# By using this file you agree to the legally binding terms of use found at # https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. # To request access to the AlphaFold 3 model parameters, follow the process set # out at https://github.com/google-deepmind/alphafold3. You may only use these if # received directly from Google. Use is subject to terms of use available at # https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. data_aca6 # _entry.id aca6 # loop_ _atom_type.symbol C N O S # loop_ _audit_author.name _audit_author.pdbx_ordinal "Google DeepMind" 1 "Isomorphic Labs" 2 # _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 # loop_ _chem_comp.formula _chem_comp.formula_weight _chem_comp.id _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_smiles _chem_comp.pdbx_synonyms _chem_comp.type "C3 H7 N O2" 89.093 ALA y ALANINE C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" # _citation.book_publisher ? _citation.country UK _citation.id primary _citation.journal_full Nature _citation.journal_id_ASTM NATUAS _citation.journal_id_CSD 0006 _citation.journal_id_ISSN 0028-0836 _citation.journal_volume 630 _citation.page_first 493 _citation.page_last 500 _citation.pdbx_database_id_DOI 10.1038/s41586-024-07487-w _citation.pdbx_database_id_PubMed 38718835 _citation.title "Accurate structure prediction of biomolecular interactions with AlphaFold 3" _citation.year 2024 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary "Google DeepMind" 1 primary "Isomorphic Labs" 2 # _entity.id 1 _entity.pdbx_description . _entity.type polymer # _entity_poly.entity_id 1 _entity_poly.pdbx_strand_id A _entity_poly.type polypeptide(L) # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 1 n MET 1 1 n THR 2 1 n ALA 3 1 n MET 4 1 n LYS 5 1 n GLU 6 1 n TRP 7 1 n ARG 8 1 n ALA 9 1 n ARG 10 1 n MET 11 1 n GLY 12 1 n TRP 13 1 n SER 14 1 n GLN 15 1 n ARG 16 1 n ARG 17 1 n ALA 18 1 n ALA 19 1 n GLN 20 1 n GLU 21 1 n LEU 22 1 n GLY 23 1 n VAL 24 1 n THR 25 1 n LEU 26 1 n PRO 27 1 n THR 28 1 n TYR 29 1 n GLN 30 1 n SER 31 1 n TRP 32 1 n GLU 33 1 n LYS 34 1 n GLY 35 1 n ILE 36 1 n ARG 37 1 n LEU 38 1 n SER 39 1 n ASP 40 1 n GLY 41 1 n SER 42 1 n PRO 43 1 n ILE 44 1 n ASP 45 1 n PRO 46 1 n PRO 47 1 n LEU 48 1 n THR 49 1 n ALA 50 1 n LEU 51 1 n LEU 52 1 n ALA 53 1 n ALA 54 1 n ALA 55 1 n ALA 56 1 n ARG 57 1 n GLU 58 1 n LYS 59 1 n GLY 60 1 n LEU 61 1 n PRO 62 1 n PRO 63 1 n ILE 64 1 n SER 65 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.1 @ 2025-04-06 19:32:37)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 94.01 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # loop_ _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value _ma_qa_metric_local.model_id _ma_qa_metric_local.ordinal_id A MET 1 2 72.88 1 1 A THR 2 2 88.48 1 2 A ALA 3 2 94.61 1 3 A MET 4 2 94.37 1 4 A LYS 5 2 91.49 1 5 A GLU 6 2 92.20 1 6 A TRP 7 2 97.36 1 7 A ARG 8 2 96.25 1 8 A ALA 9 2 97.41 1 9 A ARG 10 2 92.31 1 10 A MET 11 2 96.48 1 11 A GLY 12 2 98.04 1 12 A TRP 13 2 96.25 1 13 A SER 14 2 98.28 1 14 A GLN 15 2 96.81 1 15 A ARG 16 2 88.39 1 16 A ARG 17 2 91.99 1 17 A ALA 18 2 98.29 1 18 A ALA 19 2 98.19 1 19 A GLN 20 2 91.60 1 20 A GLU 21 2 94.36 1 21 A LEU 22 2 96.79 1 22 A GLY 23 2 96.19 1 23 A VAL 24 2 97.48 1 24 A THR 25 2 97.30 1 25 A LEU 26 2 97.22 1 26 A PRO 27 2 96.95 1 27 A THR 28 2 97.24 1 28 A TYR 29 2 97.57 1 29 A GLN 30 2 96.22 1 30 A SER 31 2 96.36 1 31 A TRP 32 2 96.68 1 32 A GLU 33 2 94.51 1 33 A LYS 34 2 91.06 1 34 A GLY 35 2 96.22 1 35 A ILE 36 2 92.82 1 36 A ARG 37 2 87.72 1 37 A LEU 38 2 91.96 1 38 A SER 39 2 92.83 1 39 A ASP 40 2 94.39 1 40 A GLY 41 2 96.49 1 41 A SER 42 2 96.72 1 42 A PRO 43 2 96.50 1 43 A ILE 44 2 95.20 1 44 A ASP 45 2 92.33 1 45 A PRO 46 2 96.26 1 46 A PRO 47 2 96.41 1 47 A LEU 48 2 96.32 1 48 A THR 49 2 95.21 1 49 A ALA 50 2 97.55 1 50 A LEU 51 2 96.89 1 51 A LEU 52 2 96.47 1 52 A ALA 53 2 97.49 1 53 A ALA 54 2 98.04 1 54 A ALA 55 2 97.65 1 55 A ALA 56 2 97.64 1 56 A ARG 57 2 90.52 1 57 A GLU 58 2 94.19 1 58 A LYS 59 2 91.43 1 59 A GLY 60 2 96.43 1 60 A LEU 61 2 93.86 1 61 A PRO 62 2 90.78 1 62 A PRO 63 2 89.24 1 63 A ILE 64 2 85.17 1 64 A SER 65 2 81.21 1 65 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # _ma_target_entity.data_id 1 _ma_target_entity.entity_id 1 _ma_target_entity.origin . # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.details . _ma_target_entity_instance.entity_id 1 # loop_ _pdbx_data_usage.details _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.url ;Non-commercial use only, by using this file you agree to the terms of use found at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. To request access to the AlphaFold 3 model parameters, follow the process set out at https://github.com/google-deepmind/alphafold3. You may only use these if received directly from Google. Use is subject to terms of use available at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. ; 1 license https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md ;AlphaFold 3 and its output are not intended for, have not been validated for, and are not approved for clinical use. They are provided "as-is" without any warranty of any kind, whether expressed or implied. No warranty is given that use shall not infringe the rights of any third party. ; 2 disclaimer ? # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.hetero _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.seq_id A 1 1 n MET . 1 A 1 A 2 1 n THR . 2 A 2 A 3 1 n ALA . 3 A 3 A 4 1 n MET . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n GLU . 6 A 6 A 7 1 n TRP . 7 A 7 A 8 1 n ARG . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n ARG . 10 A 10 A 11 1 n MET . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n TRP . 13 A 13 A 14 1 n SER . 14 A 14 A 15 1 n GLN . 15 A 15 A 16 1 n ARG . 16 A 16 A 17 1 n ARG . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n ALA . 19 A 19 A 20 1 n GLN . 20 A 20 A 21 1 n GLU . 21 A 21 A 22 1 n LEU . 22 A 22 A 23 1 n GLY . 23 A 23 A 24 1 n VAL . 24 A 24 A 25 1 n THR . 25 A 25 A 26 1 n LEU . 26 A 26 A 27 1 n PRO . 27 A 27 A 28 1 n THR . 28 A 28 A 29 1 n TYR . 29 A 29 A 30 1 n GLN . 30 A 30 A 31 1 n SER . 31 A 31 A 32 1 n TRP . 32 A 32 A 33 1 n GLU . 33 A 33 A 34 1 n LYS . 34 A 34 A 35 1 n GLY . 35 A 35 A 36 1 n ILE . 36 A 36 A 37 1 n ARG . 37 A 37 A 38 1 n LEU . 38 A 38 A 39 1 n SER . 39 A 39 A 40 1 n ASP . 40 A 40 A 41 1 n GLY . 41 A 41 A 42 1 n SER . 42 A 42 A 43 1 n PRO . 43 A 43 A 44 1 n ILE . 44 A 44 A 45 1 n ASP . 45 A 45 A 46 1 n PRO . 46 A 46 A 47 1 n PRO . 47 A 47 A 48 1 n LEU . 48 A 48 A 49 1 n THR . 49 A 49 A 50 1 n ALA . 50 A 50 A 51 1 n LEU . 51 A 51 A 52 1 n LEU . 52 A 52 A 53 1 n ALA . 53 A 53 A 54 1 n ALA . 54 A 54 A 55 1 n ALA . 55 A 55 A 56 1 n ALA . 56 A 56 A 57 1 n ARG . 57 A 57 A 58 1 n GLU . 58 A 58 A 59 1 n LYS . 59 A 59 A 60 1 n GLY . 60 A 60 A 61 1 n LEU . 61 A 61 A 62 1 n PRO . 62 A 62 A 63 1 n PRO . 63 A 63 A 64 1 n ILE . 64 A 64 A 65 1 n SER . 65 A 65 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fa08f1a239cfd4fd49a5c37bef32bd41139da97e359ba389d3209450484ef018)" # _struct_asym.entity_id 1 _struct_asym.id A # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? -6.211 -8.219 12.177 1.00 75.41 1 A 1 ATOM 2 C CA . MET A 1 1 ? -6.035 -7.062 11.263 1.00 81.56 1 A 1 ATOM 3 C C . MET A 1 1 ? -4.718 -7.250 10.531 1.00 82.72 1 A 1 ATOM 4 O O . MET A 1 1 ? -3.821 -7.846 11.111 1.00 77.86 1 A 1 ATOM 5 C CB . MET A 1 1 ? -6.049 -5.739 12.039 1.00 74.73 1 A 1 ATOM 6 C CG . MET A 1 1 ? -7.481 -5.247 12.246 1.00 67.84 1 A 1 ATOM 7 S SD . MET A 1 1 ? -7.743 -3.948 13.470 1.00 64.39 1 A 1 ATOM 8 C CE . MET A 1 1 ? -6.646 -2.633 12.909 1.00 58.50 1 A 1 ATOM 9 N N . THR A 1 2 ? -4.595 -6.811 9.269 1.00 90.52 2 A 1 ATOM 10 C CA . THR A 1 2 ? -3.315 -6.899 8.543 1.00 91.35 2 A 1 ATOM 11 C C . THR A 1 2 ? -2.405 -5.719 8.902 1.00 93.01 2 A 1 ATOM 12 O O . THR A 1 2 ? -2.903 -4.651 9.270 1.00 92.63 2 A 1 ATOM 13 C CB . THR A 1 2 ? -3.520 -6.955 7.019 1.00 87.91 2 A 1 ATOM 14 O OG1 . THR A 1 2 ? -4.157 -5.776 6.598 1.00 83.16 2 A 1 ATOM 15 C CG2 . THR A 1 2 ? -4.370 -8.147 6.589 1.00 80.78 2 A 1 ATOM 16 N N . ALA A 1 3 ? -1.088 -5.874 8.743 1.00 93.72 3 A 1 ATOM 17 C CA . ALA A 1 3 ? -0.098 -4.832 9.037 1.00 94.59 3 A 1 ATOM 18 C C . ALA A 1 3 ? -0.377 -3.514 8.284 1.00 95.98 3 A 1 ATOM 19 O O . ALA A 1 3 ? -0.261 -2.427 8.853 1.00 95.62 3 A 1 ATOM 20 C CB . ALA A 1 3 ? 1.289 -5.392 8.683 1.00 93.13 3 A 1 ATOM 21 N N . MET A 1 4 ? -0.837 -3.591 7.019 1.00 96.26 4 A 1 ATOM 22 C CA . MET A 1 4 ? -1.167 -2.407 6.214 1.00 96.94 4 A 1 ATOM 23 C C . MET A 1 4 ? -2.381 -1.645 6.758 1.00 97.50 4 A 1 ATOM 24 O O . MET A 1 4 ? -2.381 -0.414 6.787 1.00 97.23 4 A 1 ATOM 25 C CB . MET A 1 4 ? -1.417 -2.811 4.753 1.00 95.99 4 A 1 ATOM 26 C CG . MET A 1 4 ? -0.162 -3.362 4.072 1.00 92.20 4 A 1 ATOM 27 S SD . MET A 1 4 ? 1.292 -2.278 4.109 1.00 92.00 4 A 1 ATOM 28 C CE . MET A 1 4 ? 0.746 -0.947 3.028 1.00 86.81 4 A 1 ATOM 29 N N . LYS A 1 5 ? -3.403 -2.358 7.231 1.00 96.80 5 A 1 ATOM 30 C CA . LYS A 1 5 ? -4.592 -1.742 7.836 1.00 96.86 5 A 1 ATOM 31 C C . LYS A 1 5 ? -4.254 -1.041 9.154 1.00 97.36 5 A 1 ATOM 32 O O . LYS A 1 5 ? -4.726 0.071 9.390 1.00 97.35 5 A 1 ATOM 33 C CB . LYS A 1 5 ? -5.674 -2.813 8.014 1.00 96.03 5 A 1 ATOM 34 C CG . LYS A 1 5 ? -7.000 -2.217 8.507 1.00 91.72 5 A 1 ATOM 35 C CD . LYS A 1 5 ? -8.084 -3.296 8.526 1.00 89.59 5 A 1 ATOM 36 C CE . LYS A 1 5 ? -9.403 -2.715 9.041 1.00 83.28 5 A 1 ATOM 37 N NZ . LYS A 1 5 ? -10.464 -3.751 9.054 1.00 74.43 5 A 1 ATOM 38 N N . GLU A 1 6 ? -3.439 -1.674 9.986 1.00 97.13 6 A 1 ATOM 39 C CA . GLU A 1 6 ? -2.974 -1.101 11.254 1.00 97.00 6 A 1 ATOM 40 C C . GLU A 1 6 ? -2.115 0.146 11.028 1.00 97.40 6 A 1 ATOM 41 O O . GLU A 1 6 ? -2.352 1.178 11.659 1.00 97.31 6 A 1 ATOM 42 C CB . GLU A 1 6 ? -2.169 -2.147 12.029 1.00 96.36 6 A 1 ATOM 43 C CG . GLU A 1 6 ? -3.069 -3.261 12.580 1.00 92.76 6 A 1 ATOM 44 C CD . GLU A 1 6 ? -2.283 -4.412 13.219 1.00 88.84 6 A 1 ATOM 45 O OE1 . GLU A 1 6 ? -2.954 -5.420 13.548 1.00 81.61 6 A 1 ATOM 46 O OE2 . GLU A 1 6 ? -1.047 -4.285 13.357 1.00 81.37 6 A 1 ATOM 47 N N . TRP A 1 7 ? -1.171 0.081 10.089 1.00 97.62 7 A 1 ATOM 48 C CA . TRP A 1 7 ? -0.360 1.232 9.692 1.00 97.93 7 A 1 ATOM 49 C C . TRP A 1 7 ? -1.229 2.402 9.226 1.00 98.14 7 A 1 ATOM 50 O O . TRP A 1 7 ? -1.127 3.495 9.776 1.00 98.00 7 A 1 ATOM 51 C CB . TRP A 1 7 ? 0.624 0.807 8.600 1.00 97.80 7 A 1 ATOM 52 C CG . TRP A 1 7 ? 1.286 1.960 7.919 1.00 97.78 7 A 1 ATOM 53 C CD1 . TRP A 1 7 ? 2.258 2.734 8.447 1.00 97.10 7 A 1 ATOM 54 C CD2 . TRP A 1 7 ? 0.989 2.521 6.605 1.00 97.71 7 A 1 ATOM 55 N NE1 . TRP A 1 7 ? 2.590 3.734 7.550 1.00 96.91 7 A 1 ATOM 56 C CE2 . TRP A 1 7 ? 1.840 3.647 6.394 1.00 97.37 7 A 1 ATOM 57 C CE3 . TRP A 1 7 ? 0.090 2.193 5.568 1.00 97.19 7 A 1 ATOM 58 C CZ2 . TRP A 1 7 ? 1.808 4.403 5.215 1.00 96.60 7 A 1 ATOM 59 C CZ3 . TRP A 1 7 ? 0.054 2.944 4.386 1.00 96.67 7 A 1 ATOM 60 C CH2 . TRP A 1 7 ? 0.909 4.045 4.204 1.00 96.26 7 A 1 ATOM 61 N N . ARG A 1 8 ? -2.147 2.178 8.285 1.00 97.97 8 A 1 ATOM 62 C CA . ARG A 1 8 ? -3.040 3.238 7.795 1.00 98.14 8 A 1 ATOM 63 C C . ARG A 1 8 ? -3.899 3.843 8.911 1.00 98.25 8 A 1 ATOM 64 O O . ARG A 1 8 ? -4.119 5.051 8.909 1.00 98.15 8 A 1 ATOM 65 C CB . ARG A 1 8 ? -3.923 2.697 6.670 1.00 97.98 8 A 1 ATOM 66 C CG . ARG A 1 8 ? -4.794 3.821 6.082 1.00 97.24 8 A 1 ATOM 67 C CD . ARG A 1 8 ? -5.769 3.336 5.032 1.00 96.89 8 A 1 ATOM 68 N NE . ARG A 1 8 ? -6.656 2.259 5.496 1.00 95.04 8 A 1 ATOM 69 C CZ . ARG A 1 8 ? -7.666 2.319 6.330 1.00 96.41 8 A 1 ATOM 70 N NH1 . ARG A 1 8 ? -8.066 3.424 6.882 1.00 91.02 8 A 1 ATOM 71 N NH2 . ARG A 1 8 ? -8.299 1.218 6.615 1.00 91.68 8 A 1 ATOM 72 N N . ALA A 1 9 ? -4.376 3.019 9.845 1.00 97.76 9 A 1 ATOM 73 C CA . ALA A 1 9 ? -5.146 3.495 10.995 1.00 97.51 9 A 1 ATOM 74 C C . ALA A 1 9 ? -4.305 4.422 11.891 1.00 97.67 9 A 1 ATOM 75 O O . ALA A 1 9 ? -4.795 5.481 12.272 1.00 97.25 9 A 1 ATOM 76 C CB . ALA A 1 9 ? -5.705 2.287 11.764 1.00 96.88 9 A 1 ATOM 77 N N . ARG A 1 10 ? -3.037 4.084 12.159 1.00 97.57 10 A 1 ATOM 78 C CA . ARG A 1 10 ? -2.108 4.967 12.897 1.00 97.43 10 A 1 ATOM 79 C C . ARG A 1 10 ? -1.866 6.294 12.175 1.00 97.67 10 A 1 ATOM 80 O O . ARG A 1 10 ? -1.809 7.330 12.826 1.00 97.27 10 A 1 ATOM 81 C CB . ARG A 1 10 ? -0.761 4.266 13.142 1.00 96.92 10 A 1 ATOM 82 C CG . ARG A 1 10 ? -0.859 3.104 14.137 1.00 95.37 10 A 1 ATOM 83 C CD . ARG A 1 10 ? 0.530 2.619 14.580 1.00 93.88 10 A 1 ATOM 84 N NE . ARG A 1 10 ? 1.385 2.183 13.459 1.00 89.99 10 A 1 ATOM 85 C CZ . ARG A 1 10 ? 1.455 0.996 12.898 1.00 87.95 10 A 1 ATOM 86 N NH1 . ARG A 1 10 ? 0.679 0.003 13.244 1.00 80.13 10 A 1 ATOM 87 N NH2 . ARG A 1 10 ? 2.347 0.790 11.972 1.00 81.28 10 A 1 ATOM 88 N N . MET A 1 11 ? -1.790 6.265 10.846 1.00 97.77 11 A 1 ATOM 89 C CA . MET A 1 11 ? -1.626 7.472 10.024 1.00 97.70 11 A 1 ATOM 90 C C . MET A 1 11 ? -2.903 8.328 9.928 1.00 97.89 11 A 1 ATOM 91 O O . MET A 1 11 ? -2.845 9.464 9.463 1.00 97.49 11 A 1 ATOM 92 C CB . MET A 1 11 ? -1.149 7.075 8.613 1.00 97.52 11 A 1 ATOM 93 C CG . MET A 1 11 ? 0.205 6.356 8.603 1.00 96.83 11 A 1 ATOM 94 S SD . MET A 1 11 ? 1.586 7.237 9.387 1.00 95.22 11 A 1 ATOM 95 C CE . MET A 1 11 ? 1.794 8.627 8.252 1.00 91.44 11 A 1 ATOM 96 N N . GLY A 1 12 ? -4.070 7.806 10.312 1.00 97.97 12 A 1 ATOM 97 C CA . GLY A 1 12 ? -5.357 8.503 10.147 1.00 97.97 12 A 1 ATOM 98 C C . GLY A 1 12 ? -5.777 8.702 8.683 1.00 98.28 12 A 1 ATOM 99 O O . GLY A 1 12 ? -6.519 9.631 8.368 1.00 97.92 12 A 1 ATOM 100 N N . TRP A 1 13 ? -5.286 7.867 7.763 1.00 98.24 13 A 1 ATOM 101 C CA . TRP A 1 13 ? -5.504 8.051 6.329 1.00 98.35 13 A 1 ATOM 102 C C . TRP A 1 13 ? -6.646 7.198 5.769 1.00 98.55 13 A 1 ATOM 103 O O . TRP A 1 13 ? -6.962 6.105 6.248 1.00 98.31 13 A 1 ATOM 104 C CB . TRP A 1 13 ? -4.194 7.789 5.566 1.00 97.85 13 A 1 ATOM 105 C CG . TRP A 1 13 ? -3.086 8.778 5.786 1.00 97.48 13 A 1 ATOM 106 C CD1 . TRP A 1 13 ? -3.184 9.988 6.385 1.00 95.79 13 A 1 ATOM 107 C CD2 . TRP A 1 13 ? -1.682 8.645 5.406 1.00 96.61 13 A 1 ATOM 108 N NE1 . TRP A 1 13 ? -1.954 10.607 6.415 1.00 94.92 13 A 1 ATOM 109 C CE2 . TRP A 1 13 ? -0.990 9.825 5.819 1.00 95.86 13 A 1 ATOM 110 C CE3 . TRP A 1 13 ? -0.929 7.646 4.757 1.00 94.95 13 A 1 ATOM 111 C CZ2 . TRP A 1 13 ? 0.383 10.002 5.605 1.00 93.64 13 A 1 ATOM 112 C CZ3 . TRP A 1 13 ? 0.448 7.818 4.537 1.00 93.91 13 A 1 ATOM 113 C CH2 . TRP A 1 13 ? 1.107 8.988 4.963 1.00 93.10 13 A 1 ATOM 114 N N . SER A 1 14 ? -7.256 7.680 4.668 1.00 98.54 14 A 1 ATOM 115 C CA . SER A 1 14 ? -8.104 6.848 3.809 1.00 98.57 14 A 1 ATOM 116 C C . SER A 1 14 ? -7.251 5.833 3.025 1.00 98.67 14 A 1 ATOM 117 O O . SER A 1 14 ? -6.059 6.053 2.794 1.00 98.53 14 A 1 ATOM 118 C CB . SER A 1 14 ? -8.937 7.725 2.865 1.00 98.33 14 A 1 ATOM 119 O OG . SER A 1 14 ? -8.137 8.328 1.867 1.00 97.04 14 A 1 ATOM 120 N N . GLN A 1 15 ? -7.871 4.748 2.543 1.00 98.54 15 A 1 ATOM 121 C CA . GLN A 1 15 ? -7.183 3.784 1.669 1.00 98.54 15 A 1 ATOM 122 C C . GLN A 1 15 ? -6.619 4.449 0.406 1.00 98.61 15 A 1 ATOM 123 O O . GLN A 1 15 ? -5.512 4.135 -0.017 1.00 98.49 15 A 1 ATOM 124 C CB . GLN A 1 15 ? -8.144 2.662 1.250 1.00 98.23 15 A 1 ATOM 125 C CG . GLN A 1 15 ? -8.567 1.766 2.417 1.00 97.41 15 A 1 ATOM 126 C CD . GLN A 1 15 ? -9.443 0.607 1.963 1.00 96.93 15 A 1 ATOM 127 O OE1 . GLN A 1 15 ? -10.260 0.718 1.057 1.00 92.88 15 A 1 ATOM 128 N NE2 . GLN A 1 15 ? -9.312 -0.545 2.573 1.00 91.69 15 A 1 ATOM 129 N N . ARG A 1 16 ? -7.355 5.412 -0.168 1.00 98.75 16 A 1 ATOM 130 C CA . ARG A 1 16 ? -6.896 6.171 -1.339 1.00 98.71 16 A 1 ATOM 131 C C . ARG A 1 16 ? -5.636 6.977 -1.030 1.00 98.69 16 A 1 ATOM 132 O O . ARG A 1 16 ? -4.696 6.940 -1.818 1.00 98.41 16 A 1 ATOM 133 C CB . ARG A 1 16 ? -8.036 7.062 -1.857 1.00 98.44 16 A 1 ATOM 134 C CG . ARG A 1 16 ? -7.631 7.808 -3.141 1.00 90.96 16 A 1 ATOM 135 C CD . ARG A 1 16 ? -8.779 8.670 -3.681 1.00 91.93 16 A 1 ATOM 136 N NE . ARG A 1 16 ? -9.885 7.850 -4.221 1.00 84.24 16 A 1 ATOM 137 C CZ . ARG A 1 16 ? -11.136 8.243 -4.414 1.00 76.60 16 A 1 ATOM 138 N NH1 . ARG A 1 16 ? -11.543 9.441 -4.100 1.00 67.90 16 A 1 ATOM 139 N NH2 . ARG A 1 16 ? -12.007 7.427 -4.938 1.00 67.64 16 A 1 ATOM 140 N N . ARG A 1 17 ? -5.604 7.681 0.111 1.00 98.56 17 A 1 ATOM 141 C CA . ARG A 1 17 ? -4.416 8.449 0.516 1.00 98.42 17 A 1 ATOM 142 C C . ARG A 1 17 ? -3.221 7.526 0.743 1.00 98.40 17 A 1 ATOM 143 O O . ARG A 1 17 ? -2.153 7.796 0.216 1.00 98.06 17 A 1 ATOM 144 C CB . ARG A 1 17 ? -4.726 9.299 1.756 1.00 98.12 17 A 1 ATOM 145 C CG . ARG A 1 17 ? -3.524 10.141 2.238 1.00 96.04 17 A 1 ATOM 146 C CD . ARG A 1 17 ? -3.036 11.107 1.154 1.00 93.41 17 A 1 ATOM 147 N NE . ARG A 1 17 ? -1.895 11.914 1.609 1.00 88.55 17 A 1 ATOM 148 C CZ . ARG A 1 17 ? -1.402 12.976 0.994 1.00 83.54 17 A 1 ATOM 149 N NH1 . ARG A 1 17 ? -1.945 13.477 -0.076 1.00 79.40 17 A 1 ATOM 150 N NH2 . ARG A 1 17 ? -0.334 13.551 1.442 1.00 79.40 17 A 1 ATOM 151 N N . ALA A 1 18 ? -3.411 6.419 1.463 1.00 98.40 18 A 1 ATOM 152 C CA . ALA A 1 18 ? -2.348 5.445 1.707 1.00 98.37 18 A 1 ATOM 153 C C . ALA A 1 18 ? -1.790 4.842 0.403 1.00 98.25 18 A 1 ATOM 154 O O . ALA A 1 18 ? -0.578 4.744 0.247 1.00 98.08 18 A 1 ATOM 155 C CB . ALA A 1 18 ? -2.905 4.365 2.639 1.00 98.35 18 A 1 ATOM 156 N N . ALA A 1 19 ? -2.663 4.509 -0.564 1.00 98.46 19 A 1 ATOM 157 C CA . ALA A 1 19 ? -2.235 4.021 -1.876 1.00 98.37 19 A 1 ATOM 158 C C . ALA A 1 19 ? -1.389 5.062 -2.633 1.00 98.08 19 A 1 ATOM 159 O O . ALA A 1 19 ? -0.329 4.726 -3.153 1.00 97.74 19 A 1 ATOM 160 C CB . ALA A 1 19 ? -3.483 3.616 -2.675 1.00 98.29 19 A 1 ATOM 161 N N . GLN A 1 20 ? -1.821 6.329 -2.636 1.00 97.79 20 A 1 ATOM 162 C CA . GLN A 1 20 ? -1.072 7.430 -3.260 1.00 97.33 20 A 1 ATOM 163 C C . GLN A 1 20 ? 0.311 7.628 -2.624 1.00 96.87 20 A 1 ATOM 164 O O . GLN A 1 20 ? 1.298 7.761 -3.337 1.00 96.37 20 A 1 ATOM 165 C CB . GLN A 1 20 ? -1.878 8.731 -3.141 1.00 97.20 20 A 1 ATOM 166 C CG . GLN A 1 20 ? -3.078 8.764 -4.097 1.00 90.50 20 A 1 ATOM 167 C CD . GLN A 1 20 ? -3.997 9.960 -3.852 1.00 87.69 20 A 1 ATOM 168 O OE1 . GLN A 1 20 ? -4.053 10.570 -2.794 1.00 81.28 20 A 1 ATOM 169 N NE2 . GLN A 1 20 ? -4.788 10.339 -4.833 1.00 79.39 20 A 1 ATOM 170 N N . GLU A 1 21 ? 0.380 7.607 -1.290 1.00 96.89 21 A 1 ATOM 171 C CA . GLU A 1 21 ? 1.643 7.789 -0.556 1.00 96.57 21 A 1 ATOM 172 C C . GLU A 1 21 ? 2.643 6.646 -0.773 1.00 96.50 21 A 1 ATOM 173 O O . GLU A 1 21 ? 3.848 6.850 -0.647 1.00 95.70 21 A 1 ATOM 174 C CB . GLU A 1 21 ? 1.330 7.914 0.941 1.00 96.28 21 A 1 ATOM 175 C CG . GLU A 1 21 ? 0.630 9.228 1.301 1.00 94.72 21 A 1 ATOM 176 C CD . GLU A 1 21 ? 1.546 10.459 1.305 1.00 93.83 21 A 1 ATOM 177 O OE1 . GLU A 1 21 ? 0.987 11.577 1.420 1.00 89.30 21 A 1 ATOM 178 O OE2 . GLU A 1 21 ? 2.785 10.327 1.291 1.00 89.45 21 A 1 ATOM 179 N N . LEU A 1 22 ? 2.147 5.447 -1.100 1.00 97.08 22 A 1 ATOM 180 C CA . LEU A 1 22 ? 2.972 4.283 -1.430 1.00 97.07 22 A 1 ATOM 181 C C . LEU A 1 22 ? 3.222 4.118 -2.938 1.00 96.67 22 A 1 ATOM 182 O O . LEU A 1 22 ? 3.891 3.171 -3.335 1.00 95.96 22 A 1 ATOM 183 C CB . LEU A 1 22 ? 2.335 3.023 -0.816 1.00 97.35 22 A 1 ATOM 184 C CG . LEU A 1 22 ? 2.264 3.022 0.721 1.00 97.16 22 A 1 ATOM 185 C CD1 . LEU A 1 22 ? 1.608 1.721 1.177 1.00 96.53 22 A 1 ATOM 186 C CD2 . LEU A 1 22 ? 3.638 3.126 1.385 1.00 96.49 22 A 1 ATOM 187 N N . GLY A 1 23 ? 2.669 4.997 -3.790 1.00 96.72 23 A 1 ATOM 188 C CA . GLY A 1 23 ? 2.850 4.929 -5.245 1.00 96.13 23 A 1 ATOM 189 C C . GLY A 1 23 ? 2.181 3.721 -5.907 1.00 96.34 23 A 1 ATOM 190 O O . GLY A 1 23 ? 2.654 3.239 -6.932 1.00 95.58 23 A 1 ATOM 191 N N . VAL A 1 24 ? 1.080 3.205 -5.331 1.00 97.37 24 A 1 ATOM 192 C CA . VAL A 1 24 ? 0.360 2.036 -5.862 1.00 97.80 24 A 1 ATOM 193 C C . VAL A 1 24 ? -1.095 2.368 -6.197 1.00 98.18 24 A 1 ATOM 194 O O . VAL A 1 24 ? -1.646 3.382 -5.767 1.00 98.18 24 A 1 ATOM 195 C CB . VAL A 1 24 ? 0.442 0.820 -4.919 1.00 97.64 24 A 1 ATOM 196 C CG1 . VAL A 1 24 ? 1.894 0.385 -4.703 1.00 96.93 24 A 1 ATOM 197 C CG2 . VAL A 1 24 ? -0.225 1.064 -3.561 1.00 96.28 24 A 1 ATOM 198 N N . THR A 1 25 ? -1.752 1.497 -6.951 1.00 97.87 25 A 1 ATOM 199 C CA . THR A 1 25 ? -3.181 1.655 -7.240 1.00 97.95 25 A 1 ATOM 200 C C . THR A 1 25 ? -4.031 1.358 -5.999 1.00 98.11 25 A 1 ATOM 201 O O . THR A 1 25 ? -3.655 0.555 -5.137 1.00 98.04 25 A 1 ATOM 202 C CB . THR A 1 25 ? -3.648 0.804 -8.433 1.00 97.65 25 A 1 ATOM 203 O OG1 . THR A 1 25 ? -3.702 -0.561 -8.099 1.00 96.11 25 A 1 ATOM 204 C CG2 . THR A 1 25 ? -2.773 0.964 -9.676 1.00 95.38 25 A 1 ATOM 205 N N . LEU A 1 26 ? -5.218 1.975 -5.909 1.00 97.84 26 A 1 ATOM 206 C CA . LEU A 1 26 ? -6.155 1.702 -4.816 1.00 97.96 26 A 1 ATOM 207 C C . LEU A 1 26 ? -6.543 0.209 -4.721 1.00 97.87 26 A 1 ATOM 208 O O . LEU A 1 26 ? -6.501 -0.318 -3.609 1.00 97.77 26 A 1 ATOM 209 C CB . LEU A 1 26 ? -7.366 2.651 -4.933 1.00 97.95 26 A 1 ATOM 210 C CG . LEU A 1 26 ? -8.482 2.385 -3.907 1.00 96.83 26 A 1 ATOM 211 C CD1 . LEU A 1 26 ? -8.007 2.609 -2.466 1.00 95.51 26 A 1 ATOM 212 C CD2 . LEU A 1 26 ? -9.664 3.317 -4.168 1.00 96.03 26 A 1 ATOM 213 N N . PRO A 1 27 ? -6.852 -0.513 -5.823 1.00 97.66 27 A 1 ATOM 214 C CA . PRO A 1 27 ? -7.129 -1.952 -5.751 1.00 97.34 27 A 1 ATOM 215 C C . PRO A 1 27 ? -5.958 -2.777 -5.199 1.00 97.37 27 A 1 ATOM 216 O O . PRO A 1 27 ? -6.181 -3.679 -4.394 1.00 97.09 27 A 1 ATOM 217 C CB . PRO A 1 27 ? -7.484 -2.383 -7.179 1.00 96.81 27 A 1 ATOM 218 C CG . PRO A 1 27 ? -8.031 -1.106 -7.804 1.00 95.25 27 A 1 ATOM 219 C CD . PRO A 1 27 ? -7.147 -0.034 -7.170 1.00 97.11 27 A 1 ATOM 220 N N . THR A 1 28 ? -4.713 -2.450 -5.571 1.00 97.64 28 A 1 ATOM 221 C CA . THR A 1 28 ? -3.518 -3.120 -5.033 1.00 97.61 28 A 1 ATOM 222 C C . THR A 1 28 ? -3.425 -2.931 -3.522 1.00 97.86 28 A 1 ATOM 223 O O . THR A 1 28 ? -3.283 -3.902 -2.779 1.00 97.81 28 A 1 ATOM 224 C CB . THR A 1 28 ? -2.241 -2.583 -5.702 1.00 97.30 28 A 1 ATOM 225 O OG1 . THR A 1 28 ? -2.304 -2.790 -7.088 1.00 96.23 28 A 1 ATOM 226 C CG2 . THR A 1 28 ? -0.972 -3.275 -5.207 1.00 96.26 28 A 1 ATOM 227 N N . TYR A 1 29 ? -3.583 -1.694 -3.036 1.00 97.64 29 A 1 ATOM 228 C CA . TYR A 1 29 ? -3.572 -1.400 -1.605 1.00 97.87 29 A 1 ATOM 229 C C . TYR A 1 29 ? -4.700 -2.122 -0.848 1.00 97.85 29 A 1 ATOM 230 O O . TYR A 1 29 ? -4.482 -2.697 0.216 1.00 97.77 29 A 1 ATOM 231 C CB . TYR A 1 29 ? -3.646 0.120 -1.421 1.00 97.93 29 A 1 ATOM 232 C CG . TYR A 1 29 ? -3.536 0.506 0.034 1.00 97.98 29 A 1 ATOM 233 C CD1 . TYR A 1 29 ? -4.698 0.665 0.812 1.00 97.45 29 A 1 ATOM 234 C CD2 . TYR A 1 29 ? -2.269 0.580 0.640 1.00 97.51 29 A 1 ATOM 235 C CE1 . TYR A 1 29 ? -4.593 0.862 2.199 1.00 97.33 29 A 1 ATOM 236 C CE2 . TYR A 1 29 ? -2.158 0.773 2.025 1.00 97.32 29 A 1 ATOM 237 C CZ . TYR A 1 29 ? -3.322 0.893 2.809 1.00 97.48 29 A 1 ATOM 238 O OH . TYR A 1 29 ? -3.215 1.002 4.153 1.00 96.70 29 A 1 ATOM 239 N N . GLN A 1 30 ? -5.911 -2.134 -1.413 1.00 97.70 30 A 1 ATOM 240 C CA . GLN A 1 30 ? -7.056 -2.840 -0.835 1.00 97.49 30 A 1 ATOM 241 C C . GLN A 1 30 ? -6.829 -4.354 -0.751 1.00 97.30 30 A 1 ATOM 242 O O . GLN A 1 30 ? -7.241 -4.971 0.234 1.00 97.08 30 A 1 ATOM 243 C CB . GLN A 1 30 ? -8.306 -2.563 -1.673 1.00 97.52 30 A 1 ATOM 244 C CG . GLN A 1 30 ? -8.842 -1.144 -1.448 1.00 96.82 30 A 1 ATOM 245 C CD . GLN A 1 30 ? -10.047 -0.830 -2.326 1.00 96.39 30 A 1 ATOM 246 O OE1 . GLN A 1 30 ? -10.217 -1.316 -3.431 1.00 93.35 30 A 1 ATOM 247 N NE2 . GLN A 1 30 ? -10.947 0.008 -1.862 1.00 92.30 30 A 1 ATOM 248 N N . SER A 1 31 ? -6.166 -4.942 -1.754 1.00 97.63 31 A 1 ATOM 249 C CA . SER A 1 31 ? -5.773 -6.355 -1.731 1.00 97.54 31 A 1 ATOM 250 C C . SER A 1 31 ? -4.846 -6.654 -0.551 1.00 97.60 31 A 1 ATOM 251 O O . SER A 1 31 ? -5.108 -7.595 0.193 1.00 97.33 31 A 1 ATOM 252 C CB . SER A 1 31 ? -5.100 -6.755 -3.049 1.00 97.14 31 A 1 ATOM 253 O OG . SER A 1 31 ? -6.024 -6.671 -4.118 1.00 90.95 31 A 1 ATOM 254 N N . TRP A 1 32 ? -3.844 -5.804 -0.286 1.00 97.53 32 A 1 ATOM 255 C CA . TRP A 1 32 ? -2.944 -5.957 0.862 1.00 97.48 32 A 1 ATOM 256 C C . TRP A 1 32 ? -3.657 -5.803 2.212 1.00 97.28 32 A 1 ATOM 257 O O . TRP A 1 32 ? -3.369 -6.549 3.141 1.00 96.60 32 A 1 ATOM 258 C CB . TRP A 1 32 ? -1.812 -4.940 0.753 1.00 97.39 32 A 1 ATOM 259 C CG . TRP A 1 32 ? -0.937 -5.032 -0.455 1.00 97.41 32 A 1 ATOM 260 C CD1 . TRP A 1 32 ? -0.741 -6.127 -1.236 1.00 96.34 32 A 1 ATOM 261 C CD2 . TRP A 1 32 ? -0.085 -3.987 -1.008 1.00 97.20 32 A 1 ATOM 262 N NE1 . TRP A 1 32 ? 0.167 -5.831 -2.233 1.00 96.16 32 A 1 ATOM 263 C CE2 . TRP A 1 32 ? 0.616 -4.528 -2.129 1.00 96.81 32 A 1 ATOM 264 C CE3 . TRP A 1 32 ? 0.178 -2.645 -0.662 1.00 96.41 32 A 1 ATOM 265 C CZ2 . TRP A 1 32 ? 1.547 -3.776 -2.860 1.00 95.85 32 A 1 ATOM 266 C CZ3 . TRP A 1 32 ? 1.105 -1.883 -1.394 1.00 95.75 32 A 1 ATOM 267 C CH2 . TRP A 1 32 ? 1.793 -2.447 -2.485 1.00 95.36 32 A 1 ATOM 268 N N . GLU A 1 33 ? -4.616 -4.867 2.334 1.00 97.14 33 A 1 ATOM 269 C CA . GLU A 1 33 ? -5.405 -4.746 3.574 1.00 96.86 33 A 1 ATOM 270 C C . GLU A 1 33 ? -6.337 -5.935 3.825 1.00 96.75 33 A 1 ATOM 271 O O . GLU A 1 33 ? -6.669 -6.215 4.979 1.00 95.67 33 A 1 ATOM 272 C CB . GLU A 1 33 ? -6.279 -3.487 3.572 1.00 95.89 33 A 1 ATOM 273 C CG . GLU A 1 33 ? -5.513 -2.197 3.862 1.00 92.28 33 A 1 ATOM 274 C CD . GLU A 1 33 ? -6.426 -1.080 4.390 1.00 94.02 33 A 1 ATOM 275 O OE1 . GLU A 1 33 ? -5.895 -0.115 4.978 1.00 90.18 33 A 1 ATOM 276 O OE2 . GLU A 1 33 ? -7.672 -1.128 4.274 1.00 91.77 33 A 1 ATOM 277 N N . LYS A 1 34 ? -6.804 -6.599 2.760 1.00 96.70 34 A 1 ATOM 278 C CA . LYS A 1 34 ? -7.673 -7.777 2.858 1.00 96.32 34 A 1 ATOM 279 C C . LYS A 1 34 ? -6.895 -9.087 2.968 1.00 96.41 34 A 1 ATOM 280 O O . LYS A 1 34 ? -7.477 -10.076 3.396 1.00 95.35 34 A 1 ATOM 281 C CB . LYS A 1 34 ? -8.624 -7.811 1.655 1.00 95.70 34 A 1 ATOM 282 C CG . LYS A 1 34 ? -9.700 -6.719 1.736 1.00 91.49 34 A 1 ATOM 283 C CD . LYS A 1 34 ? -10.619 -6.827 0.521 1.00 89.18 34 A 1 ATOM 284 C CE . LYS A 1 34 ? -11.742 -5.787 0.583 1.00 83.09 34 A 1 ATOM 285 N NZ . LYS A 1 34 ? -12.716 -6.010 -0.509 1.00 75.27 34 A 1 ATOM 286 N N . GLY A 1 35 ? -5.621 -9.102 2.561 1.00 96.12 35 A 1 ATOM 287 C CA . GLY A 1 35 ? -4.807 -10.319 2.463 1.00 95.98 35 A 1 ATOM 288 C C . GLY A 1 35 ? -5.172 -11.214 1.272 1.00 96.67 35 A 1 ATOM 289 O O . GLY A 1 35 ? -4.757 -12.368 1.221 1.00 96.11 35 A 1 ATOM 290 N N . ILE A 1 36 ? -5.980 -10.707 0.325 1.00 96.32 36 A 1 ATOM 291 C CA . ILE A 1 36 ? -6.405 -11.435 -0.878 1.00 96.54 36 A 1 ATOM 292 C C . ILE A 1 36 ? -6.362 -10.530 -2.111 1.00 96.97 36 A 1 ATOM 293 O O . ILE A 1 36 ? -6.653 -9.330 -2.028 1.00 96.77 36 A 1 ATOM 294 C CB . ILE A 1 36 ? -7.810 -12.071 -0.719 1.00 95.69 36 A 1 ATOM 295 C CG1 . ILE A 1 36 ? -8.913 -11.020 -0.466 1.00 89.39 36 A 1 ATOM 296 C CG2 . ILE A 1 36 ? -7.796 -13.150 0.378 1.00 87.81 36 A 1 ATOM 297 C CD1 . ILE A 1 36 ? -10.342 -11.577 -0.517 1.00 83.08 36 A 1 ATOM 298 N N . ARG A 1 37 ? -6.066 -11.103 -3.284 1.00 95.91 37 A 1 ATOM 299 C CA . ARG A 1 37 ? -6.222 -10.408 -4.571 1.00 95.62 37 A 1 ATOM 300 C C . ARG A 1 37 ? -7.703 -10.186 -4.857 1.00 95.60 37 A 1 ATOM 301 O O . ARG A 1 37 ? -8.506 -11.116 -4.802 1.00 94.61 37 A 1 ATOM 302 C CB . ARG A 1 37 ? -5.572 -11.188 -5.715 1.00 94.33 37 A 1 ATOM 303 C CG . ARG A 1 37 ? -4.054 -11.294 -5.560 1.00 88.57 37 A 1 ATOM 304 C CD . ARG A 1 37 ? -3.415 -11.844 -6.834 1.00 88.27 37 A 1 ATOM 305 N NE . ARG A 1 37 ? -1.956 -11.992 -6.654 1.00 83.84 37 A 1 ATOM 306 C CZ . ARG A 1 37 ? -1.328 -13.079 -6.233 1.00 81.44 37 A 1 ATOM 307 N NH1 . ARG A 1 37 ? -1.952 -14.196 -5.986 1.00 72.98 37 A 1 ATOM 308 N NH2 . ARG A 1 37 ? -0.040 -13.061 -6.056 1.00 73.80 37 A 1 ATOM 309 N N . LEU A 1 38 ? -8.074 -8.950 -5.206 1.00 95.04 38 A 1 ATOM 310 C CA . LEU A 1 38 ? -9.468 -8.621 -5.538 1.00 93.98 38 A 1 ATOM 311 C C . LEU A 1 38 ? -9.934 -9.229 -6.869 1.00 93.77 38 A 1 ATOM 312 O O . LEU A 1 38 ? -11.136 -9.309 -7.094 1.00 91.48 38 A 1 ATOM 313 C CB . LEU A 1 38 ? -9.648 -7.092 -5.563 1.00 93.40 38 A 1 ATOM 314 C CG . LEU A 1 38 ? -9.406 -6.390 -4.215 1.00 91.70 38 A 1 ATOM 315 C CD1 . LEU A 1 38 ? -9.643 -4.890 -4.378 1.00 88.05 38 A 1 ATOM 316 C CD2 . LEU A 1 38 ? -10.344 -6.896 -3.115 1.00 88.23 38 A 1 ATOM 317 N N . SER A 1 39 ? -9.006 -9.621 -7.747 1.00 94.24 39 A 1 ATOM 318 C CA . SER A 1 39 ? -9.306 -10.197 -9.063 1.00 93.25 39 A 1 ATOM 319 C C . SER A 1 39 ? -9.767 -11.652 -9.003 1.00 93.79 39 A 1 ATOM 320 O O . SER A 1 39 ? -10.636 -12.037 -9.779 1.00 92.58 39 A 1 ATOM 321 C CB . SER A 1 39 ? -8.068 -10.104 -9.962 1.00 92.24 39 A 1 ATOM 322 O OG . SER A 1 39 ? -6.921 -10.630 -9.315 1.00 90.91 39 A 1 ATOM 323 N N . ASP A 1 40 ? -9.182 -12.457 -8.119 1.00 94.99 40 A 1 ATOM 324 C CA . ASP A 1 40 ? -9.366 -13.916 -8.102 1.00 95.73 40 A 1 ATOM 325 C C . ASP A 1 40 ? -9.524 -14.513 -6.691 1.00 96.57 40 A 1 ATOM 326 O O . ASP A 1 40 ? -9.756 -15.712 -6.547 1.00 95.42 40 A 1 ATOM 327 C CB . ASP A 1 40 ? -8.198 -14.573 -8.864 1.00 94.85 40 A 1 ATOM 328 C CG . ASP A 1 40 ? -6.813 -14.304 -8.252 1.00 94.83 40 A 1 ATOM 329 O OD1 . ASP A 1 40 ? -6.723 -13.895 -7.073 1.00 91.86 40 A 1 ATOM 330 O OD2 . ASP A 1 40 ? -5.803 -14.467 -8.969 1.00 90.89 40 A 1 ATOM 331 N N . GLY A 1 41 ? -9.412 -13.690 -5.636 1.00 96.08 41 A 1 ATOM 332 C CA . GLY A 1 41 ? -9.536 -14.135 -4.245 1.00 96.32 41 A 1 ATOM 333 C C . GLY A 1 41 ? -8.325 -14.899 -3.700 1.00 97.15 41 A 1 ATOM 334 O O . GLY A 1 41 ? -8.362 -15.331 -2.546 1.00 96.41 41 A 1 ATOM 335 N N . SER A 1 42 ? -7.251 -15.063 -4.476 1.00 97.27 42 A 1 ATOM 336 C CA . SER A 1 42 ? -6.043 -15.752 -4.008 1.00 97.32 42 A 1 ATOM 337 C C . SER A 1 42 ? -5.322 -14.964 -2.901 1.00 97.51 42 A 1 ATOM 338 O O . SER A 1 42 ? -5.336 -13.726 -2.921 1.00 97.24 42 A 1 ATOM 339 C CB . SER A 1 42 ? -5.091 -16.068 -5.168 1.00 96.85 42 A 1 ATOM 340 O OG . SER A 1 42 ? -4.608 -14.898 -5.790 1.00 94.12 42 A 1 ATOM 341 N N . PRO A 1 43 ? -4.667 -15.636 -1.931 1.00 97.21 43 A 1 ATOM 342 C CA . PRO A 1 43 ? -3.899 -14.965 -0.885 1.00 97.08 43 A 1 ATOM 343 C C . PRO A 1 43 ? -2.799 -14.055 -1.449 1.00 97.10 43 A 1 ATOM 344 O O . PRO A 1 43 ? -2.129 -14.387 -2.433 1.00 96.62 43 A 1 ATOM 345 C CB . PRO A 1 43 ? -3.313 -16.084 -0.013 1.00 96.38 43 A 1 ATOM 346 C CG . PRO A 1 43 ? -4.297 -17.235 -0.206 1.00 94.37 43 A 1 ATOM 347 C CD . PRO A 1 43 ? -4.718 -17.071 -1.668 1.00 96.74 43 A 1 ATOM 348 N N . ILE A 1 44 ? -2.608 -12.894 -0.819 1.00 96.94 44 A 1 ATOM 349 C CA . ILE A 1 44 ? -1.541 -11.951 -1.156 1.00 96.74 44 A 1 ATOM 350 C C . ILE A 1 44 ? -1.066 -11.219 0.098 1.00 96.69 44 A 1 ATOM 351 O O . ILE A 1 44 ? -1.867 -10.680 0.858 1.00 96.16 44 A 1 ATOM 352 C CB . ILE A 1 44 ? -1.976 -10.969 -2.272 1.00 96.21 44 A 1 ATOM 353 C CG1 . ILE A 1 44 ? -0.769 -10.118 -2.740 1.00 94.54 44 A 1 ATOM 354 C CG2 . ILE A 1 44 ? -3.155 -10.069 -1.858 1.00 93.23 44 A 1 ATOM 355 C CD1 . ILE A 1 44 ? -1.043 -9.262 -3.981 1.00 91.10 44 A 1 ATOM 356 N N . ASP A 1 45 ? 0.242 -11.124 0.247 1.00 95.98 45 A 1 ATOM 357 C CA . ASP A 1 45 ? 0.888 -10.265 1.233 1.00 95.62 45 A 1 ATOM 358 C C . ASP A 1 45 ? 1.500 -9.031 0.556 1.00 96.25 45 A 1 ATOM 359 O O . ASP A 1 45 ? 1.911 -9.092 -0.612 1.00 95.86 45 A 1 ATOM 360 C CB . ASP A 1 45 ? 1.940 -11.065 2.014 1.00 94.06 45 A 1 ATOM 361 C CG . ASP A 1 45 ? 1.283 -12.142 2.885 1.00 89.71 45 A 1 ATOM 362 O OD1 . ASP A 1 45 ? 0.389 -11.763 3.681 1.00 86.32 45 A 1 ATOM 363 O OD2 . ASP A 1 45 ? 1.670 -13.321 2.735 1.00 84.84 45 A 1 ATOM 364 N N . PRO A 1 46 ? 1.559 -7.879 1.254 1.00 96.63 46 A 1 ATOM 365 C CA . PRO A 1 46 ? 2.321 -6.741 0.765 1.00 96.79 46 A 1 ATOM 366 C C . PRO A 1 46 ? 3.807 -7.126 0.633 1.00 97.19 46 A 1 ATOM 367 O O . PRO A 1 46 ? 4.365 -7.756 1.540 1.00 96.83 46 A 1 ATOM 368 C CB . PRO A 1 46 ? 2.109 -5.628 1.795 1.00 95.96 46 A 1 ATOM 369 C CG . PRO A 1 46 ? 1.817 -6.396 3.087 1.00 94.39 46 A 1 ATOM 370 C CD . PRO A 1 46 ? 1.071 -7.636 2.601 1.00 96.03 46 A 1 ATOM 371 N N . PRO A 1 47 ? 4.488 -6.724 -0.459 1.00 96.68 47 A 1 ATOM 372 C CA . PRO A 1 47 ? 5.919 -6.967 -0.600 1.00 96.73 47 A 1 ATOM 373 C C . PRO A 1 47 ? 6.704 -6.197 0.472 1.00 97.26 47 A 1 ATOM 374 O O . PRO A 1 47 ? 6.279 -5.129 0.923 1.00 97.13 47 A 1 ATOM 375 C CB . PRO A 1 47 ? 6.268 -6.515 -2.021 1.00 95.96 47 A 1 ATOM 376 C CG . PRO A 1 47 ? 5.245 -5.409 -2.288 1.00 94.80 47 A 1 ATOM 377 C CD . PRO A 1 47 ? 3.998 -5.915 -1.560 1.00 96.32 47 A 1 ATOM 378 N N . LEU A 1 48 ? 7.891 -6.697 0.825 1.00 96.99 48 A 1 ATOM 379 C CA . LEU A 1 48 ? 8.769 -6.055 1.813 1.00 97.33 48 A 1 ATOM 380 C C . LEU A 1 48 ? 9.030 -4.575 1.482 1.00 97.52 48 A 1 ATOM 381 O O . LEU A 1 48 ? 9.040 -3.734 2.379 1.00 97.65 48 A 1 ATOM 382 C CB . LEU A 1 48 ? 10.086 -6.852 1.896 1.00 97.44 48 A 1 ATOM 383 C CG . LEU A 1 48 ? 11.127 -6.259 2.870 1.00 95.75 48 A 1 ATOM 384 C CD1 . LEU A 1 48 ? 10.614 -6.210 4.316 1.00 93.98 48 A 1 ATOM 385 C CD2 . LEU A 1 48 ? 12.400 -7.104 2.839 1.00 93.91 48 A 1 ATOM 386 N N . THR A 1 49 ? 9.167 -4.231 0.199 1.00 97.14 49 A 1 ATOM 387 C CA . THR A 1 49 ? 9.355 -2.845 -0.258 1.00 97.00 49 A 1 ATOM 388 C C . THR A 1 49 ? 8.193 -1.931 0.139 1.00 97.27 49 A 1 ATOM 389 O O . THR A 1 49 ? 8.429 -0.807 0.579 1.00 97.09 49 A 1 ATOM 390 C CB . THR A 1 49 ? 9.535 -2.797 -1.781 1.00 96.11 49 A 1 ATOM 391 O OG1 . THR A 1 49 ? 8.487 -3.502 -2.420 1.00 91.52 49 A 1 ATOM 392 C CG2 . THR A 1 49 ? 10.844 -3.456 -2.222 1.00 90.32 49 A 1 ATOM 393 N N . ALA A 1 50 ? 6.940 -2.411 0.070 1.00 97.56 50 A 1 ATOM 394 C CA . ALA A 1 50 ? 5.774 -1.644 0.505 1.00 97.55 50 A 1 ATOM 395 C C . ALA A 1 50 ? 5.735 -1.481 2.033 1.00 97.81 50 A 1 ATOM 396 O O . ALA A 1 50 ? 5.391 -0.404 2.523 1.00 97.72 50 A 1 ATOM 397 C CB . ALA A 1 50 ? 4.499 -2.313 -0.023 1.00 97.11 50 A 1 ATOM 398 N N . LEU A 1 51 ? 6.126 -2.511 2.789 1.00 97.50 51 A 1 ATOM 399 C CA . LEU A 1 51 ? 6.223 -2.431 4.252 1.00 97.57 51 A 1 ATOM 400 C C . LEU A 1 51 ? 7.309 -1.435 4.696 1.00 97.78 51 A 1 ATOM 401 O O . LEU A 1 51 ? 7.072 -0.624 5.592 1.00 97.85 51 A 1 ATOM 402 C CB . LEU A 1 51 ? 6.495 -3.833 4.829 1.00 97.33 51 A 1 ATOM 403 C CG . LEU A 1 51 ? 5.364 -4.858 4.609 1.00 96.33 51 A 1 ATOM 404 C CD1 . LEU A 1 51 ? 5.810 -6.229 5.124 1.00 95.45 51 A 1 ATOM 405 C CD2 . LEU A 1 51 ? 4.084 -4.466 5.347 1.00 95.33 51 A 1 ATOM 406 N N . LEU A 1 52 ? 8.467 -1.445 4.034 1.00 97.25 52 A 1 ATOM 407 C CA . LEU A 1 52 ? 9.548 -0.486 4.287 1.00 97.22 52 A 1 ATOM 408 C C . LEU A 1 52 ? 9.136 0.945 3.916 1.00 97.35 52 A 1 ATOM 409 O O . LEU A 1 52 ? 9.371 1.867 4.697 1.00 97.41 52 A 1 ATOM 410 C CB . LEU A 1 52 ? 10.805 -0.913 3.508 1.00 97.07 52 A 1 ATOM 411 C CG . LEU A 1 52 ? 11.485 -2.194 4.040 1.00 95.88 52 A 1 ATOM 412 C CD1 . LEU A 1 52 ? 12.612 -2.593 3.089 1.00 94.80 52 A 1 ATOM 413 C CD2 . LEU A 1 52 ? 12.071 -2.008 5.439 1.00 94.75 52 A 1 ATOM 414 N N . ALA A 1 53 ? 8.456 1.130 2.774 1.00 97.63 53 A 1 ATOM 415 C CA . ALA A 1 53 ? 7.923 2.432 2.379 1.00 97.50 53 A 1 ATOM 416 C C . ALA A 1 53 ? 6.891 2.955 3.397 1.00 97.73 53 A 1 ATOM 417 O O . ALA A 1 53 ? 6.963 4.115 3.804 1.00 97.64 53 A 1 ATOM 418 C CB . ALA A 1 53 ? 7.330 2.315 0.968 1.00 96.97 53 A 1 ATOM 419 N N . ALA A 1 54 ? 5.980 2.094 3.874 1.00 97.94 54 A 1 ATOM 420 C CA . ALA A 1 54 ? 5.014 2.450 4.911 1.00 98.04 54 A 1 ATOM 421 C C . ALA A 1 54 ? 5.705 2.891 6.216 1.00 98.10 54 A 1 ATOM 422 O O . ALA A 1 54 ? 5.359 3.934 6.774 1.00 98.09 54 A 1 ATOM 423 C CB . ALA A 1 54 ? 4.070 1.257 5.128 1.00 98.01 54 A 1 ATOM 424 N N . ALA A 1 55 ? 6.722 2.151 6.664 1.00 97.85 55 A 1 ATOM 425 C CA . ALA A 1 55 ? 7.505 2.511 7.845 1.00 97.67 55 A 1 ATOM 426 C C . ALA A 1 55 ? 8.243 3.852 7.668 1.00 97.79 55 A 1 ATOM 427 O O . ALA A 1 55 ? 8.240 4.682 8.577 1.00 97.55 55 A 1 ATOM 428 C CB . ALA A 1 55 ? 8.480 1.365 8.149 1.00 97.37 55 A 1 ATOM 429 N N . ALA A 1 56 ? 8.816 4.104 6.487 1.00 97.82 56 A 1 ATOM 430 C CA . ALA A 1 56 ? 9.464 5.377 6.174 1.00 97.71 56 A 1 ATOM 431 C C . ALA A 1 56 ? 8.468 6.548 6.223 1.00 97.79 56 A 1 ATOM 432 O O . ALA A 1 56 ? 8.743 7.566 6.863 1.00 97.54 56 A 1 ATOM 433 C CB . ALA A 1 56 ? 10.145 5.255 4.803 1.00 97.36 56 A 1 ATOM 434 N N . ARG A 1 57 ? 7.277 6.394 5.632 1.00 97.58 57 A 1 ATOM 435 C CA . ARG A 1 57 ? 6.212 7.415 5.684 1.00 97.46 57 A 1 ATOM 436 C C . ARG A 1 57 ? 5.734 7.678 7.113 1.00 97.53 57 A 1 ATOM 437 O O . ARG A 1 57 ? 5.533 8.830 7.469 1.00 97.15 57 A 1 ATOM 438 C CB . ARG A 1 57 ? 5.028 7.034 4.782 1.00 97.07 57 A 1 ATOM 439 C CG . ARG A 1 57 ? 5.324 6.982 3.273 1.00 94.86 57 A 1 ATOM 440 C CD . ARG A 1 57 ? 5.951 8.232 2.670 1.00 92.07 57 A 1 ATOM 441 N NE . ARG A 1 57 ? 5.056 9.400 2.676 1.00 86.97 57 A 1 ATOM 442 C CZ . ARG A 1 57 ? 5.428 10.669 2.654 1.00 82.53 57 A 1 ATOM 443 N NH1 . ARG A 1 57 ? 6.676 11.029 2.687 1.00 76.16 57 A 1 ATOM 444 N NH2 . ARG A 1 57 ? 4.541 11.609 2.591 1.00 76.39 57 A 1 ATOM 445 N N . GLU A 1 58 ? 5.606 6.642 7.948 1.00 97.33 58 A 1 ATOM 446 C CA . GLU A 1 58 ? 5.241 6.790 9.367 1.00 97.15 58 A 1 ATOM 447 C C . GLU A 1 58 ? 6.287 7.596 10.157 1.00 97.19 58 A 1 ATOM 448 O O . GLU A 1 58 ? 5.946 8.315 11.099 1.00 96.61 58 A 1 ATOM 449 C CB . GLU A 1 58 ? 5.015 5.391 9.974 1.00 96.37 58 A 1 ATOM 450 C CG . GLU A 1 58 ? 4.441 5.413 11.400 1.00 92.55 58 A 1 ATOM 451 C CD . GLU A 1 58 ? 3.923 4.044 11.891 1.00 93.31 58 A 1 ATOM 452 O OE1 . GLU A 1 58 ? 3.430 3.953 13.036 1.00 88.11 58 A 1 ATOM 453 O OE2 . GLU A 1 58 ? 3.921 3.037 11.140 1.00 89.08 58 A 1 ATOM 454 N N . LYS A 1 59 ? 7.566 7.535 9.745 1.00 97.35 59 A 1 ATOM 455 C CA . LYS A 1 59 ? 8.661 8.335 10.316 1.00 97.09 59 A 1 ATOM 456 C C . LYS A 1 59 ? 8.863 9.698 9.637 1.00 97.33 59 A 1 ATOM 457 O O . LYS A 1 59 ? 9.803 10.403 9.992 1.00 96.84 59 A 1 ATOM 458 C CB . LYS A 1 59 ? 9.953 7.497 10.340 1.00 96.71 59 A 1 ATOM 459 C CG . LYS A 1 59 ? 9.867 6.246 11.232 1.00 93.81 59 A 1 ATOM 460 C CD . LYS A 1 59 ? 9.568 6.578 12.698 1.00 87.36 59 A 1 ATOM 461 C CE . LYS A 1 59 ? 9.547 5.293 13.526 1.00 83.30 59 A 1 ATOM 462 N NZ . LYS A 1 59 ? 9.149 5.570 14.927 1.00 73.09 59 A 1 ATOM 463 N N . GLY A 1 60 ? 7.998 10.077 8.682 1.00 96.95 60 A 1 ATOM 464 C CA . GLY A 1 60 ? 8.097 11.350 7.963 1.00 96.45 60 A 1 ATOM 465 C C . GLY A 1 60 ? 9.283 11.437 6.999 1.00 96.72 60 A 1 ATOM 466 O O . GLY A 1 60 ? 9.681 12.542 6.636 1.00 95.60 60 A 1 ATOM 467 N N . LEU A 1 61 ? 9.860 10.298 6.582 1.00 95.90 61 A 1 ATOM 468 C CA . LEU A 1 61 ? 10.989 10.285 5.650 1.00 95.25 61 A 1 ATOM 469 C C . LEU A 1 61 ? 10.499 10.527 4.213 1.00 93.92 61 A 1 ATOM 470 O O . LEU A 1 61 ? 9.569 9.845 3.762 1.00 92.19 61 A 1 ATOM 471 C CB . LEU A 1 61 ? 11.773 8.970 5.770 1.00 95.15 61 A 1 ATOM 472 C CG . LEU A 1 61 ? 12.378 8.712 7.164 1.00 94.20 61 A 1 ATOM 473 C CD1 . LEU A 1 61 ? 13.062 7.346 7.187 1.00 92.02 61 A 1 ATOM 474 C CD2 . LEU A 1 61 ? 13.410 9.770 7.561 1.00 92.24 61 A 1 ATOM 475 N N . PRO A 1 62 ? 11.094 11.488 3.475 1.00 93.01 62 A 1 ATOM 476 C CA . PRO A 1 62 ? 10.799 11.688 2.061 1.00 90.96 62 A 1 ATOM 477 C C . PRO A 1 62 ? 11.423 10.573 1.202 1.00 90.22 62 A 1 ATOM 478 O O . PRO A 1 62 ? 12.382 9.927 1.634 1.00 88.62 62 A 1 ATOM 479 C CB . PRO A 1 62 ? 11.380 13.066 1.727 1.00 90.13 62 A 1 ATOM 480 C CG . PRO A 1 62 ? 12.595 13.160 2.653 1.00 90.44 62 A 1 ATOM 481 C CD . PRO A 1 62 ? 12.144 12.410 3.908 1.00 92.05 62 A 1 ATOM 482 N N . PRO A 1 63 ? 10.911 10.344 -0.033 1.00 91.97 63 A 1 ATOM 483 C CA . PRO A 1 63 ? 11.631 9.563 -1.034 1.00 90.52 63 A 1 ATOM 484 C C . PRO A 1 63 ? 13.023 10.151 -1.301 1.00 90.82 63 A 1 ATOM 485 O O . PRO A 1 63 ? 13.223 11.360 -1.174 1.00 88.55 63 A 1 ATOM 486 C CB . PRO A 1 63 ? 10.762 9.589 -2.298 1.00 87.58 63 A 1 ATOM 487 C CG . PRO A 1 63 ? 9.374 9.957 -1.778 1.00 86.30 63 A 1 ATOM 488 C CD . PRO A 1 63 ? 9.670 10.857 -0.582 1.00 88.91 63 A 1 ATOM 489 N N . ILE A 1 64 ? 13.963 9.298 -1.705 1.00 90.64 64 A 1 ATOM 490 C CA . ILE A 1 64 ? 15.254 9.766 -2.226 1.00 89.99 64 A 1 ATOM 491 C C . ILE A 1 64 ? 15.034 10.482 -3.567 1.00 88.37 64 A 1 ATOM 492 O O . ILE A 1 64 ? 14.190 10.062 -4.366 1.00 84.49 64 A 1 ATOM 493 C CB . ILE A 1 64 ? 16.284 8.610 -2.329 1.00 88.15 64 A 1 ATOM 494 C CG1 . ILE A 1 64 ? 15.815 7.467 -3.252 1.00 81.91 64 A 1 ATOM 495 C CG2 . ILE A 1 64 ? 16.615 8.103 -0.911 1.00 79.64 64 A 1 ATOM 496 C CD1 . ILE A 1 64 ? 16.862 6.368 -3.484 1.00 78.19 64 A 1 ATOM 497 N N . SER A 1 65 ? 15.737 11.579 -3.790 1.00 87.52 65 A 1 ATOM 498 C CA . SER A 1 65 ? 15.767 12.349 -5.047 1.00 86.70 65 A 1 ATOM 499 C C . SER A 1 65 ? 16.984 11.981 -5.879 1.00 81.68 65 A 1 ATOM 500 O O . SER A 1 65 ? 18.064 11.856 -5.264 1.00 75.22 65 A 1 ATOM 501 C CB . SER A 1 65 ? 15.806 13.843 -4.733 1.00 81.66 65 A 1 ATOM 502 O OG . SER A 1 65 ? 16.964 14.081 -3.963 1.00 77.96 65 A 1 ATOM 503 O OXT . SER A 1 65 ? 16.809 11.889 -7.128 1.00 77.71 65 A 1 #