -31.450 -7.566 1.00 17.94 ? 36 PHE A CZ 1 +ATOM 283 N N . LEU A 1 53 ? -2.099 -33.473 -8.371 1.00 19.76 ? 37 LEU A N 1 +ATOM 284 C CA . LEU A 1 53 ? -0.662 -33.440 -8.625 1.00 19.05 ? 37 LEU A CA 1 +ATOM 285 C C . LEU A 1 53 ? -0.296 -34.281 -9.843 1.00 18.43 ? 37 LEU A C 1 +ATOM 286 O O . LEU A 1 53 ? 0.377 -33.802 -10.753 1.00 25.90 ? 37 LEU A O 1 +ATOM 287 C CB . LEU A 1 53 ? 0.119 -33.926 -7.397 1.00 18.04 ? 37 LEU A CB 1 +ATOM 288 C CG . LEU A 1 53 ? 1.639 -34.055 -7.549 1.00 26.04 ? 37 LEU A CG 1 +ATOM 289 C CD1 . LEU A 1 53 ? 2.271 -32.704 -7.831 1.00 25.11 ? 37 LEU A CD1 1 +ATOM 290 C CD2 . LEU A 1 53 ? 2.263 -34.689 -6.310 1.00 32.29 ? 37 LEU A CD2 1 +ATOM 291 N N . VAL A 1 54 ? -0.757 -35.526 -9.870 1.00 14.48 ? 38 VAL A N 1 +ATOM 292 C CA . VAL A 1 54 ? -0.354 -36.443 -10.929 1.00 32.82 ? 38 VAL A CA 1 +ATOM 293 C C . VAL A 1 54 ? -1.006 -36.121 -12.280 1.00 22.56 ? 38 VAL A C 1 +ATOM 294 O O . VAL A 1 54 ? -0.435 -36.420 -13.323 1.00 26.07 ? 38 VAL A O 1 +ATOM 295 C CB . VAL A 1 54 ? -0.663 -37.909 -10.550 1.00 27.67 ? 38 VAL A CB 1 +ATOM 296 C CG1 . VAL A 1 54 ? 0.038 -38.275 -9.243 1.00 25.68 ? 38 VAL A CG1 1 +ATOM 297 C CG2 . VAL A 1 54 ? -2.158 -38.138 -10.431 1.00 71.35 ? 38 VAL A CG2 1 +ATOM 298 N N . VAL A 1 55 ? -2.186 -35.505 -12.265 1.00 18.69 ? 39 VAL A N 1 +ATOM 299 C CA . VAL A 1 55 ? -2.892 -35.195 -13.509 1.00 21.55 ? 39 VAL A CA 1 +ATOM 300 C C . VAL A 1 55 ? -2.380 -33.876 -14.117 1.00 9.36 ? 39 VAL A C 1 +ATOM 301 O O . VAL A 1 55 ? -2.574 -33.605 -15.303 1.00 15.20 ? 39 VAL A O 1 +ATOM 302 C CB . VAL A 1 55 ? -4.433 -35.150 -13.269 1.00 22.17 ? 39 VAL A CB 1 +ATOM 303 C CG1 . VAL A 1 55 ? -5.190 -34.671 -14.496 1.00 58.73 ? 39 VAL A CG1 1 +ATOM 304 C CG2 . VAL A 1 55 ? -4.934 -36.531 -12.870 1.00 25.59 ? 39 VAL A CG2 1 +ATOM 305 N N . SER A 1 56 ? -1.685 -33.076 -13.314 1.00 15.37 ? 40 SER A N 1 +ATOM 306 C CA . SER A 1 56 ? -1.187 -31.777 -13.776 1.00 20.37 ? 40 SER A CA 1 +ATOM 307 C C . SER A 1 56 ? -0.282 -31.874 -15.011 1.00 19.27 ? 40 SER A C 1 +ATOM 308 O O . SER A 1 56 ? -0.213 -30.943 -15.811 1.00 17.12 ? 40 SER A O 1 +ATOM 309 C CB . SER A 1 56 ? -0.438 -31.066 -12.645 1.00 16.82 ? 40 SER A CB 1 +ATOM 310 O OG . SER A 1 56 ? 0.669 -31.836 -12.208 1.00 26.49 ? 40 SER A OG 1 +ATOM 311 N N . GLN A 1 57 ? 0.399 -33.003 -15.172 1.00 16.97 ? 41 GLN A N 1 +ATOM 312 C CA . GLN A 1 57 ? 1.290 -33.201 -16.318 1.00 21.20 ? 41 GLN A CA 1 +ATOM 313 C C . GLN A 1 57 ? 0.523 -33.369 -17.628 1.00 26.47 ? 41 GLN A C 1 +ATOM 314 O O . GLN A 1 57 ? 1.115 -33.342 -18.709 1.00 22.23 ? 41 GLN A O 1 +ATOM 315 C CB . GLN A 1 57 ? 2.180 -34.424 -16.094 1.00 22.28 ? 41 GLN A CB 1 +ATOM 316 C CG . GLN A 1 57 ? 1.392 -35.719 -15.979 1.00 28.71 ? 41 GLN A CG 1 +ATOM 317 C CD . GLN A 1 57 ? 2.248 -36.886 -15.541 1.00 41.64 ? 41 GLN A CD 1 +ATOM 318 O OE1 . GLN A 1 57 ? 3.236 -37.226 -16.191 1.00 40.40 ? 41 GLN A OE1 1 +ATOM 319 N NE2 . GLN A 1 57 ? 1.876 -37.503 -14.424 1.00 31.09 ? 41 GLN A NE2 1 +ATOM 320 N N . PHE A 1 58 ? -0.790 -33.555 -17.532 1.00 16.48 ? 42 PHE A N 1 +ATOM 321 C CA . PHE A 1 58 ? -1.613 -33.729 -18.726 1.00 16.45 ? 42 PHE A CA 1 +ATOM 322 C C . PHE A 1 58 ? -2.335 -32.442 -19.096 1.00 25.05 ? 42 PHE A C 1 +ATOM 323 O O . PHE A 1 58 ? -3.167 -32.428 -19.998 1.00 26.86 ? 42 PHE A O 1 +ATOM 324 C CB . PHE A 1 58 ? -2.622 -34.863 -18.531 1.00 19.14 ? 42 PHE A CB 1 +ATOM 325 C CG . PHE A 1 58 ? -1.995 -36.163 -18.116 1.00 25.90 ? 42 PHE A CG 1 +ATOM 326 C CD1 . PHE A 1 58 ? -1.008 -36.747 -18.892 1.00 25.04 ? 42 PHE A CD1 1 +ATOM 327 C CD2 . PHE A 1 58 ? -2.397 -36.805 -16.957 1.00 32.26 ? 42 PHE A CD2 1 +ATOM 328 C CE1 . PHE A 1 58 ? -0.425 -37.943 -18.516 1.00 24.83 ? 42 PHE A CE1 1 +ATOM 329 C CE2 . PHE A 1 58 ? -1.821 -38.002 -16.576 1.00 30.74 ? 42 PHE A CE2 1 +ATOM 330 C CZ . PHE A 1 58 ? -0.835 -38.572 -17.354 1.00 28.17 ? 42 PHE A CZ 1 +ATOM 331 N N . VAL A 1 59 ? -2.007 -31.360 -18.399 1.00 19.71 ? 43 VAL A N 1 +ATOM 332 C CA . VAL A 1 59 ? -2.614 -30.060 -18.669 1.00 19.09 ? 43 VAL A CA 1 +ATOM 333 C C . VAL A 1 59 ? -1.669 -29.163 -19.464 1.00 13.55 ? 43 VAL A C 1 +ATOM 334 O O . VAL A 1 59 ? -0.484 -29.072 -19.148 1.00 15.91 ? 43 VAL A O 1 +ATOM 335 C CB . VAL A 1 59 ? -2.999 -29.337 -17.370 1.00 20.02 ? 43 VAL A CB 1 +ATOM 336 C CG1 . VAL A 1 59 ? -3.713 -28.037 -17.682 1.00 18.69 ? 43 VAL A CG1 1 +ATOM 337 C CG2 . VAL A 1 59 ? -3.870 -30.230 -16.502 1.00 19.60 ? 43 VAL A CG2 1 +ATOM 338 N N . ALA A 1 60 ? -2.195 -28.500 -20.490 1.00 18.92 ? 44 ALA A N 1 +ATOM 339 C CA . ALA A 1 60 ? -1.396 -27.568 -21.282 1.00 21.63 ? 44 ALA A CA 1 +ATOM 340 C C . ALA A 1 60 ? -0.905 -26.410 -20.412 1.00 26.16 ? 44 ALA A C 1 +ATOM 341 O O . ALA A 1 60 ? -1.550 -26.066 -19.420 1.00 20.51 ? 44 ALA A O 1 +ATOM 342 C CB . ALA A 1 60 ? -2.203 -27.050 -22.466 1.00 18.14 ? 44 ALA A CB 1 +ATOM 343 N N . PRO A 1 61 ? 0.246 -25.815 -20.776 1.00 20.93 ? 45 PRO A N 1 +ATOM 344 C CA . PRO A 1 61 ? 0.864 -24.739 -19.990 1.00 21.16 ? 45 PRO A CA 1 +ATOM 345 C C . PRO A 1 61 ? -0.076 -23.577 -19.683 1.00 21.59 ? 45 PRO A C 1 +ATOM 346 O O . PRO A 1 61 ? -0.009 -23.024 -18.589 1.00 27.39 ? 45 PRO A O 1 +ATOM 347 C CB . PRO A 1 61 ? 2.013 -24.270 -20.889 1.00 28.81 ? 45 PRO A CB 1 +ATOM 348 C CG . PRO A 1 61 ? 2.374 -25.475 -21.685 1.00 26.21 ? 45 PRO A CG 1 +ATOM 349 C CD . PRO A 1 61 ? 1.076 -26.190 -21.938 1.00 17.58 ? 45 PRO A CD 1 +ATOM 350 N N . LYS A 1 62 ? -0.944 -23.219 -20.625 1.00 24.42 ? 46 LYS A N 1 +ATOM 351 C CA . LYS A 1 62 ? -1.828 -22.076 -20.421 1.00 29.81 ? 46 LYS A CA 1 +ATOM 352 C C . LYS A 1 62 ? -2.913 -22.345 -19.373 1.00 19.38 ? 46 LYS A C 1 +ATOM 353 O O . LYS A 1 62 ? -3.503 -21.407 -18.846 1.00 18.73 ? 46 LYS A O 1 +ATOM 354 C CB . LYS A 1 62 ? -2.476 -21.652 -21.742 1.00 30.58 ? 46 LYS A CB 1 +ATOM 355 C CG . LYS A 1 62 ? -3.453 -22.657 -22.330 1.00 35.53 ? 46 LYS A CG 1 +ATOM 356 C CD . LYS A 1 62 ? -4.299 -22.013 -23.423 1.00 41.81 ? 46 LYS A CD 1 +ATOM 357 C CE . LYS A 1 62 ? -5.121 -20.859 -22.862 1.00 57.77 ? 46 LYS A CE 1 +ATOM 358 N NZ . LYS A 1 62 ? -5.957 -20.190 -23.897 1.00 50.64 ? 46 LYS A NZ 1 +ATOM 359 N N . TYR A 1 63 ? -3.168 -23.615 -19.062 1.00 15.32 ? 47 TYR A N 1 +ATOM 360 C CA . TYR A 1 63 ? -4.166 -23.961 -18.043 1.00 19.51 ? 47 TYR A CA 1 +ATOM 361 C C . TYR A 1 63 ? -3.574 -24.588 -16.778 1.00 27.85 ? 47 TYR A C 1 +ATOM 362 O O . TYR A 1 63 ? -4.288 -24.778 -15.793 1.00 25.24 ? 47 TYR A O 1 +ATOM 363 C CB . TYR A 1 63 ? -5.205 -24.936 -18.607 1.00 22.10 ? 47 TYR A CB 1 +ATOM 364 C CG . TYR A 1 63 ? -5.991 -24.435 -19.792 1.00 25.46 ? 47 TYR A CG 1 +ATOM 365 C CD1 . TYR A 1 63 ? -6.820 -23.326 -19.685 1.00 18.03 ? 47 TYR A CD1 1 +ATOM 366 C CD2 . TYR A 1 63 ? -5.920 -25.088 -21.017 1.00 20.20 ? 47 TYR A CD2 1 +ATOM 367 C CE1 . TYR A 1 63 ? -7.548 -22.874 -20.771 1.00 15.53 ? 47 TYR A CE1 1 +ATOM 368 C CE2 . TYR A 1 63 ? -6.644 -24.644 -22.107 1.00 25.98 ? 47 TYR A CE2 1 +ATOM 369 C CZ . TYR A 1 63 ? -7.457 -23.537 -21.979 1.00 16.96 ? 47 TYR A CZ 1 +ATOM 370 O OH . TYR A 1 63 ? -8.178 -23.094 -23.065 1.00 22.05 ? 47 TYR A OH 1 +ATOM 371 N N . ARG A 1 64 ? -2.284 -24.919 -16.803 1.00 25.97 ? 48 ARG A N 1 +ATOM 372 C CA . ARG A 1 64 ? -1.702 -25.780 -15.769 1.00 24.72 ? 48 ARG A CA 1 +ATOM 373 C C . ARG A 1 64 ? -1.778 -25.160 -14.374 1.00 27.42 ? 48 ARG A C 1 +ATOM 374 O O . ARG A 1 64 ? -1.850 -25.873 -13.374 1.00 29.02 ? 48 ARG A O 1 +ATOM 375 C CB . ARG A 1 64 ? -0.250 -26.121 -16.114 1.00 18.38 ? 48 ARG A CB 1 +ATOM 376 C CG . ARG A 1 64 ? 0.313 -27.310 -15.337 1.00 30.63 ? 48 ARG A CG 1 +ATOM 377 C CD . ARG A 1 64 ? 1.678 -27.738 -15.872 1.00 32.60 ? 48 ARG A CD 1 +ATOM 378 N NE . ARG A 1 64 ? 1.604 -28.193 -17.258 1.00 26.92 ? 48 ARG A NE 1 +ATOM 379 C CZ . ARG A 1 64 ? 2.460 -27.841 -18.211 1.00 26.65 ? 48 ARG A CZ 1 +ATOM 380 N NH1 . ARG A 1 64 ? 3.468 -27.025 -17.934 1.00 19.35 ? 48 ARG A NH1 1 +ATOM 381 N NH2 . ARG A 1 64 ? 2.308 -28.304 -19.444 1.00 18.13 ? 48 ARG A NH2 1 +ATOM 382 N N . ILE A 1 65 ? -1.776 -23.834 -14.314 1.00 16.36 ? 49 ILE A N 1 +ATOM 383 C CA . ILE A 1 65 ? -1.903 -23.124 -13.046 1.00 19.43 ? 49 ILE A CA 1 +ATOM 384 C C . ILE A 1 65 ? -3.294 -23.322 -12.414 1.00 27.98 ? 49 ILE A C 1 +ATOM 385 O O . ILE A 1 65 ? -3.447 -23.264 -11.195 1.00 21.50 ? 49 ILE A O 1 +ATOM 386 C CB . ILE A 1 65 ? -1.614 -21.620 -13.241 1.00 21.25 ? 49 ILE A CB 1 +ATOM 387 C CG1 . ILE A 1 65 ? -1.885 -20.831 -11.958 1.00 22.40 ? 49 ILE A CG1 1 +ATOM 388 C CG2 . ILE A 1 65 ? -2.414 -21.075 -14.412 1.00 60.12 ? 49 ILE A CG2 1 +ATOM 389 C CD1 . ILE A 1 65 ? -1.561 -19.359 -12.070 1.00 73.09 ? 49 ILE A CD1 1 +ATOM 390 N N . ALA A 1 66 ? -4.307 -23.571 -13.238 1.00 18.14 ? 50 ALA A N 1 +ATOM 391 C CA . ALA A 1 66 ? -5.637 -23.853 -12.710 1.00 25.84 ? 50 ALA A CA 1 +ATOM 392 C C . ALA A 1 66 ? -5.612 -25.131 -11.876 1.00 22.59 ? 50 ALA A C 1 +ATOM 393 O O . ALA A 1 66 ? -6.274 -25.225 -10.839 1.00 20.43 ? 50 ALA A O 1 +ATOM 394 C CB . ALA A 1 66 ? -6.659 -23.967 -13.839 1.00 26.04 ? 50 ALA A CB 1 +ATOM 395 N N . THR A 1 67 ? -4.833 -26.109 -12.324 1.00 21.70 ? 51 THR A N 1 +ATOM 396 C CA . THR A 1 67 ? -4.717 -27.375 -11.611 1.00 13.01 ? 51 THR A CA 1 +ATOM 397 C C . THR A 1 67 ? -3.806 -27.227 -10.395 1.00 14.82 ? 51 THR A C 1 +ATOM 398 O O . THR A 1 67 ? -4.038 -27.854 -9.359 1.00 19.10 ? 51 THR A O 1 +ATOM 399 C CB . THR A 1 67 ? -4.203 -28.491 -12.538 1.00 28.13 ? 51 THR A CB 1 +ATOM 400 O OG1 . THR A 1 67 ? -5.131 -28.669 -13.616 1.00 26.57 ? 51 THR A OG1 1 +ATOM 401 C CG2 . THR A 1 67 ? -4.068 -29.809 -11.781 1.00 25.38 ? 51 THR A CG2 1 +ATOM 402 N N . ALA A 1 68 ? -2.786 -26.379 -10.513 1.00 15.82 ? 52 ALA A N 1 +ATOM 403 C CA . ALA A 1 68 ? -1.895 -26.100 -9.389 1.00 19.37 ? 52 ALA A CA 1 +ATOM 404 C C . ALA A 1 68 ? -2.651 -25.424 -8.249 1.00 21.96 ? 52 ALA A C 1 +ATOM 405 O O . ALA A 1 68 ? -2.399 -25.701 -7.078 1.00 17.15 ? 52 ALA A O 1 +ATOM 406 C CB . ALA A 1 68 ? -0.722 -25.232 -9.830 1.00 14.10 ? 52 ALA A CB 1 +ATOM 407 N N . LEU A 1 69 ? -3.575 -24.533 -8.597 1.00 18.42 ? 53 LEU A N 1 +ATOM 408 C CA . LEU A 1 69 ? -4.376 -23.839 -7.592 1.00 15.56 ? 53 LEU A CA 1 +ATOM 409 C C . LEU A 1 69 ? -5.251 -24.822 -6.810 1.00 10.96 ? 53 LEU A C 1 +ATOM 410 O O . LEU A 1 69 ? -5.523 -24.619 -5.626 1.00 17.27 ? 53 LEU A O 1 +ATOM 411 C CB . LEU A 1 69 ? -5.233 -22.757 -8.248 1.00 15.37 ? 53 LEU A CB 1 +ATOM 412 C CG . LEU A 1 69 ? -4.459 -21.493 -8.641 1.00 21.26 ? 53 LEU A CG 1 +ATOM 413 C CD1 . LEU A 1 69 ? -5.277 -20.600 -9.563 1.00 17.27 ? 53 LEU A CD1 1 +ATOM 414 C CD2 . LEU A 1 69 ? -4.038 -20.729 -7.397 1.00 19.33 ? 53 LEU A CD2 1 +ATOM 415 N N . SER A 1 70 ? -5.678 -25.895 -7.466 1.00 12.55 ? 54 SER A N 1 +ATOM 416 C CA . SER A 1 70 ? -6.431 -26.927 -6.766 1.00 12.93 ? 54 SER A CA 1 +ATOM 417 C C . SER A 1 70 ? -5.551 -27.625 -5.735 1.00 23.26 ? 54 SER A C 1 +ATOM 418 O O . SER A 1 70 ? -6.020 -27.963 -4.653 1.00 20.30 ? 54 SER A O 1 +ATOM 419 C CB . SER A 1 70 ? -7.025 -27.940 -7.746 1.00 17.37 ? 54 SER A CB 1 +ATOM 420 O OG . SER A 1 70 ? -8.279 -27.488 -8.232 1.00 21.14 ? 54 SER A OG 1 +ATOM 421 N N . CYS A 1 71 ? -4.278 -27.831 -6.060 1.00 16.76 ? 55 CYS A N 1 +ATOM 422 C CA . CYS A 1 71 ? -3.343 -28.405 -5.092 1.00 14.80 ? 55 CYS A CA 1 +ATOM 423 C C . CYS A 1 71 ? -3.180 -27.475 -3.901 1.00 12.60 ? 55 CYS A C 1 +ATOM 424 O O . CYS A 1 71 ? -3.192 -27.910 -2.746 1.00 18.12 ? 55 CYS A O 1 +ATOM 425 C CB . CYS A 1 71 ? -1.982 -28.673 -5.734 1.00 18.31 ? 55 CYS A CB 1 +ATOM 426 S SG . CYS A 1 71 ? -1.989 -30.002 -6.943 1.00 22.08 ? 55 CYS A SG 1 +ATOM 427 N N . ILE A 1 72 ? -3.030 -26.189 -4.198 1.00 15.93 ? 56 ILE A N 1 +ATOM 428 C CA . ILE A 1 72 ? -2.895 -25.163 -3.175 1.00 17.17 ? 56 ILE A CA 1 +ATOM 429 C C . ILE A 1 72 ? -4.128 -25.115 -2.269 1.00 28.82 ? 56 ILE A C 1 +ATOM 430 O O . ILE A 1 72 ? -4.002 -25.011 -1.051 1.00 20.36 ? 56 ILE A O 1 +ATOM 431 C CB . ILE A 1 72 ? -2.653 -23.776 -3.815 1.00 22.70 ? 56 ILE A CB 1 +ATOM 432 C CG1 . ILE A 1 72 ? -1.266 -23.732 -4.466 1.00 22.73 ? 56 ILE A CG1 1 +ATOM 433 C CG2 . ILE A 1 72 ? -2.798 -22.667 -2.787 1.00 13.95 ? 56 ILE A CG2 1 +ATOM 434 C CD1 . ILE A 1 72 ? -0.967 -22.436 -5.193 1.00 35.73 ? 56 ILE A CD1 1 +ATOM 435 N N . VAL A 1 73 ? -5.314 -25.211 -2.859 1.00 14.21 ? 57 VAL A N 1 +ATOM 436 C CA . VAL A 1 73 ? -6.551 -25.190 -2.075 1.00 17.37 ? 57 VAL A CA 1 +ATOM 437 C C . VAL A 1 73 ? -6.684 -26.446 -1.212 1.00 16.54 ? 57 VAL A C 1 +ATOM 438 O O . VAL A 1 73 ? -7.140 -26.375 -0.069 1.00 15.86 ? 57 VAL A O 1 +ATOM 439 C CB . VAL A 1 73 ? -7.794 -25.053 -2.981 1.00 20.56 ? 57 VAL A CB 1 +ATOM 440 C CG1 . VAL A 1 73 ? -9.082 -25.329 -2.191 1.00 16.05 ? 57 VAL A CG1 1 +ATOM 441 C CG2 . VAL A 1 73 ? -7.839 -23.670 -3.602 1.00 21.67 ? 57 VAL A CG2 1 +ATOM 442 N N . MET A 1 74 ? -6.267 -27.589 -1.754 1.00 17.78 ? 58 MET A N 1 +ATOM 443 C CA . MET A 1 74 ? -6.356 -28.848 -1.021 1.00 17.78 ? 58 MET A CA 1 +ATOM 444 C C . MET A 1 74 ? -5.530 -28.807 0.264 1.00 13.34 ? 58 MET A C 1 +ATOM 445 O O . MET A 1 74 ? -5.986 -29.258 1.314 1.00 15.60 ? 58 MET A O 1 +ATOM 446 C CB . MET A 1 74 ? -5.905 -30.025 -1.893 1.00 14.77 ? 58 MET A CB 1 +ATOM 447 C CG . MET A 1 74 ? -6.870 -30.416 -3.018 1.00 14.32 ? 58 MET A CG 1 +ATOM 448 S SD . MET A 1 74 ? -8.566 -30.707 -2.469 1.00 19.33 ? 58 MET A SD 1 +ATOM 449 C CE . MET A 1 74 ? -9.381 -29.206 -3.020 1.00 16.09 ? 58 MET A CE 1 +ATOM 450 N N . VAL A 1 75 ? -4.314 -28.273 0.192 1.00 13.30 ? 59 VAL A N 1 +ATOM 451 C CA . VAL A 1 75 ? -3.461 -28.267 1.375 1.00 14.70 ? 59 VAL A CA 1 +ATOM 452 C C . VAL A 1 75 ? -3.951 -27.213 2.359 1.00 12.72 ? 59 VAL A C 1 +ATOM 453 O O . VAL A 1 75 ? -3.947 -27.436 3.568 1.00 15.67 ? 59 VAL A O 1 +ATOM 454 C CB . VAL A 1 75 ? -1.961 -28.032 1.019 1.00 16.16 ? 59 VAL A CB 1 +ATOM 455 C CG1 . VAL A 1 75 ? -1.767 -26.744 0.241 1.00 30.62 ? 59 VAL A CG1 1 +ATOM 456 C CG2 . VAL A 1 75 ? -1.104 -28.026 2.276 1.00 18.07 ? 59 VAL A CG2 1 +ATOM 457 N N . SER A 1 76 ? -4.395 -26.073 1.834 1.00 17.90 ? 60 SER A N 1 +ATOM 458 C CA . SER A 1 76 ? -4.887 -24.975 2.661 1.00 20.58 ? 60 SER A CA 1 +ATOM 459 C C . SER A 1 76 ? -6.124 -25.399 3.455 1.00 24.97 ? 60 SER A C 1 +ATOM 460 O O . SER A 1 76 ? -6.185 -25.233 4.677 1.00 19.77 ? 60 SER A O 1 +ATOM 461 C CB . SER A 1 76 ? -5.206 -23.756 1.787 1.00 20.18 ? 60 SER A CB 1 +ATOM 462 O OG . SER A 1 76 ? -5.615 -22.650 2.570 1.00 32.41 ? 60 SER A OG 1 +ATOM 463 N N . ALA A 1 77 ? -7.106 -25.952 2.751 1.00 13.23 ? 61 ALA A N 1 +ATOM 464 C CA . ALA A 1 77 ? -8.311 -26.468 3.393 1.00 13.32 ? 61 ALA A CA 1 +ATOM 465 C C . ALA A 1 77 ? -7.990 -27.655 4.300 1.00 19.28 ? 61 ALA A C 1 +ATOM 466 O O . ALA A 1 77 ? -8.541 -27.779 5.386 1.00 19.72 ? 61 ALA A O 1 +ATOM 467 C CB . ALA A 1 77 ? -9.334 -26.868 2.346 1.00 22.02 ? 61 ALA A CB 1 +ATOM 468 N N . GLY A 1 78 ? -7.105 -28.534 3.842 1.00 14.54 ? 62 GLY A N 1 +ATOM 469 C CA . GLY A 1 78 ? -6.695 -29.682 4.631 1.00 15.16 ? 62 GLY A CA 1 +ATOM 470 C C . GLY A 1 78 ? -6.021 -29.292 5.936 1.00 17.91 ? 62 GLY A C 1 +ATOM 471 O O . GLY A 1 78 ? -6.214 -29.942 6.961 1.00 16.68 ? 62 GLY A O 1 +ATOM 472 N N . LEU A 1 79 ? -5.232 -28.222 5.903 1.00 13.88 ? 63 LEU A N 1 +ATOM 473 C CA . LEU A 1 79 ? -4.550 -27.749 7.105 1.00 21.54 ? 63 LEU A CA 1 +ATOM 474 C C . LEU A 1 79 ? -5.512 -27.081 8.091 1.00 18.36 ? 63 LEU A C 1 +ATOM 475 O O . LEU A 1 79 ? -5.363 -27.222 9.306 1.00 12.59 ? 63 LEU A O 1 +ATOM 476 C CB . LEU A 1 79 ? -3.425 -26.780 6.734 1.00 14.29 ? 63 LEU A CB 1 +ATOM 477 C CG . LEU A 1 79 ? -2.150 -27.404 6.158 1.00 21.12 ? 63 LEU A CG 1 +ATOM 478 C CD1 . LEU A 1 79 ? -1.172 -26.316 5.746 1.00 16.26 ? 63 LEU A CD1 1 +ATOM 479 C CD2 . LEU A 1 79 ? -1.505 -28.355 7.157 1.00 14.58 ? 63 LEU A CD2 1 +ATOM 480 N N . ILE A 1 80 ? -6.496 -26.348 7.578 1.00 14.51 ? 64 ILE A N 1 +ATOM 481 C CA . ILE A 1 80 ? -7.439 -25.680 8.468 1.00 15.19 ? 64 ILE A CA 1 +ATOM 482 C C . ILE A 1 80 ? -8.355 -26.727 9.108 1.00 13.91 ? 64 ILE A C 1 +ATOM 483 O O . ILE A 1 80 ? -8.688 -26.624 10.284 1.00 16.30 ? 64 ILE A O 1 +ATOM 484 C CB . ILE A 1 80 ? -8.270 -24.575 7.743 1.00 21.11 ? 64 ILE A CB 1 +ATOM 485 C CG1 . ILE A 1 80 ? -8.985 -23.690 8.764 1.00 46.65 ? 64 ILE A CG1 1 +ATOM 486 C CG2 . ILE A 1 80 ? -9.280 -25.157 6.774 1.00 39.82 ? 64 ILE A CG2 1 +ATOM 487 C CD1 . ILE A 1 80 ? -8.041 -22.915 9.659 1.00 47.79 ? 64 ILE A CD1 1 +ATOM 488 N N . LEU A 1 81 ? -8.720 -27.758 8.353 1.00 12.29 ? 65 LEU A N 1 +ATOM 489 C CA . LEU A 1 81 ? -9.511 -28.851 8.905 1.00 12.31 ? 65 LEU A CA 1 +ATOM 490 C C . LEU A 1 81 ? -8.719 -29.629 9.956 1.00 19.02 ? 65 LEU A C 1 +ATOM 491 O O . LEU A 1 81 ? -9.255 -29.975 11.005 1.00 12.21 ? 65 LEU A O 1 +ATOM 492 C CB . LEU A 1 81 ? -9.977 -29.791 7.796 1.00 16.36 ? 65 LEU A CB 1 +ATOM 493 C CG . LEU A 1 81 ? -11.034 -29.212 6.851 1.00 19.83 ? 65 LEU A CG 1 +ATOM 494 C CD1 . LEU A 1 81 ? -11.450 -30.240 5.812 1.00 15.31 ? 65 LEU A CD1 1 +ATOM 495 C CD2 . LEU A 1 81 ? -12.226 -28.742 7.646 1.00 21.04 ? 65 LEU A CD2 1 +ATOM 496 N N . ASN A 1 82 ? -7.448 -29.905 9.661 1.00 11.43 ? 66 ASN A N 1 +ATOM 497 C CA . ASN A 1 82 ? -6.557 -30.575 10.608 1.00 13.55 ? 66 ASN A CA 1 +ATOM 498 C C . ASN A 1 82 ? -6.420 -29.769 11.889 1.00 18.41 ? 66 ASN A C 1 +ATOM 499 O O . ASN A 1 82 ? -6.492 -30.311 12.995 1.00 15.84 ? 66 ASN A O 1 +ATOM 500 C CB . ASN A 1 82 ? -5.177 -30.809 9.975 1.00 13.17 ? 66 ASN A CB 1 +ATOM 501 C CG . ASN A 1 82 ? -4.204 -31.483 10.925 1.00 26.41 ? 66 ASN A CG 1 +ATOM 502 O OD1 . ASN A 1 82 ? -4.331 -32.667 11.222 1.00 24.71 ? 66 ASN A OD1 1 +ATOM 503 N ND2 . ASN A 1 82 ? -3.217 -30.731 11.394 1.00 24.05 ? 66 ASN A ND2 1 +ATOM 504 N N . SER A 1 83 ? -6.236 -28.464 11.725 1.00 17.08 ? 67 SER A N 1 +ATOM 505 C CA . SER A 1 83 ? -6.120 -27.543 12.848 1.00 16.36 ? 67 SER A CA 1 +ATOM 506 C C . SER A 1 83 ? -7.392 -27.526 13.697 1.00 23.58 ? 67 SER A C 1 +ATOM 507 O O . SER A 1 83 ? -7.321 -27.540 14.922 1.00 19.05 ? 67 SER A O 1 +ATOM 508 C CB . SER A 1 83 ? -5.800 -26.131 12.343 1.00 21.14 ? 67 SER A CB 1 +ATOM 509 O OG . SER A 1 83 ? -5.679 -25.214 13.417 1.00 20.00 ? 67 SER A OG 1 +ATOM 510 N N . GLN A 1 84 ? -8.553 -27.495 13.045 1.00 13.41 ? 68 GLN A N 1 +ATOM 511 C CA . GLN A 1 84 ? -9.823 -27.526 13.763 1.00 17.21 ? 68 GLN A CA 1 +ATOM 512 C C . GLN A 1 84 ? -9.981 -28.821 14.557 1.00 16.69 ? 68 GLN A C 1 +ATOM 513 O O . GLN A 1 84 ? -10.489 -28.805 15.674 1.00 20.40 ? 68 GLN A O 1 +ATOM 514 C CB . GLN A 1 84 ? -11.007 -27.368 12.800 1.00 13.17 ? 68 GLN A CB 1 +ATOM 515 C CG . GLN A 1 84 ? -11.119 -26.007 12.128 1.00 16.82 ? 68 GLN A CG 1 +ATOM 516 C CD . GLN A 1 84 ? -11.461 -24.891 13.094 1.00 33.91 ? 68 GLN A CD 1 +ATOM 517 O OE1 . GLN A 1 84 ? -10.597 -24.108 13.491 1.00 29.08 ? 68 GLN A OE1 1 +ATOM 518 N NE2 . GLN A 1 84 ? -12.729 -24.803 13.468 1.00 24.39 ? 68 GLN A NE2 1 +ATOM 519 N N . ALA A 1 85 ? -9.554 -29.938 13.973 1.00 14.54 ? 69 ALA A N 1 +ATOM 520 C CA . ALA A 1 85 ? -9.717 -31.244 14.611 1.00 13.85 ? 69 ALA A CA 1 +ATOM 521 C C . ALA A 1 85 ? -8.883 -31.339 15.881 1.00 22.06 ? 69 ALA A C 1 +ATOM 522 O O . ALA A 1 85 ? -9.340 -31.852 16.900 1.00 15.55 ? 69 ALA A O 1 +ATOM 523 C CB . ALA A 1 85 ? -9.339 -32.363 13.646 1.00 11.64 ? 69 ALA A CB 1 +ATOM 524 N N . VAL A 1 86 ? -7.652 -30.843 15.813 1.00 11.75 ? 70 VAL A N 1 +ATOM 525 C CA . VAL A 1 86 ? -6.764 -30.882 16.968 1.00 14.36 ? 70 VAL A CA 1 +ATOM 526 C C . VAL A 1 86 ? -7.227 -29.879 18.017 1.00 15.19 ? 70 VAL A C 1 +ATOM 527 O O . VAL A 1 86 ? -7.137 -30.143 19.214 1.00 19.27 ? 70 VAL A O 1 +ATOM 528 C CB . VAL A 1 86 ? -5.306 -30.601 16.574 1.00 14.94 ? 70 VAL A CB 1 +ATOM 529 C CG1 . VAL A 1 86 ? -4.400 -30.713 17.792 1.00 25.01 ? 70 VAL A CG1 1 +ATOM 530 C CG2 . VAL A 1 86 ? -4.861 -31.578 15.499 1.00 18.12 ? 70 VAL A CG2 1 +ATOM 531 N N . MET A 1 87 ? -7.746 -28.739 17.562 1.00 12.12 ? 71 MET A N 1 +ATOM 532 C CA . MET A 1 87 ? -8.335 -27.749 18.464 1.00 19.79 ? 71 MET A CA 1 +ATOM 533 C C . MET A 1 87 ? -9.549 -28.321 19.197 1.00 32.69 ? 71 MET A C 1 +ATOM 534 O O . MET A 1 87 ? -9.787 -28.010 20.363 1.00 18.64 ? 71 MET A O 1 +ATOM 535 C CB . MET A 1 87 ? -8.746 -26.489 17.695 1.00 14.72 ? 71 MET A CB 1 +ATOM 536 C CG . MET A 1 87 ? -7.629 -25.487 17.479 1.00 25.88 ? 71 MET A CG 1 +ATOM 537 S SD . MET A 1 87 ? -8.137 -24.114 16.425 1.00 36.93 ? 71 MET A SD 1 +ATOM 538 C CE . MET A 1 87 ? -9.696 -23.663 17.181 1.00 16.95 ? 71 MET A CE 1 +ATOM 539 N N . TRP A 1 88 ? -10.314 -29.151 18.495 1.00 15.80 ? 72 TRP A N 1 +ATOM 540 C CA . TRP A 1 88 ? -11.512 -29.780 19.048 1.00 17.19 ? 72 TRP A CA 1 +ATOM 541 C C . TRP A 1 88 ? -11.136 -30.719 20.190 1.00 15.62 ? 72 TRP A C 1 +ATOM 542 O O . TRP A 1 88 ? -11.715 -30.656 21.273 1.00 18.11 ? 72 TRP A O 1 +ATOM 543 C CB . TRP A 1 88 ? -12.262 -30.531 17.939 1.00 18.59 ? 72 TRP A CB 1 +ATOM 544 C CG . TRP A 1 88 ? -13.581 -31.169 18.330 1.00 12.79 ? 72 TRP A CG 1 +ATOM 545 C CD1 . TRP A 1 88 ? -13.889 -32.501 18.292 1.00 16.07 ? 72 TRP A CD1 1 +ATOM 546 C CD2 . TRP A 1 88 ? -14.766 -30.499 18.782 1.00 10.85 ? 72 TRP A CD2 1 +ATOM 547 N NE1 . TRP A 1 88 ? -15.185 -32.701 18.700 1.00 13.91 ? 72 TRP A NE1 1 +ATOM 548 C CE2 . TRP A 1 88 ? -15.746 -31.489 19.007 1.00 19.90 ? 72 TRP A CE2 1 +ATOM 549 C CE3 . TRP A 1 88 ? -15.095 -29.159 19.019 1.00 14.23 ? 72 TRP A CE3 1 +ATOM 550 C CZ2 . TRP A 1 88 ? -17.031 -31.182 19.461 1.00 12.96 ? 72 TRP A CZ2 1 +ATOM 551 C CZ3 . TRP A 1 88 ? -16.369 -28.857 19.471 1.00 22.96 ? 72 TRP A CZ3 1 +ATOM 552 C CH2 . TRP A 1 88 ? -17.321 -29.864 19.688 1.00 23.30 ? 72 TRP A CH2 1 +ATOM 553 N N . THR A 1 89 ? -10.144 -31.571 19.949 1.00 13.47 ? 73 THR A N 1 +ATOM 554 C CA . THR A 1 89 ? -9.698 -32.527 20.958 1.00 16.24 ? 73 THR A CA 1 +ATOM 555 C C . THR A 1 89 ? -8.920 -31.855 22.098 1.00 24.14 ? 73 THR A C 1 +ATOM 556 O O . THR A 1 89 ? -8.952 -32.330 23.234 1.00 23.07 ? 73 THR A O 1 +ATOM 557 C CB . THR A 1 89 ? -8.837 -33.644 20.331 1.00 22.21 ? 73 THR A CB 1 +ATOM 558 O OG1 . THR A 1 89 ? -7.785 -33.067 19.547 1.00 29.70 ? 73 THR A OG1 1 +ATOM 559 C CG2 . THR A 1 89 ? -9.691 -34.527 19.439 1.00 22.62 ? 73 THR A CG2 1 +ATOM 560 N N . ASP A 1 90 ? -8.235 -30.751 21.803 1.00 19.92 ? 74 ASP A N 1 +ATOM 561 C CA . ASP A 1 90 ? -7.541 -29.983 22.840 1.00 18.40 ? 74 ASP A CA 1 +ATOM 562 C C . ASP A 1 90 ? -8.516 -29.332 23.819 1.00 23.71 ? 74 ASP A C 1 +ATOM 563 O O . ASP A 1 90 ? -8.291 -29.320 25.029 1.00 21.31 ? 74 ASP A O 1 +ATOM 564 C CB . ASP A 1 90 ? -6.663 -28.888 22.223 1.00 15.87 ? 74 ASP A CB 1 +ATOM 565 C CG . ASP A 1 90 ? -5.307 -29.400 21.763 1.00 28.03 ? 74 ASP A CG 1 +ATOM 566 O OD1 . ASP A 1 90 ? -4.934 -30.539 22.116 1.00 24.10 ? 74 ASP A OD1 1 +ATOM 567 O OD2 . ASP A 1 90 ? -4.607 -28.645 21.053 1.00 29.00 ? 74 ASP A OD2 1 +ATOM 568 N N . ALA A 1 91 ? -9.595 -28.776 23.284 1.00 16.72 ? 75 ALA A N 1 +ATOM 569 C CA . ALA A 1 91 ? -10.505 -27.957 24.076 1.00 13.60 ? 75 ALA A CA 1 +ATOM 570 C C . ALA A 1 91 ? -11.430 -28.772 24.972 1.00 19.08 ? 75 ALA A C 1 +ATOM 571 O O . ALA A 1 91 ? -11.908 -28.266 25.983 1.00 20.37 ? 75 ALA A O 1 +ATOM 572 C CB . ALA A 1 91 ? -11.334 -27.061 23.159 1.00 13.71 ? 75 ALA A CB 1 +ATOM 573 N N . TYR A 1 92 ? -11.702 -30.021 24.610 1.00 15.37 ? 76 TYR A N 1 +ATOM 574 C CA . TYR A 1 92 ? -12.700 -30.786 25.360 1.00 18.06 ? 76 TYR A CA 1 +ATOM 575 C C . TYR A 1 92 ? -12.162 -32.092 25.936 1.00 31.28 ? 76 TYR A C 1 +ATOM 576 O O . TYR A 1 92 ? -11.353 -32.781 25.313 1.00 22.15 ? 76 TYR A O 1 +ATOM 577 C CB . TYR A 1 92 ? -13.925 -31.066 24.480 1.00 13.95 ? 76 TYR A CB 1 +ATOM 578 C CG . TYR A 1 92 ? -14.719 -29.815 24.162 1.00 20.80 ? 76 TYR A CG 1 +ATOM 579 C CD1 . TYR A 1 92 ? -15.752 -29.392 24.991 1.00 13.50 ? 76 TYR A CD1 1 +ATOM 580 C CD2 . TYR A 1 92 ? -14.420 -29.048 23.042 1.00 22.23 ? 76 TYR A CD2 1 +ATOM 581 C CE1 . TYR A 1 92 ? -16.472 -28.237 24.709 1.00 9.45 ? 76 TYR A CE1 1 +ATOM 582 C CE2 . TYR A 1 92 ? -15.131 -27.898 22.748 1.00 22.35 ? 76 TYR A CE2 1 +ATOM 583 C CZ . TYR A 1 92 ? -16.152 -27.495 23.582 1.00 12.14 ? 76 TYR A CZ 1 +ATOM 584 O OH . TYR A 1 92 ? -16.850 -26.348 23.287 1.00 23.49 ? 76 TYR A OH 1 +ATOM 585 N N . ALA A 1 93 ? -12.620 -32.413 27.142 1.00 23.44 ? 77 ALA A N 1 +ATOM 586 C CA . ALA A 1 93 ? -12.248 -33.656 27.809 1.00 14.82 ? 77 ALA A CA 1 +ATOM 587 C C . ALA A 1 93 ? -13.481 -34.325 28.398 1.00 21.03 ? 77 ALA A C 1 +ATOM 588 O O . ALA A 1 93 ? -14.435 -33.653 28.791 1.00 12.65 ? 77 ALA A O 1 +ATOM 589 C CB . ALA A 1 93 ? -11.220 -33.398 28.901 1.00 13.85 ? 77 ALA A CB 1 +ATOM 590 N N . TYR A 1 94 ? -13.455 -35.649 28.473 1.00 14.38 ? 78 TYR A N 1 +ATOM 591 C CA . TYR A 1 94 ? -14.594 -36.381 29.010 1.00 22.11 ? 78 TYR A CA 1 +ATOM 592 C C . TYR A 1 94 ? -14.609 -36.272 30.527 1.00 20.68 ? 78 TYR A C 1 +ATOM 593 O O . TYR A 1 94 ? -13.767 -36.856 31.205 1.00 24.60 ? 78 TYR A O 1 +ATOM 594 C CB . TYR A 1 94 ? -14.559 -37.847 28.576 1.00 27.37 ? 78 TYR A CB 1 +ATOM 595 C CG . TYR A 1 94 ? -15.870 -38.565 28.800 1.00 26.16 ? 78 TYR A CG 1 +ATOM 596 C CD1 . TYR A 1 94 ? -16.970 -38.304 27.993 1.00 24.18 ? 78 TYR A CD1 1 +ATOM 597 C CD2 . TYR A 1 94 ? -16.009 -39.504 29.815 1.00 39.00 ? 78 TYR A CD2 1 +ATOM 598 C CE1 . TYR A 1 94 ? -18.172 -38.954 28.191 1.00 31.13 ? 78 TYR A CE1 1 +ATOM 599 C CE2 . TYR A 1 94 ? -17.209 -40.162 30.019 1.00 36.06 ? 78 TYR A CE2 1 +ATOM 600 C CZ . TYR A 1 94 ? -18.287 -39.883 29.204 1.00 28.99 ? 78 TYR A CZ 1 +ATOM 601 O OH . TYR A 1 94 ? -19.484 -40.533 29.401 1.00 66.58 ? 78 TYR A OH 1 +ATOM 602 N N . VAL A 1 95 ? -15.564 -35.505 31.048 1.00 16.43 ? 79 VAL A N 1 +ATOM 603 C CA . VAL A 1 95 ? -15.677 -35.268 32.482 1.00 14.89 ? 79 VAL A CA 1 +ATOM 604 C C . VAL A 1 95 ? -17.115 -35.451 32.968 1.00 21.26 ? 79 VAL A C 1 +ATOM 605 O O . VAL A 1 95 ? -18.032 -34.792 32.473 1.00 20.40 ? 79 VAL A O 1 +ATOM 606 C CB . VAL A 1 95 ? -15.214 -33.847 32.866 1.00 19.57 ? 79 VAL A CB 1 +ATOM 607 C CG1 . VAL A 1 95 ? -15.484 -33.587 34.344 1.00 20.89 ? 79 VAL A CG1 1 +ATOM 608 C CG2 . VAL A 1 95 ? -13.741 -33.648 32.540 1.00 23.38 ? 79 VAL A CG2 1 +ATOM 609 N N . ASP A 1 96 ? -17.295 -36.339 33.942 1.00 20.43 ? 80 ASP A N 1 +ATOM 610 C CA . ASP A 1 96 ? -18.603 -36.611 34.543 1.00 31.54 ? 80 ASP A CA 1 +ATOM 611 C C . ASP A 1 96 ? -19.682 -36.919 33.502 1.00 22.47 ? 80 ASP A C 1 +ATOM 612 O O . ASP A 1 96 ? -20.789 -36.384 33.566 1.00 27.45 ? 80 ASP A O 1 +ATOM 613 C CB . ASP A 1 96 ? -19.049 -35.432 35.415 1.00 25.30 ? 80 ASP A CB 1 +ATOM 614 C CG . ASP A 1 96 ? -18.110 -35.176 36.585 1.00 46.55 ? 80 ASP A CG 1 +ATOM 615 O OD1 . ASP A 1 96 ? -17.379 -36.107 36.986 1.00 35.88 ? 80 ASP A OD1 1 +ATOM 616 O OD2 . ASP A 1 96 ? -18.103 -34.040 37.105 1.00 40.32 ? 80 ASP A OD2 1 +ATOM 617 N N . GLY A 1 97 ? -19.352 -37.767 32.536 1.00 25.68 ? 81 GLY A N 1 +ATOM 618 C CA . GLY A 1 97 ? -20.343 -38.254 31.592 1.00 31.48 ? 81 GLY A CA 1 +ATOM 619 C C . GLY A 1 97 ? -20.529 -37.471 30.301 1.00 21.75 ? 81 GLY A C 1 +ATOM 620 O O . GLY A 1 97 ? -21.368 -37.836 29.479 1.00 37.17 ? 81 GLY A O 1 +ATOM 621 N N . SER A 1 98 ? -19.764 -36.400 30.112 1.00 28.99 ? 82 SER A N 1 +ATOM 622 C CA . SER A 1 98 ? -19.864 -35.617 28.880 1.00 19.27 ? 82 SER A CA 1 +ATOM 623 C C . SER A 1 98 ? -18.565 -34.879 28.569 1.00 18.93 ? 82 SER A C 1 +ATOM 624 O O . SER A 1 98 ? -17.725 -34.678 29.447 1.00 15.90 ? 82 SER A O 1 +ATOM 625 C CB . SER A 1 98 ? -21.021 -34.614 28.969 1.00 12.91 ? 82 SER A CB 1 +ATOM 626 O OG . SER A 1 98 ? -20.709 -33.532 29.830 1.00 25.49 ? 82 SER A OG 1 +ATOM 627 N N . TYR A 1 99 ? -18.404 -34.476 27.314 1.00 13.23 ? 83 TYR A N 1 +ATOM 628 C CA . TYR A 1 99 ? -17.239 -33.698 26.923 1.00 13.57 ? 83 TYR A CA 1 +ATOM 629 C C . TYR A 1 99 ? -17.447 -32.241 27.309 1.00 16.33 ? 83 TYR A C 1 +ATOM 630 O O . TYR A 1 99 ? -18.415 -31.606 26.887 1.00 18.74 ? 83 TYR A O 1 +ATOM 631 C CB . TYR A 1 99 ? -16.966 -33.852 25.423 1.00 10.56 ? 83 TYR A CB 1 +ATOM 632 C CG . TYR A 1 99 ? -16.253 -35.152 25.118 1.00 18.01 ? 83 TYR A CG 1 +ATOM 633 C CD1 . TYR A 1 99 ? -14.865 -35.230 25.168 1.00 12.82 ? 83 TYR A CD1 1 +ATOM 634 C CD2 . TYR A 1 99 ? -16.966 -36.307 24.826 1.00 17.11 ? 83 TYR A CD2 1 +ATOM 635 C CE1 . TYR A 1 99 ? -14.207 -36.418 24.912 1.00 19.34 ? 83 TYR A CE1 1 +ATOM 636 C CE2 . TYR A 1 99 ? -16.315 -37.502 24.568 1.00 16.40 ? 83 TYR A CE2 1 +ATOM 637 C CZ . TYR A 1 99 ? -14.937 -37.549 24.614 1.00 23.94 ? 83 TYR A CZ 1 +ATOM 638 O OH . TYR A 1 99 ? -14.287 -38.732 24.364 1.00 22.71 ? 83 TYR A OH 1 +ATOM 639 N N . GLN A 1 100 ? -16.547 -31.728 28.142 1.00 22.56 ? 84 GLN A N 1 +ATOM 640 C CA . GLN A 1 100 ? -16.670 -30.371 28.661 1.00 12.76 ? 84 GLN A CA 1 +ATOM 641 C C . GLN A 1 100 ? -15.448 -29.529 28.336 1.00 17.17 ? 84 GLN A C 1 +ATOM 642 O O . GLN A 1 100 ? -14.326 -30.034 28.268 1.00 17.68 ? 84 GLN A O 1 +ATOM 643 C CB . GLN A 1 100 ? -16.895 -30.392 30.172 1.00 14.73 ? 84 GLN A CB 1 +ATOM 644 C CG . GLN A 1 100 ? -18.061 -31.265 30.604 1.00 18.03 ? 84 GLN A CG 1 +ATOM 645 C CD . GLN A 1 100 ? -18.405 -31.080 32.072 1.00 24.52 ? 84 GLN A CD 1 +ATOM 646 O OE1 . GLN A 1 100 ? -18.451 -29.958 32.569 1.00 29.55 ? 84 GLN A OE1 1 +ATOM 647 N NE2 . GLN A 1 100 ? -18.637 -32.185 32.773 1.00 20.94 ? 84 GLN A NE2 1 +ATOM 648 N N . LEU A 1 101 ? -15.683 -28.236 28.152 1.00 17.91 ? 85 LEU A N 1 +ATOM 649 C CA . LEU A 1 101 ? -14.641 -27.302 27.768 1.00 23.10 ? 85 LEU A CA 1 +ATOM 650 C C . LEU A 1 101 ? -13.560 -27.229 28.842 1.00 20.14 ? 85 LEU A C 1 +ATOM 651 O O . LEU A 1 101 ? -13.854 -27.161 30.033 1.00 23.09 ? 85 LEU A O 1 +ATOM 652 C CB . LEU A 1 101 ? -15.245 -25.920 27.510 1.00 27.31 ? 85 LEU A CB 1 +ATOM 653 C CG . LEU A 1 101 ? -14.349 -24.857 26.873 1.00 29.18 ? 85 LEU A CG 1 +ATOM 654 C CD1 . LEU A 1 101 ? -13.816 -25.345 25.546 1.00 27.40 ? 85 LEU A CD1 1 +ATOM 655 C CD2 . LEU A 1 101 ? -15.128 -23.567 26.694 1.00 36.38 ? 85 LEU A CD2 1 +ATOM 656 N N . GLN A 1 102 ? -12.306 -27.277 28.413 1.00 18.05 ? 86 GLN A N 1 +ATOM 657 C CA . GLN A 1 102 ? -11.186 -27.191 29.338 1.00 21.13 ? 86 GLN A CA 1 +ATOM 658 C C . GLN A 1 102 ? -10.558 -25.801 29.292 1.00 24.56 ? 86 GLN A C 1 +ATOM 659 O O . GLN A 1 102 ? -11.255 -24.797 29.440 1.00 31.00 ? 86 GLN A O 1 +ATOM 660 C CB . GLN A 1 102 ? -10.155 -28.273 29.022 1.00 20.08 ? 86 GLN A CB 1 +ATOM 661 C CG . GLN A 1 102 ? -10.703 -29.684 29.206 1.00 15.77 ? 86 GLN A CG 1 +ATOM 662 C CD . GLN A 1 102 ? -11.191 -29.936 30.624 1.00 26.83 ? 86 GLN A CD 1 +ATOM 663 O OE1 . GLN A 1 102 ? -10.400 -29.969 31.565 1.00 17.30 ? 86 GLN A OE1 1 +ATOM 664 N NE2 . GLN A 1 102 ? -12.501 -30.110 30.783 1.00 15.12 ? 86 GLN A NE2 1 +ATOM 665 N N . ASP A 1 103 ? -9.247 -25.746 29.086 1.00 29.88 ? 87 ASP A N 1 +ATOM 666 C CA . ASP A 1 103 ? -8.522 -24.480 29.098 1.00 39.05 ? 87 ASP A CA 1 +ATOM 667 C C . ASP A 1 103 ? -8.419 -23.865 27.706 1.00 54.70 ? 87 ASP A C 1 +ATOM 668 O O . ASP A 1 103 ? -8.588 -22.657 27.535 1.00 35.23 ? 87 ASP A O 1 +ATOM 669 C CB . ASP A 1 103 ? -7.124 -24.680 29.683 1.00 38.20 ? 87 ASP A CB 1 +ATOM 670 C CG . ASP A 1 103 ? -7.158 -25.160 31.119 1.00 53.64 ? 87 ASP A CG 1 +ATOM 671 O OD1 . ASP A 1 103 ? -8.062 -24.731 31.868 1.00 58.31 ? 87 ASP A OD1 1 +ATOM 672 O OD2 . ASP A 1 103 ? -6.287 -25.971 31.497 1.00 89.15 ? 87 ASP A OD2 1 +ATOM 673 N N . LEU A 1 104 ? -8.132 -24.702 26.716 1.00 38.61 ? 88 LEU A N 1 +ATOM 674 C CA . LEU A 1 104 ? -8.025 -24.243 25.337 1.00 35.88 ? 88 LEU A CA 1 +ATOM 675 C C . LEU A 1 104 ? -9.404 -24.050 24.719 1.00 64.70 ? 88 LEU A C 1 +ATOM 676 O O . LEU A 1 104 ? -10.394 -24.597 25.203 1.00 58.01 ? 88 LEU A O 1 +ATOM 677 C CB . LEU A 1 104 ? -7.202 -25.230 24.511 1.00 23.60 ? 88 LEU A CB 1 +ATOM 678 C CG . LEU A 1 104 ? -5.765 -25.372 25.017 1.00 39.35 ? 88 LEU A CG 1 +ATOM 679 C CD1 . LEU A 1 104 ? -4.999 -26.404 24.216 1.00 41.33 ? 88 LEU A CD1 1 +ATOM 680 C CD2 . LEU A 1 104 ? -5.062 -24.026 24.977 1.00 34.95 ? 88 LEU A CD2 1 +ATOM 681 N N . THR A 1 105 ? -9.460 -23.270 23.645 1.00 39.97 ? 89 THR A N 1 +ATOM 682 C CA . THR A 1 105 ? -10.733 -22.909 23.044 1.00 49.08 ? 89 THR A CA 1 +ATOM 683 C C . THR A 1 105 ? -10.886 -23.449 21.629 1.00 58.76 ? 89 THR A C 1 +ATOM 684 O O . THR A 1 105 ? -9.909 -23.809 20.972 1.00 35.69 ? 89 THR A O 1 +ATOM 685 C CB . THR A 1 105 ? -10.916 -21.384 23.006 1.00 68.70 ? 89 THR A CB 1 +ATOM 686 O OG1 . THR A 1 105 ? -9.762 -20.784 22.404 1.00 64.97 ? 89 THR A OG1 1 +ATOM 687 C CG2 . THR A 1 105 ? -11.093 -20.833 24.414 1.00 52.08 ? 89 THR A CG2 1 +ATOM 688 N N . PHE A 1 106 ? -12.131 -23.502 21.174 1.00 40.06 ? 90 PHE A N 1 +ATOM 689 C CA . PHE A 1 106 ? -12.438 -23.891 19.809 1.00 47.42 ? 90 PHE A CA 1 +ATOM 690 C C . PHE A 1 106 ? -13.249 -22.787 19.146 1.00 30.77 ? 90 PHE A C 1 +ATOM 691 O O . PHE A 1 106 ? -14.184 -22.255 19.744 1.00 65.57 ? 90 PHE A O 1 +ATOM 692 C CB . PHE A 1 106 ? -13.205 -25.212 19.782 1.00 28.99 ? 90 PHE A CB 1 +ATOM 693 C CG . PHE A 1 106 ? -13.572 -25.670 18.401 1.00 41.82 ? 90 PHE A CG 1 +ATOM 694 C CD1 . PHE A 1 106 ? -14.792 -25.325 17.843 1.00 36.10 ? 90 PHE A CD1 1 +ATOM 695 C CD2 . PHE A 1 106 ? -12.697 -26.449 17.661 1.00 22.52 ? 90 PHE A CD2 1 +ATOM 696 C CE1 . PHE A 1 106 ? -15.131 -25.742 16.573 1.00 30.58 ? 90 PHE A CE1 1 +ATOM 697 C CE2 . PHE A 1 106 ? -13.033 -26.872 16.389 1.00 18.76 ? 90 PHE A CE2 1 +ATOM 698 C CZ . PHE A 1 106 ? -14.251 -26.518 15.845 1.00 29.48 ? 90 PHE A CZ 1 +ATOM 699 N N . SER A 1 107 ? -12.891 -22.443 17.913 1.00 39.05 ? 91 SER A N 1 +ATOM 700 C CA . SER A 1 107 ? -13.589 -21.386 17.192 1.00 59.14 ? 91 SER A CA 1 +ATOM 701 C C . SER A 1 107 ? -13.576 -21.624 15.687 1.00 40.01 ? 91 SER A C 1 +ATOM 702 O O . SER A 1 107 ? -12.579 -22.083 15.132 1.00 34.39 ? 91 SER A O 1 +ATOM 703 C CB . SER A 1 107 ? -12.964 -20.024 17.508 1.00 72.33 ? 91 SER A CB 1 +ATOM 704 O OG . SER A 1 107 ? -13.607 -18.986 16.788 1.00 66.66 ? 91 SER A OG 1 +ATOM 705 N N . ASN A 1 108 ? -14.687 -21.304 15.031 1.00 33.65 ? 92 ASN A N 1 +ATOM 706 C CA . ASN A 1 108 ? -14.757 -21.387 13.579 1.00 22.82 ? 92 ASN A CA 1 +ATOM 707 C C . ASN A 1 108 ? -14.171 -20.146 12.927 1.00 24.19 ? 92 ASN A C 1 +ATOM 708 O O . ASN A 1 108 ? -14.119 -20.048 11.702 1.00 29.47 ? 92 ASN A O 1 +ATOM 709 C CB . ASN A 1 108 ? -16.202 -21.585 13.112 1.00 33.79 ? 92 ASN A CB 1 +ATOM 710 C CG . ASN A 1 108 ? -16.760 -22.935 13.506 1.00 42.41 ? 92 ASN A CG 1 +ATOM 711 O OD1 . ASN A 1 108 ? -16.392 -23.960 12.933 1.00 39.68 ? 92 ASN A OD1 1 +ATOM 712 N ND2 . ASN A 1 108 ? -17.660 -22.942 14.482 1.00 50.58 ? 92 ASN A ND2 1 +ATOM 713 N N . GLY A 1 109 ? -13.728 -19.202 13.755 1.00 23.99 ? 93 GLY A N 1 +ATOM 714 C CA . GLY A 1 109 ? -13.189 -17.943 13.273 1.00 25.70 ? 93 GLY A CA 1 +ATOM 715 C C . GLY A 1 109 ? -12.002 -18.102 12.342 1.00 37.85 ? 93 GLY A C 1 +ATOM 716 O O . GLY A 1 109 ? -11.809 -17.304 11.421 1.00 24.55 ? 93 GLY A O 1 +ATOM 717 N N . TYR A 1 110 ? -11.203 -19.136 12.578 1.00 23.30 ? 94 TYR A N 1 +ATOM 718 C CA . TYR A 1 110 ? -10.026 -19.382 11.758 1.00 21.04 ? 94 TYR A CA 1 +ATOM 719 C C . TYR A 1 110 ? -10.393 -19.852 10.350 1.00 18.59 ? 94 TYR A C 1 +ATOM 720 O O . TYR A 1 110 ? -9.600 -19.706 9.419 1.00 14.27 ? 94 TYR A O 1 +ATOM 721 C CB . TYR A 1 110 ? -9.113 -20.405 12.433 1.00 21.49 ? 94 TYR A CB 1 +ATOM 722 C CG . TYR A 1 110 ? -8.496 -19.893 13.714 1.00 43.96 ? 94 TYR A CG 1 +ATOM 723 C CD1 . TYR A 1 110 ? -7.406 -19.035 13.685 1.00 37.35 ? 94 TYR A CD1 1 +ATOM 724 C CD2 . TYR A 1 110 ? -9.010 -20.258 14.951 1.00 28.73 ? 94 TYR A CD2 1 +ATOM 725 C CE1 . TYR A 1 110 ? -6.840 -18.559 14.850 1.00 38.98 ? 94 TYR A CE1 1 +ATOM 726 C CE2 . TYR A 1 110 ? -8.449 -19.787 16.124 1.00 56.63 ? 94 TYR A CE2 1 +ATOM 727 C CZ . TYR A 1 110 ? -7.364 -18.937 16.066 1.00 50.81 ? 94 TYR A CZ 1 +ATOM 728 O OH . TYR A 1 110 ? -6.800 -18.463 17.229 1.00 101.53 ? 94 TYR A OH 1 +ATOM 729 N N . ARG A 1 111 ? -11.581 -20.428 10.190 1.00 18.93 ? 95 ARG A N 1 +ATOM 730 C CA . ARG A 1 111 ? -12.060 -20.773 8.854 1.00 25.03 ? 95 ARG A CA 1 +ATOM 731 C C . ARG A 1 111 ? -12.188 -19.513 8.010 1.00 13.43 ? 95 ARG A C 1 +ATOM 732 O O . ARG A 1 111 ? -11.840 -19.500 6.834 1.00 17.15 ? 95 ARG A O 1 +ATOM 733 C CB . ARG A 1 111 ? -13.411 -21.482 8.907 1.00 19.05 ? 95 ARG A CB 1 +ATOM 734 C CG . ARG A 1 111 ? -13.377 -22.946 9.289 1.00 30.21 ? 95 ARG A CG 1 +ATOM 735 C CD . ARG A 1 111 ? -14.775 -23.518 9.137 1.00 32.08 ? 95 ARG A CD 1 +ATOM 736 N NE . ARG A 1 111 ? -14.857 -24.937 9.458 1.00 32.03 ? 95 ARG A NE 1 +ATOM 737 C CZ . ARG A 1 111 ? -14.754 -25.914 8.565 1.00 26.60 ? 95 ARG A CZ 1 +ATOM 738 N NH1 . ARG A 1 111 ? -14.854 -27.175 8.959 1.00 31.88 ? 95 ARG A NH1 1 +ATOM 739 N NH2 . ARG A 1 111 ? -14.553 -25.632 7.282 1.00 22.85 ? 95 ARG A NH2 1 +ATOM 740 N N . TYR A 1 112 ? -12.703 -18.456 8.629 1.00 18.38 ? 96 TYR A N 1 +ATOM 741 C CA . TYR A 1 112 ? -12.924 -17.190 7.942 1.00 19.00 ? 96 TYR A CA 1 +ATOM 742 C C . TYR A 1 112 ? -11.620 -16.596 7.428 1.00 22.45 ? 96 TYR A C 1 +ATOM 743 O O . TYR A 1 112 ? -11.546 -16.131 6.287 1.00 19.95 ? 96 TYR A O 1 +ATOM 744 C CB . TYR A 1 112 ? -13.631 -16.204 8.876 1.00 13.95 ? 96 TYR A CB 1 +ATOM 745 C CG . TYR A 1 112 ? -15.100 -16.522 9.079 1.00 16.48 ? 96 TYR A CG 1 +ATOM 746 C CD1 . TYR A 1 112 ? -15.497 -17.639 9.802 1.00 23.23 ? 96 TYR A CD1 1 +ATOM 747 C CD2 . TYR A 1 112 ? -16.087 -15.703 8.545 1.00 21.65 ? 96 TYR A CD2 1 +ATOM 748 C CE1 . TYR A 1 112 ? -16.837 -17.938 9.982 1.00 16.95 ? 96 TYR A CE1 1 +ATOM 749 C CE2 . TYR A 1 112 ? -17.433 -15.989 8.728 1.00 14.39 ? 96 TYR A CE2 1 +ATOM 750 C CZ . TYR A 1 112 ? -17.799 -17.107 9.444 1.00 14.52 ? 96 TYR A CZ 1 +ATOM 751 O OH . TYR A 1 112 ? -19.132 -17.397 9.623 1.00 24.19 ? 96 TYR A OH 1 +ATOM 752 N N . VAL A 1 113 ? -10.592 -16.622 8.272 1.00 18.47 ? 97 VAL A N 1 +ATOM 753 C CA . VAL A 1 113 ? -9.276 -16.115 7.902 1.00 17.83 ? 97 VAL A CA 1 +ATOM 754 C C . VAL A 1 113 ? -8.726 -16.899 6.714 1.00 20.24 ? 97 VAL A C 1 +ATOM 755 O O . VAL A 1 113 ? -8.144 -16.329 5.793 1.00 19.28 ? 97 VAL A O 1 +ATOM 756 C CB . VAL A 1 113 ? -8.283 -16.196 9.089 1.00 21.25 ? 97 VAL A CB 1 +ATOM 757 C CG1 . VAL A 1 113 ? -6.912 -15.673 8.684 1.00 23.68 ? 97 VAL A CG1 1 +ATOM 758 C CG2 . VAL A 1 113 ? -8.814 -15.417 10.272 1.00 20.76 ? 97 VAL A CG2 1 +ATOM 759 N N . ASN A 1 114 ? -8.932 -18.212 6.730 1.00 19.17 ? 98 ASN A N 1 +ATOM 760 C CA . ASN A 1 114 ? -8.421 -19.064 5.665 1.00 16.74 ? 98 ASN A CA 1 +ATOM 761 C C . ASN A 1 114 ? -9.111 -18.802 4.325 1.00 22.05 ? 98 ASN A C 1 +ATOM 762 O O . ASN A 1 114 ? -8.494 -18.934 3.267 1.00 16.04 ? 98 ASN A O 1 +ATOM 763 C CB . ASN A 1 114 ? -8.572 -20.532 6.048 1.00 17.51 ? 98 ASN A CB 1 +ATOM 764 C CG . ASN A 1 114 ? -7.587 -21.423 5.320 1.00 35.61 ? 98 ASN A CG 1 +ATOM 765 O OD1 . ASN A 1 114 ? -7.947 -22.143 4.390 1.00 44.36 ? 98 ASN A OD1 1 +ATOM 766 N ND2 . ASN A 1 114 ? -6.329 -21.366 5.735 1.00 29.90 ? 98 ASN A ND2 1 +ATOM 767 N N . TRP A 1 115 ? -10.387 -18.427 4.377 1.00 17.51 ? 99 TRP A N 1 +ATOM 768 C CA . TRP A 1 115 ? -11.146 -18.085 3.170 1.00 14.19 ? 99 TRP A CA 1 +ATOM 769 C C . TRP A 1 115 ? -10.539 -16.897 2.424 1.00 20.56 ? 99 TRP A C 1 +ATOM 770 O O . TRP A 1 115 ? -10.669 -16.787 1.206 1.00 15.29 ? 99 TRP A O 1 +ATOM 771 C CB . TRP A 1 115 ? -12.598 -17.770 3.520 1.00 10.91 ? 99 TRP A CB 1 +ATOM 772 C CG . TRP A 1 115 ? -13.377 -18.938 4.037 1.00 16.24 ? 99 TRP A CG 1 +ATOM 773 C CD1 . TRP A 1 115 ? -13.047 -20.260 3.942 1.00 13.09 ? 99 TRP A CD1 1 +ATOM 774 C CD2 . TRP A 1 115 ? -14.620 -18.885 4.743 1.00 16.48 ? 99 TRP A CD2 1 +ATOM 775 N NE1 . TRP A 1 115 ? -14.015 -21.033 4.541 1.00 13.19 ? 99 TRP A NE1 1 +ATOM 776 C CE2 . TRP A 1 115 ? -14.989 -20.211 5.046 1.00 11.86 ? 99 TRP A CE2 1 +ATOM 777 C CE3 . TRP A 1 115 ? -15.459 -17.842 5.152 1.00 15.89 ? 99 TRP A CE3 1 +ATOM 778 C CZ2 . TRP A 1 115 ? -16.157 -20.521 5.735 1.00 19.36 ? 99 TRP A CZ2 1 +ATOM 779 C CZ3 . TRP A 1 115 ? -16.617 -18.152 5.833 1.00 12.36 ? 99 TRP A CZ3 1 +ATOM 780 C CH2 . TRP A 1 115 ? -16.957 -19.480 6.116 1.00 18.92 ? 99 TRP A CH2 1 +ATOM 781 N N . MET A 1 116 ? -9.887 -16.005 3.161 1.00 12.42 ? 100 MET A N 1 +ATOM 782 C CA . MET A 1 116 ? -9.212 -14.852 2.566 1.00 16.40 ? 100 MET A CA 1 +ATOM 783 C C . MET A 1 116 ? -8.211 -15.275 1.496 1.00 21.71 ? 100 MET A C 1 +ATOM 784 O O . MET A 1 116 ? -7.937 -14.526 0.559 1.00 18.11 ? 100 MET A O 1 +ATOM 785 C CB . MET A 1 116 ? -8.500 -14.033 3.648 1.00 20.01 ? 100 MET A CB 1 +ATOM 786 C CG . MET A 1 116 ? -9.436 -13.428 4.682 1.00 16.88 ? 100 MET A CG 1 +ATOM 787 S SD . MET A 1 116 ? -10.412 -12.084 3.983 1.00 22.28 ? 100 MET A SD 1 +ATOM 788 C CE . MET A 1 116 ? -9.144 -10.854 3.659 1.00 20.95 ? 100 MET A CE 1 +ATOM 789 N N . ALA A 1 117 ? -7.671 -16.480 1.650 1.00 11.46 ? 101 ALA A N 1 +ATOM 790 C CA . ALA A 1 117 ? -6.713 -17.036 0.703 1.00 15.60 ? 101 ALA A CA 1 +ATOM 791 C C . ALA A 1 117 ? -7.368 -18.024 -0.261 1.00 20.17 ? 101 ALA A C 1 +ATOM 792 O O . ALA A 1 117 ? -7.118 -17.981 -1.465 1.00 20.26 ? 101 ALA A O 1 +ATOM 793 C CB . ALA A 1 117 ? -5.564 -17.715 1.451 1.00 20.35 ? 101 ALA A CB 1 +ATOM 794 N N . THR A 1 118 ? -8.213 -18.908 0.263 1.00 19.01 ? 102 THR A N 1 +ATOM 795 C CA . THR A 1 118 ? -8.755 -19.994 -0.549 1.00 13.76 ? 102 THR A CA 1 +ATOM 796 C C . THR A 1 118 ? -9.775 -19.525 -1.583 1.00 18.70 ? 102 THR A C 1 +ATOM 797 O O . THR A 1 118 ? -9.781 -20.012 -2.708 1.00 20.09 ? 102 THR A O 1 +ATOM 798 C CB . THR A 1 118 ? -9.408 -21.089 0.323 1.00 15.31 ? 102 THR A CB 1 +ATOM 799 O OG1 . THR A 1 118 ? -10.367 -20.501 1.205 1.00 34.10 ? 102 THR A OG1 1 +ATOM 800 C CG2 . THR A 1 118 ? -8.354 -21.802 1.145 1.00 27.13 ? 102 THR A CG2 1 +ATOM 801 N N . ILE A 1 119 ? -10.638 -18.589 -1.207 1.00 16.57 ? 103 ILE A N 1 +ATOM 802 C CA . ILE A 1 119 ? -11.663 -18.119 -2.133 1.00 18.46 ? 103 ILE A CA 1 +ATOM 803 C C . ILE A 1 119 ? -11.058 -17.407 -3.356 1.00 21.22 ? 103 ILE A C 1 +ATOM 804 O O . ILE A 1 119 ? -11.495 -17.663 -4.478 1.00 19.57 ? 103 ILE A O 1 +ATOM 805 C CB . ILE A 1 119 ? -12.688 -17.205 -1.424 1.00 19.15 ? 103 ILE A CB 1 +ATOM 806 C CG1 . ILE A 1 119 ? -13.508 -18.023 -0.421 1.00 19.26 ? 103 ILE A CG1 1 +ATOM 807 C CG2 . ILE A 1 119 ? -13.610 -16.543 -2.439 1.00 19.63 ? 103 ILE A CG2 1 +ATOM 808 C CD1 . ILE A 1 119 ? -14.627 -17.242 0.263 1.00 18.18 ? 103 ILE A CD1 1 +ATOM 809 N N . PRO A 1 120 ? -10.046 -16.533 -3.160 1.00 18.46 ? 104 PRO A N 1 +ATOM 810 C CA . PRO A 1 120 ? -9.389 -16.014 -4.366 1.00 19.91 ? 104 PRO A CA 1 +ATOM 811 C C . PRO A 1 120 ? -8.819 -17.118 -5.259 1.00 14.97 ? 104 PRO A C 1 +ATOM 812 O O . PRO A 1 120 ? -8.894 -16.994 -6.476 1.00 17.66 ? 104 PRO A O 1 +ATOM 813 C CB . PRO A 1 120 ? -8.267 -15.138 -3.801 1.00 12.48 ? 104 PRO A CB 1 +ATOM 814 C CG . PRO A 1 120 ? -8.807 -14.658 -2.506 1.00 21.11 ? 104 PRO A CG 1 +ATOM 815 C CD . PRO A 1 120 ? -9.583 -15.824 -1.949 1.00 25.30 ? 104 PRO A CD 1 +ATOM 816 N N . CYS A 1 121 ? -8.278 -18.179 -4.664 1.00 15.56 ? 105 CYS A N 1 +ATOM 817 C CA . CYS A 1 121 ? -7.726 -19.284 -5.449 1.00 17.58 ? 105 CYS A CA 1 +ATOM 818 C C . CYS A 1 121 ? -8.801 -19.995 -6.258 1.00 16.51 ? 105 CYS A C 1 +ATOM 819 O O . CYS A 1 121 ? -8.573 -20.367 -7.411 1.00 17.56 ? 105 CYS A O 1 +ATOM 820 C CB . CYS A 1 121 ? -7.016 -20.296 -4.549 1.00 23.25 ? 105 CYS A CB 1 +ATOM 821 S SG . CYS A 1 121 ? -5.439 -19.732 -3.891 1.00 24.44 ? 105 CYS A SG 1 +ATOM 822 N N . LEU A 1 122 ? -9.965 -20.196 -5.650 1.00 12.13 ? 106 LEU A N 1 +ATOM 823 C CA . LEU A 1 122 ? -11.060 -20.875 -6.334 1.00 16.22 ? 106 LEU A CA 1 +ATOM 824 C C . LEU A 1 122 ? -11.547 -20.025 -7.509 1.00 15.20 ? 106 LEU A C 1 +ATOM 825 O O . LEU A 1 122 ? -11.878 -20.546 -8.575 1.00 17.50 ? 106 LEU A O 1 +ATOM 826 C CB . LEU A 1 122 ? -12.211 -21.163 -5.365 1.00 11.60 ? 106 LEU A CB 1 +ATOM 827 C CG . LEU A 1 122 ? -11.998 -22.202 -4.257 1.00 12.85 ? 106 LEU A CG 1 +ATOM 828 C CD1 . LEU A 1 122 ? -13.189 -22.212 -3.307 1.00 20.07 ? 106 LEU A CD1 1 +ATOM 829 C CD2 . LEU A 1 122 ? -11.776 -23.593 -4.838 1.00 8.05 ? 106 LEU A CD2 1 +ATOM 830 N N . LEU A 1 123 ? -11.571 -18.713 -7.309 1.00 14.05 ? 107 LEU A N 1 +ATOM 831 C CA . LEU A 1 123 ? -12.026 -17.782 -8.339 1.00 20.89 ? 107 LEU A CA 1 +ATOM 832 C C . LEU A 1 123 ? -11.007 -17.662 -9.471 1.00 15.38 ? 107 LEU A C 1 +ATOM 833 O O . LEU A 1 123 ? -11.376 -17.544 -10.641 1.00 22.31 ? 107 LEU A O 1 +ATOM 834 C CB . LEU A 1 123 ? -12.298 -16.402 -7.725 1.00 14.02 ? 107 LEU A CB 1 +ATOM 835 C CG . LEU A 1 123 ? -13.459 -16.311 -6.730 1.00 24.82 ? 107 LEU A CG 1 +ATOM 836 C CD1 . LEU A 1 123 ? -13.473 -14.956 -6.034 1.00 22.30 ? 107 LEU A CD1 1 +ATOM 837 C CD2 . LEU A 1 123 ? -14.787 -16.577 -7.427 1.00 20.66 ? 107 LEU A CD2 1 +ATOM 838 N N . LEU A 1 124 ? -9.725 -17.707 -9.123 1.00 17.19 ? 108 LEU A N 1 +ATOM 839 C CA . LEU A 1 124 ? -8.679 -17.533 -10.124 1.00 15.93 ? 108 LEU A CA 1 +ATOM 840 C C . LEU A 1 124 ? -8.642 -18.708 -11.098 1.00 15.63 ? 108 LEU A C 1 +ATOM 841 O O . LEU A 1 124 ? -8.498 -18.508 -12.299 1.00 21.04 ? 108 LEU A O 1 +ATOM 842 C CB . LEU A 1 124 ? -7.313 -17.350 -9.461 1.00 15.43 ? 108 LEU A CB 1 +ATOM 843 C CG . LEU A 1 124 ? -6.156 -17.081 -10.428 1.00 27.23 ? 108 LEU A CG 1 +ATOM 844 C CD1 . LEU A 1 124 ? -6.472 -15.900 -11.336 1.00 27.98 ? 108 LEU A CD1 1 +ATOM 845 C CD2 . LEU A 1 124 ? -4.852 -16.845 -9.677 1.00 36.59 ? 108 LEU A CD2 1 +ATOM 846 N N . GLN A 1 125 ? -8.785 -19.930 -10.596 1.00 14.05 ? 109 GLN A N 1 +ATOM 847 C CA . GLN A 1 125 ? -8.719 -21.085 -11.487 1.00 19.77 ? 109 GLN A CA 1 +ATOM 848 C C . GLN A 1 125 ? -9.928 -21.121 -12.427 1.00 18.58 ? 109 GLN A C 1 +ATOM 849 O O . GLN A 1 125 ? -9.842 -21.652 -13.531 1.00 15.09 ? 109 GLN A O 1 +ATOM 850 C CB . GLN A 1 125 ? -8.597 -22.394 -10.692 1.00 21.26 ? 109 GLN A CB 1 +ATOM 851 C CG . GLN A 1 125 ? -9.683 -22.644 -9.672 1.00 16.44 ? 109 GLN A CG 1 +ATOM 852 C CD . GLN A 1 125 ? -9.480 -23.942 -8.897 1.00 29.96 ? 109 GLN A CD 1 +ATOM 853 O OE1 . GLN A 1 125 ? -10.160 -24.196 -7.906 1.00 22.44 ? 109 GLN A OE1 1 +ATOM 854 N NE2 . GLN A 1 125 ? -8.547 -24.770 -9.352 1.00 22.08 ? 109 GLN A NE2 1 +ATOM 855 N N . LEU A 1 126 ? -11.043 -20.535 -12.004 1.00 15.40 ? 110 LEU A N 1 +ATOM 856 C CA . LEU A 1 126 ? -12.195 -20.392 -12.888 1.00 8.87 ? 110 LEU A CA 1 +ATOM 857 C C . LEU A 1 126 ? -11.902 -19.428 -14.035 1.00 10.49 ? 110 LEU A C 1 +ATOM 858 O O . LEU A 1 126 ? -12.207 -19.716 -15.186 1.00 16.43 ? 110 LEU A O 1 +ATOM 859 C CB . LEU A 1 126 ? -13.425 -19.905 -12.115 1.00 17.55 ? 110 LEU A CB 1 +ATOM 860 C CG . LEU A 1 126 ? -14.606 -19.487 -12.999 1.00 20.05 ? 110 LEU A CG 1 +ATOM 861 C CD1 . LEU A 1 126 ? -15.184 -20.682 -13.748 1.00 18.23 ? 110 LEU A CD1 1 +ATOM 862 C CD2 . LEU A 1 126 ? -15.682 -18.782 -12.187 1.00 26.59 ? 110 LEU A CD2 1 +ATOM 863 N N . LEU A 1 127 ? -11.314 -18.281 -13.711 1.00 16.72 ? 111 LEU A N 1 +ATOM 864 C CA . LEU A 1 127 ? -10.992 -17.275 -14.719 1.00 17.81 ? 111 LEU A CA 1 +ATOM 865 C C . LEU A 1 127 ? -10.011 -17.829 -15.750 1.00 20.11 ? 111 LEU A C 1 +ATOM 866 O O . LEU A 1 127 ? -10.097 -17.525 -16.940 1.00 19.91 ? 111 LEU A O 1 +ATOM 867 C CB . LEU A 1 127 ? -10.413 -16.022 -14.061 1.00 14.99 ? 111 LEU A CB 1 +ATOM 868 C CG . LEU A 1 127 ? -11.302 -15.277 -13.067 1.00 22.30 ? 111 LEU A CG 1 +ATOM 869 C CD1 . LEU A 1 127 ? -10.676 -13.939 -12.707 1.00 21.57 ? 111 LEU A CD1 1 +ATOM 870 C CD2 . LEU A 1 127 ? -12.720 -15.093 -13.615 1.00 12.47 ? 111 LEU A CD2 1 +ATOM 871 N N . ILE A 1 128 ? -9.093 -18.665 -15.284 1.00 14.57 ? 112 ILE A N 1 +ATOM 872 C CA . ILE A 1 128 ? -8.092 -19.268 -16.154 1.00 17.25 ? 112 ILE A CA 1 +ATOM 873 C C . ILE A 1 128 ? -8.729 -20.189 -17.198 1.00 15.61 ? 112 ILE A C 1 +ATOM 874 O O . ILE A 1 128 ? -8.443 -20.059 -18.387 1.00 18.23 ? 112 ILE A O 1 +ATOM 875 C CB . ILE A 1 128 ? -7.046 -20.046 -15.332 1.00 13.82 ? 112 ILE A CB 1 +ATOM 876 C CG1 . ILE A 1 128 ? -6.256 -19.077 -14.454 1.00 24.50 ? 112 ILE A CG1 1 +ATOM 877 C CG2 . ILE A 1 128 ? -6.082 -20.801 -16.252 1.00 15.62 ? 112 ILE A CG2 1 +ATOM 878 C CD1 . ILE A 1 128 ? -5.514 -19.743 -13.334 1.00 31.56 ? 112 ILE A CD1 1 +ATOM 879 N N . VAL A 1 129 ? -9.609 -21.097 -16.775 1.00 15.40 ? 113 VAL A N 1 +ATOM 880 C CA . VAL A 1 129 ? -10.229 -22.014 -17.738 1.00 12.39 ? 113 VAL A CA 1 +ATOM 881 C C . VAL A 1 129 ? -11.280 -21.308 -18.597 1.00 24.84 ? 113 VAL A C 1 +ATOM 882 O O . VAL A 1 129 ? -11.685 -21.830 -19.634 1.00 12.95 ? 113 VAL A O 1 +ATOM 883 C CB . VAL A 1 129 ? -10.874 -23.245 -17.055 1.00 19.38 ? 113 VAL A CB 1 +ATOM 884 C CG1 . VAL A 1 129 ? -9.813 -24.090 -16.369 1.00 18.58 ? 113 VAL A CG1 1 +ATOM 885 C CG2 . VAL A 1 129 ? -11.976 -22.826 -16.081 1.00 18.68 ? 113 VAL A CG2 1 +ATOM 886 N N . LEU A 1 130 ? -11.708 -20.121 -18.175 1.00 15.64 ? 114 LEU A N 1 +ATOM 887 C CA . LEU A 1 130 ? -12.575 -19.283 -19.004 1.00 15.79 ? 114 LEU A CA 1 +ATOM 888 C C . LEU A 1 130 ? -11.782 -18.588 -20.109 1.00 21.77 ? 114 LEU A C 1 +ATOM 889 O O . LEU A 1 130 ? -12.341 -17.814 -20.893 1.00 23.68 ? 114 LEU A O 1 +ATOM 890 C CB . LEU A 1 130 ? -13.293 -18.234 -18.152 1.00 19.00 ? 114 LEU A CB 1 +ATOM 891 C CG . LEU A 1 130 ? -14.491 -18.698 -17.332 1.00 22.18 ? 114 LEU A CG 1 +ATOM 892 C CD1 . LEU A 1 130 ? -15.072 -17.534 -16.540 1.00 24.76 ? 114 LEU A CD1 1 +ATOM 893 C CD2 . LEU A 1 130 ? -15.538 -19.312 -18.241 1.00 21.14 ? 114 LEU A CD2 1 +ATOM 894 N N . ASN A 1 131 ? -10.479 -18.863 -20.144 1.00 18.41 ? 115 ASN A N 1 +ATOM 895 C CA . ASN A 1 131 ? -9.565 -18.339 -21.158 1.00 20.64 ? 115 ASN A CA 1 +ATOM 896 C C . ASN A 1 131 ? -9.399 -16.825 -21.088 1.00 30.14 ? 115 ASN A C 1 +ATOM 897 O O . ASN A 1 131 ? -9.080 -16.183 -22.083 1.00 27.98 ? 115 ASN A O 1 +ATOM 898 C CB . ASN A 1 131 ? -10.032 -18.756 -22.557 1.00 19.97 ? 115 ASN A CB 1 +ATOM 899 C CG . ASN A 1 131 ? -10.078 -20.259 -22.724 1.00 25.68 ? 115 ASN A CG 1 +ATOM 900 O OD1 . ASN A 1 131 ? -9.090 -20.947 -22.477 1.00 22.02 ? 115 ASN A OD1 1 +ATOM 901 N ND2 . ASN A 1 131 ? -11.237 -20.784 -23.116 1.00 22.60 ? 115 ASN A ND2 1 +ATOM 902 N N . LEU A 1 132 ? -9.609 -16.256 -19.906 1.00 21.83 ? 116 LEU A N 1 +ATOM 903 C CA . LEU A 1 132 ? -9.328 -14.840 -19.699 1.00 26.56 ? 116 LEU A CA 1 +ATOM 904 C C . LEU A 1 132 ? -7.822 -14.623 -19.680 1.00 35.49 ? 116 LEU A C 1 +ATOM 905 O O . LEU A 1 132 ? -7.073 -15.466 -19.183 1.00 32.01 ? 116 LEU A O 1 +ATOM 906 C CB . LEU A 1 132 ? -9.958 -14.335 -18.399 1.00 23.93 ? 116 LEU A CB 1 +ATOM 907 C CG . LEU A 1 132 ? -11.486 -14.276 -18.366 1.00 27.99 ? 116 LEU A CG 1 +ATOM 908 C CD1 . LEU A 1 132 ? -11.970 -13.562 -17.112 1.00 30.66 ? 116 LEU A CD1 1 +ATOM 909 C CD2 . LEU A 1 132 ? -12.013 -13.589 -19.610 1.00 37.57 ? 116 LEU A CD2 1 +ATOM 910 N N . LYS A 1 133 ? -7.379 -13.498 -20.231 1.00 28.94 ? 117 LYS A N 1 +ATOM 911 C CA . LYS A 1 133 ? -5.952 -13.220 -20.345 1.00 38.53 ? 117 LYS A CA 1 +ATOM 912 C C . LYS A 1 133 ? -5.627 -11.765 -20.041 1.00 27.92 ? 117 LYS A C 1 +ATOM 913 O O . LYS A 1 133 ? -6.497 -10.897 -20.115 1.00 36.68 ? 117 LYS A O 1 +ATOM 914 C CB . LYS A 1 133 ? -5.445 -13.569 -21.750 1.00 34.54 ? 117 LYS A CB 1 +ATOM 915 C CG . LYS A 1 133 ? -5.556 -15.036 -22.129 1.00 61.79 ? 117 LYS A CG 1 +ATOM 916 C CD . LYS A 1 133 ? -5.064 -15.271 -23.551 1.00 77.03 ? 117 LYS A CD 1 +ATOM 917 C CE . LYS A 1 133 ? -5.213 -16.729 -23.961 1.00 90.51 ? 117 LYS A CE 1 +ATOM 918 N NZ . LYS A 1 133 ? -6.635 -17.172 -23.971 1.00 58.53 ? 117 LYS A NZ 1 +ATOM 919 N N . GLY A 1 134 ? -4.367 -11.517 -19.695 1.00 38.65 ? 118 GLY A N 1 +ATOM 920 C CA . GLY A 1 134 ? -3.826 -10.174 -19.572 1.00 48.96 ? 118 GLY A CA 1 +ATOM 921 C C . GLY A 1 134 ? -4.619 -9.183 -18.743 1.00 52.47 ? 118 GLY A C 1 +ATOM 922 O O . GLY A 1 134 ? -4.860 -9.400 -17.556 1.00 34.36 ? 118 GLY A O 1 +ATOM 923 N N . LYS A 1 135 ? -5.024 -8.091 -19.386 1.00 31.75 ? 119 LYS A N 1 +ATOM 924 C CA . LYS A 1 135 ? -5.686 -6.980 -18.710 1.00 32.29 ? 119 LYS A CA 1 +ATOM 925 C C . LYS A 1 135 ? -7.039 -7.368 -18.124 1.00 24.64 ? 119 LYS A C 1 +ATOM 926 O O . LYS A 1 135 ? -7.344 -7.027 -16.981 1.00 35.79 ? 119 LYS A O 1 +ATOM 927 C CB . LYS A 1 135 ? -5.865 -5.808 -19.677 1.00 47.74 ? 119 LYS A CB 1 +ATOM 928 C CG . LYS A 1 135 ? -6.391 -4.539 -19.029 1.00 45.54 ? 119 LYS A CG 1 +ATOM 929 C CD . LYS A 1 135 ? -5.298 -3.817 -18.260 1.00 108.53 ? 119 LYS A CD 1 +ATOM 930 C CE . LYS A 1 135 ? -5.830 -2.557 -17.594 1.00 90.25 ? 119 LYS A CE 1 +ATOM 931 N NZ . LYS A 1 135 ? -6.823 -2.872 -16.531 1.00 108.59 ? 119 LYS A NZ 1 +ATOM 932 N N . GLU A 1 136 ? -7.852 -8.066 -18.914 1.00 24.94 ? 120 GLU A N 1 +ATOM 933 C CA . GLU A 1 136 ? -9.177 -8.479 -18.463 1.00 40.09 ? 120 GLU A CA 1 +ATOM 934 C C . GLU A 1 136 ? -9.070 -9.454 -17.293 1.00 29.32 ? 120 GLU A C 1 +ATOM 935 O O . GLU A 1 136 ? -9.886 -9.426 -16.377 1.00 29.76 ? 120 GLU A O 1 +ATOM 936 C CB . GLU A 1 136 ? -9.974 -9.115 -19.608 1.00 30.32 ? 120 GLU A CB 1 +ATOM 937 C CG . GLU A 1 136 ? -11.407 -9.473 -19.219 1.00 41.75 ? 120 GLU A CG 1 +ATOM 938 C CD . GLU A 1 136 ? -12.177 -10.162 -20.331 1.00 70.29 ? 120 GLU A CD 1 +ATOM 939 O OE1 . GLU A 1 136 ? -11.573 -10.470 -21.380 1.00 66.08 ? 120 GLU A OE1 1 +ATOM 940 O OE2 . GLU A 1 136 ? -13.392 -10.397 -20.150 1.00 61.77 ? 120 GLU A OE2 1 +ATOM 941 N N . LEU A 1 137 ? -8.056 -10.312 -17.332 1.00 28.83 ? 121 LEU A N 1 +ATOM 942 C CA . LEU A 1 137 ? -7.824 -11.268 -16.259 1.00 27.67 ? 121 LEU A CA 1 +ATOM 943 C C . LEU A 1 137 ? -7.473 -10.543 -14.963 1.00 32.97 ? 121 LEU A C 1 +ATOM 944 O O . LEU A 1 137 ? -8.073 -10.798 -13.921 1.00 24.50 ? 121 LEU A O 1 +ATOM 945 C CB . LEU A 1 137 ? -6.710 -12.251 -16.638 1.00 19.00 ? 121 LEU A CB 1 +ATOM 946 C CG . LEU A 1 137 ? -6.298 -13.234 -15.537 1.00 23.27 ? 121 LEU A CG 1 +ATOM 947 C CD1 . LEU A 1 137 ? -7.467 -14.126 -15.131 1.00 19.61 ? 121 LEU A CD1 1 +ATOM 948 C CD2 . LEU A 1 137 ? -5.100 -14.072 -15.965 1.00 31.26 ? 121 LEU A CD2 1 +ATOM 949 N N . PHE A 1 138 ? -6.508 -9.631 -15.039 1.00 31.15 ? 122 PHE A N 1 +ATOM 950 C CA . PHE A 1 138 ? -6.064 -8.890 -13.864 1.00 29.95 ? 122 PHE A CA 1 +ATOM 951 C C . PHE A 1 138 ? -7.188 -8.053 -13.253 1.00 20.71 ? 122 PHE A C 1 +ATOM 952 O O . PHE A 1 138 ? -7.382 -8.057 -12.037 1.00 25.26 ? 122 PHE A O 1 +ATOM 953 C CB . PHE A 1 138 ? -4.877 -7.989 -14.215 1.00 32.28 ? 122 PHE A CB 1 +ATOM 954 C CG . PHE A 1 138 ? -4.407 -7.136 -13.069 1.00 57.18 ? 122 PHE A CG 1 +ATOM 955 C CD1 . PHE A 1 138 ? -3.570 -7.659 -12.097 1.00 68.91 ? 122 PHE A CD1 1 +ATOM 956 C CD2 . PHE A 1 138 ? -4.805 -5.812 -12.963 1.00 48.46 ? 122 PHE A CD2 1 +ATOM 957 C CE1 . PHE A 1 138 ? -3.138 -6.878 -11.039 1.00 69.40 ? 122 PHE A CE1 1 +ATOM 958 C CE2 . PHE A 1 138 ? -4.376 -5.026 -11.908 1.00 52.84 ? 122 PHE A CE2 1 +ATOM 959 C CZ . PHE A 1 138 ? -3.542 -5.560 -10.945 1.00 50.92 ? 122 PHE A CZ 1 +ATOM 960 N N . SER A 1 139 ? -7.925 -7.336 -14.096 1.00 27.75 ? 123 SER A N 1 +ATOM 961 C CA . SER A 1 139 ? -9.002 -6.473 -13.617 1.00 30.22 ? 123 SER A CA 1 +ATOM 962 C C . SER A 1 139 ? -10.172 -7.274 -13.036 1.00 28.90 ? 123 SER A C 1 +ATOM 963 O O . SER A 1 139 ? -10.732 -6.898 -12.007 1.00 29.36 ? 123 SER A O 1 +ATOM 964 C CB . SER A 1 139 ? -9.497 -5.560 -14.743 1.00 26.73 ? 123 SER A CB 1 +ATOM 965 O OG . SER A 1 139 ? -10.001 -6.317 -15.828 1.00 73.67 ? 123 SER A OG 1 +ATOM 966 N N . THR A 1 140 ? -10.544 -8.371 -13.692 1.00 26.14 ? 124 THR A N 1 +ATOM 967 C CA . THR A 1 140 ? -11.643 -9.205 -13.204 1.00 23.43 ? 124 THR A CA 1 +ATOM 968 C C . THR A 1 140 ? -11.285 -9.855 -11.870 1.00 20.04 ? 124 THR A C 1 +ATOM 969 O O . THR A 1 140 ? -12.096 -9.878 -10.941 1.00 28.54 ? 124 THR A O 1 +ATOM 970 C CB . THR A 1 140 ? -12.020 -10.309 -14.208 1.00 23.88 ? 124 THR A CB 1 +ATOM 971 O OG1 . THR A 1 140 ? -12.334 -9.721 -15.476 1.00 29.15 ? 124 THR A OG1 1 +ATOM 972 C CG2 . THR A 1 140 ? -13.227 -11.101 -13.706 1.00 21.76 ? 124 THR A CG2 1 +ATOM 973 N N . ALA A 1 141 ? -10.068 -10.380 -11.783 1.00 18.70 ? 125 ALA A N 1 +ATOM 974 C CA . ALA A 1 141 ? -9.591 -11.004 -10.557 1.00 27.59 ? 125 ALA A CA 1 +ATOM 975 C C . ALA A 1 141 ? -9.576 -9.998 -9.415 1.00 22.60 ? 125 ALA A C 1 +ATOM 976 O O . ALA A 1 141 ? -9.949 -10.315 -8.288 1.00 22.93 ? 125 ALA A O 1 +ATOM 977 C CB . ALA A 1 141 ? -8.203 -11.594 -10.762 1.00 21.06 ? 125 ALA A CB 1 +ATOM 978 N N . THR A 1 142 ? -9.149 -8.779 -9.717 1.00 23.71 ? 126 THR A N 1 +ATOM 979 C CA . THR A 1 142 ? -9.049 -7.741 -8.700 1.00 21.75 ? 126 THR A CA 1 +ATOM 980 C C . THR A 1 142 ? -10.420 -7.416 -8.128 1.00 23.65 ? 126 THR A C 1 +ATOM 981 O O . THR A 1 142 ? -10.588 -7.364 -6.915 1.00 24.90 ? 126 THR A O 1 +ATOM 982 C CB . THR A 1 142 ? -8.409 -6.465 -9.259 1.00 29.20 ? 126 THR A CB 1 +ATOM 983 O OG1 . THR A 1 142 ? -7.087 -6.765 -9.718 1.00 35.29 ? 126 THR A OG1 1 +ATOM 984 C CG2 . THR A 1 142 ? -8.329 -5.392 -8.184 1.00 32.99 ? 126 THR A CG2 1 +ATOM 985 N N . TRP A 1 143 ? -11.403 -7.215 -9.001 1.00 16.04 ? 127 TRP A N 1 +ATOM 986 C CA . TRP A 1 143 ? -12.757 -6.913 -8.548 1.00 17.58 ? 127 TRP A CA 1 +ATOM 987 C C . TRP A 1 143 ? -13.377 -8.086 -7.797 1.00 27.50 ? 127 TRP A C 1 +ATOM 988 O O . TRP A 1 143 ? -14.111 -7.895 -6.827 1.00 21.84 ? 127 TRP A O 1 +ATOM 989 C CB . TRP A 1 143 ? -13.648 -6.523 -9.730 1.00 37.50 ? 127 TRP A CB 1 +ATOM 990 C CG . TRP A 1 143 ? -13.363 -5.157 -10.258 1.00 34.97 ? 127 TRP A CG 1 +ATOM 991 C CD1 . TRP A 1 143 ? -12.822 -4.842 -11.469 1.00 33.99 ? 127 TRP A CD1 1 +ATOM 992 C CD2 . TRP A 1 143 ? -13.592 -3.914 -9.585 1.00 28.91 ? 127 TRP A CD2 1 +ATOM 993 N NE1 . TRP A 1 143 ? -12.706 -3.479 -11.595 1.00 39.49 ? 127 TRP A NE1 1 +ATOM 994 C CE2 . TRP A 1 143 ? -13.172 -2.886 -10.451 1.00 47.41 ? 127 TRP A CE2 1 +ATOM 995 C CE3 . TRP A 1 143 ? -14.117 -3.571 -8.336 1.00 37.36 ? 127 TRP A CE3 1 +ATOM 996 C CZ2 . TRP A 1 143 ? -13.259 -1.539 -10.108 1.00 36.94 ? 127 TRP A CZ2 1 +ATOM 997 C CZ3 . TRP A 1 143 ? -14.202 -2.233 -7.996 1.00 44.82 ? 127 TRP A CZ3 1 +ATOM 998 C CH2 . TRP A 1 143 ? -13.776 -1.234 -8.879 1.00 49.08 ? 127 TRP A CH2 1 +ATOM 999 N N . LEU A 1 144 ? -13.088 -9.299 -8.258 1.00 20.39 ? 128 LEU A N 1 +ATOM 1000 C CA . LEU A 1 144 ? -13.602 -10.500 -7.612 1.00 20.63 ? 128 LEU A CA 1 +ATOM 1001 C C . LEU A 1 144 ? -13.048 -10.656 -6.205 1.00 17.14 ? 128 LEU A C 1 +ATOM 1002 O O . LEU A 1 144 ? -13.784 -10.952 -5.267 1.00 23.59 ? 128 LEU A O 1 +ATOM 1003 C CB . LEU A 1 144 ? -13.268 -11.740 -8.441 1.00 16.02 ? 128 LEU A CB 1 +ATOM 1004 C CG . LEU A 1 144 ? -14.275 -12.066 -9.541 1.00 24.01 ? 128 LEU A CG 1 +ATOM 1005 C CD1 . LEU A 1 144 ? -13.804 -13.250 -10.361 1.00 16.75 ? 128 LEU A CD1 1 +ATOM 1006 C CD2 . LEU A 1 144 ? -15.637 -12.342 -8.920 1.00 20.11 ? 128 LEU A CD2 1 +ATOM 1007 N N . ILE A 1 145 ? -11.741 -10.456 -6.073 1.00 19.30 ? 129 ILE A N 1 +ATOM 1008 C CA . ILE A 1 145 ? -11.057 -10.637 -4.803 1.00 20.36 ? 129 ILE A CA 1 +ATOM 1009 C C . ILE A 1 145 ? -11.484 -9.568 -3.800 1.00 19.57 ? 129 ILE A C 1 +ATOM 1010 O O . ILE A 1 145 ? -11.647 -9.855 -2.614 1.00 22.57 ? 129 ILE A O 1 +ATOM 1011 C CB . ILE A 1 145 ? -9.527 -10.625 -5.002 1.00 21.27 ? 129 ILE A CB 1 +ATOM 1012 C CG1 . ILE A 1 145 ? -9.098 -11.881 -5.764 1.00 24.55 ? 129 ILE A CG1 1 +ATOM 1013 C CG2 . ILE A 1 145 ? -8.800 -10.560 -3.668 1.00 28.35 ? 129 ILE A CG2 1 +ATOM 1014 C CD1 . ILE A 1 145 ? -7.651 -11.868 -6.200 1.00 38.97 ? 129 ILE A CD1 1 +ATOM 1015 N N . LEU A 1 146 ? -11.689 -8.343 -4.280 1.00 17.50 ? 130 LEU A N 1 +ATOM 1016 C CA . LEU A 1 146 ? -12.175 -7.265 -3.419 1.00 23.98 ? 130 LEU A CA 1 +ATOM 1017 C C . LEU A 1 146 ? -13.597 -7.542 -2.931 1.00 23.65 ? 130 LEU A C 1 +ATOM 1018 O O . LEU A 1 146 ? -13.941 -7.252 -1.782 1.00 23.67 ? 130 LEU A O 1 +ATOM 1019 C CB . LEU A 1 146 ? -12.125 -5.922 -4.155 1.00 21.10 ? 130 LEU A CB 1 +ATOM 1020 C CG . LEU A 1 146 ? -10.731 -5.336 -4.398 1.00 29.89 ? 130 LEU A CG 1 +ATOM 1021 C CD1 . LEU A 1 146 ? -10.817 -4.067 -5.233 1.00 32.31 ? 130 LEU A CD1 1 +ATOM 1022 C CD2 . LEU A 1 146 ? -10.023 -5.065 -3.079 1.00 27.06 ? 130 LEU A CD2 1 +ATOM 1023 N N . ALA A 1 147 ? -14.426 -8.099 -3.808 1.00 18.43 ? 131 ALA A N 1 +ATOM 1024 C CA . ALA A 1 147 ? -15.787 -8.459 -3.427 1.00 14.24 ? 131 ALA A CA 1 +ATOM 1025 C C . ALA A 1 147 ? -15.786 -9.603 -2.411 1.00 23.03 ? 131 ALA A C 1 +ATOM 1026 O O . ALA A 1 147 ? -16.553 -9.585 -1.449 1.00 18.38 ? 131 ALA A O 1 +ATOM 1027 C CB . ALA A 1 147 ? -16.599 -8.838 -4.652 1.00 17.96 ? 131 ALA A CB 1 +ATOM 1028 N N . ALA A 1 148 ? -14.924 -10.595 -2.635 1.00 21.94 ? 132 ALA A N 1 +ATOM 1029 C CA . ALA A 1 148 ? -14.830 -11.752 -1.745 1.00 21.74 ? 132 ALA A CA 1 +ATOM 1030 C C . ALA A 1 148 ? -14.316 -11.355 -0.365 1.00 21.69 ? 132 ALA A C 1 +ATOM 1031 O O . ALA A 1 148 ? -14.826 -11.817 0.651 1.00 19.73 ? 132 ALA A O 1 +ATOM 1032 C CB . ALA A 1 148 ? -13.930 -12.819 -2.356 1.00 14.13 ? 132 ALA A CB 1 +ATOM 1033 N N . TRP A 1 149 ? -13.302 -10.498 -0.337 1.00 13.73 ? 133 TRP A N 1 +ATOM 1034 C CA . TRP A 1 149 ? -12.740 -10.019 0.920 1.00 23.20 ? 133 TRP A CA 1 +ATOM 1035 C C . TRP A 1 149 ? -13.743 -9.185 1.716 1.00 18.12 ? 133 TRP A C 1 +ATOM 1036 O O . TRP A 1 149 ? -13.775 -9.253 2.939 1.00 19.17 ? 133 TRP A O 1 +ATOM 1037 C CB . TRP A 1 149 ? -11.470 -9.210 0.657 1.00 17.86 ? 133 TRP A CB 1 +ATOM 1038 C CG . TRP A 1 149 ? -10.277 -10.071 0.375 1.00 18.60 ? 133 TRP A CG 1 +ATOM 1039 C CD1 . TRP A 1 149 ? -10.209 -11.434 0.457 1.00 21.99 ? 133 TRP A CD1 1 +ATOM 1040 C CD2 . TRP A 1 149 ? -8.976 -9.628 -0.027 1.00 29.85 ? 133 TRP A CD2 1 +ATOM 1041 N NE1 . TRP A 1 149 ? -8.943 -11.866 0.132 1.00 24.62 ? 133 TRP A NE1 1 +ATOM 1042 C CE2 . TRP A 1 149 ? -8.168 -10.776 -0.169 1.00 26.86 ? 133 TRP A CE2 1 +ATOM 1043 C CE3 . TRP A 1 149 ? -8.414 -8.373 -0.281 1.00 39.08 ? 133 TRP A CE3 1 +ATOM 1044 C CZ2 . TRP A 1 149 ? -6.831 -10.705 -0.555 1.00 31.45 ? 133 TRP A CZ2 1 +ATOM 1045 C CZ3 . TRP A 1 149 ? -7.085 -8.304 -0.664 1.00 37.26 ? 133 TRP A CZ3 1 +ATOM 1046 C CH2 . TRP A 1 149 ? -6.309 -9.464 -0.798 1.00 30.33 ? 133 TRP A CH2 1 +ATOM 1047 N N . GLY A 1 150 ? -14.561 -8.402 1.023 1.00 16.66 ? 134 GLY A N 1 +ATOM 1048 C CA . GLY A 1 150 ? -15.614 -7.652 1.684 1.00 15.54 ? 134 GLY A CA 1 +ATOM 1049 C C . GLY A 1 150 ? -16.625 -8.588 2.327 1.00 23.48 ? 134 GLY A C 1 +ATOM 1050 O O . GLY A 1 150 ? -17.078 -8.368 3.450 1.00 18.41 ? 134 GLY A O 1 +ATOM 1051 N N . MET A 1 151 ? -16.977 -9.643 1.603 1.00 15.25 ? 135 MET A N 1 +ATOM 1052 C CA . MET A 1 151 ? -17.888 -10.662 2.107 1.00 12.66 ? 135 MET A CA 1 +ATOM 1053 C C . MET A 1 151 ? -17.337 -11.350 3.360 1.00 11.98 ? 135 MET A C 1 +ATOM 1054 O O . MET A 1 151 ? -18.024 -11.473 4.372 1.00 12.64 ? 135 MET A O 1 +ATOM 1055 C CB . MET A 1 151 ? -18.153 -11.698 1.013 1.00 13.21 ? 135 MET A CB 1 +ATOM 1056 C CG . MET A 1 151 ? -19.087 -12.822 1.408 1.00 11.46 ? 135 MET A CG 1 +ATOM 1057 S SD . MET A 1 151 ? -19.207 -14.077 0.115 1.00 17.65 ? 135 MET A SD 1 +ATOM 1058 C CE . MET A 1 151 ? -17.541 -14.750 0.107 1.00 16.94 ? 135 MET A CE 1 +ATOM 1059 N N . ILE A 1 152 ? -16.091 -11.801 3.269 1.00 14.50 ? 136 ILE A N 1 +ATOM 1060 C CA . ILE A 1 152 ? -15.449 -12.567 4.331 1.00 13.39 ? 136 ILE A CA 1 +ATOM 1061 C C . ILE A 1 152 ? -15.235 -11.744 5.603 1.00 14.24 ? 136 ILE A C 1 +ATOM 1062 O O . ILE A 1 152 ? -15.530 -12.203 6.708 1.00 16.79 ? 136 ILE A O 1 +ATOM 1063 C CB . ILE A 1 152 ? -14.092 -13.118 3.857 1.00 9.52 ? 136 ILE A CB 1 +ATOM 1064 C CG1 . ILE A 1 152 ? -14.297 -14.101 2.700 1.00 14.93 ? 136 ILE A CG1 1 +ATOM 1065 C CG2 . ILE A 1 152 ? -13.354 -13.795 5.011 1.00 16.79 ? 136 ILE A CG2 1 +ATOM 1066 C CD1 . ILE A 1 152 ? -13.033 -14.388 1.924 1.00 16.24 ? 136 ILE A CD1 1 +ATOM 1067 N N . ILE A 1 153 ? -14.732 -10.525 5.439 1.00 19.35 ? 137 ILE A N 1 +ATOM 1068 C CA . ILE A 1 153 ? -14.436 -9.654 6.573 1.00 16.41 ? 137 ILE A CA 1 +ATOM 1069 C C . ILE A 1 153 ? -15.705 -9.247 7.326 1.00 16.24 ? 137 ILE A C 1 +ATOM 1070 O O . ILE A 1 153 ? -15.744 -9.279 8.557 1.00 16.76 ? 137 ILE A O 1 +ATOM 1071 C CB . ILE A 1 153 ? -13.679 -8.392 6.116 1.00 18.51 ? 137 ILE A CB 1 +ATOM 1072 C CG1 . ILE A 1 153 ? -12.274 -8.767 5.636 1.00 16.27 ? 137 ILE A CG1 1 +ATOM 1073 C CG2 . ILE A 1 153 ? -13.601 -7.366 7.242 1.00 19.64 ? 137 ILE A CG2 1 +ATOM 1074 C CD1 . ILE A 1 153 ? -11.566 -7.650 4.892 1.00 22.81 ? 137 ILE A CD1 1 +ATOM 1075 N N . THR A 1 154 ? -16.748 -8.874 6.592 1.00 14.85 ? 138 THR A N 1 +ATOM 1076 C CA . THR A 1 154 ? -17.999 -8.491 7.238 1.00 11.42 ? 138 THR A CA 1 +ATOM 1077 C C . THR A 1 154 ? -18.656 -9.700 7.897 1.00 17.73 ? 138 THR A C 1 +ATOM 1078 O O . THR A 1 154 ? -19.286 -9.579 8.948 1.00 20.44 ? 138 THR A O 1 +ATOM 1079 C CB . THR A 1 154 ? -18.975 -7.841 6.245 1.00 18.71 ? 138 THR A CB 1 +ATOM 1080 O OG1 . THR A 1 154 ? -19.170 -8.705 5.117 1.00 18.38 ? 138 THR A OG1 1 +ATOM 1081 C CG2 . THR A 1 154 ? -18.424 -6.510 5.770 1.00 14.84 ? 138 THR A CG2 1 +ATOM 1082 N N . GLY A 1 155 ? -18.503 -10.865 7.279 1.00 19.33 ? 139 GLY A N 1 +ATOM 1083 C CA . GLY A 1 155 ? -19.011 -12.094 7.858 1.00 13.01 ? 139 GLY A CA 1 +ATOM 1084 C C . GLY A 1 155 ? -18.240 -12.468 9.113 1.00 17.70 ? 139 GLY A C 1 +ATOM 1085 O O . GLY A 1 155 ? -18.824 -12.937 10.092 1.00 14.49 ? 139 GLY A O 1 +ATOM 1086 N N . TYR A 1 156 ? -16.926 -12.259 9.085 1.00 19.65 ? 140 TYR A N 1 +ATOM 1087 C CA . TYR A 1 156 ? -16.089 -12.536 10.247 1.00 15.41 ? 140 TYR A CA 1 +ATOM 1088 C C . TYR A 1 156 ? -16.504 -11.673 11.430 1.00 16.75 ? 140 TYR A C 1 +ATOM 1089 O O . TYR A 1 156 ? -16.625 -12.160 12.552 1.00 16.36 ? 140 TYR A O 1 +ATOM 1090 C CB . TYR A 1 156 ? -14.607 -12.303 9.941 1.00 19.68 ? 140 TYR A CB 1 +ATOM 1091 C CG . TYR A 1 156 ? -13.754 -12.376 11.188 1.00 21.77 ? 140 TYR A CG 1 +ATOM 1092 C CD1 . TYR A 1 156 ? -13.342 -13.601 11.699 1.00 19.18 ? 140 TYR A CD1 1 +ATOM 1093 C CD2 . TYR A 1 156 ? -13.389 -11.221 11.877 1.00 20.95 ? 140 TYR A CD2 1 +ATOM 1094 C CE1 . TYR A 1 156 ? -12.578 -13.674 12.852 1.00 24.39 ? 140 TYR A CE1 1 +ATOM 1095 C CE2 . TYR A 1 156 ? -12.629 -11.285 13.029 1.00 27.70 ? 140 TYR A CE2 1 +ATOM 1096 C CZ . TYR A 1 156 ? -12.225 -12.512 13.511 1.00 31.26 ? 140 TYR A CZ 1 +ATOM 1097 O OH . TYR A 1 156 ? -11.462 -12.575 14.654 1.00 35.76 ? 140 TYR A OH 1 +ATOM 1098 N N . VAL A 1 157 ? -16.712 -10.386 11.173 1.00 15.26 ? 141 VAL A N 1 +ATOM 1099 C CA . VAL A 1 157 ? -17.167 -9.473 12.211 1.00 19.58 ? 141 VAL A CA 1 +ATOM 1100 C C . VAL A 1 157 ? -18.529 -9.909 12.748 1.00 22.09 ? 141 VAL A C 1 +ATOM 1101 O O . VAL A 1 157 ? -18.759 -9.914 13.958 1.00 21.40 ? 141 VAL A O 1 +ATOM 1102 C CB . VAL A 1 157 ? -17.251 -8.025 11.692 1.00 20.64 ? 141 VAL A CB 1 +ATOM 1103 C CG1 . VAL A 1 157 ? -17.777 -7.102 12.776 1.00 22.81 ? 141 VAL A CG1 1 +ATOM 1104 C CG2 . VAL A 1 157 ? -15.886 -7.562 11.221 1.00 14.74 ? 141 VAL A CG2 1 +ATOM 1105 N N . GLY A 1 158 ? -19.423 -10.290 11.841 1.00 16.27 ? 142 GLY A N 1 +ATOM 1106 C CA . GLY A 1 158 ? -20.754 -10.731 12.222 1.00 15.79 ? 142 GLY A CA 1 +ATOM 1107 C C . GLY A 1 158 ? -20.785 -11.890 13.206 1.00 16.79 ? 142 GLY A C 1 +ATOM 1108 O O . GLY A 1 158 ? -21.519 -11.851 14.194 1.00 17.15 ? 142 GLY A O 1 +ATOM 1109 N N . GLN A 1 159 ? -19.985 -12.921 12.946 1.00 19.22 ? 143 GLN A N 1 +ATOM 1110 C CA . GLN A 1 159 ? -20.006 -14.118 13.782 1.00 14.85 ? 143 GLN A CA 1 +ATOM 1111 C C . GLN A 1 159 ? -19.356 -13.901 15.154 1.00 17.23 ? 143 GLN A C 1 +ATOM 1112 O O . GLN A 1 159 ? -19.433 -14.767 16.024 1.00 20.41 ? 143 GLN A O 1 +ATOM 1113 C CB . GLN A 1 159 ? -19.336 -15.283 13.055 1.00 7.25 ? 143 GLN A CB 1 +ATOM 1114 C CG . GLN A 1 159 ? -17.912 -15.026 12.606 1.00 15.08 ? 143 GLN A CG 1 +ATOM 1115 C CD . GLN A 1 159 ? -16.899 -15.423 13.651 1.00 28.71 ? 143 GLN A CD 1 +ATOM 1116 O OE1 . GLN A 1 159 ? -17.030 -16.467 14.289 1.00 21.51 ? 143 GLN A OE1 1 +ATOM 1117 N NE2 . GLN A 1 159 ? -15.887 -14.587 13.842 1.00 17.34 ? 143 GLN A NE2 1 +ATOM 1118 N N . LEU A 1 160 ? -18.733 -12.743 15.352 1.00 23.90 ? 144 LEU A N 1 +ATOM 1119 C CA . LEU A 1 160 ? -18.240 -12.370 16.676 1.00 23.70 ? 144 LEU A CA 1 +ATOM 1120 C C . LEU A 1 160 ? -19.405 -12.124 17.635 1.00 26.83 ? 144 LEU A C 1 +ATOM 1121 O O . LEU A 1 160 ? -19.224 -12.110 18.851 1.00 22.91 ? 144 LEU A O 1 +ATOM 1122 C CB . LEU A 1 160 ? -17.358 -11.124 16.599 1.00 19.40 ? 144 LEU A CB 1 +ATOM 1123 C CG . LEU A 1 160 ? -16.055 -11.223 15.807 1.00 22.88 ? 144 LEU A CG 1 +ATOM 1124 C CD1 . LEU A 1 160 ? -15.365 -9.875 15.784 1.00 30.56 ? 144 LEU A CD1 1 +ATOM 1125 C CD2 . LEU A 1 160 ? -15.139 -12.289 16.387 1.00 24.68 ? 144 LEU A CD2 1 +ATOM 1126 N N . TYR A 1 161 ? -20.600 -11.936 17.079 1.00 21.30 ? 145 TYR A N 1 +ATOM 1127 C CA . TYR A 1 161 ? -21.776 -11.592 17.873 1.00 19.92 ? 145 TYR A CA 1 +ATOM 1128 C C . TYR A 1 161 ? -22.815 -12.704 17.930 1.00 23.35 ? 145 TYR A C 1 +ATOM 1129 O O . TYR A 1 161 ? -23.941 -12.476 18.374 1.00 23.64 ? 145 TYR A O 1 +ATOM 1130 C CB . TYR A 1 161 ? -22.433 -10.324 17.317 1.00 19.02 ? 145 TYR A CB 1 +ATOM 1131 C CG . TYR A 1 161 ? -21.542 -9.110 17.386 1.00 26.31 ? 145 TYR A CG 1 +ATOM 1132 C CD1 . TYR A 1 161 ? -21.477 -8.339 18.540 1.00 22.42 ? 145 TYR A CD1 1 +ATOM 1133 C CD2 . TYR A 1 161 ? -20.760 -8.736 16.303 1.00 27.65 ? 145 TYR A CD2 1 +ATOM 1134 C CE1 . TYR A 1 161 ? -20.660 -7.232 18.612 1.00 26.76 ? 145 TYR A CE1 1 +ATOM 1135 C CE2 . TYR A 1 161 ? -19.940 -7.629 16.364 1.00 28.15 ? 145 TYR A CE2 1 +ATOM 1136 C CZ . TYR A 1 161 ? -19.895 -6.879 17.522 1.00 32.01 ? 145 TYR A CZ 1 +ATOM 1137 O OH . TYR A 1 161 ? -19.079 -5.774 17.588 1.00 32.76 ? 145 TYR A OH 1 +ATOM 1138 N N . GLU A 1 162 ? -22.442 -13.904 17.493 1.00 14.19 ? 146 GLU A N 1 +ATOM 1139 C CA . GLU A 1 162 ? -23.416 -14.982 17.347 1.00 25.51 ? 146 GLU A CA 1 +ATOM 1140 C C . GLU A 1 162 ? -23.964 -15.447 18.698 1.00 28.51 ? 146 GLU A C 1 +ATOM 1141 O O . GLU A 1 162 ? -25.008 -16.092 18.757 1.00 24.22 ? 146 GLU A O 1 +ATOM 1142 C CB . GLU A 1 162 ? -22.809 -16.163 16.575 1.00 17.20 ? 146 GLU A CB 1 +ATOM 1143 C CG . GLU A 1 162 ? -21.752 -16.961 17.327 1.00 23.48 ? 146 GLU A CG 1 +ATOM 1144 C CD . GLU A 1 162 ? -21.192 -18.111 16.500 1.00 32.23 ? 146 GLU A CD 1 +ATOM 1145 O OE1 . GLU A 1 162 ? -21.153 -17.995 15.256 1.00 27.10 ? 146 GLU A OE1 1 +ATOM 1146 O OE2 . GLU A 1 162 ? -20.798 -19.137 17.092 1.00 27.35 ? 146 GLU A OE2 1 +ATOM 1147 N N . VAL A 1 163 ? -23.272 -15.105 19.781 1.00 26.52 ? 147 VAL A N 1 +ATOM 1148 C CA . VAL A 1 163 ? -23.785 -15.374 21.122 1.00 30.85 ? 147 VAL A CA 1 +ATOM 1149 C C . VAL A 1 163 ? -24.353 -14.105 21.761 1.00 28.30 ? 147 VAL A C 1 +ATOM 1150 O O . VAL A 1 163 ? -25.461 -14.109 22.299 1.00 33.28 ? 147 VAL A O 1 +ATOM 1151 C CB . VAL A 1 163 ? -22.694 -15.956 22.048 1.00 29.99 ? 147 VAL A CB 1 +ATOM 1152 C CG1 . VAL A 1 163 ? -23.185 -16.002 23.488 1.00 29.83 ? 147 VAL A CG1 1 +ATOM 1153 C CG2 . VAL A 1 163 ? -22.270 -17.338 21.576 1.00 18.91 ? 147 VAL A CG2 1 +ATOM 1154 N N . ASP A 1 164 ? -23.594 -13.018 21.681 1.00 30.58 ? 148 ASP A N 1 +ATOM 1155 C CA . ASP A 1 164 ? -23.931 -11.786 22.393 1.00 35.31 ? 148 ASP A CA 1 +ATOM 1156 C C . ASP A 1 164 ? -25.044 -10.963 21.747 1.00 48.46 ? 148 ASP A C 1 +ATOM 1157 O O . ASP A 1 164 ? -25.855 -10.364 22.450 1.00 28.66 ? 148 ASP A O 1 +ATOM 1158 C CB . ASP A 1 164 ? -22.684 -10.909 22.537 1.00 33.41 ? 148 ASP A CB 1 +ATOM 1159 C CG . ASP A 1 164 ? -21.593 -11.575 23.355 1.00 78.54 ? 148 ASP A CG 1 +ATOM 1160 O OD1 . ASP A 1 164 ? -21.912 -12.509 24.121 1.00 39.75 ? 148 ASP A OD1 1 +ATOM 1161 O OD2 . ASP A 1 164 ? -20.421 -11.158 23.240 1.00 40.02 ? 148 ASP A OD2 1 +ATOM 1162 N N . ASP A 1 165 ? -25.081 -10.923 20.417 1.00 27.60 ? 149 ASP A N 1 +ATOM 1163 C CA . ASP A 1 165 ? -25.974 -10.000 19.721 1.00 22.60 ? 149 ASP A CA 1 +ATOM 1164 C C . ASP A 1 165 ? -26.440 -10.539 18.369 1.00 31.04 ? 149 ASP A C 1 +ATOM 1165 O O . ASP A 1 165 ? -25.886 -10.182 17.327 1.00 26.89 ? 149 ASP A O 1 +ATOM 1166 C CB . ASP A 1 165 ? -25.270 -8.652 19.532 1.00 23.76 ? 149 ASP A CB 1 +ATOM 1167 C CG . ASP A 1 165 ? -26.231 -7.524 19.198 1.00 31.50 ? 149 ASP A CG 1 +ATOM 1168 O OD1 . ASP A 1 165 ? -27.386 -7.806 18.817 1.00 29.07 ? 149 ASP A OD1 1 +ATOM 1169 O OD2 . ASP A 1 165 ? -25.818 -6.350 19.304 1.00 32.45 ? 149 ASP A OD2 1 +ATOM 1170 N N . ILE A 1 166 ? -27.473 -11.379 18.397 1.00 24.96 ? 150 ILE A N 1 +ATOM 1171 C CA . ILE A 1 166 ? -28.013 -12.008 17.189 1.00 24.34 ? 150 ILE A CA 1 +ATOM 1172 C C . ILE A 1 166 ? -28.433 -10.981 16.136 1.00 38.27 ? 150 ILE A C 1 +ATOM 1173 O O . ILE A 1 166 ? -28.242 -11.193 14.936 1.00 29.44 ? 150 ILE A O 1 +ATOM 1174 C CB . ILE A 1 166 ? -29.218 -12.913 17.527 1.00 32.74 ? 150 ILE A CB 1 +ATOM 1175 C CG1 . ILE A 1 166 ? -28.736 -14.178 18.231 1.00 47.17 ? 150 ILE A CG1 1 +ATOM 1176 C CG2 . ILE A 1 166 ? -29.976 -13.310 16.271 1.00 38.21 ? 150 ILE A CG2 1 +ATOM 1177 C CD1 . ILE A 1 166 ? -27.807 -15.010 17.385 1.00 36.53 ? 150 ILE A CD1 1 +ATOM 1178 N N . ALA A 1 167 ? -28.992 -9.865 16.591 1.00 21.61 ? 151 ALA A N 1 +ATOM 1179 C CA . ALA A 1 167 ? -29.389 -8.790 15.689 1.00 21.51 ? 151 ALA A CA 1 +ATOM 1180 C C . ALA A 1 167 ? -28.191 -8.271 14.902 1.00 24.37 ? 151 ALA A C 1 +ATOM 1181 O O . ALA A 1 167 ? -28.290 -8.007 13.705 1.00 21.48 ? 151 ALA A O 1 +ATOM 1182 C CB . ALA A 1 167 ? -30.040 -7.660 16.467 1.00 25.18 ? 151 ALA A CB 1 +ATOM 1183 N N . GLN A 1 168 ? -27.058 -8.132 15.580 1.00 16.17 ? 152 GLN A N 1 +ATOM 1184 C CA . GLN A 1 168 ? -25.855 -7.620 14.939 1.00 20.24 ? 152 GLN A CA 1 +ATOM 1185 C C . GLN A 1 168 ? -25.290 -8.647 13.965 1.00 23.83 ? 152 GLN A C 1 +ATOM 1186 O O . GLN A 1 168 ? -24.801 -8.290 12.896 1.00 22.39 ? 152 GLN A O 1 +ATOM 1187 C CB . GLN A 1 168 ? -24.805 -7.234 15.982 1.00 17.69 ? 152 GLN A CB 1 +ATOM 1188 C CG . GLN A 1 168 ? -23.540 -6.661 15.376 1.00 25.94 ? 152 GLN A CG 1 +ATOM 1189 C CD . GLN A 1 168 ? -22.902 -5.587 16.233 1.00 55.13 ? 152 GLN A CD 1 +ATOM 1190 O OE1 . GLN A 1 168 ? -22.010 -4.872 15.778 1.00 39.54 ? 152 GLN A OE1 1 +ATOM 1191 N NE2 . GLN A 1 168 ? -23.357 -5.465 17.477 1.00 38.47 ? 152 GLN A NE2 1 +ATOM 1192 N N . LEU A 1 169 ? -25.372 -9.920 14.340 1.00 23.85 ? 153 LEU A N 1 +ATOM 1193 C CA . LEU A 1 169 ? -25.004 -11.013 13.448 1.00 27.33 ? 153 LEU A CA 1 +ATOM 1194 C C . LEU A 1 169 ? -25.788 -10.939 12.140 1.00 24.50 ? 153 LEU A C 1 +ATOM 1195 O O . LEU A 1 169 ? -25.230 -11.114 11.058 1.00 22.42 ? 153 LEU A O 1 +ATOM 1196 C CB . LEU A 1 169 ? -25.249 -12.360 14.125 1.00 30.76 ? 153 LEU A CB 1 +ATOM 1197 C CG . LEU A 1 169 ? -25.094 -13.605 13.251 1.00 33.43 ? 153 LEU A CG 1 +ATOM 1198 C CD1 . LEU A 1 169 ? -23.716 -14.218 13.440 1.00 19.45 ? 153 LEU A CD1 1 +ATOM 1199 C CD2 . LEU A 1 169 ? -26.186 -14.618 13.558 1.00 37.50 ? 153 LEU A CD2 1 +ATOM 1200 N N . MET A 1 170 ? -27.082 -10.665 12.244 1.00 17.69 ? 154 MET A N 1 +ATOM 1201 C CA . MET A 1 170 ? -27.943 -10.617 11.065 1.00 30.68 ? 154 MET A CA 1 +ATOM 1202 C C . MET A 1 170 ? -27.630 -9.437 10.152 1.00 20.75 ? 154 MET A C 1 +ATOM 1203 O O . MET A 1 170 ? -27.622 -9.580 8.930 1.00 22.48 ? 154 MET A O 1 +ATOM 1204 C CB . MET A 1 170 ? -29.409 -10.569 11.484 1.00 22.36 ? 154 MET A CB 1 +ATOM 1205 C CG . MET A 1 170 ? -29.925 -11.881 12.052 1.00 40.86 ? 154 MET A CG 1 +ATOM 1206 S SD . MET A 1 170 ? -31.563 -11.704 12.775 1.00 68.41 ? 154 MET A SD 1 +ATOM 1207 C CE . MET A 1 170 ? -31.951 -13.405 13.172 1.00 50.37 ? 154 MET A CE 1 +ATOM 1208 N N . ILE A 1 171 ? -27.370 -8.275 10.740 1.00 21.10 ? 155 ILE A N 1 +ATOM 1209 C CA . ILE A 1 171 ? -27.087 -7.084 9.945 1.00 25.09 ? 155 ILE A CA 1 +ATOM 1210 C C . ILE A 1 171 ? -25.768 -7.212 9.199 1.00 22.08 ? 155 ILE A C 1 +ATOM 1211 O O . ILE A 1 171 ? -25.688 -6.892 8.010 1.00 20.90 ? 155 ILE A O 1 +ATOM 1212 C CB . ILE A 1 171 ? -27.056 -5.815 10.812 1.00 27.12 ? 155 ILE A CB 1 +ATOM 1213 C CG1 . ILE A 1 171 ? -28.384 -5.660 11.550 1.00 37.56 ? 155 ILE A CG1 1 +ATOM 1214 C CG2 . ILE A 1 171 ? -26.777 -4.588 9.952 1.00 21.25 ? 155 ILE A CG2 1 +ATOM 1215 C CD1 . ILE A 1 171 ? -29.592 -5.756 10.648 1.00 28.18 ? 155 ILE A CD1 1 +ATOM 1216 N N . TRP A 1 172 ? -24.733 -7.677 9.894 1.00 19.82 ? 156 TRP A N 1 +ATOM 1217 C CA . TRP A 1 172 ? -23.442 -7.909 9.252 1.00 20.70 ? 156 TRP A CA 1 +ATOM 1218 C C . TRP A 1 172 ? -23.568 -8.971 8.166 1.00 16.67 ? 156 TRP A C 1 +ATOM 1219 O O . TRP A 1 172 ? -22.892 -8.905 7.142 1.00 15.41 ? 156 TRP A O 1 +ATOM 1220 C CB . TRP A 1 172 ? -22.392 -8.337 10.273 1.00 13.54 ? 156 TRP A CB 1 +ATOM 1221 C CG . TRP A 1 172 ? -21.818 -7.218 11.087 1.00 19.78 ? 156 TRP A CG 1 +ATOM 1222 C CD1 . TRP A 1 172 ? -22.010 -6.995 12.417 1.00 25.40 ? 156 TRP A CD1 1 +ATOM 1223 C CD2 . TRP A 1 172 ? -20.950 -6.174 10.627 1.00 21.17 ? 156 TRP A CD2 1 +ATOM 1224 N NE1 . TRP A 1 172 ? -21.318 -5.877 12.816 1.00 31.45 ? 156 TRP A NE1 1 +ATOM 1225 C CE2 . TRP A 1 172 ? -20.659 -5.354 11.736 1.00 27.15 ? 156 TRP A CE2 1 +ATOM 1226 C CE3 . TRP A 1 172 ? -20.395 -5.851 9.385 1.00 20.46 ? 156 TRP A CE3 1 +ATOM 1227 C CZ2 . TRP A 1 172 ? -19.833 -4.235 11.642 1.00 34.93 ? 156 TRP A CZ2 1 +ATOM 1228 C CZ3 . TRP A 1 172 ? -19.574 -4.738 9.294 1.00 26.63 ? 156 TRP A CZ3 1 +ATOM 1229 C CH2 . TRP A 1 172 ? -19.302 -3.943 10.415 1.00 30.20 ? 156 TRP A CH2 1 +ATOM 1230 N N . GLY A 1 173 ? -24.445 -9.943 8.400 1.00 14.77 ? 157 GLY A N 1 +ATOM 1231 C CA . GLY A 1 173 ? -24.701 -10.995 7.435 1.00 21.22 ? 157 GLY A CA 1 +ATOM 1232 C C . GLY A 1 173 ? -25.403 -10.455 6.204 1.00 20.13 ? 157 GLY A C 1 +ATOM 1233 O O . GLY A 1 173 ? -25.204 -10.953 5.102 1.00 25.26 ? 157 GLY A O 1 +ATOM 1234 N N . ALA A 1 174 ? -26.225 -9.429 6.396 1.00 21.15 ? 158 ALA A N 1 +ATOM 1235 C CA . ALA A 1 174 ? -26.922 -8.796 5.283 1.00 17.99 ? 158 ALA A CA 1 +ATOM 1236 C C . ALA A 1 174 ? -25.929 -8.088 4.384 1.00 12.65 ? 158 ALA A C 1 +ATOM 1237 O O . ALA A 1 174 ? -25.991 -8.209 3.164 1.00 15.77 ? 158 ALA A O 1 +ATOM 1238 C CB . ALA A 1 174 ? -27.973 -7.818 5.792 1.00 23.25 ? 158 ALA A CB 1 +ATOM 1239 N N . VAL A 1 175 ? -25.013 -7.347 5.001 1.00 17.62 ? 159 VAL A N 1 +ATOM 1240 C CA . VAL A 1 175 ? -23.957 -6.656 4.272 1.00 20.17 ? 159 VAL A CA 1 +ATOM 1241 C C . VAL A 1 175 ? -23.067 -7.655 3.543 1.00 26.48 ? 159 VAL A C 1 +ATOM 1242 O O . VAL A 1 175 ? -22.704 -7.451 2.385 1.00 19.97 ? 159 VAL A O 1 +ATOM 1243 C CB . VAL A 1 175 ? -23.095 -5.793 5.213 1.00 18.16 ? 159 VAL A CB 1 +ATOM 1244 C CG1 . VAL A 1 175 ? -21.962 -5.128 4.445 1.00 24.65 ? 159 VAL A CG1 1 +ATOM 1245 C CG2 . VAL A 1 175 ? -23.957 -4.752 5.910 1.00 23.24 ? 159 VAL A CG2 1 +ATOM 1246 N N . SER A 1 176 ? -22.733 -8.742 4.230 1.00 17.09 ? 160 SER A N 1 +ATOM 1247 C CA . SER A 1 176 ? -21.896 -9.787 3.661 1.00 19.66 ? 160 SER A CA 1 +ATOM 1248 C C . SER A 1 176 ? -22.569 -10.417 2.441 1.00 17.20 ? 160 SER A C 1 +ATOM 1249 O O . SER A 1 176 ? -21.922 -10.692 1.431 1.00 17.82 ? 160 SER A O 1 +ATOM 1250 C CB . SER A 1 176 ? -21.599 -10.856 4.719 1.00 14.39 ? 160 SER A CB 1 +ATOM 1251 O OG . SER A 1 176 ? -20.671 -11.809 4.232 1.00 25.03 ? 160 SER A OG 1 +ATOM 1252 N N . THR A 1 177 ? -23.874 -10.637 2.550 1.00 15.70 ? 161 THR A N 1 +ATOM 1253 C CA . THR A 1 177 ? -24.655 -11.238 1.482 1.00 23.77 ? 161 THR A CA 1 +ATOM 1254 C C . THR A 1 177 ? -24.684 -10.334 0.247 1.00 16.41 ? 161 THR A C 1 +ATOM 1255 O O . THR A 1 177 ? -24.692 -10.821 -0.882 1.00 23.67 ? 161 THR A O 1 +ATOM 1256 C CB . THR A 1 177 ? -26.089 -11.549 1.962 1.00 26.98 ? 161 THR A CB 1 +ATOM 1257 O OG1 . THR A 1 177 ? -26.031 -12.529 3.007 1.00 19.69 ? 161 THR A OG1 1 +ATOM 1258 C CG2 . THR A 1 177 ? -26.950 -12.089 0.825 1.00 24.01 ? 161 THR A CG2 1 +ATOM 1259 N N . ALA A 1 178 ? -24.664 -9.021 0.467 1.00 27.50 ? 162 ALA A N 1 +ATOM 1260 C CA . ALA A 1 178 ? -24.615 -8.060 -0.635 1.00 23.91 ? 162 ALA A CA 1 +ATOM 1261 C C . ALA A 1 178 ? -23.341 -8.233 -1.463 1.00 27.75 ? 162 ALA A C 1 +ATOM 1262 O O . ALA A 1 178 ? -23.393 -8.272 -2.691 1.00 21.17 ? 162 ALA A O 1 +ATOM 1263 C CB . ALA A 1 178 ? -24.716 -6.635 -0.108 1.00 19.08 ? 162 ALA A CB 1 +ATOM 1264 N N . PHE A 1 179 ? -22.200 -8.323 -0.785 1.00 11.54 ? 163 PHE A N 1 +ATOM 1265 C CA . PHE A 1 179 ? -20.933 -8.628 -1.446 1.00 11.76 ? 163 PHE A CA 1 +ATOM 1266 C C . PHE A 1 179 ? -21.009 -9.972 -2.169 1.00 14.42 ? 163 PHE A C 1 +ATOM 1267 O O . PHE A 1 179 ? -20.517 -10.117 -3.287 1.00 22.79 ? 163 PHE A O 1 +ATOM 1268 C CB . PHE A 1 179 ? -19.775 -8.667 -0.440 1.00 15.94 ? 163 PHE A CB 1 +ATOM 1269 C CG . PHE A 1 179 ? -19.310 -7.314 0.021 1.00 30.01 ? 163 PHE A CG 1 +ATOM 1270 C CD1 . PHE A 1 179 ? -18.495 -6.535 -0.784 1.00 24.77 ? 163 PHE A CD1 1 +ATOM 1271 C CD2 . PHE A 1 179 ? -19.663 -6.835 1.269 1.00 21.92 ? 163 PHE A CD2 1 +ATOM 1272 C CE1 . PHE A 1 179 ? -18.057 -5.293 -0.359 1.00 35.89 ? 163 PHE A CE1 1 +ATOM 1273 C CE2 . PHE A 1 179 ? -19.222 -5.593 1.703 1.00 20.96 ? 163 PHE A CE2 1 +ATOM 1274 C CZ . PHE A 1 179 ? -18.422 -4.823 0.888 1.00 24.76 ? 163 PHE A CZ 1 +ATOM 1275 N N . PHE A 1 180 ? -21.615 -10.949 -1.502 1.00 15.75 ? 164 PHE A N 1 +ATOM 1276 C CA . PHE A 1 180 ? -21.783 -12.300 -2.033 1.00 17.04 ? 164 PHE A CA 1 +ATOM 1277 C C . PHE A 1 180 ? -22.534 -12.282 -3.358 1.00 20.17 ? 164 PHE A C 1 +ATOM 1278 O O . PHE A 1 180 ? -22.094 -12.866 -4.344 1.00 14.94 ? 164 PHE A O 1 +ATOM 1279 C CB . PHE A 1 180 ? -22.523 -13.160 -1.004 1.00 14.68 ? 164 PHE A CB 1 +ATOM 1280 C CG . PHE A 1 180 ? -22.767 -14.582 -1.433 1.00 13.28 ? 164 PHE A CG 1 +ATOM 1281 C CD1 . PHE A 1 180 ? -21.746 -15.356 -1.952 1.00 17.67 ? 164 PHE A CD1 1 +ATOM 1282 C CD2 . PHE A 1 180 ? -24.014 -15.161 -1.255 1.00 25.67 ? 164 PHE A CD2 1 +ATOM 1283 C CE1 . PHE A 1 180 ? -21.974 -16.674 -2.323 1.00 19.23 ? 164 PHE A CE1 1 +ATOM 1284 C CE2 . PHE A 1 180 ? -24.247 -16.476 -1.619 1.00 29.64 ? 164 PHE A CE2 1 +ATOM 1285 C CZ . PHE A 1 180 ? -23.225 -17.233 -2.154 1.00 22.98 ? 164 PHE A CZ 1 +ATOM 1286 N N . VAL A 1 181 ? -23.670 -11.597 -3.369 1.00 15.10 ? 165 VAL A N 1 +ATOM 1287 C CA . VAL A 1 181 ? -24.506 -11.503 -4.559 1.00 16.25 ? 165 VAL A CA 1 +ATOM 1288 C C . VAL A 1 181 ? -23.803 -10.775 -5.706 1.00 19.15 ? 165 VAL A C 1 +ATOM 1289 O O . VAL A 1 181 ? -23.880 -11.196 -6.866 1.00 16.91 ? 165 VAL A O 1 +ATOM 1290 C CB . VAL A 1 181 ? -25.836 -10.796 -4.227 1.00 18.15 ? 165 VAL A CB 1 +ATOM 1291 C CG1 . VAL A 1 181 ? -26.580 -10.420 -5.497 1.00 27.22 ? 165 VAL A CG1 1 +ATOM 1292 C CG2 . VAL A 1 181 ? -26.683 -11.690 -3.340 1.00 14.30 ? 165 VAL A CG2 1 +ATOM 1293 N N . VAL A 1 182 ? -23.109 -9.690 -5.381 1.00 17.11 ? 166 VAL A N 1 +ATOM 1294 C CA . VAL A 1 182 ? -22.350 -8.951 -6.387 1.00 17.19 ? 166 VAL A CA 1 +ATOM 1295 C C . VAL A 1 182 ? -21.214 -9.804 -6.946 1.00 23.52 ? 166 VAL A C 1 +ATOM 1296 O O . VAL A 1 182 ? -20.972 -9.821 -8.155 1.00 17.71 ? 166 VAL A O 1 +ATOM 1297 C CB . VAL A 1 182 ? -21.787 -7.636 -5.811 1.00 25.87 ? 166 VAL A CB 1 +ATOM 1298 C CG1 . VAL A 1 182 ? -20.715 -7.054 -6.725 1.00 24.57 ? 166 VAL A CG1 1 +ATOM 1299 C CG2 . VAL A 1 182 ? -22.915 -6.635 -5.597 1.00 21.70 ? 166 VAL A CG2 1 +ATOM 1300 N N . MET A 1 183 ? -20.522 -10.518 -6.065 1.00 16.72 ? 167 MET A N 1 +ATOM 1301 C CA . MET A 1 183 ? -19.464 -11.428 -6.494 1.00 16.96 ? 167 MET A CA 1 +ATOM 1302 C C . MET A 1 183 ? -20.002 -12.465 -7.473 1.00 14.67 ? 167 MET A C 1 +ATOM 1303 O O . MET A 1 183 ? -19.405 -12.713 -8.522 1.00 19.31 ? 167 MET A O 1 +ATOM 1304 C CB . MET A 1 183 ? -18.834 -12.127 -5.289 1.00 15.44 ? 167 MET A CB 1 +ATOM 1305 C CG . MET A 1 183 ? -17.733 -13.122 -5.647 1.00 20.68 ? 167 MET A CG 1 +ATOM 1306 S SD . MET A 1 183 ? -17.131 -14.015 -4.194 1.00 25.71 ? 167 MET A SD 1 +ATOM 1307 C CE . MET A 1 183 ? -18.638 -14.800 -3.631 1.00 46.16 ? 167 MET A CE 1 +ATOM 1308 N N . ASN A 1 184 ? -21.136 -13.063 -7.121 1.00 16.55 ? 168 ASN A N 1 +ATOM 1309 C CA . ASN A 1 184 ? -21.764 -14.078 -7.962 1.00 20.38 ? 168 ASN A CA 1 +ATOM 1310 C C . ASN A 1 184 ? -22.197 -13.519 -9.311 1.00 27.64 ? 168 ASN A C 1 +ATOM 1311 O O . ASN A 1 184 ? -22.161 -14.216 -10.323 1.00 19.75 ? 168 ASN A O 1 +ATOM 1312 C CB . ASN A 1 184 ? -22.969 -14.699 -7.244 1.00 19.21 ? 168 ASN A CB 1 +ATOM 1313 C CG . ASN A 1 184 ? -22.560 -15.588 -6.082 1.00 27.08 ? 168 ASN A CG 1 +ATOM 1314 O OD1 . ASN A 1 184 ? -21.418 -16.033 -6.003 1.00 39.74 ? 168 ASN A OD1 1 +ATOM 1315 N ND2 . ASN A 1 184 ? -23.497 -15.856 -5.179 1.00 29.54 ? 168 ASN A ND2 1 +ATOM 1316 N N . TRP A 1 185 ? -22.599 -12.254 -9.323 1.00 19.77 ? 169 TRP A N 1 +ATOM 1317 C CA . TRP A 1 185 ? -23.001 -11.604 -10.563 1.00 25.78 ? 169 TRP A CA 1 +ATOM 1318 C C . TRP A 1 185 ? -21.813 -11.451 -11.503 1.00 20.53 ? 169 TRP A C 1 +ATOM 1319 O O . TRP A 1 185 ? -21.933 -11.690 -12.702 1.00 22.60 ? 169 TRP A O 1 +ATOM 1320 C CB . TRP A 1 185 ? -23.631 -10.241 -10.283 1.00 26.57 ? 169 TRP A CB 1 +ATOM 1321 C CG . TRP A 1 185 ? -23.736 -9.382 -11.500 1.00 25.85 ? 169 TRP A CG 1 +ATOM 1322 C CD1 . TRP A 1 185 ? -24.666 -9.478 -12.494 1.00 16.39 ? 169 TRP A CD1 1 +ATOM 1323 C CD2 . TRP A 1 185 ? -22.871 -8.299 -11.862 1.00 18.92 ? 169 TRP A CD2 1 +ATOM 1324 N NE1 . TRP A 1 185 ? -24.436 -8.520 -13.451 1.00 17.65 ? 169 TRP A NE1 1 +ATOM 1325 C CE2 . TRP A 1 185 ? -23.341 -7.781 -13.085 1.00 18.61 ? 169 TRP A CE2 1 +ATOM 1326 C CE3 . TRP A 1 185 ? -21.748 -7.716 -11.269 1.00 22.40 ? 169 TRP A CE3 1 +ATOM 1327 C CZ2 . TRP A 1 185 ? -22.727 -6.710 -13.726 1.00 18.83 ? 169 TRP A CZ2 1 +ATOM 1328 C CZ3 . TRP A 1 185 ? -21.137 -6.652 -11.907 1.00 23.75 ? 169 TRP A CZ3 1 +ATOM 1329 C CH2 . TRP A 1 185 ? -21.627 -6.160 -13.124 1.00 20.09 ? 169 TRP A CH2 1 +ATOM 1330 N N . ILE A 1 186 ? -20.667 -11.058 -10.957 1.00 19.27 ? 170 ILE A N 1 +ATOM 1331 C CA . ILE A 1 186 ? -19.451 -10.952 -11.752 1.00 22.60 ? 170 ILE A CA 1 +ATOM 1332 C C . ILE A 1 186 ? -19.084 -12.307 -12.351 1.00 21.86 ? 170 ILE A C 1 +ATOM 1333 O O . ILE A 1 186 ? -18.795 -12.418 -13.543 1.00 24.80 ? 170 ILE A O 1 +ATOM 1334 C CB . ILE A 1 186 ? -18.269 -10.432 -10.918 1.00 29.30 ? 170 ILE A CB 1 +ATOM 1335 C CG1 . ILE A 1 186 ? -18.574 -9.035 -10.377 1.00 23.50 ? 170 ILE A CG1 1 +ATOM 1336 C CG2 . ILE A 1 186 ? -17.002 -10.419 -11.753 1.00 15.45 ? 170 ILE A CG2 1 +ATOM 1337 C CD1 . ILE A 1 186 ? -17.458 -8.438 -9.544 1.00 20.73 ? 170 ILE A CD1 1 +ATOM 1338 N N . VAL A 1 187 ? -19.112 -13.336 -11.512 1.00 18.71 ? 171 VAL A N 1 +ATOM 1339 C CA . VAL A 1 187 ? -18.793 -14.692 -11.938 1.00 26.33 ? 171 VAL A CA 1 +ATOM 1340 C C . VAL A 1 187 ? -19.733 -15.162 -13.054 1.00 22.50 ? 171 VAL A C 1 +ATOM 1341 O O . VAL A 1 187 ? -19.280 -15.595 -14.114 1.00 20.17 ? 171 VAL A O 1 +ATOM 1342 C CB . VAL A 1 187 ? -18.862 -15.673 -10.751 1.00 28.14 ? 171 VAL A CB 1 +ATOM 1343 C CG1 . VAL A 1 187 ? -18.791 -17.108 -11.236 1.00 18.90 ? 171 VAL A CG1 1 +ATOM 1344 C CG2 . VAL A 1 187 ? -17.740 -15.377 -9.744 1.00 14.69 ? 171 VAL A CG2 1 +ATOM 1345 N N . GLY A 1 188 ? -21.037 -15.059 -12.815 1.00 21.57 ? 172 GLY A N 1 +ATOM 1346 C CA . GLY A 1 188 ? -22.030 -15.457 -13.799 1.00 26.47 ? 172 GLY A CA 1 +ATOM 1347 C C . GLY A 1 188 ? -21.880 -14.717 -15.116 1.00 20.89 ? 172 GLY A C 1 +ATOM 1348 O O . GLY A 1 188 ? -21.950 -15.313 -16.191 1.00 28.44 ? 172 GLY A O 1 +ATOM 1349 N N . THR A 1 189 ? -21.655 -13.412 -15.030 1.00 18.25 ? 173 THR A N 1 +ATOM 1350 C CA . THR A 1 189 ? -21.483 -12.590 -16.217 1.00 20.01 ? 173 THR A CA 1 +ATOM 1351 C C . THR A 1 189 ? -20.266 -13.035 -17.028 1.00 33.30 ? 173 THR A C 1 +ATOM 1352 O O . THR A 1 189 ? -20.337 -13.128 -18.248 1.00 22.16 ? 173 THR A O 1 +ATOM 1353 C CB . THR A 1 189 ? -21.352 -11.098 -15.848 1.00 21.62 ? 173 THR A CB 1 +ATOM 1354 O OG1 . THR A 1 189 ? -22.582 -10.647 -15.263 1.00 25.61 ? 173 THR A OG1 1 +ATOM 1355 C CG2 . THR A 1 189 ? -21.055 -10.261 -17.084 1.00 28.92 ? 173 THR A CG2 1 +ATOM 1356 N N . LYS A 1 190 ? -19.159 -13.330 -16.354 1.00 20.39 ? 174 LYS A N 1 +ATOM 1357 C CA . LYS A 1 190 ? -17.957 -13.784 -17.055 1.00 20.20 ? 174 LYS A CA 1 +ATOM 1358 C C . LYS A 1 190 ? -18.141 -15.182 -17.643 1.00 23.88 ? 174 LYS A C 1 +ATOM 1359 O O . LYS A 1 190 ? -17.695 -15.453 -18.756 1.00 26.02 ? 174 LYS A O 1 +ATOM 1360 C CB . LYS A 1 190 ? -16.744 -13.766 -16.121 1.00 18.32 ? 174 LYS A CB 1 +ATOM 1361 C CG . LYS A 1 190 ? -16.295 -12.369 -15.719 1.00 26.43 ? 174 LYS A CG 1 +ATOM 1362 C CD . LYS A 1 190 ? -15.936 -11.534 -16.940 1.00 32.84 ? 174 LYS A CD 1 +ATOM 1363 C CE . LYS A 1 190 ? -15.512 -10.128 -16.544 1.00 46.60 ? 174 LYS A CE 1 +ATOM 1364 N NZ . LYS A 1 190 ? -15.175 -9.294 -17.732 1.00 40.03 ? 174 LYS A NZ 1 +ATOM 1365 N N . ILE A 1 191 ? -18.796 -16.066 -16.895 1.00 17.13 ? 175 ILE A N 1 +ATOM 1366 C CA . ILE A 1 191 ? -19.032 -17.428 -17.364 1.00 20.52 ? 175 ILE A CA 1 +ATOM 1367 C C . ILE A 1 191 ? -19.904 -17.463 -18.619 1.00 33.97 ? 175 ILE A C 1 +ATOM 1368 O O . ILE A 1 191 ? -19.521 -18.048 -19.631 1.00 25.67 ? 175 ILE A O 1 +ATOM 1369 C CB . ILE A 1 191 ? -19.687 -18.292 -16.273 1.00 19.21 ? 175 ILE A CB 1 +ATOM 1370 C CG1 . ILE A 1 191 ? -18.664 -18.636 -15.188 1.00 19.52 ? 175 ILE A CG1 1 +ATOM 1371 C CG2 . ILE A 1 191 ? -20.234 -19.580 -16.867 1.00 28.05 ? 175 ILE A CG2 1 +ATOM 1372 C CD1 . ILE A 1 191 ? -19.197 -19.560 -14.122 1.00 22.73 ? 175 ILE A CD1 1 +ATOM 1373 N N . PHE A 1 192 ? -21.069 -16.828 -18.562 1.00 23.75 ? 176 PHE A N 1 +ATOM 1374 C CA . PHE A 1 192 ? -22.009 -16.907 -19.675 1.00 45.18 ? 176 PHE A CA 1 +ATOM 1375 C C . PHE A 1 192 ? -21.562 -16.072 -20.875 1.00 36.06 ? 176 PHE A C 1 +ATOM 1376 O O . PHE A 1 192 ? -22.006 -16.308 -21.996 1.00 42.46 ? 176 PHE A O 1 +ATOM 1377 C CB . PHE A 1 192 ? -23.413 -16.499 -19.215 1.00 35.10 ? 176 PHE A CB 1 +ATOM 1378 C CG . PHE A 1 192 ? -24.040 -17.490 -18.273 1.00 33.49 ? 176 PHE A CG 1 +ATOM 1379 C CD1 . PHE A 1 192 ? -24.416 -18.746 -18.724 1.00 50.21 ? 176 PHE A CD1 1 +ATOM 1380 C CD2 . PHE A 1 192 ? -24.232 -17.180 -16.938 1.00 47.83 ? 176 PHE A CD2 1 +ATOM 1381 C CE1 . PHE A 1 192 ? -24.980 -19.671 -17.863 1.00 31.99 ? 176 PHE A CE1 1 +ATOM 1382 C CE2 . PHE A 1 192 ? -24.796 -18.101 -16.070 1.00 35.25 ? 176 PHE A CE2 1 +ATOM 1383 C CZ . PHE A 1 192 ? -25.170 -19.346 -16.534 1.00 52.88 ? 176 PHE A CZ 1 +ATOM 1384 N N . LYS A 1 193 ? -20.666 -15.117 -20.648 1.00 25.38 ? 177 LYS A N 1 +ATOM 1385 C CA . LYS A 1 193 ? -20.100 -14.344 -21.751 1.00 26.05 ? 177 LYS A CA 1 +ATOM 1386 C C . LYS A 1 193 ? -18.965 -15.088 -22.463 1.00 42.91 ? 177 LYS A C 1 +ATOM 1387 O O . LYS A 1 193 ? -18.907 -15.112 -23.692 1.00 77.38 ? 177 LYS A O 1 +ATOM 1388 C CB . LYS A 1 193 ? -19.593 -12.993 -21.251 1.00 23.15 ? 177 LYS A CB 1 +ATOM 1389 C CG . LYS A 1 193 ? -18.768 -12.224 -22.274 1.00 35.48 ? 177 LYS A CG 1 +ATOM 1390 C CD . LYS A 1 193 ? -18.018 -11.075 -21.619 1.00 91.50 ? 177 LYS A CD 1 +ATOM 1391 C CE . LYS A 1 193 ? -17.055 -10.413 -22.593 1.00 102.04 ? 177 LYS A CE 1 +ATOM 1392 N NZ . LYS A 1 193 ? -16.253 -9.338 -21.942 1.00 84.27 ? 177 LYS A NZ 1 +ATOM 1393 N N . ASN A 1 194 ? -18.068 -15.697 -21.690 1.00 28.09 ? 178 ASN A N 1 +ATOM 1394 C CA . ASN A 1 194 ? -16.882 -16.347 -22.248 1.00 22.93 ? 178 ASN A CA 1 +ATOM 1395 C C . ASN A 1 194 ? -17.087 -17.820 -22.549 1.00 25.58 ? 178 ASN A C 1 +ATOM 1396 O O . ASN A 1 194 ? -16.166 -18.504 -22.998 1.00 29.26 ? 178 ASN A O 1 +ATOM 1397 C CB . ASN A 1 194 ? -15.694 -16.192 -21.299 1.00 24.85 ? 178 ASN A CB 1 +ATOM 1398 C CG . ASN A 1 194 ? -15.233 -14.762 -21.183 1.00 41.14 ? 178 ASN A CG 1 +ATOM 1399 O OD1 . ASN A 1 194 ? -14.429 -14.292 -21.989 1.00 36.93 ? 178 ASN A OD1 1 +ATOM 1400 N ND2 . ASN A 1 194 ? -15.735 -14.058 -20.176 1.00 32.93 ? 178 ASN A ND2 1 +ATOM 1401 N N . ARG A 1 195 ? -18.296 -18.300 -22.287 1.00 26.18 ? 179 ARG A N 1 +ATOM 1402 C CA . ARG A 1 195 ? -18.665 -19.687 -22.540 1.00 31.06 ? 179 ARG A CA 1 +ATOM 1403 C C . ARG A 1 195 ? -18.361 -20.108 -23.981 1.00 63.37 ? 179 ARG A C 1 +ATOM 1404 O O . ARG A 1 195 ? -17.916 -21.229 -24.234 1.00 36.12 ? 179 ARG A O 1 +ATOM 1405 C CB . ARG A 1 195 ? -20.150 -19.884 -22.225 1.00 33.12 ? 179 ARG A CB 1 +ATOM 1406 C CG . ARG A 1 195 ? -20.678 -21.269 -22.498 1.00 52.70 ? 179 ARG A CG 1 +ATOM 1407 C CD . ARG A 1 195 ? -22.055 -21.457 -21.883 1.00 41.73 ? 179 ARG A CD 1 +ATOM 1408 N NE . ARG A 1 195 ? -23.010 -20.442 -22.314 1.00 54.14 ? 179 ARG A NE 1 +ATOM 1409 C CZ . ARG A 1 195 ? -24.291 -20.427 -21.955 1.00 77.94 ? 179 ARG A CZ 1 +ATOM 1410 N NH1 . ARG A 1 195 ? -24.769 -21.377 -21.163 1.00 54.73 ? 179 ARG A NH1 1 +ATOM 1411 N NH2 . ARG A 1 195 ? -25.095 -19.468 -22.392 1.00 62.06 ? 179 ARG A NH2 1 +ATOM 1412 N N . ALA A 1 196 ? -18.576 -19.189 -24.917 1.00 38.40 ? 180 ALA A N 1 +ATOM 1413 C CA . ALA A 1 196 ? -18.401 -19.472 -26.341 1.00 47.99 ? 180 ALA A CA 1 +ATOM 1414 C C . ALA A 1 196 ? -16.942 -19.709 -26.738 1.00 35.65 ? 180 ALA A C 1 +ATOM 1415 O O . ALA A 1 196 ? -16.671 -20.360 -27.746 1.00 46.32 ? 180 ALA A O 1 +ATOM 1416 C CB . ALA A 1 196 ? -18.985 -18.335 -27.167 1.00 44.62 ? 180 ALA A CB 1 +ATOM 1417 N N . THR A 1 197 ? -16.006 -19.187 -25.950 1.00 42.27 ? 181 THR A N 1 +ATOM 1418 C CA . THR A 1 197 ? -14.585 -19.303 -26.276 1.00 43.28 ? 181 THR A CA 1 +ATOM 1419 C C . THR A 1 197 ? -14.010 -20.670 -25.918 1.00 36.78 ? 181 THR A C 1 +ATOM 1420 O O . THR A 1 197 ? -12.863 -20.973 -26.246 1.00 39.93 ? 181 THR A O 1 +ATOM 1421 C CB . THR A 1 197 ? -13.744 -18.230 -25.549 1.00 57.51 ? 181 THR A CB 1 +ATOM 1422 O OG1 . THR A 1 197 ? -13.499 -18.636 -24.192 1.00 31.73 ? 181 THR A OG1 1 +ATOM 1423 C CG2 . THR A 1 197 ? -14.458 -16.889 -25.569 1.00 49.88 ? 181 THR A CG2 1 +ATOM 1424 N N . MET A 1 198 ? -14.805 -21.494 -25.247 1.00 32.07 ? 182 MET A N 1 +ATOM 1425 C CA . MET A 1 198 ? -14.283 -22.717 -24.656 1.00 42.02 ? 182 MET A CA 1 +ATOM 1426 C C . MET A 1 198 ? -14.412 -23.931 -25.562 1.00 37.98 ? 182 MET A C 1 +ATOM 1427 O O . MET A 1 198 ? -15.397 -24.093 -26.281 1.00 31.27 ? 182 MET A O 1 +ATOM 1428 C CB . MET A 1 198 ? -14.968 -22.966 -23.319 1.00 32.83 ? 182 MET A CB 1 +ATOM 1429 C CG . MET A 1 198 ? -14.722 -21.826 -22.346 1.00 30.62 ? 182 MET A CG 1 +ATOM 1430 S SD . MET A 1 198 ? -15.526 -22.048 -20.764 1.00 32.46 ? 182 MET A SD 1 +ATOM 1431 C CE . MET A 1 198 ? -14.689 -23.502 -20.136 1.00 24.34 ? 182 MET A CE 1 +ATOM 1432 N N . LEU A 1 199 ? -13.400 -24.788 -25.491 1.00 23.08 ? 183 LEU A N 1 +ATOM 1433 C CA . LEU A 1 199 ? -13.195 -25.863 -26.451 1.00 21.32 ? 183 LEU A CA 1 +ATOM 1434 C C . LEU A 1 199 ? -13.611 -27.230 -25.929 1.00 23.09 ? 183 LEU A C 1 +ATOM 1435 O O . LEU A 1 199 ? -13.814 -27.410 -24.729 1.00 26.19 ? 183 LEU A O 1 +ATOM 1436 C CB . LEU A 1 199 ? -11.718 -25.914 -26.851 1.00 22.97 ? 183 LEU A CB 1 +ATOM 1437 C CG . LEU A 1 199 ? -10.992 -24.579 -27.029 1.00 36.80 ? 183 LEU A CG 1 +ATOM 1438 C CD1 . LEU A 1 199 ? -9.487 -24.792 -27.114 1.00 35.55 ? 183 LEU A CD1 1 +ATOM 1439 C CD2 . LEU A 1 199 ? -11.500 -23.859 -28.267 1.00 36.11 ? 183 LEU A CD2 1 +ATOM 1440 N N . GLY A 1 200 ? -13.718 -28.190 -26.845 1.00 21.57 ? 184 GLY A N 1 +ATOM 1441 C CA . GLY A 1 200 ? -13.931 -29.583 -26.496 1.00 18.88 ? 184 GLY A CA 1 +ATOM 1442 C C . GLY A 1 200 ? -15.230 -29.853 -25.768 1.00 26.34 ? 184 GLY A C 1 +ATOM 1443 O O . GLY A 1 200 ? -15.347 -30.836 -25.037 1.00 26.01 ? 184 GLY A O 1 +ATOM 1444 N N . GLY A 1 201 ? -16.206 -28.973 -25.962 1.00 24.16 ? 185 GLY A N 1 +ATOM 1445 C CA . GLY A 1 201 ? -17.515 -29.135 -25.357 1.00 30.38 ? 185 GLY A CA 1 +ATOM 1446 C C . GLY A 1 201 ? -17.600 -28.647 -23.922 1.00 28.76 ? 185 GLY A C 1 +ATOM 1447 O O . GLY A 1 201 ? -18.605 -28.870 -23.247 1.00 33.02 ? 185 GLY A O 1 +ATOM 1448 N N . THR A 1 202 ? -16.555 -27.970 -23.455 1.00 26.86 ? 186 THR A N 1 +ATOM 1449 C CA . THR A 1 202 ? -16.520 -27.495 -22.074 1.00 21.22 ? 186 THR A CA 1 +ATOM 1450 C C . THR A 1 202 ? -17.380 -26.247 -21.889 1.00 34.44 ? 186 THR A C 1 +ATOM 1451 O O . THR A 1 202 ? -17.557 -25.771 -20.768 1.00 24.32 ? 186 THR A O 1 +ATOM 1452 C CB . THR A 1 202 ? -15.082 -27.194 -21.611 1.00 20.22 ? 186 THR A CB 1 +ATOM 1453 O OG1 . THR A 1 202 ? -14.503 -26.181 -22.443 1.00 19.93 ? 186 THR A OG1 1 +ATOM 1454 C CG2 . THR A 1 202 ? -14.232 -28.451 -21.683 1.00 17.09 ? 186 THR A CG2 1 +ATOM 1455 N N . ASP A 1 203 ? -17.911 -25.723 -22.991 1.00 22.60 ? 187 ASP A N 1 +ATOM 1456 C CA . ASP A 1 203 ? -18.882 -24.635 -22.929 1.00 20.72 ? 187 ASP A CA 1 +ATOM 1457 C C . ASP A 1 203 ? -20.136 -25.110 -22.198 1.00 24.08 ? 187 ASP A C 1 +ATOM 1458 O O . ASP A 1 203 ? -20.789 -24.342 -21.499 1.00 30.23 ? 187 ASP A O 1 +ATOM 1459 C CB . ASP A 1 203 ? -19.234 -24.132 -24.331 1.00 31.12 ? 187 ASP A CB 1 +ATOM 1460 C CG . ASP A 1 203 ? -19.787 -25.226 -25.224 1.00 42.46 ? 187 ASP A CG 1 +ATOM 1461 O OD1 . ASP A 1 203 ? -19.168 -26.308 -25.297 1.00 49.15 ? 187 ASP A OD1 1 +ATOM 1462 O OD2 . ASP A 1 203 ? -20.846 -25.006 -25.847 1.00 73.36 ? 187 ASP A OD2 1 +ATOM 1463 N N . SER A 1 204 ? -20.457 -26.388 -22.361 1.00 24.13 ? 188 SER A N 1 +ATOM 1464 C CA . SER A 1 204 ? -21.563 -27.002 -21.638 1.00 27.86 ? 188 SER A CA 1 +ATOM 1465 C C . SER A 1 204 ? -21.189 -27.282 -20.185 1.00 33.17 ? 188 SER A C 1 +ATOM 1466 O O . SER A 1 204 ? -21.997 -27.092 -19.275 1.00 28.98 ? 188 SER A O 1 +ATOM 1467 C CB . SER A 1 204 ? -21.992 -28.303 -22.320 1.00 33.85 ? 188 SER A CB 1 +ATOM 1468 O OG . SER A 1 204 ? -22.843 -29.057 -21.474 1.00 45.84 ? 188 SER A OG 1 +ATOM 1469 N N . THR A 1 205 ? -19.958 -27.737 -19.976 1.00 23.50 ? 189 THR A N 1 +ATOM 1470 C CA . THR A 1 205 ? -19.504 -28.139 -18.651 1.00 16.34 ? 189 THR A CA 1 +ATOM 1471 C C . THR A 1 205 ? -19.412 -26.961 -17.685 1.00 22.17 ? 189 THR A C 1 +ATOM 1472 O O . THR A 1 205 ? -19.782 -27.078 -16.519 1.00 20.36 ? 189 THR A O 1 +ATOM 1473 C CB . THR A 1 205 ? -18.129 -28.825 -18.717 1.00 25.82 ? 189 THR A CB 1 +ATOM 1474 O OG1 . THR A 1 205 ? -18.095 -29.732 -19.826 1.00 27.66 ? 189 THR A OG1 1 +ATOM 1475 C CG2 . THR A 1 205 ? -17.850 -29.584 -17.420 1.00 20.56 ? 189 THR A CG2 1 +ATOM 1476 N N . ILE A 1 206 ? -18.920 -25.829 -18.180 1.00 15.62 ? 190 ILE A N 1 +ATOM 1477 C CA . ILE A 1 206 ? -18.690 -24.656 -17.347 1.00 21.56 ? 190 ILE A CA 1 +ATOM 1478 C C . ILE A 1 206 ? -19.997 -24.107 -16.764 1.00 24.28 ? 190 ILE A C 1 +ATOM 1479 O O . ILE A 1 206 ? -19.997 -23.475 -15.707 1.00 19.22 ? 190 ILE A O 1 +ATOM 1480 C CB . ILE A 1 206 ? -17.957 -23.546 -18.143 1.00 20.54 ? 190 ILE A CB 1 +ATOM 1481 C CG1 . ILE A 1 206 ? -17.387 -22.485 -17.200 1.00 20.68 ? 190 ILE A CG1 1 +ATOM 1482 C CG2 . ILE A 1 206 ? -18.871 -22.928 -19.197 1.00 26.49 ? 190 ILE A CG2 1 +ATOM 1483 C CD1 . ILE A 1 206 ? -16.337 -23.020 -16.248 1.00 18.29 ? 190 ILE A CD1 1 +ATOM 1484 N N . THR A 1 207 ? -21.107 -24.369 -17.448 1.00 17.11 ? 191 THR A N 1 +ATOM 1485 C CA . THR A 1 207 ? -22.426 -23.978 -16.964 1.00 25.59 ? 191 THR A CA 1 +ATOM 1486 C C . THR A 1 207 ? -22.811 -24.744 -15.697 1.00 19.75 ? 191 THR A C 1 +ATOM 1487 O O . THR A 1 207 ? -23.370 -24.168 -14.764 1.00 22.95 ? 191 THR A O 1 +ATOM 1488 C CB . THR A 1 207 ? -23.499 -24.199 -18.051 1.00 30.33 ? 191 THR A CB 1 +ATOM 1489 O OG1 . THR A 1 207 ? -23.196 -23.376 -19.184 1.00 40.55 ? 191 THR A OG1 1 +ATOM 1490 C CG2 . THR A 1 207 ? -24.884 -23.848 -17.532 1.00 34.25 ? 191 THR A CG2 1 +ATOM 1491 N N . LYS A 1 208 ? -22.508 -26.040 -15.658 1.00 18.51 ? 192 LYS A N 1 +ATOM 1492 C CA . LYS A 1 208 ? -22.767 -26.826 -14.455 1.00 20.60 ? 192 LYS A CA 1 +ATOM 1493 C C . LYS A 1 208 ? -21.860 -26.382 -13.313 1.00 16.54 ? 192 LYS A C 1 +ATOM 1494 O O . LYS A 1 208 ? -22.223 -26.501 -12.145 1.00 19.92 ? 192 LYS A O 1 +ATOM 1495 C CB . LYS A 1 208 ? -22.578 -28.324 -14.713 1.00 21.56 ? 192 LYS A CB 1 +ATOM 1496 C CG . LYS A 1 208 ? -23.742 -28.984 -15.433 1.00 29.72 ? 192 LYS A CG 1 +ATOM 1497 C CD . LYS A 1 208 ? -23.464 -29.096 -16.917 1.00 36.43 ? 192 LYS A CD 1 +ATOM 1498 C CE . LYS A 1 208 ? -24.562 -28.462 -17.739 1.00 44.86 ? 192 LYS A CE 1 +ATOM 1499 N NZ . LYS A 1 208 ? -24.362 -28.740 -19.191 1.00 26.37 ? 192 LYS A NZ 1 +ATOM 1500 N N . VAL A 1 209 ? -20.676 -25.883 -13.653 1.00 13.41 ? 193 VAL A N 1 +ATOM 1501 C CA . VAL A 1 209 ? -19.751 -25.395 -12.640 1.00 13.28 ? 193 VAL A CA 1 +ATOM 1502 C C . VAL A 1 209 ? -20.351 -24.185 -11.931 1.00 23.14 ? 193 VAL A C 1 +ATOM 1503 O O . VAL A 1 209 ? -20.286 -24.089 -10.710 1.00 20.49 ? 193 VAL A O 1 +ATOM 1504 C CB . VAL A 1 209 ? -18.380 -25.029 -13.247 1.00 22.78 ? 193 VAL A CB 1 +ATOM 1505 C CG1 . VAL A 1 209 ? -17.564 -24.201 -12.271 1.00 23.43 ? 193 VAL A CG1 1 +ATOM 1506 C CG2 . VAL A 1 209 ? -17.618 -26.295 -13.634 1.00 23.69 ? 193 VAL A CG2 1 +ATOM 1507 N N . PHE A 1 210 ? -20.944 -23.276 -12.701 1.00 12.88 ? 194 PHE A N 1 +ATOM 1508 C CA . PHE A 1 210 ? -21.611 -22.105 -12.137 1.00 22.93 ? 194 PHE A CA 1 +ATOM 1509 C C . PHE A 1 210 ? -22.678 -22.511 -11.125 1.00 23.44 ? 194 PHE A C 1 +ATOM 1510 O O . PHE A 1 210 ? -22.730 -21.978 -10.015 1.00 19.55 ? 194 PHE A O 1 +ATOM 1511 C CB . PHE A 1 210 ? -22.245 -21.254 -13.245 1.00 20.70 ? 194 PHE A CB 1 +ATOM 1512 C CG . PHE A 1 210 ? -23.177 -20.185 -12.734 1.00 22.69 ? 194 PHE A CG 1 +ATOM 1513 C CD1 . PHE A 1 210 ? -22.679 -18.993 -12.233 1.00 26.10 ? 194 PHE A CD1 1 +ATOM 1514 C CD2 . PHE A 1 210 ? -24.551 -20.375 -12.752 1.00 29.57 ? 194 PHE A CD2 1 +ATOM 1515 C CE1 . PHE A 1 210 ? -23.535 -18.010 -11.759 1.00 20.96 ? 194 PHE A CE1 1 +ATOM 1516 C CE2 . PHE A 1 210 ? -25.412 -19.397 -12.279 1.00 45.47 ? 194 PHE A CE2 1 +ATOM 1517 C CZ . PHE A 1 210 ? -24.904 -18.213 -11.782 1.00 28.28 ? 194 PHE A CZ 1 +ATOM 1518 N N . TRP A 1 211 ? -23.523 -23.462 -11.508 1.00 15.92 ? 195 TRP A N 1 +ATOM 1519 C CA . TRP A 1 211 ? -24.613 -23.889 -10.639 1.00 18.71 ? 195 TRP A CA 1 +ATOM 1520 C C . TRP A 1 211 ? -24.093 -24.660 -9.432 1.00 27.14 ? 195 TRP A C 1 +ATOM 1521 O O . TRP A 1 211 ? -24.669 -24.582 -8.347 1.00 17.76 ? 195 TRP A O 1 +ATOM 1522 C CB . TRP A 1 211 ? -25.630 -24.726 -11.420 1.00 21.25 ? 195 TRP A CB 1 +ATOM 1523 C CG . TRP A 1 211 ? -26.498 -23.888 -12.307 1.00 24.20 ? 195 TRP A CG 1 +ATOM 1524 C CD1 . TRP A 1 211 ? -26.415 -23.770 -13.664 1.00 25.62 ? 195 TRP A CD1 1 +ATOM 1525 C CD2 . TRP A 1 211 ? -27.571 -23.033 -11.894 1.00 18.06 ? 195 TRP A CD2 1 +ATOM 1526 N NE1 . TRP A 1 211 ? -27.375 -22.898 -14.122 1.00 30.37 ? 195 TRP A NE1 1 +ATOM 1527 C CE2 . TRP A 1 211 ? -28.096 -22.431 -13.054 1.00 21.10 ? 195 TRP A CE2 1 +ATOM 1528 C CE3 . TRP A 1 211 ? -28.141 -22.720 -10.655 1.00 22.36 ? 195 TRP A CE3 1 +ATOM 1529 C CZ2 . TRP A 1 211 ? -29.164 -21.536 -13.013 1.00 37.79 ? 195 TRP A CZ2 1 +ATOM 1530 C CZ3 . TRP A 1 211 ? -29.200 -21.831 -10.616 1.00 42.10 ? 195 TRP A CZ3 1 +ATOM 1531 C CH2 . TRP A 1 211 ? -29.701 -21.250 -11.788 1.00 33.09 ? 195 TRP A CH2 1 +ATOM 1532 N N . LEU A 1 212 ? -22.999 -25.392 -9.616 1.00 15.25 ? 196 LEU A N 1 +ATOM 1533 C CA . LEU A 1 212 ? -22.347 -26.052 -8.490 1.00 15.37 ? 196 LEU A CA 1 +ATOM 1534 C C . LEU A 1 212 ? -21.880 -25.021 -7.461 1.00 18.45 ? 196 LEU A C 1 +ATOM 1535 O O . LEU A 1 212 ? -22.029 -25.224 -6.256 1.00 19.07 ? 196 LEU A O 1 +ATOM 1536 C CB . LEU A 1 212 ? -21.162 -26.894 -8.961 1.00 17.01 ? 196 LEU A CB 1 +ATOM 1537 C CG . LEU A 1 212 ? -20.295 -27.469 -7.838 1.00 19.45 ? 196 LEU A CG 1 +ATOM 1538 C CD1 . LEU A 1 212 ? -21.092 -28.464 -7.018 1.00 19.08 ? 196 LEU A CD1 1 +ATOM 1539 C CD2 . LEU A 1 212 ? -19.021 -28.106 -8.382 1.00 16.38 ? 196 LEU A CD2 1 +ATOM 1540 N N . MET A 1 213 ? -21.318 -23.916 -7.946 1.00 14.67 ? 197 MET A N 1 +ATOM 1541 C CA . MET A 1 213 ? -20.843 -22.843 -7.071 1.00 21.14 ? 197 MET A CA 1 +ATOM 1542 C C . MET A 1 213 ? -21.995 -22.191 -6.317 1.00 20.06 ? 197 MET A C 1 +ATOM 1543 O O . MET A 1 213 ? -21.894 -21.937 -5.116 1.00 21.78 ? 197 MET A O 1 +ATOM 1544 C CB . MET A 1 213 ? -20.094 -21.774 -7.872 1.00 17.53 ? 197 MET A CB 1 +ATOM 1545 C CG . MET A 1 213 ? -18.850 -22.262 -8.585 1.00 34.04 ? 197 MET A CG 1 +ATOM 1546 S SD . MET A 1 213 ? -18.088 -20.961 -9.575 1.00 31.89 ? 197 MET A SD 1 +ATOM 1547 C CE . MET A 1 213 ? -17.487 -19.867 -8.291 1.00 35.56 ? 197 MET A CE 1 +ATOM 1548 N N . MET A 1 214 ? -23.078 -21.903 -7.034 1.00 29.11 ? 198 MET A N 1 +ATOM 1549 C CA . MET A 1 214 ? -24.254 -21.276 -6.437 1.00 26.40 ? 198 MET A CA 1 +ATOM 1550 C C . MET A 1 214 ? -24.790 -22.116 -5.290 1.00 24.44 ? 198 MET A C 1 +ATOM 1551 O O . MET A 1 214 ? -25.115 -21.596 -4.223 1.00 25.65 ? 198 MET A O 1 +ATOM 1552 C CB . MET A 1 214 ? -25.354 -21.070 -7.483 1.00 23.98 ? 198 MET A CB 1 +ATOM 1553 C CG . MET A 1 214 ? -24.983 -20.145 -8.635 1.00 34.10 ? 198 MET A CG 1 +ATOM 1554 S SD . MET A 1 214 ? -24.605 -18.461 -8.117 1.00 34.07 ? 198 MET A SD 1 +ATOM 1555 C CE . MET A 1 214 ? -22.814 -18.491 -8.108 1.00 33.05 ? 198 MET A CE 1 +ATOM 1556 N N . PHE A 1 215 ? -24.881 -23.420 -5.521 1.00 20.02 ? 199 PHE A N 1 +ATOM 1557 C CA . PHE A 1 215 ? -25.386 -24.340 -4.515 1.00 21.83 ? 199 PHE A CA 1 +ATOM 1558 C C . PHE A 1 215 ? -24.416 -24.431 -3.334 1.00 17.29 ? 199 PHE A C 1 +ATOM 1559 O O . PHE A 1 215 ? -24.781 -24.137 -2.195 1.00 20.08 ? 199 PHE A O 1 +ATOM 1560 C CB . PHE A 1 215 ? -25.632 -25.723 -5.136 1.00 20.10 ? 199 PHE A CB 1 +ATOM 1561 C CG . PHE A 1 215 ? -25.419 -26.869 -4.180 1.00 24.58 ? 199 PHE A CG 1 +ATOM 1562 C CD1 . PHE A 1 215 ? -26.328 -27.125 -3.167 1.00 26.09 ? 199 PHE A CD1 1 +ATOM 1563 C CD2 . PHE A 1 215 ? -24.308 -27.692 -4.303 1.00 28.84 ? 199 PHE A CD2 1 +ATOM 1564 C CE1 . PHE A 1 215 ? -26.127 -28.173 -2.285 1.00 24.60 ? 199 PHE A CE1 1 +ATOM 1565 C CE2 . PHE A 1 215 ? -24.103 -28.745 -3.426 1.00 32.02 ? 199 PHE A CE2 1 +ATOM 1566 C CZ . PHE A 1 215 ? -25.017 -28.982 -2.416 1.00 28.30 ? 199 PHE A CZ 1 +ATOM 1567 N N . ALA A 1 216 ? -23.175 -24.808 -3.620 1.00 15.91 ? 200 ALA A N 1 +ATOM 1568 C CA . ALA A 1 216 ? -22.200 -25.105 -2.573 1.00 18.95 ? 200 ALA A CA 1 +ATOM 1569 C C . ALA A 1 216 ? -21.846 -23.889 -1.714 1.00 21.12 ? 200 ALA A C 1 +ATOM 1570 O O . ALA A 1 216 ? -21.795 -23.986 -0.494 1.00 16.15 ? 200 ALA A O 1 +ATOM 1571 C CB . ALA A 1 216 ? -20.939 -25.697 -3.188 1.00 16.66 ? 200 ALA A CB 1 +ATOM 1572 N N . TRP A 1 217 ? -21.603 -22.745 -2.342 1.00 13.59 ? 201 TRP A N 1 +ATOM 1573 C CA . TRP A 1 217 ? -21.212 -21.561 -1.584 1.00 20.08 ? 201 TRP A CA 1 +ATOM 1574 C C . TRP A 1 217 ? -22.346 -21.050 -0.688 1.00 23.93 ? 201 TRP A C 1 +ATOM 1575 O O . TRP A 1 217 ? -22.095 -20.407 0.328 1.00 13.41 ? 201 TRP A O 1 +ATOM 1576 C CB . TRP A 1 217 ? -20.743 -20.444 -2.523 1.00 13.05 ? 201 TRP A CB 1 +ATOM 1577 C CG . TRP A 1 217 ? -19.459 -20.751 -3.242 1.00 18.57 ? 201 TRP A CG 1 +ATOM 1578 C CD1 . TRP A 1 217 ? -19.063 -21.960 -3.743 1.00 21.79 ? 201 TRP A CD1 1 +ATOM 1579 C CD2 . TRP A 1 217 ? -18.395 -19.835 -3.527 1.00 19.55 ? 201 TRP A CD2 1 +ATOM 1580 N NE1 . TRP A 1 217 ? -17.828 -21.849 -4.331 1.00 18.90 ? 201 TRP A NE1 1 +ATOM 1581 C CE2 . TRP A 1 217 ? -17.394 -20.555 -4.209 1.00 20.40 ? 201 TRP A CE2 1 +ATOM 1582 C CE3 . TRP A 1 217 ? -18.192 -18.475 -3.272 1.00 27.23 ? 201 TRP A CE3 1 +ATOM 1583 C CZ2 . TRP A 1 217 ? -16.207 -19.961 -4.639 1.00 18.52 ? 201 TRP A CZ2 1 +ATOM 1584 C CZ3 . TRP A 1 217 ? -17.014 -17.888 -3.702 1.00 31.82 ? 201 TRP A CZ3 1 +ATOM 1585 C CH2 . TRP A 1 217 ? -16.038 -18.631 -4.378 1.00 30.73 ? 201 TRP A CH2 1 +ATOM 1586 N N . THR A 1 218 ? -23.589 -21.349 -1.048 1.00 12.15 ? 202 THR A N 1 +ATOM 1587 C CA . THR A 1 218 ? -24.731 -20.849 -0.279 1.00 21.38 ? 202 THR A CA 1 +ATOM 1588 C C . THR A 1 218 ? -24.903 -21.634 1.027 1.00 22.31 ? 202 THR A C 1 +ATOM 1589 O O . THR A 1 218 ? -25.581 -21.185 1.949 1.00 20.97 ? 202 THR A O 1 +ATOM 1590 C CB . THR A 1 218 ? -26.024 -20.888 -1.128 1.00 15.58 ? 202 THR A CB 1 +ATOM 1591 O OG1 . THR A 1 218 ? -25.839 -20.064 -2.283 1.00 20.99 ? 202 THR A OG1 1 +ATOM 1592 C CG2 . THR A 1 218 ? -27.233 -20.363 -0.352 1.00 18.42 ? 202 THR A CG2 1 +ATOM 1593 N N . LEU A 1 219 ? -24.253 -22.789 1.128 1.00 14.89 ? 203 LEU A N 1 +ATOM 1594 C CA . LEU A 1 219 ? -24.286 -23.552 2.376 1.00 14.57 ? 203 LEU A CA 1 +ATOM 1595 C C . LEU A 1 219 ? -23.593 -22.810 3.518 1.00 15.73 ? 203 LEU A C 1 +ATOM 1596 O O . LEU A 1 219 ? -23.936 -22.995 4.680 1.00 13.49 ? 203 LEU A O 1 +ATOM 1597 C CB . LEU A 1 219 ? -23.641 -24.923 2.186 1.00 16.32 ? 203 LEU A CB 1 +ATOM 1598 C CG . LEU A 1 219 ? -24.347 -25.846 1.193 1.00 21.24 ? 203 LEU A CG 1 +ATOM 1599 C CD1 . LEU A 1 219 ? -23.621 -27.175 1.105 1.00 20.88 ? 203 LEU A CD1 1 +ATOM 1600 C CD2 . LEU A 1 219 ? -25.801 -26.042 1.585 1.00 21.04 ? 203 LEU A CD2 1 +ATOM 1601 N N . TYR A 1 220 ? -22.618 -21.970 3.183 1.00 12.03 ? 204 TYR A N 1 +ATOM 1602 C CA . TYR A 1 220 ? -21.853 -21.263 4.203 1.00 13.25 ? 204 TYR A CA 1 +ATOM 1603 C C . TYR A 1 220 ? -22.675 -20.210 4.955 1.00 13.79 ? 204 TYR A C 1 +ATOM 1604 O O . TYR A 1 220 ? -22.611 -20.159 6.178 1.00 13.00 ? 204 TYR A O 1 +ATOM 1605 C CB . TYR A 1 220 ? -20.597 -20.629 3.589 1.00 11.32 ? 204 TYR A CB 1 +ATOM 1606 C CG . TYR A 1 220 ? -19.581 -21.657 3.145 1.00 19.61 ? 204 TYR A CG 1 +ATOM 1607 C CD1 . TYR A 1 220 ? -18.713 -22.244 4.058 1.00 17.00 ? 204 TYR A CD1 1 +ATOM 1608 C CD2 . TYR A 1 220 ? -19.501 -22.053 1.818 1.00 16.80 ? 204 TYR A CD2 1 +ATOM 1609 C CE1 . TYR A 1 220 ? -17.782 -23.192 3.655 1.00 12.49 ? 204 TYR A CE1 1 +ATOM 1610 C CE2 . TYR A 1 220 ? -18.580 -22.998 1.406 1.00 16.28 ? 204 TYR A CE2 1 +ATOM 1611 C CZ . TYR A 1 220 ? -17.720 -23.563 2.328 1.00 18.54 ? 204 TYR A CZ 1 +ATOM 1612 O OH . TYR A 1 220 ? -16.802 -24.504 1.913 1.00 17.66 ? 204 TYR A OH 1 +ATOM 1613 N N . PRO A 1 221 ? -23.450 -19.370 4.244 1.00 14.23 ? 205 PRO A N 1 +ATOM 1614 C CA . PRO A 1 221 ? -24.294 -18.469 5.041 1.00 17.64 ? 205 PRO A CA 1 +ATOM 1615 C C . PRO A 1 221 ? -25.392 -19.191 5.822 1.00 25.42 ? 205 PRO A C 1 +ATOM 1616 O O . PRO A 1 221 ? -25.884 -18.638 6.803 1.00 17.31 ? 205 PRO A O 1 +ATOM 1617 C CB . PRO A 1 221 ? -24.904 -17.526 3.990 1.00 19.38 ? 205 PRO A CB 1 +ATOM 1618 C CG . PRO A 1 221 ? -24.718 -18.213 2.687 1.00 18.41 ? 205 PRO A CG 1 +ATOM 1619 C CD . PRO A 1 221 ? -23.456 -18.997 2.819 1.00 13.50 ? 205 PRO A CD 1 +ATOM 1620 N N . ILE A 1 222 ? -25.774 -20.393 5.398 1.00 17.33 ? 206 ILE A N 1 +ATOM 1621 C CA . ILE A 1 222 ? -26.749 -21.173 6.155 1.00 24.44 ? 206 ILE A CA 1 +ATOM 1622 C C . ILE A 1 222 ? -26.120 -21.616 7.477 1.00 21.09 ? 206 ILE A C 1 +ATOM 1623 O O . ILE A 1 222 ? -26.745 -21.546 8.537 1.00 19.30 ? 206 ILE A O 1 +ATOM 1624 C CB . ILE A 1 222 ? -27.246 -22.405 5.361 1.00 15.91 ? 206 ILE A CB 1 +ATOM 1625 C CG1 . ILE A 1 222 ? -27.971 -21.964 4.085 1.00 22.94 ? 206 ILE A CG1 1 +ATOM 1626 C CG2 . ILE A 1 222 ? -28.155 -23.273 6.229 1.00 21.02 ? 206 ILE A CG2 1 +ATOM 1627 C CD1 . ILE A 1 222 ? -28.481 -23.118 3.224 1.00 20.20 ? 206 ILE A CD1 1 +ATOM 1628 N N . ALA A 1 223 ? -24.870 -22.058 7.409 1.00 19.89 ? 207 ALA A N 1 +ATOM 1629 C CA . ALA A 1 223 ? -24.130 -22.426 8.609 1.00 14.69 ? 207 ALA A CA 1 +ATOM 1630 C C . ALA A 1 223 ? -23.955 -21.213 9.523 1.00 12.93 ? 207 ALA A C 1 +ATOM 1631 O O . ALA A 1 223 ? -23.994 -21.329 10.745 1.00 17.92 ? 207 ALA A O 1 +ATOM 1632 C CB . ALA A 1 223 ? -22.777 -23.015 8.238 1.00 17.69 ? 207 ALA A CB 1 +ATOM 1633 N N . TYR A 1 224 ? -23.770 -20.050 8.909 1.00 13.81 ? 208 TYR A N 1 +ATOM 1634 C CA . TYR A 1 224 ? -23.575 -18.792 9.628 1.00 19.90 ? 208 TYR A CA 1 +ATOM 1635 C C . TYR A 1 224 ? -24.800 -18.436 10.472 1.00 18.24 ? 208 TYR A C 1 +ATOM 1636 O O . TYR A 1 224 ? -24.680 -17.859 11.553 1.00 14.43 ? 208 TYR A O 1 +ATOM 1637 C CB . TYR A 1 224 ? -23.258 -17.683 8.614 1.00 14.25 ? 208 TYR A CB 1 +ATOM 1638 C CG . TYR A 1 224 ? -23.183 -16.262 9.141 1.00 15.76 ? 208 TYR A CG 1 +ATOM 1639 C CD1 . TYR A 1 224 ? -24.321 -15.465 9.216 1.00 17.57 ? 208 TYR A CD1 1 +ATOM 1640 C CD2 . TYR A 1 224 ? -21.967 -15.695 9.492 1.00 15.62 ? 208 TYR A CD2 1 +ATOM 1641 C CE1 . TYR A 1 224 ? -24.256 -14.159 9.669 1.00 13.18 ? 208 TYR A CE1 1 +ATOM 1642 C CE2 . TYR A 1 224 ? -21.891 -14.386 9.945 1.00 15.42 ? 208 TYR A CE2 1 +ATOM 1643 C CZ . TYR A 1 224 ? -23.038 -13.625 10.030 1.00 18.14 ? 208 TYR A CZ 1 +ATOM 1644 O OH . TYR A 1 224 ? -22.967 -12.322 10.480 1.00 20.71 ? 208 TYR A OH 1 +ATOM 1645 N N . LEU A 1 225 ? -25.978 -18.797 9.976 1.00 18.71 ? 209 LEU A N 1 +ATOM 1646 C CA . LEU A 1 225 ? -27.229 -18.447 10.641 1.00 14.98 ? 209 LEU A CA 1 +ATOM 1647 C C . LEU A 1 225 ? -27.675 -19.482 11.664 1.00 19.32 ? 209 LEU A C 1 +ATOM 1648 O O . LEU A 1 225 ? -28.664 -19.268 12.364 1.00 23.84 ? 209 LEU A O 1 +ATOM 1649 C CB . LEU A 1 225 ? -28.340 -18.247 9.606 1.00 13.96 ? 209 LEU A CB 1 +ATOM 1650 C CG . LEU A 1 225 ? -28.233 -16.947 8.810 1.00 31.09 ? 209 LEU A CG 1 +ATOM 1651 C CD1 . LEU A 1 225 ? -29.254 -16.905 7.683 1.00 26.28 ? 209 LEU A CD1 1 +ATOM 1652 C CD2 . LEU A 1 225 ? -28.403 -15.757 9.745 1.00 27.57 ? 209 LEU A CD2 1 +ATOM 1653 N N . VAL A 1 226 ? -26.959 -20.602 11.745 1.00 20.62 ? 210 VAL A N 1 +ATOM 1654 C CA . VAL A 1 226 ? -27.308 -21.664 12.693 1.00 26.53 ? 210 VAL A CA 1 +ATOM 1655 C C . VAL A 1 226 ? -27.495 -21.168 14.142 1.00 17.60 ? 210 VAL A C 1 +ATOM 1656 O O . VAL A 1 226 ? -28.448 -21.584 14.809 1.00 21.47 ? 210 VAL A O 1 +ATOM 1657 C CB . VAL A 1 226 ? -26.264 -22.805 12.659 1.00 30.45 ? 210 VAL A CB 1 +ATOM 1658 C CG1 . VAL A 1 226 ? -26.378 -23.692 13.894 1.00 22.56 ? 210 VAL A CG1 1 +ATOM 1659 C CG2 . VAL A 1 226 ? -26.439 -23.632 11.390 1.00 19.84 ? 210 VAL A CG2 1 +ATOM 1660 N N . PRO A 1 227 ? -26.623 -20.260 14.632 1.00 18.25 ? 211 PRO A N 1 +ATOM 1661 C CA . PRO A 1 227 ? -26.904 -19.756 15.984 1.00 20.27 ? 211 PRO A CA 1 +ATOM 1662 C C . PRO A 1 227 ? -28.245 -19.037 16.121 1.00 28.28 ? 211 PRO A C 1 +ATOM 1663 O O . PRO A 1 227 ? -28.703 -18.837 17.245 1.00 22.63 ? 211 PRO A O 1 +ATOM 1664 C CB . PRO A 1 227 ? -25.752 -18.777 16.236 1.00 25.63 ? 211 PRO A CB 1 +ATOM 1665 C CG . PRO A 1 227 ? -24.640 -19.291 15.402 1.00 19.66 ? 211 PRO A CG 1 +ATOM 1666 C CD . PRO A 1 227 ? -25.302 -19.807 14.154 1.00 18.70 ? 211 PRO A CD 1 +ATOM 1667 N N . ALA A 1 228 ? -28.865 -18.662 15.006 1.00 34.44 ? 212 ALA A N 1 +ATOM 1668 C CA . ALA A 1 228 ? -30.127 -17.934 15.057 1.00 28.98 ? 212 ALA A CA 1 +ATOM 1669 C C . ALA A 1 228 ? -31.345 -18.860 15.055 1.00 34.33 ? 212 ALA A C 1 +ATOM 1670 O O . ALA A 1 228 ? -32.380 -18.511 15.614 1.00 31.91 ? 212 ALA A O 1 +ATOM 1671 C CB . ALA A 1 228 ? -30.216 -16.945 13.900 1.00 20.64 ? 212 ALA A CB 1 +ATOM 1672 N N . PHE A 1 229 ? -31.238 -20.035 14.438 1.00 21.37 ? 213 PHE A N 1 +ATOM 1673 C CA . PHE A 1 229 ? -32.401 -20.917 14.367 1.00 26.47 ? 213 PHE A CA 1 +ATOM 1674 C C . PHE A 1 229 ? -32.203 -22.258 15.069 1.00 31.65 ? 213 PHE A C 1 +ATOM 1675 O O . PHE A 1 229 ? -33.149 -23.030 15.207 1.00 29.65 ? 213 PHE A O 1 +ATOM 1676 C CB . PHE A 1 229 ? -32.827 -21.145 12.906 1.00 26.76 ? 213 PHE A CB 1 +ATOM 1677 C CG . PHE A 1 229 ? -31.799 -21.846 12.044 1.00 21.87 ? 213 PHE A CG 1 +ATOM 1678 C CD1 . PHE A 1 229 ? -31.711 -23.230 12.022 1.00 27.96 ? 213 PHE A CD1 1 +ATOM 1679 C CD2 . PHE A 1 229 ? -30.967 -21.118 11.207 1.00 18.14 ? 213 PHE A CD2 1 +ATOM 1680 C CE1 . PHE A 1 229 ? -30.787 -23.871 11.211 1.00 27.59 ? 213 PHE A CE1 1 +ATOM 1681 C CE2 . PHE A 1 229 ? -30.040 -21.754 10.393 1.00 25.38 ? 213 PHE A CE2 1 +ATOM 1682 C CZ . PHE A 1 229 ? -29.951 -23.129 10.395 1.00 23.67 ? 213 PHE A CZ 1 +ATOM 1683 N N . MET A 1 230 ? -30.985 -22.534 15.520 1.00 26.10 ? 214 MET A N 1 +ATOM 1684 C CA . MET A 1 230 ? -30.736 -23.752 16.282 1.00 17.57 ? 214 MET A CA 1 +ATOM 1685 C C . MET A 1 230 ? -29.563 -23.571 17.231 1.00 24.82 ? 214 MET A C 1 +ATOM 1686 O O . MET A 1 230 ? -28.477 -24.109 17.008 1.00 26.10 ? 214 MET A O 1 +ATOM 1687 C CB . MET A 1 230 ? -30.480 -24.937 15.350 1.00 20.85 ? 214 MET A CB 1 +ATOM 1688 C CG . MET A 1 230 ? -30.588 -26.283 16.049 1.00 34.19 ? 214 MET A CG 1 +ATOM 1689 S SD . MET A 1 230 ? -30.429 -27.671 14.918 1.00 37.20 ? 214 MET A SD 1 +ATOM 1690 C CE . MET A 1 230 ? -31.784 -27.327 13.799 1.00 30.74 ? 214 MET A CE 1 +ATOM 1691 N N . ASN A 1 231 ? -29.795 -22.804 18.291 1.00 21.73 ? 215 ASN A N 1 +ATOM 1692 C CA . ASN A 1 231 ? -28.765 -22.514 19.272 1.00 19.41 ? 215 ASN A CA 1 +ATOM 1693 C C . ASN A 1 231 ? -28.679 -23.598 20.336 1.00 26.47 ? 215 ASN A C 1 +ATOM 1694 O O . ASN A 1 231 ? -29.093 -23.398 21.474 1.00 29.09 ? 215 ASN A O 1 +ATOM 1695 C CB . ASN A 1 231 ? -29.019 -21.156 19.930 1.00 29.51 ? 215 ASN A CB 1 +ATOM 1696 C CG . ASN A 1 231 ? -27.834 -20.674 20.742 1.00 39.28 ? 215 ASN A CG 1 +ATOM 1697 O OD1 . ASN A 1 231 ? -26.730 -21.204 20.620 1.00 35.05 ? 215 ASN A OD1 1 +ATOM 1698 N ND2 . ASN A 1 231 ? -28.054 -19.663 21.570 1.00 48.13 ? 215 ASN A ND2 1 +ATOM 1699 N N . ASN A 1 232 ? -28.145 -24.750 19.952 1.00 18.17 ? 216 ASN A N 1 +ATOM 1700 C CA . ASN A 1 232 ? -27.929 -25.847 20.885 1.00 26.02 ? 216 ASN A CA 1 +ATOM 1701 C C . ASN A 1 232 ? -26.809 -26.743 20.367 1.00 17.03 ? 216 ASN A C 1 +ATOM 1702 O O . ASN A 1 232 ? -26.265 -26.495 19.292 1.00 20.85 ? 216 ASN A O 1 +ATOM 1703 C CB . ASN A 1 232 ? -29.224 -26.638 21.106 1.00 21.61 ? 216 ASN A CB 1 +ATOM 1704 C CG . ASN A 1 232 ? -29.879 -27.073 19.805 1.00 29.97 ? 216 ASN A CG 1 +ATOM 1705 O OD1 . ASN A 1 232 ? -29.249 -27.703 18.957 1.00 27.47 ? 216 ASN A OD1 1 +ATOM 1706 N ND2 . ASN A 1 232 ? -31.152 -26.731 19.643 1.00 28.70 ? 216 ASN A ND2 1 +ATOM 1707 N N . ALA A 1 233 ? -26.457 -27.770 21.133 1.00 19.01 ? 217 ALA A N 1 +ATOM 1708 C CA . ALA A 1 233 ? -25.355 -28.652 20.763 1.00 21.16 ? 217 ALA A CA 1 +ATOM 1709 C C . ALA A 1 233 ? -25.603 -29.334 19.417 1.00 22.98 ? 217 ALA A C 1 +ATOM 1710 O O . ALA A 1 233 ? -24.673 -29.539 18.639 1.00 17.92 ? 217 ALA A O 1 +ATOM 1711 C CB . ALA A 1 233 ? -25.120 -29.690 21.852 1.00 21.60 ? 217 ALA A CB 1 +ATOM 1712 N N . ASP A 1 234 ? -26.858 -29.682 19.141 1.00 19.21 ? 218 ASP A N 1 +ATOM 1713 C CA . ASP A 1 234 ? -27.199 -30.308 17.866 1.00 14.41 ? 218 ASP A CA 1 +ATOM 1714 C C . ASP A 1 234 ? -27.004 -29.331 16.702 1.00 12.57 ? 218 ASP A C 1 +ATOM 1715 O O . ASP A 1 234 ? -26.629 -29.732 15.603 1.00 16.50 ? 218 ASP A O 1 +ATOM 1716 C CB . ASP A 1 234 ? -28.636 -30.833 17.894 1.00 28.47 ? 218 ASP A CB 1 +ATOM 1717 C CG . ASP A 1 234 ? -28.805 -32.030 18.820 1.00 25.64 ? 218 ASP A CG 1 +ATOM 1718 O OD1 . ASP A 1 234 ? -27.958 -32.951 18.782 1.00 25.14 ? 218 ASP A OD1 1 +ATOM 1719 O OD2 . ASP A 1 234 ? -29.782 -32.043 19.592 1.00 45.13 ? 218 ASP A OD2 1 +ATOM 1720 N N . GLY A 1 235 ? -27.251 -28.049 16.950 1.00 16.01 ? 219 GLY A N 1 +ATOM 1721 C CA . GLY A 1 235 ? -26.970 -27.017 15.969 1.00 12.05 ? 219 GLY A CA 1 +ATOM 1722 C C . GLY A 1 235 ? -25.481 -26.908 15.672 1.00 21.36 ? 219 GLY A C 1 +ATOM 1723 O O . GLY A 1 235 ? -25.082 -26.664 14.533 1.00 19.57 ? 219 GLY A O 1 +ATOM 1724 N N . VAL A 1 236 ? -24.656 -27.091 16.697 1.00 16.95 ? 220 VAL A N 1 +ATOM 1725 C CA . VAL A 1 236 ? -23.205 -27.111 16.521 1.00 14.88 ? 220 VAL A CA 1 +ATOM 1726 C C . VAL A 1 236 ? -22.789 -28.261 15.604 1.00 20.02 ? 220 VAL A C 1 +ATOM 1727 O O . VAL A 1 236 ? -21.933 -28.095 14.740 1.00 16.68 ? 220 VAL A O 1 +ATOM 1728 C CB . VAL A 1 236 ? -22.467 -27.232 17.876 1.00 21.32 ? 220 VAL A CB 1 +ATOM 1729 C CG1 . VAL A 1 236 ? -20.996 -27.570 17.665 1.00 15.53 ? 220 VAL A CG1 1 +ATOM 1730 C CG2 . VAL A 1 236 ? -22.611 -25.944 18.675 1.00 23.16 ? 220 VAL A CG2 1 +ATOM 1731 N N . VAL A 1 237 ? -23.404 -29.424 15.790 1.00 13.05 ? 221 VAL A N 1 +ATOM 1732 C CA . VAL A 1 237 ? -23.142 -30.564 14.918 1.00 17.83 ? 221 VAL A CA 1 +ATOM 1733 C C . VAL A 1 237 ? -23.592 -30.258 13.490 1.00 25.27 ? 221 VAL A C 1 +ATOM 1734 O O . VAL A 1 237 ? -22.887 -30.566 12.531 1.00 16.34 ? 221 VAL A O 1 +ATOM 1735 C CB . VAL A 1 237 ? -23.848 -31.841 15.417 1.00 22.48 ? 221 VAL A CB 1 +ATOM 1736 C CG1 . VAL A 1 237 ? -23.684 -32.972 14.415 1.00 11.57 ? 221 VAL A CG1 1 +ATOM 1737 C CG2 . VAL A 1 237 ? -23.305 -32.254 16.780 1.00 14.87 ? 221 VAL A CG2 1 +ATOM 1738 N N . LEU A 1 238 ? -24.764 -29.643 13.354 1.00 17.94 ? 222 LEU A N 1 +ATOM 1739 C CA . LEU A 1 238 ? -25.303 -29.306 12.038 1.00 16.45 ? 222 LEU A CA 1 +ATOM 1740 C C . LEU A 1 238 ? -24.377 -28.370 11.260 1.00 17.77 ? 222 LEU A C 1 +ATOM 1741 O O . LEU A 1 238 ? -24.175 -28.543 10.061 1.00 18.27 ? 222 LEU A O 1 +ATOM 1742 C CB . LEU A 1 238 ? -26.691 -28.671 12.175 1.00 22.49 ? 222 LEU A CB 1 +ATOM 1743 C CG . LEU A 1 238 ? -27.337 -28.116 10.902 1.00 17.85 ? 222 LEU A CG 1 +ATOM 1744 C CD1 . LEU A 1 238 ? -27.479 -29.203 9.849 1.00 10.06 ? 222 LEU A CD1 1 +ATOM 1745 C CD2 . LEU A 1 238 ? -28.690 -27.481 11.209 1.00 15.29 ? 222 LEU A CD2 1 +ATOM 1746 N N . ARG A 1 239 ? -23.814 -27.380 11.943 1.00 14.16 ? 223 ARG A N 1 +ATOM 1747 C CA . ARG A 1 239 ? -22.919 -26.437 11.286 1.00 19.50 ? 223 ARG A CA 1 +ATOM 1748 C C . ARG A 1 239 ? -21.658 -27.115 10.752 1.00 14.78 ? 223 ARG A C 1 +ATOM 1749 O O . ARG A 1 239 ? -21.220 -26.834 9.637 1.00 17.62 ? 223 ARG A O 1 +ATOM 1750 C CB . ARG A 1 239 ? -22.536 -25.306 12.235 1.00 19.18 ? 223 ARG A CB 1 +ATOM 1751 C CG . ARG A 1 239 ? -21.509 -24.365 11.636 1.00 36.69 ? 223 ARG A CG 1 +ATOM 1752 C CD . ARG A 1 239 ? -21.694 -22.950 12.130 1.00 22.98 ? 223 ARG A CD 1 +ATOM 1753 N NE . ARG A 1 239 ? -21.252 -22.781 13.505 1.00 22.28 ? 223 ARG A NE 1 +ATOM 1754 C CZ . ARG A 1 239 ? -21.324 -21.632 14.167 1.00 28.52 ? 223 ARG A CZ 1 +ATOM 1755 N NH1 . ARG A 1 239 ? -20.895 -21.559 15.417 1.00 26.06 ? 223 ARG A NH1 1 +ATOM 1756 N NH2 . ARG A 1 239 ? -21.829 -20.556 13.577 1.00 26.54 ? 223 ARG A NH2 1 +ATOM 1757 N N . GLN A 1 240 ? -21.076 -28.014 11.540 1.00 16.36 ? 224 GLN A N 1 +ATOM 1758 C CA . GLN A 1 240 ? -19.887 -28.733 11.089 1.00 17.25 ? 224 GLN A CA 1 +ATOM 1759 C C . GLN A 1 240 ? -20.233 -29.641 9.917 1.00 18.17 ? 224 GLN A C 1 +ATOM 1760 O O . GLN A 1 240 ? -19.441 -29.803 8.993 1.00 13.47 ? 224 GLN A O 1 +ATOM 1761 C CB . GLN A 1 240 ? -19.266 -29.544 12.232 1.00 15.18 ? 224 GLN A CB 1 +ATOM 1762 C CG . GLN A 1 240 ? -18.694 -28.683 13.350 1.00 18.50 ? 224 GLN A CG 1 +ATOM 1763 C CD . GLN A 1 240 ? -17.701 -27.646 12.841 1.00 36.00 ? 224 GLN A CD 1 +ATOM 1764 O OE1 . GLN A 1 240 ? -16.754 -27.970 12.120 1.00 27.02 ? 224 GLN A OE1 1 +ATOM 1765 N NE2 . GLN A 1 240 ? -17.923 -26.388 13.207 1.00 23.11 ? 224 GLN A NE2 1 +ATOM 1766 N N . LEU A 1 241 ? -21.429 -30.217 9.950 1.00 15.53 ? 225 LEU A N 1 +ATOM 1767 C CA . LEU A 1 241 ? -21.890 -31.077 8.869 1.00 14.34 ? 225 LEU A CA 1 +ATOM 1768 C C . LEU A 1 241 ? -22.064 -30.279 7.572 1.00 17.75 ? 225 LEU A C 1 +ATOM 1769 O O . LEU A 1 241 ? -21.684 -30.733 6.491 1.00 17.65 ? 225 LEU A O 1 +ATOM 1770 C CB . LEU A 1 241 ? -23.199 -31.755 9.264 1.00 19.01 ? 225 LEU A CB 1 +ATOM 1771 C CG . LEU A 1 241 ? -23.702 -32.844 8.323 1.00 27.99 ? 225 LEU A CG 1 +ATOM 1772 C CD1 . LEU A 1 241 ? -22.762 -34.037 8.350 1.00 22.79 ? 225 LEU A CD1 1 +ATOM 1773 C CD2 . LEU A 1 241 ? -25.108 -33.252 8.713 1.00 35.90 ? 225 LEU A CD2 1 +ATOM 1774 N N . LEU A 1 242 ? -22.627 -29.081 7.693 1.00 13.47 ? 226 LEU A N 1 +ATOM 1775 C CA . LEU A 1 242 ? -22.807 -28.189 6.550 1.00 16.37 ? 226 LEU A CA 1 +ATOM 1776 C C . LEU A 1 242 ? -21.460 -27.773 5.949 1.00 13.87 ? 226 LEU A C 1 +ATOM 1777 O O . LEU A 1 242 ? -21.280 -27.817 4.736 1.00 16.75 ? 226 LEU A O 1 +ATOM 1778 C CB . LEU A 1 242 ? -23.606 -26.947 6.957 1.00 12.37 ? 226 LEU A CB 1 +ATOM 1779 C CG . LEU A 1 242 ? -25.085 -27.135 7.293 1.00 15.68 ? 226 LEU A CG 1 +ATOM 1780 C CD1 . LEU A 1 242 ? -25.689 -25.827 7.802 1.00 16.48 ? 226 LEU A CD1 1 +ATOM 1781 C CD2 . LEU A 1 242 ? -25.845 -27.648 6.083 1.00 21.85 ? 226 LEU A CD2 1 +ATOM 1782 N N . PHE A 1 243 ? -20.526 -27.366 6.805 1.00 12.51 ? 227 PHE A N 1 +ATOM 1783 C CA . PHE A 1 243 ? -19.164 -27.037 6.375 1.00 16.51 ? 227 PHE A CA 1 +ATOM 1784 C C . PHE A 1 243 ? -18.520 -28.182 5.589 1.00 16.02 ? 227 PHE A C 1 +ATOM 1785 O O . PHE A 1 243 ? -17.853 -27.961 4.584 1.00 15.51 ? 227 PHE A O 1 +ATOM 1786 C CB . PHE A 1 243 ? -18.286 -26.696 7.584 1.00 13.95 ? 227 PHE A CB 1 +ATOM 1787 C CG . PHE A 1 243 ? -18.458 -25.294 8.097 1.00 27.93 ? 227 PHE A CG 1 +ATOM 1788 C CD1 . PHE A 1 243 ? -18.864 -24.273 7.255 1.00 24.73 ? 227 PHE A CD1 1 +ATOM 1789 C CD2 . PHE A 1 243 ? -18.199 -24.997 9.429 1.00 25.84 ? 227 PHE A CD2 1 +ATOM 1790 C CE1 . PHE A 1 243 ? -19.015 -22.982 7.728 1.00 25.00 ? 227 PHE A CE1 1 +ATOM 1791 C CE2 . PHE A 1 243 ? -18.348 -23.710 9.911 1.00 17.77 ? 227 PHE A CE2 1 +ATOM 1792 C CZ . PHE A 1 243 ? -18.757 -22.699 9.057 1.00 27.29 ? 227 PHE A CZ 1 +ATOM 1793 N N . THR A 1 244 ? -18.722 -29.406 6.065 1.00 14.68 ? 228 THR A N 1 +ATOM 1794 C CA . THR A 1 244 ? -18.151 -30.591 5.437 1.00 19.88 ? 228 THR A CA 1 +ATOM 1795 C C . THR A 1 244 ? -18.708 -30.820 4.036 1.00 24.55 ? 228 THR A C 1 +ATOM 1796 O O . THR A 1 244 ? -17.952 -31.034 3.088 1.00 23.53 ? 228 THR A O 1 +ATOM 1797 C CB . THR A 1 244 ? -18.407 -31.844 6.290 1.00 15.67 ? 228 THR A CB 1 +ATOM 1798 O OG1 . THR A 1 244 ? -17.887 -31.632 7.606 1.00 23.92 ? 228 THR A OG1 1 +ATOM 1799 C CG2 . THR A 1 244 ? -17.735 -33.064 5.672 1.00 24.53 ? 228 THR A CG2 1 +ATOM 1800 N N . ILE A 1 245 ? -20.031 -30.783 3.915 1.00 21.70 ? 229 ILE A N 1 +ATOM 1801 C CA . ILE A 1 245 ? -20.684 -30.871 2.614 1.00 23.37 ? 229 ILE A CA 1 +ATOM 1802 C C . ILE A 1 245 ? -20.192 -29.759 1.694 1.00 15.09 ? 229 ILE A C 1 +ATOM 1803 O O . ILE A 1 245 ? -19.847 -30.001 0.536 1.00 18.22 ? 229 ILE A O 1 +ATOM 1804 C CB . ILE A 1 245 ? -22.217 -30.775 2.739 1.00 20.26 ? 229 ILE A CB 1 +ATOM 1805 C CG1 . ILE A 1 245 ? -22.752 -31.899 3.629 1.00 24.62 ? 229 ILE A CG1 1 +ATOM 1806 C CG2 . ILE A 1 245 ? -22.872 -30.817 1.363 1.00 21.37 ? 229 ILE A CG2 1 +ATOM 1807 C CD1 . ILE A 1 245 ? -24.219 -31.753 3.972 1.00 22.51 ? 229 ILE A CD1 1 +ATOM 1808 N N . ALA A 1 246 ? -20.156 -28.541 2.227 1.00 13.76 ? 230 ALA A N 1 +ATOM 1809 C CA . ALA A 1 246 ? -19.774 -27.364 1.455 1.00 14.84 ? 230 ALA A CA 1 +ATOM 1810 C C . ALA A 1 246 ? -18.309 -27.398 1.036 1.00 21.50 ? 230 ALA A C 1 +ATOM 1811 O O . ALA A 1 246 ? -17.991 -27.083 -0.107 1.00 15.55 ? 230 ALA A O 1 +ATOM 1812 C CB . ALA A 1 246 ? -20.059 -26.096 2.248 1.00 11.07 ? 230 ALA A CB 1 +ATOM 1813 N N . ASP A 1 247 ? -17.420 -27.768 1.957 1.00 15.02 ? 231 ASP A N 1 +ATOM 1814 C CA . ASP A 1 247 ? -15.987 -27.809 1.648 1.00 20.56 ? 231 ASP A CA 1 +ATOM 1815 C C . ASP A 1 247 ? -15.696 -28.812 0.538 1.00 26.43 ? 231 ASP A C 1 +ATOM 1816 O O . ASP A 1 247 ? -14.987 -28.507 -0.418 1.00 22.92 ? 231 ASP A O 1 +ATOM 1817 C CB . ASP A 1 247 ? -15.158 -28.168 2.883 1.00 15.28 ? 231 ASP A CB 1 +ATOM 1818 C CG . ASP A 1 247 ? -15.094 -27.045 3.908 1.00 37.87 ? 231 ASP A CG 1 +ATOM 1819 O OD1 . ASP A 1 247 ? -15.225 -25.858 3.534 1.00 24.13 ? 231 ASP A OD1 1 +ATOM 1820 O OD2 . ASP A 1 247 ? -14.905 -27.362 5.101 1.00 27.80 ? 231 ASP A OD2 1 +ATOM 1821 N N . ILE A 1 248 ? -16.243 -30.014 0.676 1.00 10.93 ? 232 ILE A N 1 +ATOM 1822 C CA . ILE A 1 248 ? -16.048 -31.057 -0.323 1.00 13.63 ? 232 ILE A CA 1 +ATOM 1823 C C . ILE A 1 248 ? -16.616 -30.640 -1.684 1.00 27.05 ? 232 ILE A C 1 +ATOM 1824 O O . ILE A 1 248 ? -15.987 -30.859 -2.716 1.00 18.20 ? 232 ILE A O 1 +ATOM 1825 C CB . ILE A 1 248 ? -16.691 -32.384 0.127 1.00 19.13 ? 232 ILE A CB 1 +ATOM 1826 C CG1 . ILE A 1 248 ? -15.950 -32.938 1.346 1.00 23.09 ? 232 ILE A CG1 1 +ATOM 1827 C CG2 . ILE A 1 248 ? -16.678 -33.402 -1.006 1.00 22.56 ? 232 ILE A CG2 1 +ATOM 1828 C CD1 . ILE A 1 248 ? -16.528 -34.223 1.883 1.00 26.64 ? 232 ILE A CD1 1 +ATOM 1829 N N . SER A 1 249 ? -17.792 -30.017 -1.683 1.00 14.85 ? 233 SER A N 1 +ATOM 1830 C CA . SER A 1 249 ? -18.431 -29.605 -2.934 1.00 15.74 ? 233 SER A CA 1 +ATOM 1831 C C . SER A 1 249 ? -17.732 -28.413 -3.590 1.00 18.24 ? 233 SER A C 1 +ATOM 1832 O O . SER A 1 249 ? -17.524 -28.404 -4.802 1.00 15.91 ? 233 SER A O 1 +ATOM 1833 C CB . SER A 1 249 ? -19.904 -29.272 -2.694 1.00 12.98 ? 233 SER A CB 1 +ATOM 1834 O OG . SER A 1 249 ? -20.602 -30.412 -2.224 1.00 22.68 ? 233 SER A OG 1 +ATOM 1835 N N . SER A 1 250 ? -17.352 -27.424 -2.784 1.00 12.85 ? 234 SER A N 1 +ATOM 1836 C CA . SER A 1 250 ? -16.822 -26.164 -3.300 1.00 16.75 ? 234 SER A CA 1 +ATOM 1837 C C . SER A 1 250 ? -15.340 -26.222 -3.648 1.00 18.25 ? 234 SER A C 1 +ATOM 1838 O O . SER A 1 250 ? -14.840 -25.393 -4.416 1.00 16.70 ? 234 SER A O 1 +ATOM 1839 C CB . SER A 1 250 ? -17.053 -25.038 -2.287 1.00 14.40 ? 234 SER A CB 1 +ATOM 1840 O OG . SER A 1 250 ? -16.216 -25.195 -1.157 1.00 22.10 ? 234 SER A OG 1 +ATOM 1841 N N . LYS A 1 251 ? -14.631 -27.188 -3.078 1.00 11.92 ? 235 LYS A N 1 +ATOM 1842 C CA . LYS A 1 251 ? -13.197 -27.283 -3.315 1.00 16.82 ? 235 LYS A CA 1 +ATOM 1843 C C . LYS A 1 251 ? -12.836 -28.541 -4.096 1.00 16.75 ? 235 LYS A C 1 +ATOM 1844 O O . LYS A 1 251 ? -12.134 -28.467 -5.100 1.00 20.89 ? 235 LYS A O 1 +ATOM 1845 C CB . LYS A 1 251 ? -12.430 -27.250 -1.990 1.00 13.77 ? 235 LYS A CB 1 +ATOM 1846 C CG . LYS A 1 251 ? -12.835 -26.096 -1.087 1.00 27.22 ? 235 LYS A CG 1 +ATOM 1847 C CD . LYS A 1 251 ? -12.052 -26.101 0.208 1.00 22.46 ? 235 LYS A CD 1 +ATOM 1848 C CE . LYS A 1 251 ? -12.761 -25.305 1.294 1.00 32.57 ? 235 LYS A CE 1 +ATOM 1849 N NZ . LYS A 1 251 ? -12.986 -23.884 0.930 1.00 27.53 ? 235 LYS A NZ 1 +ATOM 1850 N N . VAL A 1 252 ? -13.319 -29.691 -3.638 1.00 13.09 ? 236 VAL A N 1 +ATOM 1851 C CA . VAL A 1 252 ? -12.930 -30.964 -4.239 1.00 14.71 ? 236 VAL A CA 1 +ATOM 1852 C C . VAL A 1 252 ? -13.688 -31.263 -5.535 1.00 20.84 ? 236 VAL A C 1 +ATOM 1853 O O . VAL A 1 252 ? -13.071 -31.439 -6.577 1.00 15.12 ? 236 VAL A O 1 +ATOM 1854 C CB . VAL A 1 252 ? -13.133 -32.139 -3.257 1.00 17.36 ? 236 VAL A CB 1 +ATOM 1855 C CG1 . VAL A 1 252 ? -12.683 -33.449 -3.898 1.00 20.52 ? 236 VAL A CG1 1 +ATOM 1856 C CG2 . VAL A 1 252 ? -12.370 -31.889 -1.965 1.00 18.28 ? 236 VAL A CG2 1 +ATOM 1857 N N . ILE A 1 253 ? -15.015 -31.330 -5.472 1.00 15.01 ? 237 ILE A N 1 +ATOM 1858 C CA . ILE A 1 253 ? -15.811 -31.608 -6.669 1.00 19.32 ? 237 ILE A CA 1 +ATOM 1859 C C . ILE A 1 253 ? -15.613 -30.504 -7.705 1.00 12.57 ? 237 ILE A C 1 +ATOM 1860 O O . ILE A 1 253 ? -15.434 -30.770 -8.892 1.00 16.46 ? 237 ILE A O 1 +ATOM 1861 C CB . ILE A 1 253 ? -17.312 -31.745 -6.343 1.00 17.91 ? 237 ILE A CB 1 +ATOM 1862 C CG1 . ILE A 1 253 ? -17.534 -32.879 -5.338 1.00 19.86 ? 237 ILE A CG1 1 +ATOM 1863 C CG2 . ILE A 1 253 ? -18.112 -31.986 -7.618 1.00 15.64 ? 237 ILE A CG2 1 +ATOM 1864 C CD1 . ILE A 1 253 ? -18.992 -33.152 -5.028 1.00 27.45 ? 237 ILE A CD1 1 +ATOM 1865 N N . TYR A 1 254 ? -15.630 -29.262 -7.234 1.00 18.24 ? 238 TYR A N 1 +ATOM 1866 C CA . TYR A 1 254 ? -15.314 -28.101 -8.061 1.00 13.78 ? 238 TYR A CA 1 +ATOM 1867 C C . TYR A 1 254 ? -13.946 -28.222 -8.738 1.00 16.22 ? 238 TYR A C 1 +ATOM 1868 O O . TYR A 1 254 ? -13.830 -28.041 -9.948 1.00 12.92 ? 238 TYR A O 1 +ATOM 1869 C CB . TYR A 1 254 ? -15.366 -26.845 -7.196 1.00 14.70 ? 238 TYR A CB 1 +ATOM 1870 C CG . TYR A 1 254 ? -14.955 -25.549 -7.860 1.00 18.98 ? 238 TYR A CG 1 +ATOM 1871 C CD1 . TYR A 1 254 ? -15.854 -24.828 -8.634 1.00 16.06 ? 238 TYR A CD1 1 +ATOM 1872 C CD2 . TYR A 1 254 ? -13.687 -25.015 -7.660 1.00 15.70 ? 238 TYR A CD2 1 +ATOM 1873 C CE1 . TYR A 1 254 ? -15.496 -23.629 -9.217 1.00 20.58 ? 238 TYR A CE1 1 +ATOM 1874 C CE2 . TYR A 1 254 ? -13.319 -23.817 -8.235 1.00 10.79 ? 238 TYR A CE2 1 +ATOM 1875 C CZ . TYR A 1 254 ? -14.230 -23.126 -9.014 1.00 17.60 ? 238 TYR A CZ 1 +ATOM 1876 O OH . TYR A 1 254 ? -13.875 -21.931 -9.593 1.00 23.41 ? 238 TYR A OH 1 +ATOM 1877 N N . GLY A 1 255 ? -12.919 -28.526 -7.951 1.00 12.40 ? 239 GLY A N 1 +ATOM 1878 C CA . GLY A 1 255 ? -11.571 -28.673 -8.477 1.00 8.58 ? 239 GLY A CA 1 +ATOM 1879 C C . GLY A 1 255 ? -11.489 -29.761 -9.533 1.00 14.79 ? 239 GLY A C 1 +ATOM 1880 O O . GLY A 1 255 ? -10.787 -29.621 -10.532 1.00 13.94 ? 239 GLY A O 1 +ATOM 1881 N N . LEU A 1 256 ? -12.218 -30.849 -9.310 1.00 15.91 ? 240 LEU A N 1 +ATOM 1882 C CA . LEU A 1 256 ? -12.243 -31.956 -10.256 1.00 20.90 ? 240 LEU A CA 1 +ATOM 1883 C C . LEU A 1 256 ? -12.861 -31.534 -11.586 1.00 19.49 ? 240 LEU A C 1 +ATOM 1884 O O . LEU A 1 256 ? -12.427 -31.974 -12.647 1.00 15.90 ? 240 LEU A O 1 +ATOM 1885 C CB . LEU A 1 256 ? -13.007 -33.144 -9.667 1.00 16.38 ? 240 LEU A CB 1 +ATOM 1886 C CG . LEU A 1 256 ? -12.291 -33.909 -8.551 1.00 21.96 ? 240 LEU A CG 1 +ATOM 1887 C CD1 . LEU A 1 256 ? -13.194 -34.975 -7.948 1.00 20.16 ? 240 LEU A CD1 1 +ATOM 1888 C CD2 . LEU A 1 256 ? -11.015 -34.538 -9.088 1.00 23.26 ? 240 LEU A CD2 1 +ATOM 1889 N N . MET A 1 257 ? -13.869 -30.672 -11.529 1.00 10.39 ? 241 MET A N 1 +ATOM 1890 C CA . MET A 1 257 ? -14.520 -30.204 -12.749 1.00 15.28 ? 241 MET A CA 1 +ATOM 1891 C C . MET A 1 257 ? -13.655 -29.197 -13.485 1.00 10.21 ? 241 MET A C 1 +ATOM 1892 O O . MET A 1 257 ? -13.593 -29.212 -14.713 1.00 20.08 ? 241 MET A O 1 +ATOM 1893 C CB . MET A 1 257 ? -15.883 -29.584 -12.439 1.00 16.43 ? 241 MET A CB 1 +ATOM 1894 C CG . MET A 1 257 ? -16.875 -30.561 -11.852 1.00 40.59 ? 241 MET A CG 1 +ATOM 1895 S SD . MET A 1 257 ? -18.536 -29.877 -11.783 1.00 46.24 ? 241 MET A SD 1 +ATOM 1896 C CE . MET A 1 257 ? -18.909 -29.706 -13.526 1.00 28.16 ? 241 MET A CE 1 +ATOM 1897 N N . ILE A 1 258 ? -12.991 -28.321 -12.734 1.00 18.37 ? 242 ILE A N 1 +ATOM 1898 C CA . ILE A 1 258 ? -12.070 -27.351 -13.323 1.00 14.30 ? 242 ILE A CA 1 +ATOM 1899 C C . ILE A 1 258 ? -10.927 -28.074 -14.039 1.00 19.99 ? 242 ILE A C 1 +ATOM 1900 O O . ILE A 1 258 ? -10.552 -27.713 -15.155 1.00 21.37 ? 242 ILE A O 1 +ATOM 1901 C CB . ILE A 1 258 ? -11.477 -26.392 -12.260 1.00 15.55 ? 242 ILE A CB 1 +ATOM 1902 C CG1 . ILE A 1 258 ? -12.568 -25.516 -11.628 1.00 19.59 ? 242 ILE A CG1 1 +ATOM 1903 C CG2 . ILE A 1 258 ? -10.385 -25.527 -12.874 1.00 14.11 ? 242 ILE A CG2 1 +ATOM 1904 C CD1 . ILE A 1 258 ? -13.205 -24.518 -12.584 1.00 17.81 ? 242 ILE A CD1 1 +ATOM 1905 N N . THR A 1 259 ? -10.385 -29.100 -13.388 1.00 20.68 ? 243 THR A N 1 +ATOM 1906 C CA . THR A 1 259 ? -9.291 -29.884 -13.955 1.00 16.87 ? 243 THR A CA 1 +ATOM 1907 C C . THR A 1 259 ? -9.752 -30.644 -15.193 1.00 20.90 ? 243 THR A C 1 +ATOM 1908 O O . THR A 1 259 ? -9.045 -30.690 -16.201 1.00 18.73 ? 243 THR A O 1 +ATOM 1909 C CB . THR A 1 259 ? -8.709 -30.867 -12.919 1.00 21.45 ? 243 THR A CB 1 +ATOM 1910 O OG1 . THR A 1 259 ? -7.962 -30.135 -11.940 1.00 24.88 ? 243 THR A OG1 1 +ATOM 1911 C CG2 . THR A 1 259 ? -7.787 -31.876 -13.582 1.00 21.93 ? 243 THR A CG2 1 +ATOM 1912 N N . TYR A 1 260 ? -10.944 -31.227 -15.123 1.00 17.39 ? 244 TYR A N 1 +ATOM 1913 C CA . TYR A 1 260 ? -11.520 -31.880 -16.290 1.00 15.73 ? 244 TYR A CA 1 +ATOM 1914 C C . TYR A 1 260 ? -11.643 -30.905 -17.464 1.00 20.93 ? 244 TYR A C 1 +ATOM 1915 O O . TYR A 1 260 ? -11.329 -31.245 -18.606 1.00 19.64 ? 244 TYR A O 1 +ATOM 1916 C CB . TYR A 1 260 ? -12.892 -32.475 -15.964 1.00 12.85 ? 244 TYR A CB 1 +ATOM 1917 C CG . TYR A 1 260 ? -13.619 -32.945 -17.203 1.00 26.05 ? 244 TYR A CG 1 +ATOM 1918 C CD1 . TYR A 1 260 ? -13.288 -34.152 -17.807 1.00 34.32 ? 244 TYR A CD1 1 +ATOM 1919 C CD2 . TYR A 1 260 ? -14.619 -32.175 -17.783 1.00 31.19 ? 244 TYR A CD2 1 +ATOM 1920 C CE1 . TYR A 1 260 ? -13.938 -34.583 -18.946 1.00 32.09 ? 244 TYR A CE1 1 +ATOM 1921 C CE2 . TYR A 1 260 ? -15.276 -32.599 -18.924 1.00 46.56 ? 244 TYR A CE2 1 +ATOM 1922 C CZ . TYR A 1 260 ? -14.930 -33.804 -19.500 1.00 62.24 ? 244 TYR A CZ 1 +ATOM 1923 O OH . TYR A 1 260 ? -15.577 -34.235 -20.635 1.00 50.64 ? 244 TYR A OH 1 +ATOM 1924 N N . ILE A 1 261 ? -12.104 -29.692 -17.175 1.00 17.86 ? 245 ILE A N 1 +ATOM 1925 C CA . ILE A 1 261 ? -12.265 -28.665 -18.200 1.00 13.27 ? 245 ILE A CA 1 +ATOM 1926 C C . ILE A 1 261 ? -10.901 -28.234 -18.755 1.00 22.68 ? 245 ILE A C 1 +ATOM 1927 O O . ILE A 1 261 ? -10.758 -27.979 -19.953 1.00 17.49 ? 245 ILE A O 1 +ATOM 1928 C CB . ILE A 1 261 ? -13.036 -27.441 -17.643 1.00 16.82 ? 245 ILE A CB 1 +ATOM 1929 C CG1 . ILE A 1 261 ? -14.510 -27.806 -17.426 1.00 13.77 ? 245 ILE A CG1 1 +ATOM 1930 C CG2 . ILE A 1 261 ? -12.924 -26.246 -18.575 1.00 15.21 ? 245 ILE A CG2 1 +ATOM 1931 C CD1 . ILE A 1 261 ? -15.359 -26.683 -16.852 1.00 16.21 ? 245 ILE A CD1 1 +ATOM 1932 N N . ALA A 1 262 ? -9.897 -28.174 -17.884 1.00 19.72 ? 246 ALA A N 1 +ATOM 1933 C CA . ALA A 1 262 ? -8.546 -27.813 -18.301 1.00 21.75 ? 246 ALA A CA 1 +ATOM 1934 C C . ALA A 1 262 ? -7.966 -28.861 -19.251 1.00 16.85 ? 246 ALA A C 1 +ATOM 1935 O O . ALA A 1 262 ? -7.397 -28.523 -20.289 1.00 17.67 ? 246 ALA A O 1 +ATOM 1936 C CB . ALA A 1 262 ? -7.641 -27.640 -17.086 1.00 12.28 ? 246 ALA A CB 1 +ATOM 1937 N N . ILE A 1 263 ? -8.118 -30.130 -18.886 1.00 13.38 ? 247 ILE A N 1 +ATOM 1938 C CA . ILE A 1 263 ? -7.593 -31.236 -19.686 1.00 19.77 ? 247 ILE A CA 1 +ATOM 1939 C C . ILE A 1 263 ? -8.285 -31.313 -21.041 1.00 23.83 ? 247 ILE A C 1 +ATOM 1940 O O . ILE A 1 263 ? -7.637 -31.458 -22.075 1.00 20.04 ? 247 ILE A O 1 +ATOM 1941 C CB . ILE A 1 263 ? -7.768 -32.592 -18.977 1.00 16.69 ? 247 ILE A CB 1 +ATOM 1942 C CG1 . ILE A 1 263 ? -7.011 -32.624 -17.648 1.00 30.58 ? 247 ILE A CG1 1 +ATOM 1943 C CG2 . ILE A 1 263 ? -7.276 -33.723 -19.872 1.00 26.32 ? 247 ILE A CG2 1 +ATOM 1944 C CD1 . ILE A 1 263 ? -5.565 -32.996 -17.782 1.00 58.22 ? 247 ILE A CD1 1 +ATOM 1945 N N . GLN A 1 264 ? -9.609 -31.220 -21.023 1.00 17.89 ? 248 GLN A N 1 +ATOM 1946 C CA . GLN A 1 264 ? -10.398 -31.313 -22.240 1.00 21.94 ? 248 GLN A CA 1 +ATOM 1947 C C . GLN A 1 264 ? -10.033 -30.191 -23.207 1.00 21.91 ? 248 GLN A C 1 +ATOM 1948 O O . GLN A 1 264 ? -9.899 -30.420 -24.408 1.00 20.75 ? 248 GLN A O 1 +ATOM 1949 C CB . GLN A 1 264 ? -11.894 -31.278 -21.918 1.00 18.94 ? 248 GLN A CB 1 +ATOM 1950 C CG . GLN A 1 264 ? -12.783 -31.611 -23.103 1.00 48.28 ? 248 GLN A CG 1 +ATOM 1951 C CD . GLN A 1 264 ? -12.613 -33.045 -23.566 1.00 30.34 ? 248 GLN A CD 1 +ATOM 1952 O OE1 . GLN A 1 264 ? -12.368 -33.945 -22.760 1.00 44.80 ? 248 GLN A OE1 1 +ATOM 1953 N NE2 . GLN A 1 264 ? -12.740 -33.266 -24.869 1.00 70.25 ? 248 GLN A NE2 1 +ATOM 1954 N N . GLN A 1 265 ? -9.854 -28.981 -22.688 1.00 15.61 ? 249 GLN A N 1 +ATOM 1955 C CA . GLN A 1 265 ? -9.491 -27.860 -23.551 1.00 17.51 ? 249 GLN A CA 1 +ATOM 1956 C C . GLN A 1 265 ? -8.052 -27.978 -24.033 1.00 29.24 ? 249 GLN A C 1 +ATOM 1957 O O . GLN A 1 265 ? -7.723 -27.536 -25.131 1.00 17.04 ? 249 GLN A O 1 +ATOM 1958 C CB . GLN A 1 265 ? -9.690 -26.528 -22.835 1.00 20.18 ? 249 GLN A CB 1 +ATOM 1959 C CG . GLN A 1 265 ? -11.143 -26.106 -22.721 1.00 17.47 ? 249 GLN A CG 1 +ATOM 1960 C CD . GLN A 1 265 ? -11.284 -24.662 -22.315 1.00 24.28 ? 249 GLN A CD 1 +ATOM 1961 O OE1 . GLN A 1 265 ? -11.601 -23.802 -23.139 1.00 24.97 ? 249 GLN A OE1 1 +ATOM 1962 N NE2 . GLN A 1 265 ? -11.036 -24.379 -21.041 1.00 19.36 ? 249 GLN A NE2 1 +ATOM 1963 N N . SER A 1 266 ? -7.196 -28.570 -23.205 1.00 16.33 ? 250 SER A N 1 +ATOM 1964 C CA . SER A 1 266 ? -5.805 -28.802 -23.582 1.00 13.04 ? 250 SER A CA 1 +ATOM 1965 C C . SER A 1 266 ? -5.728 -29.741 -24.779 1.00 20.57 ? 250 SER A C 1 +ATOM 1966 O O . SER A 1 266 ? -5.014 -29.477 -25.746 1.00 18.25 ? 250 SER A O 1 +ATOM 1967 C CB . SER A 1 266 ? -5.016 -29.377 -22.400 1.00 9.09 ? 250 SER A CB 1 +ATOM 1968 O OG . SER A 1 266 ? -4.933 -28.438 -21.336 1.00 17.13 ? 250 SER A OG 1 +ATOM 1969 N N . ALA A 1 267 ? -6.480 -30.835 -24.708 1.00 15.41 ? 251 ALA A N 1 +ATOM 1970 C CA . ALA A 1 267 ? -6.514 -31.812 -25.789 1.00 27.13 ? 251 ALA A CA 1 +ATOM 1971 C C . ALA A 1 267 ? -7.043 -31.180 -27.072 1.00 33.37 ? 251 ALA A C 1 +ATOM 1972 O O . ALA A 1 267 ? -6.495 -31.394 -28.151 1.00 29.37 ? 251 ALA A O 1 +ATOM 1973 C CB . ALA A 1 267 ? -7.365 -33.009 -25.393 1.00 17.52 ? 251 ALA A CB 1 +ATOM 1974 N N . ALA A 1 268 ? -8.101 -30.388 -26.943 1.00 20.38 ? 252 ALA A N 1 +ATOM 1975 C CA . ALA A 1 268 ? -8.709 -29.729 -28.092 1.00 32.01 ? 252 ALA A CA 1 +ATOM 1976 C C . ALA A 1 268 ? -7.770 -28.701 -28.715 1.00 34.42 ? 252 ALA A C 1 +ATOM 1977 O O . ALA A 1 268 ? -7.884 -28.386 -29.897 1.00 29.65 ? 252 ALA A O 1 +ATOM 1978 C CB . ALA A 1 268 ? -10.024 -29.071 -27.690 1.00 24.92 ? 252 ALA A CB 1 +ATOM 1979 N N . ALA A 1 269 ? -6.843 -28.179 -27.919 1.00 24.35 ? 253 ALA A N 1 +ATOM 1980 C CA . ALA A 1 269 ? -5.880 -27.201 -28.416 1.00 24.43 ? 253 ALA A CA 1 +ATOM 1981 C C . ALA A 1 269 ? -4.632 -27.881 -28.981 1.00 24.56 ? 253 ALA A C 1 +ATOM 1982 O O . ALA A 1 269 ? -3.711 -27.213 -29.447 1.00 31.35 ? 253 ALA A O 1 +ATOM 1983 C CB . ALA A 1 269 ? -5.497 -26.226 -27.315 1.00 21.24 ? 253 ALA A CB 1 +ATOM 1984 N N . GLY A 1 270 ? -4.598 -29.208 -28.926 1.00 23.29 ? 254 GLY A N 1 +ATOM 1985 C CA . GLY A 1 270 ? -3.506 -29.958 -29.522 1.00 18.67 ? 254 GLY A CA 1 +ATOM 1986 C C . GLY A 1 270 ? -2.404 -30.387 -28.568 1.00 37.14 ? 254 GLY A C 1 +ATOM 1987 O O . GLY A 1 270 ? -1.354 -30.852 -29.007 1.00 28.48 ? 254 GLY A O 1 +ATOM 1988 N N . TYR A 1 271 ? -2.628 -30.237 -27.267 1.00 28.34 ? 255 TYR A N 1 +ATOM 1989 C CA . TYR A 1 271 ? -1.642 -30.679 -26.284 1.00 22.98 ? 255 TYR A CA 1 +ATOM 1990 C C . TYR A 1 271 ? -1.615 -32.202 -26.244 1.00 17.48 ? 255 TYR A C 1 +ATOM 1991 O O . TYR A 1 271 ? -2.566 -32.841 -25.785 1.00 19.87 ? 255 TYR A O 1 +ATOM 1992 C CB . TYR A 1 271 ? -1.946 -30.104 -24.896 1.00 17.28 ? 255 TYR A CB 1 +ATOM 1993 C CG . TYR A 1 271 ? -0.821 -30.302 -23.901 1.00 20.00 ? 255 TYR A CG 1 +ATOM 1994 C CD1 . TYR A 1 271 ? 0.452 -29.811 -24.158 1.00 19.55 ? 255 TYR A CD1 1 +ATOM 1995 C CD2 . TYR A 1 271 ? -1.034 -30.972 -22.708 1.00 14.06 ? 255 TYR A CD2 1 +ATOM 1996 C CE1 . TYR A 1 271 ? 1.482 -29.992 -23.260 1.00 21.86 ? 255 TYR A CE1 1 +ATOM 1997 C CE2 . TYR A 1 271 ? -0.013 -31.153 -21.797 1.00 16.27 ? 255 TYR A CE2 1 +ATOM 1998 C CZ . TYR A 1 271 ? 1.245 -30.661 -22.081 1.00 29.69 ? 255 TYR A CZ 1 +ATOM 1999 O OH . TYR A 1 271 ? 2.269 -30.837 -21.182 1.00 24.57 ? 255 TYR A OH 1 +ATOM 2000 N N . VAL A 1 272 ? -0.523 -32.781 -26.740 1.00 24.04 ? 256 VAL A N 1 +ATOM 2001 C CA . VAL A 1 272 ? -0.420 -34.230 -26.913 1.00 18.84 ? 256 VAL A CA 1 +ATOM 2002 C C . VAL A 1 272 ? -0.571 -35.056 -25.621 1.00 14.70 ? 256 VAL A C 1 +ATOM 2003 O O . VAL A 1 272 ? -1.275 -36.066 -25.634 1.00 27.99 ? 256 VAL A O 1 +ATOM 2004 C CB . VAL A 1 272 ? 0.919 -34.608 -27.606 1.00 34.91 ? 256 VAL A CB 1 +ATOM 2005 C CG1 . VAL A 1 272 ? 1.128 -36.110 -27.599 1.00 22.90 ? 256 VAL A CG1 1 +ATOM 2006 C CG2 . VAL A 1 272 ? 0.936 -34.082 -29.030 1.00 34.68 ? 256 VAL A CG2 1 +ATOM 2007 N N . PRO A 1 273 ? 0.078 -34.646 -24.508 1.00 21.38 ? 257 PRO A N 1 +ATOM 2008 C CA . PRO A 1 273 ? -0.150 -35.430 -23.282 1.00 17.01 ? 257 PRO A CA 1 +ATOM 2009 C C . PRO A 1 273 ? -1.619 -35.464 -22.833 1.00 22.56 ? 257 PRO A C 1 +ATOM 2010 O O . PRO A 1 273 ? -2.066 -36.472 -22.286 1.00 22.00 ? 257 PRO A O 1 +ATOM 2011 C CB . PRO A 1 273 ? 0.715 -34.710 -22.239 1.00 22.78 ? 257 PRO A CB 1 +ATOM 2012 C CG . PRO A 1 273 ? 1.786 -34.042 -23.036 1.00 19.22 ? 257 PRO A CG 1 +ATOM 2013 C CD . PRO A 1 273 ? 1.106 -33.606 -24.304 1.00 21.81 ? 257 PRO A CD 1 +ATOM 2014 N N . ALA A 1 274 ? -2.353 -34.379 -23.062 1.00 17.40 ? 258 ALA A N 1 +ATOM 2015 C CA . ALA A 1 274 ? -3.779 -34.348 -22.748 1.00 15.29 ? 258 ALA A CA 1 +ATOM 2016 C C . ALA A 1 274 ? -4.555 -35.312 -23.637 1.00 27.08 ? 258 ALA A C 1 +ATOM 2017 O O . ALA A 1 274 ? -5.438 -36.030 -23.169 1.00 23.76 ? 258 ALA A O 1 +ATOM 2018 C CB . ALA A 1 274 ? -4.329 -32.935 -22.900 1.00 19.95 ? 258 ALA A CB 1 +ATOM 2019 N N . GLN A 1 275 ? -4.227 -35.317 -24.924 1.00 20.70 ? 259 GLN A N 1 +ATOM 2020 C CA . GLN A 1 275 ? -4.881 -36.211 -25.874 1.00 27.86 ? 259 GLN A CA 1 +ATOM 2021 C C . GLN A 1 275 ? -4.598 -37.668 -25.529 1.00 35.53 ? 259 GLN A C 1 +ATOM 2022 O O . GLN A 1 275 ? -5.490 -38.513 -25.575 1.00 28.97 ? 259 GLN A O 1 +ATOM 2023 C CB . GLN A 1 275 ? -4.424 -35.901 -27.297 1.00 22.57 ? 259 GLN A CB 1 +ATOM 2024 C CG . GLN A 1 275 ? -4.756 -34.485 -27.744 1.00 18.10 ? 259 GLN A CG 1 +ATOM 2025 C CD . GLN A 1 275 ? -4.242 -34.179 -29.131 1.00 30.60 ? 259 GLN A CD 1 +ATOM 2026 O OE1 . GLN A 1 275 ? -3.379 -34.880 -29.652 1.00 36.08 ? 259 GLN A OE1 1 +ATOM 2027 N NE2 . GLN A 1 275 ? -4.776 -33.129 -29.742 1.00 33.65 ? 259 GLN A NE2 1 +ATOM 2028 N N . GLN A 1 276 ? -3.353 -37.954 -25.170 1.00 22.62 ? 260 GLN A N 1 +ATOM 2029 C CA . GLN A 1 276 ? -2.969 -39.299 -24.757 1.00 30.73 ? 260 GLN A CA 1 +ATOM 2030 C C . GLN A 1 276 ? -3.684 -39.712 -23.472 1.00 44.63 ? 260 GLN A C 1 +ATOM 2031 O O . GLN A 1 276 ? -4.136 -40.849 -23.350 1.00 45.46 ? 260 GLN A O 1 +ATOM 2032 C CB . GLN A 1 276 ? -1.452 -39.390 -24.566 1.00 29.45 ? 260 GLN A CB 1 +ATOM 2033 C CG . GLN A 1 276 ? -0.653 -39.272 -25.855 1.00 27.07 ? 260 GLN A CG 1 +ATOM 2034 C CD . GLN A 1 276 ? 0.845 -39.165 -25.614 1.00 81.64 ? 260 GLN A CD 1 +ATOM 2035 O OE1 . GLN A 1 276 ? 1.285 -38.718 -24.555 1.00 64.62 ? 260 GLN A OE1 1 +ATOM 2036 N NE2 . GLN A 1 276 ? 1.634 -39.573 -26.602 1.00 71.58 ? 260 GLN A NE2 1 +ATOM 2037 N N . ALA A 1 277 ? -3.787 -38.785 -22.522 1.00 37.76 ? 261 ALA A N 1 +ATOM 2038 C CA . ALA A 1 277 ? -4.425 -39.067 -21.237 1.00 37.01 ? 261 ALA A CA 1 +ATOM 2039 C C . ALA A 1 277 ? -5.890 -39.448 -21.409 1.00 38.44 ? 261 ALA A C 1 +ATOM 2040 O O . ALA A 1 277 ? -6.352 -40.438 -20.845 1.00 42.03 ? 261 ALA A O 1 +ATOM 2041 C CB . ALA A 1 277 ? -4.301 -37.868 -20.300 1.00 23.27 ? 261 ALA A CB 1 +ATOM 2042 N N . LEU A 1 278 ? -6.616 -38.658 -22.195 1.00 26.64 ? 262 LEU A N 1 +ATOM 2043 C CA . LEU A 1 278 ? -8.031 -38.916 -22.434 1.00 28.86 ? 262 LEU A CA 1 +ATOM 2044 C C . LEU A 1 278 ? -8.215 -40.165 -23.291 1.00 49.88 ? 262 LEU A C 1 +ATOM 2045 O O . LEU A 1 278 ? -9.293 -40.757 -23.318 1.00 49.06 ? 262 LEU A O 1 +ATOM 2046 C CB . LEU A 1 278 ? -8.692 -37.709 -23.099 1.00 24.70 ? 262 LEU A CB 1 +ATOM 2047 C CG . LEU A 1 278 ? -8.747 -36.438 -22.250 1.00 33.52 ? 262 LEU A CG 1 +ATOM 2048 C CD1 . LEU A 1 278 ? -9.320 -35.278 -23.046 1.00 27.16 ? 262 LEU A CD1 1 +ATOM 2049 C CD2 . LEU A 1 278 ? -9.566 -36.681 -20.992 1.00 38.61 ? 262 LEU A CD2 1 +ATOM 2050 N N . GLY A 1 279 ? -7.151 -40.563 -23.983 1.00 49.84 ? 263 GLY A N 1 +ATOM 2051 C CA . GLY A 1 279 ? -7.170 -41.760 -24.801 1.00 49.81 ? 263 GLY A CA 1 +ATOM 2052 C C . GLY A 1 279 ? -7.118 -43.036 -23.980 1.00 74.09 ? 263 GLY A C 1 +ATOM 2053 O O . GLY A 1 279 ? -7.680 -44.058 -24.376 1.00 61.79 ? 263 GLY A O 1 +ATOM 2054 N N . ARG A 1 280 ? -6.445 -42.979 -22.834 1.00 73.91 ? 264 ARG A N 1 +ATOM 2055 C CA . ARG A 1 280 ? -6.315 -44.144 -21.962 1.00 65.73 ? 264 ARG A CA 1 +ATOM 2056 C C . ARG A 1 280 ? -7.620 -44.433 -21.224 1.00 52.28 ? 264 ARG A C 1 +ATOM 2057 O O . ARG A 1 280 ? -7.822 -45.536 -20.714 1.00 90.35 ? 264 ARG A O 1 +ATOM 2058 C CB . ARG A 1 280 ? -5.181 -43.943 -20.950 1.00 54.84 ? 264 ARG A CB 1 +ATOM 2059 C CG . ARG A 1 280 ? -3.856 -43.515 -21.563 1.00 74.86 ? 264 ARG A CG 1 +ATOM 2060 C CD . ARG A 1 280 ? -2.743 -43.485 -20.521 1.00 91.18 ? 264 ARG A CD 1 +ATOM 2061 N NE . ARG A 1 280 ? -1.595 -42.700 -20.969 1.00 102.18 ? 264 ARG A NE 1 +ATOM 2062 C CZ . ARG A 1 280 ? -1.310 -41.478 -20.530 1.00 61.96 ? 264 ARG A CZ 1 +ATOM 2063 N NH1 . ARG A 1 280 ? -2.083 -40.903 -19.619 1.00 87.19 ? 264 ARG A NH1 1 +ATOM 2064 N NH2 . ARG A 1 280 ? -0.249 -40.832 -20.993 1.00 53.15 ? 264 ARG A NH2 1 +ATOM 2065 N N . ILE A 1 281 ? -8.500 -43.438 -21.170 1.00 68.51 ? 265 ILE A N 1 +ATOM 2066 C CA . ILE A 1 281 ? -9.780 -43.579 -20.484 1.00 76.34 ? 265 ILE A CA 1 +ATOM 2067 C C . ILE A 1 281 ? -10.955 -43.364 -21.436 1.00 73.26 ? 265 ILE A C 1 +ATOM 2068 O O . ILE A 1 281 ? -10.883 -43.700 -22.620 1.00 49.06 ? 265 ILE A O 1 +ATOM 2069 C CB . ILE A 1 281 ? -9.901 -42.590 -19.308 1.00 56.03 ? 265 ILE A CB 1 +ATOM 2070 C CG1 . ILE A 1 281 ? -9.980 -41.153 -19.827 1.00 57.53 ? 265 ILE A CG1 1 +ATOM 2071 C CG2 . ILE A 1 281 ? -8.731 -42.752 -18.349 1.00 70.66 ? 265 ILE A CG2 1 +ATOM 2072 C CD1 . ILE A 1 281 ? -10.100 -40.114 -18.735 1.00 62.67 ? 265 ILE A CD1 1 +HETATM 2073 C C1 . RET B 2 . ? -20.399 -15.465 5.238 1.00 20.84 ? 301 RET A C1 1 +HETATM 2074 C C2 . RET B 2 . ? -21.156 -14.502 6.139 1.00 16.67 ? 301 RET A C2 1 +HETATM 2075 C C3 . RET B 2 . ? -22.651 -14.743 6.052 1.00 16.34 ? 301 RET A C3 1 +HETATM 2076 C C4 . RET B 2 . ? -23.126 -14.352 4.665 1.00 20.44 ? 301 RET A C4 1 +HETATM 2077 C C5 . RET B 2 . ? -22.217 -14.919 3.597 1.00 18.07 ? 301 RET A C5 1 +HETATM 2078 C C6 . RET B 2 . ? -21.057 -15.546 3.858 1.00 14.38 ? 301 RET A C6 1 +HETATM 2079 C C7 . RET B 2 . ? -20.488 -16.332 2.725 1.00 20.23 ? 301 RET A C7 1 +HETATM 2080 C C8 . RET B 2 . ? -19.476 -17.196 2.831 1.00 9.61 ? 301 RET A C8 1 +HETATM 2081 C C9 . RET B 2 . ? -18.948 -17.984 1.710 1.00 16.64 ? 301 RET A C9 1 +HETATM 2082 C C10 . RET B 2 . ? -17.859 -18.723 1.952 1.00 15.33 ? 301 RET A C10 1 +HETATM 2083 C C11 . RET B 2 . ? -17.221 -19.588 0.967 1.00 15.50 ? 301 RET A C11 1 +HETATM 2084 C C12 . RET B 2 . ? -16.257 -20.380 1.431 1.00 18.27 ? 301 RET A C12 1 +HETATM 2085 C C13 . RET B 2 . ? -15.534 -21.329 0.571 1.00 18.22 ? 301 RET A C13 1 +HETATM 2086 C C14 . RET B 2 . ? -14.551 -22.065 1.109 1.00 24.34 ? 301 RET A C14 1 +HETATM 2087 C C15 . RET B 2 . ? -13.816 -23.028 0.299 1.00 25.86 ? 301 RET A C15 1 +HETATM 2088 C C16 . RET B 2 . ? -18.958 -14.963 5.162 1.00 15.45 ? 301 RET A C16 1 +HETATM 2089 C C17 . RET B 2 . ? -20.440 -16.833 5.915 1.00 13.67 ? 301 RET A C17 1 +HETATM 2090 C C18 . RET B 2 . ? -22.671 -14.781 2.172 1.00 14.21 ? 301 RET A C18 1 +HETATM 2091 C C19 . RET B 2 . ? -19.632 -17.973 0.372 1.00 10.79 ? 301 RET A C19 1 +HETATM 2092 C C20 . RET B 2 . ? -15.919 -21.494 -0.873 1.00 18.54 ? 301 RET A C20 1 +HETATM 2093 CL CL . CL C 3 . ? -10.687 -23.067 3.320 1.00 32.55 ? 302 CL A CL 1 +HETATM 2094 CL CL . CL D 3 . ? -0.557 -23.869 -23.802 1.00 40.01 ? 303 CL A CL 1 +HETATM 2095 C C1 . OLA E 4 . ? -23.550 -2.457 14.151 1.00 47.05 ? 304 OLA A C1 1 +HETATM 2096 O O1 . OLA E 4 . ? -24.460 -3.314 14.148 1.00 53.41 ? 304 OLA A O1 1 +HETATM 2097 O O2 . OLA E 4 . ? -23.176 -1.970 15.242 1.00 38.30 ? 304 OLA A O2 1 +HETATM 2098 C C2 . OLA E 4 . ? -22.916 -2.020 12.852 1.00 38.63 ? 304 OLA A C2 1 +HETATM 2099 C C3 . OLA E 4 . ? -23.474 -2.859 11.708 1.00 27.47 ? 304 OLA A C3 1 +HETATM 2100 C C4 . OLA E 4 . ? -22.662 -2.668 10.435 1.00 49.84 ? 304 OLA A C4 1 +HETATM 2101 C C5 . OLA E 4 . ? -23.444 -3.138 9.216 1.00 46.72 ? 304 OLA A C5 1 +HETATM 2102 C C6 . OLA E 4 . ? -23.855 -1.962 8.336 1.00 56.83 ? 304 OLA A C6 1 +HETATM 2103 C C7 . OLA E 4 . ? -22.742 -0.927 8.211 1.00 48.64 ? 304 OLA A C7 1 +HETATM 2104 C C8 . OLA E 4 . ? -21.906 -1.156 6.956 1.00 60.56 ? 304 OLA A C8 1 +HETATM 2105 C C9 . OLA E 4 . ? -20.584 -1.787 7.325 1.00 77.57 ? 304 OLA A C9 1 +HETATM 2106 C C10 . OLA E 4 . ? -19.433 -1.667 6.416 1.00 75.19 ? 304 OLA A C10 1 +HETATM 2107 C C11 . OLA E 4 . ? -19.624 -1.822 4.926 1.00 49.82 ? 304 OLA A C11 1 +HETATM 2108 C C12 . OLA E 4 . ? -18.312 -1.515 4.213 1.00 48.25 ? 304 OLA A C12 1 +HETATM 2109 C C1 . OLA F 4 . ? -25.128 -37.384 16.199 1.00 64.39 ? 305 OLA A C1 1 +HETATM 2110 O O1 . OLA F 4 . ? -24.778 -38.423 16.798 1.00 62.38 ? 305 OLA A O1 1 +HETATM 2111 O O2 . OLA F 4 . ? -24.648 -36.291 16.568 1.00 51.28 ? 305 OLA A O2 1 +HETATM 2112 C C2 . OLA F 4 . ? -26.124 -37.440 15.062 1.00 47.64 ? 305 OLA A C2 1 +HETATM 2113 C C3 . OLA F 4 . ? -25.774 -38.565 14.093 1.00 43.20 ? 305 OLA A C3 1 +HETATM 2114 C C4 . OLA F 4 . ? -25.598 -38.040 12.671 1.00 39.92 ? 305 OLA A C4 1 +HETATM 2115 C C5 . OLA F 4 . ? -25.731 -39.164 11.648 1.00 46.71 ? 305 OLA A C5 1 +HETATM 2116 C C6 . OLA F 4 . ? -24.696 -39.027 10.539 1.00 37.72 ? 305 OLA A C6 1 +HETATM 2117 C C7 . OLA F 4 . ? -25.325 -38.640 9.208 1.00 20.79 ? 305 OLA A C7 1 +HETATM 2118 C C8 . OLA F 4 . ? -24.317 -38.813 8.074 1.00 41.88 ? 305 OLA A C8 1 +HETATM 2119 C C9 . OLA F 4 . ? -23.449 -37.580 7.991 1.00 103.20 ? 305 OLA A C9 1 +HETATM 2120 C C10 . OLA F 4 . ? -22.605 -37.313 6.814 1.00 60.77 ? 305 OLA A C10 1 +HETATM 2121 C C11 . OLA F 4 . ? -21.290 -38.024 6.598 1.00 37.58 ? 305 OLA A C11 1 +HETATM 2122 C C12 . OLA F 4 . ? -20.706 -37.609 5.248 1.00 44.10 ? 305 OLA A C12 1 +HETATM 2123 C C13 . OLA F 4 . ? -20.763 -36.096 5.056 1.00 37.71 ? 305 OLA A C13 1 +HETATM 2124 C C14 . OLA F 4 . ? -20.054 -35.655 3.779 1.00 33.64 ? 305 OLA A C14 1 +HETATM 2125 C C15 . OLA F 4 . ? -21.002 -35.611 2.588 1.00 34.89 ? 305 OLA A C15 1 +HETATM 2126 C C16 . OLA F 4 . ? -20.304 -35.059 1.349 1.00 41.61 ? 305 OLA A C16 1 +HETATM 2127 C C17 . OLA F 4 . ? -21.314 -34.683 0.271 1.00 43.96 ? 305 OLA A C17 1 +HETATM 2128 C C18 . OLA F 4 . ? -20.620 -34.192 -0.993 1.00 44.79 ? 305 OLA A C18 1 +HETATM 2129 C C1 . OLA G 4 . ? -18.145 -34.972 -18.063 1.00 68.28 ? 306 OLA A C1 1 +HETATM 2130 O O1 . OLA G 4 . ? -18.502 -33.825 -18.408 1.00 64.45 ? 306 OLA A O1 1 +HETATM 2131 O O2 . OLA G 4 . ? -18.390 -35.934 -18.824 1.00 61.66 ? 306 OLA A O2 1 +HETATM 2132 C C2 . OLA G 4 . ? -17.431 -35.189 -16.749 1.00 39.42 ? 306 OLA A C2 1 +HETATM 2133 C C3 . OLA G 4 . ? -18.029 -34.256 -15.706 1.00 35.00 ? 306 OLA A C3 1 +HETATM 2134 C C4 . OLA G 4 . ? -16.952 -33.549 -14.892 1.00 51.76 ? 306 OLA A C4 1 +HETATM 2135 C C5 . OLA G 4 . ? -16.213 -34.523 -13.983 1.00 59.22 ? 306 OLA A C5 1 +HETATM 2136 C C6 . OLA G 4 . ? -16.258 -34.049 -12.535 1.00 50.00 ? 306 OLA A C6 1 +HETATM 2137 C C7 . OLA G 4 . ? -16.203 -35.215 -11.555 1.00 45.73 ? 306 OLA A C7 1 +HETATM 2138 C C8 . OLA G 4 . ? -17.120 -34.972 -10.361 1.00 37.51 ? 306 OLA A C8 1 +HETATM 2139 C C9 . OLA G 4 . ? -16.814 -35.984 -9.283 1.00 67.90 ? 306 OLA A C9 1 +HETATM 2140 C C10 . OLA G 4 . ? -17.884 -36.599 -8.484 1.00 50.87 ? 306 OLA A C10 1 +HETATM 2141 C C11 . OLA G 4 . ? -19.165 -35.864 -8.168 1.00 46.00 ? 306 OLA A C11 1 +HETATM 2142 C C12 . OLA G 4 . ? -20.042 -36.796 -7.340 1.00 70.20 ? 306 OLA A C12 1 +HETATM 2143 C C13 . OLA G 4 . ? -21.512 -36.394 -7.367 1.00 49.47 ? 306 OLA A C13 1 +HETATM 2144 C C14 . OLA G 4 . ? -22.295 -37.200 -6.335 1.00 45.43 ? 306 OLA A C14 1 +HETATM 2145 C C15 . OLA G 4 . ? -23.634 -37.657 -6.899 1.00 38.93 ? 306 OLA A C15 1 +HETATM 2146 C C16 . OLA G 4 . ? -24.379 -38.551 -5.912 1.00 38.49 ? 306 OLA A C16 1 +HETATM 2147 C C1 . OLA H 4 . ? -22.892 -41.762 14.838 1.00 86.65 ? 307 OLA A C1 1 +HETATM 2148 O O1 . OLA H 4 . ? -22.337 -42.882 14.841 1.00 87.63 ? 307 OLA A O1 1 +HETATM 2149 O O2 . OLA H 4 . ? -23.301 -41.287 15.920 1.00 55.71 ? 307 OLA A O2 1 +HETATM 2150 C C2 . OLA H 4 . ? -23.067 -40.995 13.548 1.00 48.88 ? 307 OLA A C2 1 +HETATM 2151 C C3 . OLA H 4 . ? -22.035 -41.454 12.524 1.00 39.28 ? 307 OLA A C3 1 +HETATM 2152 C C4 . OLA H 4 . ? -22.710 -42.075 11.306 1.00 47.83 ? 307 OLA A C4 1 +HETATM 2153 C C5 . OLA H 4 . ? -21.679 -42.500 10.268 1.00 49.89 ? 307 OLA A C5 1 +HETATM 2154 C C6 . OLA H 4 . ? -22.215 -42.315 8.853 1.00 44.59 ? 307 OLA A C6 1 +HETATM 2155 C C7 . OLA H 4 . ? -22.470 -43.658 8.177 1.00 59.27 ? 307 OLA A C7 1 +HETATM 2156 C C8 . OLA H 4 . ? -22.480 -43.518 6.659 1.00 44.54 ? 307 OLA A C8 1 +HETATM 2157 C C1 . OLA I 4 . ? 5.140 -36.540 -10.826 1.00 83.79 ? 308 OLA A C1 1 +HETATM 2158 O O1 . OLA I 4 . ? 4.138 -36.708 -11.554 1.00 59.71 ? 308 OLA A O1 1 +HETATM 2159 O O2 . OLA I 4 . ? 5.863 -35.536 -11.009 1.00 60.67 ? 308 OLA A O2 1 +HETATM 2160 C C2 . OLA I 4 . ? 5.475 -37.541 -9.746 1.00 48.27 ? 308 OLA A C2 1 +HETATM 2161 C C3 . OLA I 4 . ? 4.396 -37.514 -8.669 1.00 42.65 ? 308 OLA A C3 1 +HETATM 2162 C C4 . OLA I 4 . ? 4.997 -37.802 -7.298 1.00 65.31 ? 308 OLA A C4 1 +HETATM 2163 C C5 . OLA I 4 . ? 3.975 -38.460 -6.378 1.00 51.65 ? 308 OLA A C5 1 +HETATM 2164 C C6 . OLA I 4 . ? 4.403 -38.362 -4.918 1.00 37.48 ? 308 OLA A C6 1 +HETATM 2165 C C7 . OLA I 4 . ? 3.202 -38.505 -3.992 1.00 48.52 ? 308 OLA A C7 1 +HETATM 2166 C C8 . OLA I 4 . ? 3.601 -39.146 -2.667 1.00 47.33 ? 308 OLA A C8 1 +HETATM 2167 C C9 . OLA I 4 . ? 2.412 -39.152 -1.737 1.00 59.42 ? 308 OLA A C9 1 +HETATM 2168 C C10 . OLA I 4 . ? 2.569 -39.589 -0.343 1.00 53.67 ? 308 OLA A C10 1 +HETATM 2169 C C9 . OLA J 4 . ? -29.060 -22.479 -4.398 1.00 39.05 ? 309 OLA A C9 1 +HETATM 2170 C C10 . OLA J 4 . ? -29.474 -23.101 -3.130 1.00 69.33 ? 309 OLA A C10 1 +HETATM 2171 C C11 . OLA J 4 . ? -28.436 -23.660 -2.186 1.00 64.45 ? 309 OLA A C11 1 +HETATM 2172 C C12 . OLA J 4 . ? -29.093 -24.083 -0.876 1.00 43.40 ? 309 OLA A C12 1 +HETATM 2173 C C13 . OLA J 4 . ? -30.050 -25.249 -1.093 1.00 66.30 ? 309 OLA A C13 1 +HETATM 2174 C C14 . OLA J 4 . ? -29.384 -26.584 -0.781 1.00 58.23 ? 309 OLA A C14 1 +HETATM 2175 C C15 . OLA J 4 . ? -29.521 -26.942 0.695 1.00 59.98 ? 309 OLA A C15 1 +HETATM 2176 C C16 . OLA J 4 . ? -29.035 -28.364 0.952 1.00 56.18 ? 309 OLA A C16 1 +HETATM 2177 C C17 . OLA J 4 . ? -29.311 -28.797 2.387 1.00 35.93 ? 309 OLA A C17 1 +HETATM 2178 C C18 . OLA J 4 . ? -30.807 -28.887 2.651 1.00 48.58 ? 309 OLA A C18 1 +HETATM 2179 C C1 . OLA K 4 . ? -6.712 -40.900 -5.331 1.00 56.86 ? 310 OLA A C1 1 +HETATM 2180 C C2 . OLA K 4 . ? -5.256 -41.279 -5.197 1.00 50.05 ? 310 OLA A C2 1 +HETATM 2181 C C3 . OLA K 4 . ? -4.323 -40.996 -6.297 1.00 62.09 ? 310 OLA A C3 1 +HETATM 2182 C C4 . OLA K 4 . ? -4.769 -41.170 -7.729 1.00 48.02 ? 310 OLA A C4 1 +HETATM 2183 C C5 . OLA K 4 . ? -3.554 -41.112 -8.646 1.00 33.80 ? 310 OLA A C5 1 +HETATM 2184 C C6 . OLA K 4 . ? -3.945 -41.394 -10.092 1.00 56.92 ? 310 OLA A C6 1 +HETATM 2185 C C1 . OLA L 4 . ? -5.493 -38.939 -16.587 1.00 46.46 ? 311 OLA A C1 1 +HETATM 2186 C C2 . OLA L 4 . ? -6.916 -38.614 -17.022 1.00 66.19 ? 311 OLA A C2 1 +HETATM 2187 C C3 . OLA L 4 . ? -7.569 -37.618 -16.072 1.00 41.88 ? 311 OLA A C3 1 +HETATM 2188 C C4 . OLA L 4 . ? -8.913 -37.212 -16.624 1.00 40.45 ? 311 OLA A C4 1 +HETATM 2189 C C5 . OLA L 4 . ? -9.669 -36.110 -16.013 1.00 37.12 ? 311 OLA A C5 1 +HETATM 2190 C C6 . OLA L 4 . ? -9.403 -35.701 -14.585 1.00 59.95 ? 311 OLA A C6 1 +HETATM 2191 C C7 . OLA L 4 . ? -10.680 -35.139 -13.972 1.00 33.96 ? 311 OLA A C7 1 +HETATM 2192 C C8 . OLA L 4 . ? -11.454 -36.239 -13.252 1.00 49.57 ? 311 OLA A C8 1 +HETATM 2193 C C9 . OLA L 4 . ? -12.958 -36.067 -13.423 1.00 38.55 ? 311 OLA A C9 1 +HETATM 2194 C C1 . OLA M 4 . ? -31.949 -24.238 -13.859 1.00 79.91 ? 312 OLA A C1 1 +HETATM 2195 O O1 . OLA M 4 . ? -31.613 -23.498 -14.809 1.00 73.09 ? 312 OLA A O1 1 +HETATM 2196 O O2 . OLA M 4 . ? -31.888 -25.477 -14.009 1.00 70.53 ? 312 OLA A O2 1 +HETATM 2197 C C2 . OLA M 4 . ? -32.423 -23.643 -12.554 1.00 59.47 ? 312 OLA A C2 1 +HETATM 2198 C C3 . OLA M 4 . ? -32.099 -24.599 -11.412 1.00 52.35 ? 312 OLA A C3 1 +HETATM 2199 C C4 . OLA M 4 . ? -32.955 -24.306 -10.186 1.00 53.11 ? 312 OLA A C4 1 +HETATM 2200 C C5 . OLA M 4 . ? -32.654 -22.913 -9.644 1.00 86.86 ? 312 OLA A C5 1 +HETATM 2201 C C6 . OLA M 4 . ? -32.671 -22.893 -8.120 1.00 65.90 ? 312 OLA A C6 1 +HETATM 2202 C C7 . OLA M 4 . ? -33.872 -22.117 -7.593 1.00 55.21 ? 312 OLA A C7 1 +HETATM 2203 C C1 . OLA N 4 . ? 3.169 -22.582 -8.949 1.00 70.72 ? 313 OLA A C1 1 +HETATM 2204 O O1 . OLA N 4 . ? 4.169 -23.089 -9.504 1.00 51.83 ? 313 OLA A O1 1 +HETATM 2205 O O2 . OLA N 4 . ? 2.548 -23.252 -8.096 1.00 68.08 ? 313 OLA A O2 1 +HETATM 2206 C C2 . OLA N 4 . ? 2.718 -21.185 -9.301 1.00 87.60 ? 313 OLA A C2 1 +HETATM 2207 C C3 . OLA N 4 . ? 1.237 -21.020 -8.975 1.00 62.83 ? 313 OLA A C3 1 +HETATM 2208 C C4 . OLA N 4 . ? 0.999 -19.826 -8.057 1.00 49.51 ? 313 OLA A C4 1 +HETATM 2209 C C5 . OLA N 4 . ? -0.492 -19.593 -7.840 1.00 44.71 ? 313 OLA A C5 1 +HETATM 2210 C C6 . OLA N 4 . ? -0.816 -18.107 -7.731 1.00 55.24 ? 313 OLA A C6 1 +HETATM 2211 C C7 . OLA N 4 . ? -1.220 -17.736 -6.308 1.00 47.94 ? 313 OLA A C7 1 +HETATM 2212 C C8 . OLA O 4 . ? -11.913 -4.864 1.255 1.00 32.99 ? 314 OLA A C8 1 +HETATM 2213 C C9 . OLA O 4 . ? -13.384 -4.699 0.952 1.00 46.85 ? 314 OLA A C9 1 +HETATM 2214 C C10 . OLA O 4 . ? -14.306 -4.220 1.993 1.00 68.94 ? 314 OLA A C10 1 +HETATM 2215 C C11 . OLA O 4 . ? -14.023 -4.505 3.451 1.00 50.73 ? 314 OLA A C11 1 +HETATM 2216 C C12 . OLA O 4 . ? -15.168 -3.995 4.321 1.00 54.60 ? 314 OLA A C12 1 +HETATM 2217 C C13 . OLA O 4 . ? -14.626 -3.416 5.622 1.00 48.33 ? 314 OLA A C13 1 +HETATM 2218 C C14 . OLA O 4 . ? -15.474 -3.794 6.831 1.00 53.34 ? 314 OLA A C14 1 +HETATM 2219 C C15 . OLA O 4 . ? -15.105 -2.915 8.022 1.00 63.75 ? 314 OLA A C15 1 +HETATM 2220 C C16 . OLA O 4 . ? -15.453 -3.577 9.351 1.00 62.59 ? 314 OLA A C16 1 +HETATM 2221 C C17 . OLA O 4 . ? -15.281 -2.595 10.506 1.00 64.62 ? 314 OLA A C17 1 +HETATM 2222 C C18 . OLA O 4 . ? -15.360 -3.304 11.854 1.00 42.90 ? 314 OLA A C18 1 +HETATM 2223 O O . HOH P 5 . ? -9.113 -33.746 25.061 1.00 6.34 ? 401 HOH A O 1 +HETATM 2224 O O . HOH P 5 . ? -20.028 -18.655 11.520 1.00 20.68 ? 402 HOH A O 1 +HETATM 2225 O O . HOH P 5 . ? -29.481 -9.009 19.378 1.00 34.24 ? 403 HOH A O 1 +HETATM 2226 O O . HOH P 5 . ? -18.776 -40.884 14.665 1.00 36.14 ? 404 HOH A O 1 +HETATM 2227 O O . HOH P 5 . ? -15.987 -23.518 -5.596 1.00 22.70 ? 405 HOH A O 1 +HETATM 2228 O O . HOH P 5 . ? -4.615 -23.174 5.972 1.00 37.01 ? 406 HOH A O 1 +HETATM 2229 O O . HOH P 5 . ? -19.785 -28.017 31.615 1.00 28.56 ? 407 HOH A O 1 +HETATM 2230 O O . HOH P 5 . ? -5.535 -32.823 21.242 1.00 27.17 ? 408 HOH A O 1 +HETATM 2231 O O . HOH P 5 . ? -20.033 -25.713 14.781 1.00 30.34 ? 409 HOH A O 1 +HETATM 2232 O O . HOH P 5 . ? -16.649 -26.271 -26.648 1.00 37.34 ? 410 HOH A O 1 +HETATM 2233 O O . HOH P 5 . ? 3.408 -33.892 -19.707 1.00 29.01 ? 411 HOH A O 1 +HETATM 2234 O O . HOH P 5 . ? -14.970 -25.940 12.128 1.00 31.18 ? 412 HOH A O 1 +HETATM 2235 O O . HOH P 5 . ? -12.392 -15.711 -22.647 1.00 38.86 ? 413 HOH A O 1 +HETATM 2236 O O . HOH P 5 . ? -8.334 -25.773 21.487 1.00 25.21 ? 414 HOH A O 1 +HETATM 2237 O O . HOH P 5 . ? -20.025 -31.438 -19.718 1.00 34.60 ? 415 HOH A O 1 +HETATM 2238 O O . HOH P 5 . ? -15.425 -28.931 7.110 1.00 29.18 ? 416 HOH A O 1 +HETATM 2239 O O . HOH P 5 . ? -27.164 -17.363 19.509 1.00 39.72 ? 417 HOH A O 1 +HETATM 2240 O O . HOH P 5 . ? -22.292 -17.473 12.614 1.00 22.76 ? 418 HOH A O 1 +HETATM 2241 O O . HOH P 5 . ? -8.660 -27.786 -10.930 1.00 26.51 ? 419 HOH A O 1 +HETATM 2242 O O . HOH P 5 . ? -13.250 -11.836 -22.916 1.00 37.12 ? 420 HOH A O 1 +HETATM 2243 O O . HOH P 5 . ? -21.754 -34.159 32.472 1.00 33.33 ? 421 HOH A O 1 +HETATM 2244 O O . HOH P 5 . ? -18.320 -27.376 28.034 1.00 20.08 ? 422 HOH A O 1 +HETATM 2245 O O . HOH P 5 . ? -20.697 -13.583 20.559 1.00 23.84 ? 423 HOH A O 1 +HETATM 2246 O O . HOH P 5 . ? -12.698 -37.937 19.133 1.00 49.79 ? 424 HOH A O 1 +HETATM 2247 O O . HOH P 5 . ? -18.318 -25.650 25.675 1.00 25.27 ? 425 HOH A O 1 +HETATM 2248 O O . HOH P 5 . ? -24.703 -9.337 -16.308 1.00 20.49 ? 426 HOH A O 1 +HETATM 2249 O O . HOH P 5 . ? -7.726 -23.468 13.071 1.00 31.20 ? 427 HOH A O 1 +HETATM 2250 O O . HOH P 5 . ? -3.470 -25.171 14.994 1.00 29.73 ? 428 HOH A O 1 +HETATM 2251 O O . HOH P 5 . ? -25.026 -32.179 24.402 1.00 27.78 ? 429 HOH A O 1 +HETATM 2252 O O . HOH P 5 . ? -29.058 -30.254 21.517 1.00 42.47 ? 430 HOH A O 1 +HETATM 2253 O O . HOH P 5 . ? -4.583 -31.253 24.730 1.00 36.49 ? 431 HOH A O 1 +HETATM 2254 O O . HOH P 5 . ? -4.077 -27.582 31.533 1.00 30.93 ? 432 HOH A O 1 +HETATM 2255 O O . HOH P 5 . ? -8.647 -31.829 26.059 1.00 38.57 ? 433 HOH A O 1 +HETATM 2256 O O . HOH P 5 . ? -13.922 -24.013 5.092 1.00 21.48 ? 434 HOH A O 1 +HETATM 2257 O O . HOH P 5 . ? 2.362 -34.164 -12.627 1.00 27.79 ? 435 HOH A O 1 +HETATM 2258 O O . HOH P 5 . ? -7.663 -29.697 31.309 1.00 48.40 ? 436 HOH A O 1 +HETATM 2259 O O . HOH P 5 . ? -6.618 -18.178 -19.452 1.00 26.57 ? 437 HOH A O 1 +HETATM 2260 O O . HOH P 5 . ? -11.019 -37.178 31.372 1.00 32.91 ? 438 HOH A O 1 +HETATM 2261 O O . HOH P 5 . ? -21.789 -39.038 26.516 1.00 25.67 ? 439 HOH A O 1 +HETATM 2262 O O . HOH P 5 . ? -9.142 -12.082 -21.867 1.00 31.65 ? 440 HOH A O 1 +HETATM 2263 O O . HOH P 5 . ? -17.585 -16.223 17.532 1.00 40.16 ? 441 HOH A O 1 +HETATM 2264 O O . HOH P 5 . ? -19.432 -31.873 35.924 1.00 45.35 ? 442 HOH A O 1 +HETATM 2265 O O . HOH P 5 . ? -2.890 -27.849 10.528 1.00 22.92 ? 443 HOH A O 1 +HETATM 2266 O O . HOH P 5 . ? -17.539 -20.514 15.930 1.00 39.07 ? 444 HOH A O 1 +HETATM 2267 O O . HOH P 5 . ? -18.699 -18.721 13.910 1.00 24.03 ? 445 HOH A O 1 +HETATM 2268 O O . HOH P 5 . ? -6.927 -26.645 34.182 1.00 41.32 ? 446 HOH A O 1 +HETATM 2269 O O . HOH P 5 . ? -23.238 -40.327 23.298 1.00 24.57 ? 447 HOH A O 1 +HETATM 2270 O O . HOH P 5 . ? -10.155 -26.509 -6.220 1.00 15.27 ? 448 HOH A O 1 +HETATM 2271 O O . HOH P 5 . ? -20.591 -40.584 17.020 1.00 42.46 ? 449 HOH A O 1 +HETATM 2272 O O . HOH P 5 . ? -13.244 -26.273 32.690 1.00 45.32 ? 450 HOH A O 1 +HETATM 2273 O O . HOH P 5 . ? -10.266 -35.198 24.152 1.00 28.42 ? 451 HOH A O 1 +HETATM 2274 O O . HOH P 5 . ? -6.231 -34.811 17.815 1.00 37.11 ? 452 HOH A O 1 +HETATM 2275 O O . HOH P 5 . ? -32.424 -21.594 18.599 1.00 39.71 ? 453 HOH A O 1 +HETATM 2276 O O . HOH P 5 . ? -23.466 -5.486 20.854 1.00 39.90 ? 454 HOH A O 1 +HETATM 2277 O O . HOH P 5 . ? -15.001 -37.661 35.248 1.00 30.21 ? 455 HOH A O 1 +HETATM 2278 O O . HOH P 5 . ? -20.228 -19.978 7.918 1.00 32.18 ? 456 HOH A O 1 +HETATM 2279 O O . HOH P 5 . ? -27.649 -28.447 23.755 1.00 25.31 ? 457 HOH A O 1 +HETATM 2280 O O . HOH P 5 . ? -14.860 -31.651 7.447 1.00 42.18 ? 458 HOH A O 1 +HETATM 2281 O O . HOH P 5 . ? -27.812 -32.193 22.720 1.00 42.53 ? 459 HOH A O 1 +HETATM 2282 O O . HOH P 5 . ? 5.536 -21.677 -11.753 1.00 46.71 ? 460 HOH A O 1 +HETATM 2283 O O . HOH P 5 . ? -15.353 -23.928 22.359 1.00 31.60 ? 461 HOH A O 1 +HETATM 2284 O O . HOH P 5 . ? 1.953 -31.248 -27.474 1.00 32.19 ? 462 HOH A O 1 +HETATM 2285 O O . HOH P 5 . ? -13.995 -15.591 15.993 1.00 28.83 ? 463 HOH A O 1 +HETATM 2286 O O . HOH P 5 . ? -14.873 -35.093 38.373 1.00 27.76 ? 464 HOH A O 1 +HETATM 2287 O O . HOH P 5 . ? -11.047 -37.179 27.416 1.00 19.83 ? 465 HOH A O 1 +HETATM 2288 O O . HOH P 5 . ? -20.548 -30.749 -24.664 1.00 41.23 ? 466 HOH A O 1 +HETATM 2289 O O . HOH P 5 . ? -5.813 -25.839 20.501 1.00 32.00 ? 467 HOH A O 1 +HETATM 2290 O O . HOH P 5 . ? -13.087 -27.475 -29.812 1.00 31.76 ? 468 HOH A O 1 +HETATM 2291 O O . HOH P 5 . ? -16.894 -33.482 39.957 1.00 42.17 ? 469 HOH A O 1 +HETATM 2292 O O . HOH P 5 . ? -27.491 -22.452 -19.970 1.00 45.88 ? 470 HOH A O 1 +HETATM 2293 O O . HOH P 5 . ? -27.925 -22.228 -17.165 1.00 29.41 ? 471 HOH A O 1 +HETATM 2294 O O . HOH P 5 . ? -9.719 -21.077 -26.623 1.00 49.60 ? 472 HOH A O 1 +HETATM 2295 O O . HOH P 5 . ? -29.356 -11.846 20.903 1.00 44.59 ? 473 HOH A O 1 +HETATM 2296 O O . HOH P 5 . ? -25.014 -28.274 27.498 1.00 25.38 ? 474 HOH A O 1 +HETATM 2297 O O . HOH P 5 . ? -16.627 -31.227 36.690 1.00 41.73 ? 475 HOH A O 1 +HETATM 2298 O O . HOH P 5 . ? -25.934 -29.860 25.470 1.00 34.40 ? 476 HOH A O 1 +HETATM 2299 O O . HOH P 5 . ? -21.674 -3.450 19.399 1.00 46.31 ? 477 HOH A O 1 +HETATM 2300 O O . HOH P 5 . ? -16.899 -39.724 33.595 1.00 39.76 ? 478 HOH A O 1 +HETATM 2301 O O . HOH P 5 . ? -24.210 -33.631 26.999 1.00 46.63 ? 479 HOH A O 1 +HETATM 2302 O O . HOH P 5 . ? 1.931 -25.737 -12.464 1.00 37.75 ? 480 HOH A O 1 +HETATM 2303 O O . HOH P 5 . ? 7.104 -36.441 -16.203 1.00 45.02 ? 481 HOH A O 1 +HETATM 2304 O O . HOH P 5 . ? -11.031 -12.437 8.476 1.00 34.74 ? 482 HOH A O 1 +HETATM 2305 O O . HOH P 5 . ? -27.450 -35.066 24.042 1.00 41.18 ? 483 HOH A O 1 +HETATM 2306 O O . HOH P 5 . ? -10.484 -37.205 22.435 1.00 46.28 ? 484 HOH A O 1 +HETATM 2307 O O . HOH P 5 . ? -2.376 -24.733 -25.456 1.00 45.06 ? 485 HOH A O 1 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 MET 1 -15 ? ? ? A . n +A 1 2 ALA 2 -14 ? ? ? A . n +A 1 3 SER 3 -13 ? ? ? A . n +A 1 4 MET 4 -12 ? ? ? A . n +A 1 5 THR 5 -11 ? ? ? A . n +A 1 6 GLY 6 -10 ? ? ? A . n +A 1 7 GLY 7 -9 ? ? ? A . n +A 1 8 GLN 8 -8 ? ? ? A . n +A 1 9 GLN 9 -7 ? ? ? A . n +A 1 10 MET 10 -6 ? ? ? A . n +A 1 11 GLY 11 -5 ? ? ? A . n +A 1 12 ARG 12 -4 ? ? ? A . n +A 1 13 ASP 13 -3 ? ? ? A . n +A 1 14 PRO 14 -2 ? ? ? A . n +A 1 15 ASN 15 -1 ? ? ? A . n +A 1 16 SER 16 0 ? ? ? A . n +A 1 17 MET 17 1 ? ? ? A . n +A 1 18 LYS 18 2 2 LYS LYS A . n +A 1 19 ASN 19 3 3 ASN ASN A . n +A 1 20 ILE 20 4 4 ILE ILE A . n +A 1 21 GLU 21 5 5 GLU GLU A . n +A 1 22 SER 22 6 6 SER SER A . n +A 1 23 LEU 23 7 7 LEU LEU A . n +A 1 24 PHE 24 8 8 PHE PHE A . n +A 1 25 ASP 25 9 9 ASP ASP A . n +A 1 26 TYR 26 10 10 TYR TYR A . n +A 1 27 SER 27 11 11 SER SER A . n +A 1 28 ALA 28 12 12 ALA ALA A . n +A 1 29 GLY 29 13 13 GLY GLY A . n +A 1 30 GLN 30 14 14 GLN GLN A . n +A 1 31 PHE 31 15 15 PHE PHE A . n +A 1 32 GLU 32 16 16 GLU GLU A . n +A 1 33 PHE 33 17 17 PHE PHE A . n +A 1 34 ILE 34 18 18 ILE ILE A . n +A 1 35 ASP 35 19 19 ASP ASP A . n +A 1 36 HIS 36 20 20 HIS HIS A . n +A 1 37 LEU 37 21 21 LEU LEU A . n +A 1 38 LEU 38 22 22 LEU LEU A . n +A 1 39 THR 39 23 23 THR THR A . n +A 1 40 MET 40 24 24 MET MET A . n +A 1 41 GLY 41 25 25 GLY GLY A . n +A 1 42 VAL 42 26 26 VAL VAL A . n +A 1 43 GLY 43 27 27 GLY GLY A . n +A 1 44 VAL 44 28 28 VAL VAL A . n +A 1 45 HIS 45 29 29 HIS HIS A . n +A 1 46 PHE 46 30 30 PHE PHE A . n +A 1 47 ALA 47 31 31 ALA ALA A . n +A 1 48 ALA 48 32 32 ALA ALA A . n +A 1 49 LEU 49 33 33 LEU LEU A . n +A 1 50 ILE 50 34 34 ILE ILE A . n +A 1 51 PHE 51 35 35 PHE PHE A . n +A 1 52 PHE 52 36 36 PHE PHE A . n +A 1 53 LEU 53 37 37 LEU LEU A . n +A 1 54 VAL 54 38 38 VAL VAL A . n +A 1 55 VAL 55 39 39 VAL VAL A . n +A 1 56 SER 56 40 40 SER SER A . n +A 1 57 GLN 57 41 41 GLN GLN A . n +A 1 58 PHE 58 42 42 PHE PHE A . n +A 1 59 VAL 59 43 43 VAL VAL A . n +A 1 60 ALA 60 44 44 ALA ALA A . n +A 1 61 PRO 61 45 45 PRO PRO A . n +A 1 62 LYS 62 46 46 LYS LYS A . n +A 1 63 TYR 63 47 47 TYR TYR A . n +A 1 64 ARG 64 48 48 ARG ARG A . n +A 1 65 ILE 65 49 49 ILE ILE A . n +A 1 66 ALA 66 50 50 ALA ALA A . n +A 1 67 THR 67 51 51 THR THR A . n +A 1 68 ALA 68 52 52 ALA ALA A . n +A 1 69 LEU 69 53 53 LEU LEU A . n +A 1 70 SER 70 54 54 SER SER A . n +A 1 71 CYS 71 55 55 CYS CYS A . n +A 1 72 ILE 72 56 56 ILE ILE A . n +A 1 73 VAL 73 57 57 VAL VAL A . n +A 1 74 MET 74 58 58 MET MET A . n +A 1 75 VAL 75 59 59 VAL VAL A . n +A 1 76 SER 76 60 60 SER SER A . n +A 1 77 ALA 77 61 61 ALA ALA A . n +A 1 78 GLY 78 62 62 GLY GLY A . n +A 1 79 LEU 79 63 63 LEU LEU A . n +A 1 80 ILE 80 64 64 ILE ILE A . n +A 1 81 LEU 81 65 65 LEU LEU A . n +A 1 82 ASN 82 66 66 ASN ASN A . n +A 1 83 SER 83 67 67 SER SER A . n +A 1 84 GLN 84 68 68 GLN GLN A . n +A 1 85 ALA 85 69 69 ALA ALA A . n +A 1 86 VAL 86 70 70 VAL VAL A . n +A 1 87 MET 87 71 71 MET MET A . n +A 1 88 TRP 88 72 72 TRP TRP A . n +A 1 89 THR 89 73 73 THR THR A . n +A 1 90 ASP 90 74 74 ASP ASP A . n +A 1 91 ALA 91 75 75 ALA ALA A . n +A 1 92 TYR 92 76 76 TYR TYR A . n +A 1 93 ALA 93 77 77 ALA ALA A . n +A 1 94 TYR 94 78 78 TYR TYR A . n +A 1 95 VAL 95 79 79 VAL VAL A . n +A 1 96 ASP 96 80 80 ASP ASP A . n +A 1 97 GLY 97 81 81 GLY GLY A . n +A 1 98 SER 98 82 82 SER SER A . n +A 1 99 TYR 99 83 83 TYR TYR A . n +A 1 100 GLN 100 84 84 GLN GLN A . n +A 1 101 LEU 101 85 85 LEU LEU A . n +A 1 102 GLN 102 86 86 GLN GLN A . n +A 1 103 ASP 103 87 87 ASP ASP A . n +A 1 104 LEU 104 88 88 LEU LEU A . n +A 1 105 THR 105 89 89 THR THR A . n +A 1 106 PHE 106 90 90 PHE PHE A . n +A 1 107 SER 107 91 91 SER SER A . n +A 1 108 ASN 108 92 92 ASN ASN A . n +A 1 109 GLY 109 93 93 GLY GLY A . n +A 1 110 TYR 110 94 94 TYR TYR A . n +A 1 111 ARG 111 95 95 ARG ARG A . n +A 1 112 TYR 112 96 96 TYR TYR A . n +A 1 113 VAL 113 97 97 VAL VAL A . n +A 1 114 ASN 114 98 98 ASN ASN A . n +A 1 115 TRP 115 99 99 TRP TRP A . n +A 1 116 MET 116 100 100 MET MET A . n +A 1 117 ALA 117 101 101 ALA ALA A . n +A 1 118 THR 118 102 102 THR THR A . n +A 1 119 ILE 119 103 103 ILE ILE A . n +A 1 120 PRO 120 104 104 PRO PRO A . n +A 1 121 CYS 121 105 105 CYS CYS A . n +A 1 122 LEU 122 106 106 LEU LEU A . n +A 1 123 LEU 123 107 107 LEU LEU A . n +A 1 124 LEU 124 108 108 LEU LEU A . n +A 1 125 GLN 125 109 109 GLN GLN A . n +A 1 126 LEU 126 110 110 LEU LEU A . n +A 1 127 LEU 127 111 111 LEU LEU A . n +A 1 128 ILE 128 112 112 ILE ILE A . n +A 1 129 VAL 129 113 113 VAL VAL A . n +A 1 130 LEU 130 114 114 LEU LEU A . n +A 1 131 ASN 131 115 115 ASN ASN A . n +A 1 132 LEU 132 116 116 LEU LEU A . n +A 1 133 LYS 133 117 117 LYS LYS A . n +A 1 134 GLY 134 118 118 GLY GLY A . n +A 1 135 LYS 135 119 119 LYS LYS A . n +A 1 136 GLU 136 120 120 GLU GLU A . n +A 1 137 LEU 137 121 121 LEU LEU A . n +A 1 138 PHE 138 122 122 PHE PHE A . n +A 1 139 SER 139 123 123 SER SER A . n +A 1 140 THR 140 124 124 THR THR A . n +A 1 141 ALA 141 125 125 ALA ALA A . n +A 1 142 THR 142 126 126 THR THR A . n +A 1 143 TRP 143 127 127 TRP TRP A . n +A 1 144 LEU 144 128 128 LEU LEU A . n +A 1 145 ILE 145 129 129 ILE ILE A . n +A 1 146 LEU 146 130 130 LEU LEU A . n +A 1 147 ALA 147 131 131 ALA ALA A . n +A 1 148 ALA 148 132 132 ALA ALA A . n +A 1 149 TRP 149 133 133 TRP TRP A . n +A 1 150 GLY 150 134 134 GLY GLY A . n +A 1 151 MET 151 135 135 MET MET A . n +A 1 152 ILE 152 136 136 ILE ILE A . n +A 1 153 ILE 153 137 137 ILE ILE A . n +A 1 154 THR 154 138 138 THR THR A . n +A 1 155 GLY 155 139 139 GLY GLY A . n +A 1 156 TYR 156 140 140 TYR TYR A . n +A 1 157 VAL 157 141 141 VAL VAL A . n +A 1 158 GLY 158 142 142 GLY GLY A . n +A 1 159 GLN 159 143 143 GLN GLN A . n +A 1 160 LEU 160 144 144 LEU LEU A . n +A 1 161 TYR 161 145 145 TYR TYR A . n +A 1 162 GLU 162 146 146 GLU GLU A . n +A 1 163 VAL 163 147 147 VAL VAL A . n +A 1 164 ASP 164 148 148 ASP ASP A . n +A 1 165 ASP 165 149 149 ASP ASP A . n +A 1 166 ILE 166 150 150 ILE ILE A . n +A 1 167 ALA 167 151 151 ALA ALA A . n +A 1 168 GLN 168 152 152 GLN GLN A . n +A 1 169 LEU 169 153 153 LEU LEU A . n +A 1 170 MET 170 154 154 MET MET A . n +A 1 171 ILE 171 155 155 ILE ILE A . n +A 1 172 TRP 172 156 156 TRP TRP A . n +A 1 173 GLY 173 157 157 GLY GLY A . n +A 1 174 ALA 174 158 158 ALA ALA A . n +A 1 175 VAL 175 159 159 VAL VAL A . n +A 1 176 SER 176 160 160 SER SER A . n +A 1 177 THR 177 161 161 THR THR A . n +A 1 178 ALA 178 162 162 ALA ALA A . n +A 1 179 PHE 179 163 163 PHE PHE A . n +A 1 180 PHE 180 164 164 PHE PHE A . n +A 1 181 VAL 181 165 165 VAL VAL A . n +A 1 182 VAL 182 166 166 VAL VAL A . n +A 1 183 MET 183 167 167 MET MET A . n +A 1 184 ASN 184 168 168 ASN ASN A . n +A 1 185 TRP 185 169 169 TRP TRP A . n +A 1 186 ILE 186 170 170 ILE ILE A . n +A 1 187 VAL 187 171 171 VAL VAL A . n +A 1 188 GLY 188 172 172 GLY GLY A . n +A 1 189 THR 189 173 173 THR THR A . n +A 1 190 LYS 190 174 174 LYS LYS A . n +A 1 191 ILE 191 175 175 ILE ILE A . n +A 1 192 PHE 192 176 176 PHE PHE A . n +A 1 193 LYS 193 177 177 LYS LYS A . n +A 1 194 ASN 194 178 178 ASN ASN A . n +A 1 195 ARG 195 179 179 ARG ARG A . n +A 1 196 ALA 196 180 180 ALA ALA A . n +A 1 197 THR 197 181 181 THR THR A . n +A 1 198 MET 198 182 182 MET MET A . n +A 1 199 LEU 199 183 183 LEU LEU A . n +A 1 200 GLY 200 184 184 GLY GLY A . n +A 1 201 GLY 201 185 185 GLY GLY A . n +A 1 202 THR 202 186 186 THR THR A . n +A 1 203 ASP 203 187 187 ASP ASP A . n +A 1 204 SER 204 188 188 SER SER A . n +A 1 205 THR 205 189 189 THR THR A . n +A 1 206 ILE 206 190 190 ILE ILE A . n +A 1 207 THR 207 191 191 THR THR A . n +A 1 208 LYS 208 192 192 LYS LYS A . n +A 1 209 VAL 209 193 193 VAL VAL A . n +A 1 210 PHE 210 194 194 PHE PHE A . n +A 1 211 TRP 211 195 195 TRP TRP A . n +A 1 212 LEU 212 196 196 LEU LEU A . n +A 1 213 MET 213 197 197 MET MET A . n +A 1 214 MET 214 198 198 MET MET A . n +A 1 215 PHE 215 199 199 PHE PHE A . n +A 1 216 ALA 216 200 200 ALA ALA A . n +A 1 217 TRP 217 201 201 TRP TRP A . n +A 1 218 THR 218 202 202 THR THR A . n +A 1 219 LEU 219 203 203 LEU LEU A . n +A 1 220 TYR 220 204 204 TYR TYR A . n +A 1 221 PRO 221 205 205 PRO PRO A . n +A 1 222 ILE 222 206 206 ILE ILE A . n +A 1 223 ALA 223 207 207 ALA ALA A . n +A 1 224 TYR 224 208 208 TYR TYR A . n +A 1 225 LEU 225 209 209 LEU LEU A . n +A 1 226 VAL 226 210 210 VAL VAL A . n +A 1 227 PRO 227 211 211 PRO PRO A . n +A 1 228 ALA 228 212 212 ALA ALA A . n +A 1 229 PHE 229 213 213 PHE PHE A . n +A 1 230 MET 230 214 214 MET MET A . n +A 1 231 ASN 231 215 215 ASN ASN A . n +A 1 232 ASN 232 216 216 ASN ASN A . n +A 1 233 ALA 233 217 217 ALA ALA A . n +A 1 234 ASP 234 218 218 ASP ASP A . n +A 1 235 GLY 235 219 219 GLY GLY A . n +A 1 236 VAL 236 220 220 VAL VAL A . n +A 1 237 VAL 237 221 221 VAL VAL A . n +A 1 238 LEU 238 222 222 LEU LEU A . n +A 1 239 ARG 239 223 223 ARG ARG A . n +A 1 240 GLN 240 224 224 GLN GLN A . n +A 1 241 LEU 241 225 225 LEU LEU A . n +A 1 242 LEU 242 226 226 LEU LEU A . n +A 1 243 PHE 243 227 227 PHE PHE A . n +A 1 244 THR 244 228 228 THR THR A . n +A 1 245 ILE 245 229 229 ILE ILE A . n +A 1 246 ALA 246 230 230 ALA ALA A . n +A 1 247 ASP 247 231 231 ASP ASP A . n +A 1 248 ILE 248 232 232 ILE ILE A . n +A 1 249 SER 249 233 233 SER SER A . n +A 1 250 SER 250 234 234 SER SER A . n +A 1 251 LYS 251 235 235 LYS LYS A . n +A 1 252 VAL 252 236 236 VAL VAL A . n +A 1 253 ILE 253 237 237 ILE ILE A . n +A 1 254 TYR 254 238 238 TYR TYR A . n +A 1 255 GLY 255 239 239 GLY GLY A . n +A 1 256 LEU 256 240 240 LEU LEU A . n +A 1 257 MET 257 241 241 MET MET A . n +A 1 258 ILE 258 242 242 ILE ILE A . n +A 1 259 THR 259 243 243 THR THR A . n +A 1 260 TYR 260 244 244 TYR TYR A . n +A 1 261 ILE 261 245 245 ILE ILE A . n +A 1 262 ALA 262 246 246 ALA ALA A . n +A 1 263 ILE 263 247 247 ILE ILE A . n +A 1 264 GLN 264 248 248 GLN GLN A . n +A 1 265 GLN 265 249 249 GLN GLN A . n +A 1 266 SER 266 250 250 SER SER A . n +A 1 267 ALA 267 251 251 ALA ALA A . n +A 1 268 ALA 268 252 252 ALA ALA A . n +A 1 269 ALA 269 253 253 ALA ALA A . n +A 1 270 GLY 270 254 254 GLY GLY A . n +A 1 271 TYR 271 255 255 TYR TYR A . n +A 1 272 VAL 272 256 256 VAL VAL A . n +A 1 273 PRO 273 257 257 PRO PRO A . n +A 1 274 ALA 274 258 258 ALA ALA A . n +A 1 275 GLN 275 259 259 GLN GLN A . n +A 1 276 GLN 276 260 260 GLN GLN A . n +A 1 277 ALA 277 261 261 ALA ALA A . n +A 1 278 LEU 278 262 262 LEU LEU A . n +A 1 279 GLY 279 263 263 GLY GLY A . n +A 1 280 ARG 280 264 264 ARG ARG A . n +A 1 281 ILE 281 265 265 ILE ILE A . n +A 1 282 GLY 282 266 ? ? ? A . n +A 1 283 MET 283 267 ? ? ? A . n +A 1 284 ASP 284 268 ? ? ? A . n +A 1 285 SER 285 269 ? ? ? A . n +A 1 286 LYS 286 270 ? ? ? A . n +A 1 287 ALA 287 271 ? ? ? A . n +A 1 288 ALA 288 272 ? ? ? A . n +A 1 289 LEU 289 273 ? ? ? A . n +A 1 290 GLU 290 274 ? ? ? A . n +A 1 291 HIS 291 275 ? ? ? A . n +A 1 292 HIS 292 276 ? ? ? A . n +A 1 293 HIS 293 277 ? ? ? A . n +A 1 294 HIS 294 278 ? ? ? A . n +A 1 295 HIS 295 279 ? ? ? A . n +A 1 296 HIS 296 280 ? ? ? A . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +B 2 RET 1 301 301 RET RET A . +C 3 CL 1 302 1 CL CL A . +D 3 CL 1 303 2 CL CL A . +E 4 OLA 1 304 1 OLA OLA A . +F 4 OLA 1 305 2 OLA OLA A . +G 4 OLA 1 306 3 OLA OLA A . +H 4 OLA 1 307 4 OLA OLA A . +I 4 OLA 1 308 5 OLA OLA A . +J 4 OLA 1 309 6 OLA OLA A . +K 4 OLA 1 310 7 OLA OLA A . +L 4 OLA 1 311 8 OLA OLA A . +M 4 OLA 1 312 9 OLA OLA A . +N 4 OLA 1 313 10 OLA OLA A . +O 4 OLA 1 314 11 OLA OLA A . +P 5 HOH 1 401 1 HOH HOH A . +P 5 HOH 2 402 3 HOH HOH A . +P 5 HOH 3 403 47 HOH HOH A . +P 5 HOH 4 404 49 HOH HOH A . +P 5 HOH 5 405 8 HOH HOH A . +P 5 HOH 6 406 56 HOH HOH A . +P 5 HOH 7 407 26 HOH HOH A . +P 5 HOH 8 408 22 HOH HOH A . +P 5 HOH 9 409 30 HOH HOH A . +P 5 HOH 10 410 50 HOH HOH A . +P 5 HOH 11 411 25 HOH HOH A . +P 5 HOH 12 412 33 HOH HOH A . +P 5 HOH 13 413 58 HOH HOH A . +P 5 HOH 14 414 16 HOH HOH A . +P 5 HOH 15 415 46 HOH HOH A . +P 5 HOH 16 416 28 HOH HOH A . +P 5 HOH 17 417 55 HOH HOH A . +P 5 HOH 18 418 9 HOH HOH A . +P 5 HOH 19 419 21 HOH HOH A . +P 5 HOH 20 420 54 HOH HOH A . +P 5 HOH 21 421 42 HOH HOH A . +P 5 HOH 22 422 5 HOH HOH A . +P 5 HOH 23 423 13 HOH HOH A . +P 5 HOH 24 424 84 HOH HOH A . +P 5 HOH 25 425 11 HOH HOH A . +P 5 HOH 26 426 6 HOH HOH A . +P 5 HOH 27 427 39 HOH HOH A . +P 5 HOH 28 428 32 HOH HOH A . +P 5 HOH 29 429 18 HOH HOH A . +P 5 HOH 30 430 64 HOH HOH A . +P 5 HOH 31 431 48 HOH HOH A . +P 5 HOH 32 432 36 HOH HOH A . +P 5 HOH 33 433 53 HOH HOH A . +P 5 HOH 34 434 7 HOH HOH A . +P 5 HOH 35 435 24 HOH HOH A . +P 5 HOH 36 436 81 HOH HOH A . +P 5 HOH 37 437 20 HOH HOH A . +P 5 HOH 38 438 37 HOH HOH A . +P 5 HOH 39 439 19 HOH HOH A . +P 5 HOH 40 440 44 HOH HOH A . +P 5 HOH 41 441 67 HOH HOH A . +P 5 HOH 42 442 80 HOH HOH A . +P 5 HOH 43 443 10 HOH HOH A . +P 5 HOH 44 444 59 HOH HOH A . +P 5 HOH 45 445 12 HOH HOH A . +P 5 HOH 46 446 68 HOH HOH A . +P 5 HOH 47 447 15 HOH HOH A . +P 5 HOH 48 448 2 HOH HOH A . +P 5 HOH 49 449 65 HOH HOH A . +P 5 HOH 50 450 72 HOH HOH A . +P 5 HOH 51 451 27 HOH HOH A . +P 5 HOH 52 452 66 HOH HOH A . +P 5 HOH 53 453 60 HOH HOH A . +P 5 HOH 54 454 57 HOH HOH A . +P 5 HOH 55 455 38 HOH HOH A . +P 5 HOH 56 456 45 HOH HOH A . +P 5 HOH 57 457 14 HOH HOH A . +P 5 HOH 58 458 79 HOH HOH A . +P 5 HOH 59 459 71 HOH HOH A . +P 5 HOH 60 460 78 HOH HOH A . +P 5 HOH 61 461 40 HOH HOH A . +P 5 HOH 62 462 41 HOH HOH A . +P 5 HOH 63 463 29 HOH HOH A . +P 5 HOH 64 464 23 HOH HOH A . +P 5 HOH 65 465 4 HOH HOH A . +P 5 HOH 66 466 70 HOH HOH A . +P 5 HOH 67 467 34 HOH HOH A . +P 5 HOH 68 468 35 HOH HOH A . +P 5 HOH 69 469 62 HOH HOH A . +P 5 HOH 70 470 73 HOH HOH A . +P 5 HOH 71 471 31 HOH HOH A . +P 5 HOH 72 472 83 HOH HOH A . +P 5 HOH 73 473 75 HOH HOH A . +P 5 HOH 74 474 17 HOH HOH A . +P 5 HOH 75 475 63 HOH HOH A . +P 5 HOH 76 476 51 HOH HOH A . +P 5 HOH 77 477 85 HOH HOH A . +P 5 HOH 78 478 61 HOH HOH A . +P 5 HOH 79 479 77 HOH HOH A . +P 5 HOH 80 480 52 HOH HOH A . +P 5 HOH 81 481 74 HOH HOH A . +P 5 HOH 82 482 43 HOH HOH A . +P 5 HOH 83 483 69 HOH HOH A . +P 5 HOH 84 484 76 HOH HOH A . +P 5 HOH 85 485 82 HOH HOH A . +# +_pdbx_struct_assembly.id 1 +_pdbx_struct_assembly.details author_and_software_defined_assembly +_pdbx_struct_assembly.method_details PISA +_pdbx_struct_assembly.oligomeric_details monomeric +_pdbx_struct_assembly.oligomeric_count 1 +# +_pdbx_struct_assembly_gen.assembly_id 1 +_pdbx_struct_assembly_gen.oper_expression 1 +_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 3990 ? +1 MORE -8 ? +1 'SSA (A^2)' 12280 ? +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +_pdbx_audit_revision_history.ordinal 1 +_pdbx_audit_revision_history.data_content_type 'Structure model' +_pdbx_audit_revision_history.major_revision 1 +_pdbx_audit_revision_history.minor_revision 0 +_pdbx_audit_revision_history.revision_date 2020-03-04 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_software.citation_id +_software.classification +_software.compiler_name +_software.compiler_version +_software.contact_author +_software.contact_author_email +_software.date +_software.description +_software.dependencies +_software.hardware +_software.language +_software.location +_software.mods +_software.name +_software.os +_software.os_version +_software.type +_software.version +_software.pdbx_ordinal +? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? dev_1839 1 +? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 +? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 3 +? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 +# +_pdbx_validate_close_contact.id 1 +_pdbx_validate_close_contact.PDB_model_num 1 +_pdbx_validate_close_contact.auth_atom_id_1 O +_pdbx_validate_close_contact.auth_asym_id_1 A +_pdbx_validate_close_contact.auth_comp_id_1 HOH +_pdbx_validate_close_contact.auth_seq_id_1 401 +_pdbx_validate_close_contact.PDB_ins_code_1 ? +_pdbx_validate_close_contact.label_alt_id_1 ? +_pdbx_validate_close_contact.auth_atom_id_2 O +_pdbx_validate_close_contact.auth_asym_id_2 A +_pdbx_validate_close_contact.auth_comp_id_2 HOH +_pdbx_validate_close_contact.auth_seq_id_2 451 +_pdbx_validate_close_contact.PDB_ins_code_2 ? +_pdbx_validate_close_contact.label_alt_id_2 ? +_pdbx_validate_close_contact.dist 2.06 +# +_pdbx_validate_symm_contact.id 1 +_pdbx_validate_symm_contact.PDB_model_num 1 +_pdbx_validate_symm_contact.auth_atom_id_1 O +_pdbx_validate_symm_contact.auth_asym_id_1 A +_pdbx_validate_symm_contact.auth_comp_id_1 HOH +_pdbx_validate_symm_contact.auth_seq_id_1 407 +_pdbx_validate_symm_contact.PDB_ins_code_1 ? +_pdbx_validate_symm_contact.label_alt_id_1 ? +_pdbx_validate_symm_contact.site_symmetry_1 1_555 +_pdbx_validate_symm_contact.auth_atom_id_2 O +_pdbx_validate_symm_contact.auth_asym_id_2 A +_pdbx_validate_symm_contact.auth_comp_id_2 HOH +_pdbx_validate_symm_contact.auth_seq_id_2 432 +_pdbx_validate_symm_contact.PDB_ins_code_2 ? +_pdbx_validate_symm_contact.label_alt_id_2 ? +_pdbx_validate_symm_contact.site_symmetry_2 2_556 +_pdbx_validate_symm_contact.dist 2.18 +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 GLN A 86 ? ? -103.24 -127.20 +2 1 MET A 214 ? ? -152.50 72.72 +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 N 1 A OLA 304 ? C13 ? E OLA 1 C13 +2 1 N 1 A OLA 304 ? C14 ? E OLA 1 C14 +3 1 N 1 A OLA 304 ? C15 ? E OLA 1 C15 +4 1 N 1 A OLA 304 ? C16 ? E OLA 1 C16 +5 1 N 1 A OLA 304 ? C17 ? E OLA 1 C17 +6 1 N 1 A OLA 304 ? C18 ? E OLA 1 C18 +7 1 N 1 A OLA 306 ? C17 ? G OLA 1 C17 +8 1 N 1 A OLA 306 ? C18 ? G OLA 1 C18 +9 1 N 1 A OLA 307 ? C9 ? H OLA 1 C9 +10 1 N 1 A OLA 307 ? C10 ? H OLA 1 C10 +11 1 N 1 A OLA 307 ? C11 ? H OLA 1 C11 +12 1 N 1 A OLA 307 ? C12 ? H OLA 1 C12 +13 1 N 1 A OLA 307 ? C13 ? H OLA 1 C13 +14 1 N 1 A OLA 307 ? C14 ? H OLA 1 C14 +15 1 N 1 A OLA 307 ? C15 ? H OLA 1 C15 +16 1 N 1 A OLA 307 ? C16 ? H OLA 1 C16 +17 1 N 1 A OLA 307 ? C17 ? H OLA 1 C17 +18 1 N 1 A OLA 307 ? C18 ? H OLA 1 C18 +19 1 N 1 A OLA 308 ? C11 ? I OLA 1 C11 +20 1 N 1 A OLA 308 ? C12 ? I OLA 1 C12 +21 1 N 1 A OLA 308 ? C13 ? I OLA 1 C13 +22 1 N 1 A OLA 308 ? C14 ? I OLA 1 C14 +23 1 N 1 A OLA 308 ? C15 ? I OLA 1 C15 +24 1 N 1 A OLA 308 ? C16 ? I OLA 1 C16 +25 1 N 1 A OLA 308 ? C17 ? I OLA 1 C17 +26 1 N 1 A OLA 308 ? C18 ? I OLA 1 C18 +27 1 N 1 A OLA 309 ? C1 ? J OLA 1 C1 +28 1 N 1 A OLA 309 ? O1 ? J OLA 1 O1 +29 1 N 1 A OLA 309 ? O2 ? J OLA 1 O2 +30 1 N 1 A OLA 309 ? C2 ? J OLA 1 C2 +31 1 N 1 A OLA 309 ? C3 ? J OLA 1 C3 +32 1 N 1 A OLA 309 ? C4 ? J OLA 1 C4 +33 1 N 1 A OLA 309 ? C5 ? J OLA 1 C5 +34 1 N 1 A OLA 309 ? C6 ? J OLA 1 C6 +35 1 N 1 A OLA 309 ? C7 ? J OLA 1 C7 +36 1 N 1 A OLA 309 ? C8 ? J OLA 1 C8 +37 1 N 1 A OLA 310 ? O1 ? K OLA 1 O1 +38 1 N 1 A OLA 310 ? O2 ? K OLA 1 O2 +39 1 N 1 A OLA 310 ? C7 ? K OLA 1 C7 +40 1 N 1 A OLA 310 ? C8 ? K OLA 1 C8 +41 1 N 1 A OLA 310 ? C9 ? K OLA 1 C9 +42 1 N 1 A OLA 310 ? C10 ? K OLA 1 C10 +43 1 N 1 A OLA 310 ? C11 ? K OLA 1 C11 +44 1 N 1 A OLA 310 ? C12 ? K OLA 1 C12 +45 1 N 1 A OLA 310 ? C13 ? K OLA 1 C13 +46 1 N 1 A OLA 310 ? C14 ? K OLA 1 C14 +47 1 N 1 A OLA 310 ? C15 ? K OLA 1 C15 +48 1 N 1 A OLA 310 ? C16 ? K OLA 1 C16 +49 1 N 1 A OLA 310 ? C17 ? K OLA 1 C17 +50 1 N 1 A OLA 310 ? C18 ? K OLA 1 C18 +51 1 N 1 A OLA 311 ? O1 ? L OLA 1 O1 +52 1 N 1 A OLA 311 ? O2 ? L OLA 1 O2 +53 1 N 1 A OLA 311 ? C10 ? L OLA 1 C10 +54 1 N 1 A OLA 311 ? C11 ? L OLA 1 C11 +55 1 N 1 A OLA 311 ? C12 ? L OLA 1 C12 +56 1 N 1 A OLA 311 ? C13 ? L OLA 1 C13 +57 1 N 1 A OLA 311 ? C14 ? L OLA 1 C14 +58 1 N 1 A OLA 311 ? C15 ? L OLA 1 C15 +59 1 N 1 A OLA 311 ? C16 ? L OLA 1 C16 +60 1 N 1 A OLA 311 ? C17 ? L OLA 1 C17 +61 1 N 1 A OLA 311 ? C18 ? L OLA 1 C18 +62 1 N 1 A OLA 312 ? C8 ? M OLA 1 C8 +63 1 N 1 A OLA 312 ? C9 ? M OLA 1 C9 +64 1 N 1 A OLA 312 ? C10 ? M OLA 1 C10 +65 1 N 1 A OLA 312 ? C11 ? M OLA 1 C11 +66 1 N 1 A OLA 312 ? C12 ? M OLA 1 C12 +67 1 N 1 A OLA 312 ? C13 ? M OLA 1 C13 +68 1 N 1 A OLA 312 ? C14 ? M OLA 1 C14 +69 1 N 1 A OLA 312 ? C15 ? M OLA 1 C15 +70 1 N 1 A OLA 312 ? C16 ? M OLA 1 C16 +71 1 N 1 A OLA 312 ? C17 ? M OLA 1 C17 +72 1 N 1 A OLA 312 ? C18 ? M OLA 1 C18 +73 1 N 1 A OLA 313 ? C8 ? N OLA 1 C8 +74 1 N 1 A OLA 313 ? C9 ? N OLA 1 C9 +75 1 N 1 A OLA 313 ? C10 ? N OLA 1 C10 +76 1 N 1 A OLA 313 ? C11 ? N OLA 1 C11 +77 1 N 1 A OLA 313 ? C12 ? N OLA 1 C12 +78 1 N 1 A OLA 313 ? C13 ? N OLA 1 C13 +79 1 N 1 A OLA 313 ? C14 ? N OLA 1 C14 +80 1 N 1 A OLA 313 ? C15 ? N OLA 1 C15 +81 1 N 1 A OLA 313 ? C16 ? N OLA 1 C16 +82 1 N 1 A OLA 313 ? C17 ? N OLA 1 C17 +83 1 N 1 A OLA 313 ? C18 ? N OLA 1 C18 +84 1 N 1 A OLA 314 ? C1 ? O OLA 1 C1 +85 1 N 1 A OLA 314 ? O1 ? O OLA 1 O1 +86 1 N 1 A OLA 314 ? O2 ? O OLA 1 O2 +87 1 N 1 A OLA 314 ? C2 ? O OLA 1 C2 +88 1 N 1 A OLA 314 ? C3 ? O OLA 1 C3 +89 1 N 1 A OLA 314 ? C4 ? O OLA 1 C4 +90 1 N 1 A OLA 314 ? C5 ? O OLA 1 C5 +91 1 N 1 A OLA 314 ? C6 ? O OLA 1 C6 +92 1 N 1 A OLA 314 ? C7 ? O OLA 1 C7 +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A MET -15 ? A MET 1 +2 1 Y 1 A ALA -14 ? A ALA 2 +3 1 Y 1 A SER -13 ? A SER 3 +4 1 Y 1 A MET -12 ? A MET 4 +5 1 Y 1 A THR -11 ? A THR 5 +6 1 Y 1 A GLY -10 ? A GLY 6 +7 1 Y 1 A GLY -9 ? A GLY 7 +8 1 Y 1 A GLN -8 ? A GLN 8 +9 1 Y 1 A GLN -7 ? A GLN 9 +10 1 Y 1 A MET -6 ? A MET 10 +11 1 Y 1 A GLY -5 ? A GLY 11 +12 1 Y 1 A ARG -4 ? A ARG 12 +13 1 Y 1 A ASP -3 ? A ASP 13 +14 1 Y 1 A PRO -2 ? A PRO 14 +15 1 Y 1 A ASN -1 ? A ASN 15 +16 1 Y 1 A SER 0 ? A SER 16 +17 1 Y 1 A MET 1 ? A MET 17 +18 1 Y 1 A GLY 266 ? A GLY 282 +19 1 Y 1 A MET 267 ? A MET 283 +20 1 Y 1 A ASP 268 ? A ASP 284 +21 1 Y 1 A SER 269 ? A SER 285 +22 1 Y 1 A LYS 270 ? A LYS 286 +23 1 Y 1 A ALA 271 ? A ALA 287 +24 1 Y 1 A ALA 272 ? A ALA 288 +25 1 Y 1 A LEU 273 ? A LEU 289 +26 1 Y 1 A GLU 274 ? A GLU 290 +27 1 Y 1 A HIS 275 ? A HIS 291 +28 1 Y 1 A HIS 276 ? A HIS 292 +29 1 Y 1 A HIS 277 ? A HIS 293 +30 1 Y 1 A HIS 278 ? A HIS 294 +31 1 Y 1 A HIS 279 ? A HIS 295 +32 1 Y 1 A HIS 280 ? A HIS 296 +# +loop_ +_pdbx_audit_support.funding_organization +_pdbx_audit_support.country +_pdbx_audit_support.grant_number +_pdbx_audit_support.ordinal +'National Research Foundation (Korea)' 'Korea, Republic Of' NRF-2017R1A2B2008483 1 +'National Research Foundation (Korea)' 'Korea, Republic Of' NRF-2016R1A6A3A04010213 2 +# +loop_ +_pdbx_entity_instance_feature.ordinal +_pdbx_entity_instance_feature.comp_id +_pdbx_entity_instance_feature.asym_id +_pdbx_entity_instance_feature.seq_num +_pdbx_entity_instance_feature.auth_comp_id +_pdbx_entity_instance_feature.auth_asym_id +_pdbx_entity_instance_feature.auth_seq_num +_pdbx_entity_instance_feature.feature_type +_pdbx_entity_instance_feature.details +1 CL ? ? CL ? ? 'SUBJECT OF INVESTIGATION' ? +2 RET ? ? RET ? ? 'SUBJECT OF INVESTIGATION' ? +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +2 RETINAL RET +3 'CHLORIDE ION' CL +4 'OLEIC ACID' OLA +5 water HOH +# +_pdbx_struct_assembly_auth_evidence.id 1 +_pdbx_struct_assembly_auth_evidence.assembly_id 1 +_pdbx_struct_assembly_auth_evidence.experimental_support 'gel filtration' +_pdbx_struct_assembly_auth_evidence.details ? +#