# 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_spkb38417 # _entry.id spkb38417 # 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" "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" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[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" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "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 PHE 2 1 n LYS 3 1 n LYS 4 1 n LEU 5 1 n ILE 6 1 n GLY 7 1 n LEU 8 1 n LEU 9 1 n PHE 10 1 n LEU 11 1 n MET 12 1 n PRO 13 1 n MET 14 1 n THR 15 1 n ALA 16 1 n LEU 17 1 n ALA 18 # _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 (3.0.0 @ 2025-07-08 07:28:40)" _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 87.48 _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 81.89 1 1 A PHE 2 2 84.87 1 2 A LYS 3 2 86.16 1 3 A LYS 4 2 85.63 1 4 A LEU 5 2 88.45 1 5 A ILE 6 2 89.40 1 6 A GLY 7 2 93.10 1 7 A LEU 8 2 90.12 1 8 A LEU 9 2 90.55 1 9 A PHE 10 2 89.43 1 10 A LEU 11 2 89.41 1 11 A MET 12 2 85.81 1 12 A PRO 13 2 91.62 1 13 A MET 14 2 86.79 1 14 A THR 15 2 87.51 1 15 A ALA 16 2 90.55 1 16 A LEU 17 2 84.94 1 17 A ALA 18 2 82.14 1 18 # _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 PHE . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n LYS . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n ILE . 6 A 6 A 7 1 n GLY . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n PHE . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n MET . 12 A 12 A 13 1 n PRO . 13 A 13 A 14 1 n MET . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n ALA . 18 A 18 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (9ceee3b5f7825b611ab42eaad843248507ced2da1e745fa3b3d93c6c4ad3ca74)" # _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 ? -6.548 3.018 12.353 1.00 84.70 1 A 1 ATOM 2 C CA . MET A 1 1 ? -5.629 1.929 12.004 1.00 88.34 1 A 1 ATOM 3 C C . MET A 1 1 ? -5.840 1.473 10.564 1.00 89.53 1 A 1 ATOM 4 O O . MET A 1 1 ? -4.932 0.925 9.942 1.00 87.45 1 A 1 ATOM 5 C CB . MET A 1 1 ? -5.830 0.741 12.950 1.00 81.99 1 A 1 ATOM 6 C CG . MET A 1 1 ? -5.510 1.080 14.406 1.00 77.11 1 A 1 ATOM 7 S SD . MET A 1 1 ? -3.791 1.514 14.638 1.00 75.43 1 A 1 ATOM 8 C CE . MET A 1 1 ? -3.778 1.922 16.381 1.00 70.59 1 A 1 ATOM 9 N N . PHE A 1 2 ? -7.025 1.705 10.055 1.00 86.71 2 A 1 ATOM 10 C CA . PHE A 1 2 ? -7.350 1.328 8.684 1.00 89.94 2 A 1 ATOM 11 C C . PHE A 1 2 ? -6.489 2.088 7.686 1.00 92.55 2 A 1 ATOM 12 O O . PHE A 1 2 ? -6.026 1.528 6.697 1.00 90.64 2 A 1 ATOM 13 C CB . PHE A 1 2 ? -8.828 1.590 8.404 1.00 88.38 2 A 1 ATOM 14 C CG . PHE A 1 2 ? -9.728 0.487 8.893 1.00 85.37 2 A 1 ATOM 15 C CD1 . PHE A 1 2 ? -10.023 0.350 10.232 1.00 82.06 2 A 1 ATOM 16 C CD2 . PHE A 1 2 ? -10.276 -0.409 7.992 1.00 80.87 2 A 1 ATOM 17 C CE1 . PHE A 1 2 ? -10.847 -0.669 10.677 1.00 79.23 2 A 1 ATOM 18 C CE2 . PHE A 1 2 ? -11.103 -1.427 8.428 1.00 79.36 2 A 1 ATOM 19 C CZ . PHE A 1 2 ? -11.391 -1.556 9.776 1.00 78.41 2 A 1 ATOM 20 N N . LYS A 1 3 ? -6.262 3.353 7.938 1.00 93.44 3 A 1 ATOM 21 C CA . LYS A 1 3 ? -5.451 4.188 7.059 1.00 93.61 3 A 1 ATOM 22 C C . LYS A 1 3 ? -4.022 3.662 6.965 1.00 93.61 3 A 1 ATOM 23 O O . LYS A 1 3 ? -3.338 3.886 5.967 1.00 91.97 3 A 1 ATOM 24 C CB . LYS A 1 3 ? -5.446 5.637 7.551 1.00 92.05 3 A 1 ATOM 25 C CG . LYS A 1 3 ? -4.963 5.811 8.974 1.00 85.64 3 A 1 ATOM 26 C CD . LYS A 1 3 ? -5.128 7.248 9.436 1.00 82.12 3 A 1 ATOM 27 C CE . LYS A 1 3 ? -4.762 7.411 10.901 1.00 75.19 3 A 1 ATOM 28 N NZ . LYS A 1 3 ? -3.311 7.229 11.123 1.00 67.80 3 A 1 ATOM 29 N N . LYS A 1 4 ? -3.583 2.956 7.994 1.00 92.71 4 A 1 ATOM 30 C CA . LYS A 1 4 ? -2.240 2.389 8.024 1.00 92.79 4 A 1 ATOM 31 C C . LYS A 1 4 ? -2.096 1.315 6.955 1.00 93.53 4 A 1 ATOM 32 O O . LYS A 1 4 ? -1.078 1.252 6.268 1.00 92.39 4 A 1 ATOM 33 C CB . LYS A 1 4 ? -1.955 1.804 9.407 1.00 92.01 4 A 1 ATOM 34 C CG . LYS A 1 4 ? -0.499 1.404 9.602 1.00 85.02 4 A 1 ATOM 35 C CD . LYS A 1 4 ? 0.404 2.622 9.679 1.00 80.31 4 A 1 ATOM 36 C CE . LYS A 1 4 ? 1.844 2.231 9.945 1.00 74.85 4 A 1 ATOM 37 N NZ . LYS A 1 4 ? 2.728 3.425 10.046 1.00 67.06 4 A 1 ATOM 38 N N . LEU A 1 5 ? -3.123 0.483 6.813 1.00 91.82 5 A 1 ATOM 39 C CA . LEU A 1 5 ? -3.126 -0.578 5.814 1.00 92.00 5 A 1 ATOM 40 C C . LEU A 1 5 ? -3.218 -0.001 4.407 1.00 93.33 5 A 1 ATOM 41 O O . LEU A 1 5 ? -2.529 -0.452 3.494 1.00 92.47 5 A 1 ATOM 42 C CB . LEU A 1 5 ? -4.300 -1.524 6.068 1.00 91.60 5 A 1 ATOM 43 C CG . LEU A 1 5 ? -4.199 -2.338 7.350 1.00 84.37 5 A 1 ATOM 44 C CD1 . LEU A 1 5 ? -5.533 -2.974 7.683 1.00 81.02 5 A 1 ATOM 45 C CD2 . LEU A 1 5 ? -3.125 -3.407 7.209 1.00 81.00 5 A 1 ATOM 46 N N . ILE A 1 6 ? -4.062 0.995 4.248 1.00 92.14 6 A 1 ATOM 47 C CA . ILE A 1 6 ? -4.248 1.650 2.957 1.00 91.55 6 A 1 ATOM 48 C C . ILE A 1 6 ? -3.002 2.443 2.571 1.00 91.95 6 A 1 ATOM 49 O O . ILE A 1 6 ? -2.580 2.445 1.417 1.00 90.93 6 A 1 ATOM 50 C CB . ILE A 1 6 ? -5.478 2.573 2.991 1.00 91.36 6 A 1 ATOM 51 C CG1 . ILE A 1 6 ? -6.739 1.787 3.348 1.00 87.98 6 A 1 ATOM 52 C CG2 . ILE A 1 6 ? -5.656 3.259 1.636 1.00 87.36 6 A 1 ATOM 53 C CD1 . ILE A 1 6 ? -7.926 2.671 3.667 1.00 81.91 6 A 1 ATOM 54 N N . GLY A 1 7 ? -2.425 3.106 3.544 1.00 93.24 7 A 1 ATOM 55 C CA . GLY A 1 7 ? -1.224 3.895 3.304 1.00 92.51 7 A 1 ATOM 56 C C . GLY A 1 7 ? -0.062 3.042 2.837 1.00 93.74 7 A 1 ATOM 57 O O . GLY A 1 7 ? 0.714 3.449 1.972 1.00 92.90 7 A 1 ATOM 58 N N . LEU A 1 8 ? 0.044 1.841 3.401 1.00 93.36 8 A 1 ATOM 59 C CA . LEU A 1 8 ? 1.107 0.911 3.031 1.00 93.21 8 A 1 ATOM 60 C C . LEU A 1 8 ? 0.825 0.266 1.680 1.00 94.15 8 A 1 ATOM 61 O O . LEU A 1 8 ? 1.733 0.097 0.869 1.00 93.24 8 A 1 ATOM 62 C CB . LEU A 1 8 ? 1.250 -0.165 4.107 1.00 92.92 8 A 1 ATOM 63 C CG . LEU A 1 8 ? 2.440 -1.096 3.919 1.00 86.97 8 A 1 ATOM 64 C CD1 . LEU A 1 8 ? 3.747 -0.351 4.149 1.00 83.66 8 A 1 ATOM 65 C CD2 . LEU A 1 8 ? 2.343 -2.282 4.867 1.00 83.47 8 A 1 ATOM 66 N N . LEU A 1 9 ? -0.423 -0.090 1.452 1.00 93.50 9 A 1 ATOM 67 C CA . LEU A 1 9 ? -0.838 -0.715 0.198 1.00 93.14 9 A 1 ATOM 68 C C . LEU A 1 9 ? -0.795 0.274 -0.960 1.00 94.01 9 A 1 ATOM 69 O O . LEU A 1 9 ? -0.556 -0.108 -2.105 1.00 93.28 9 A 1 ATOM 70 C CB . LEU A 1 9 ? -2.248 -1.287 0.349 1.00 92.69 9 A 1 ATOM 71 C CG . LEU A 1 9 ? -2.756 -2.081 -0.847 1.00 88.62 9 A 1 ATOM 72 C CD1 . LEU A 1 9 ? -1.974 -3.380 -1.000 1.00 84.53 9 A 1 ATOM 73 C CD2 . LEU A 1 9 ? -4.238 -2.379 -0.693 1.00 84.60 9 A 1 ATOM 74 N N . PHE A 1 10 ? -1.029 1.533 -0.664 1.00 92.88 10 A 1 ATOM 75 C CA . PHE A 1 10 ? -1.046 2.579 -1.681 1.00 92.26 10 A 1 ATOM 76 C C . PHE A 1 10 ? 0.355 3.120 -1.953 1.00 93.50 10 A 1 ATOM 77 O O . PHE A 1 10 ? 0.662 3.536 -3.073 1.00 92.48 10 A 1 ATOM 78 C CB . PHE A 1 10 ? -1.963 3.715 -1.227 1.00 91.90 10 A 1 ATOM 79 C CG . PHE A 1 10 ? -2.531 4.504 -2.372 1.00 89.79 10 A 1 ATOM 80 C CD1 . PHE A 1 10 ? -1.828 5.566 -2.913 1.00 86.31 10 A 1 ATOM 81 C CD2 . PHE A 1 10 ? -3.762 4.169 -2.906 1.00 86.91 10 A 1 ATOM 82 C CE1 . PHE A 1 10 ? -2.340 6.290 -3.976 1.00 85.55 10 A 1 ATOM 83 C CE2 . PHE A 1 10 ? -4.283 4.890 -3.970 1.00 85.89 10 A 1 ATOM 84 C CZ . PHE A 1 10 ? -3.569 5.949 -4.504 1.00 86.31 10 A 1 ATOM 85 N N . LEU A 1 11 ? 1.185 3.103 -0.940 1.00 92.99 11 A 1 ATOM 86 C CA . LEU A 1 11 ? 2.544 3.622 -1.065 1.00 92.65 11 A 1 ATOM 87 C C . LEU A 1 11 ? 3.542 2.541 -1.462 1.00 93.23 11 A 1 ATOM 88 O O . LEU A 1 11 ? 4.526 2.828 -2.141 1.00 91.14 11 A 1 ATOM 89 C CB . LEU A 1 11 ? 2.969 4.266 0.253 1.00 91.86 11 A 1 ATOM 90 C CG . LEU A 1 11 ? 4.281 5.040 0.192 1.00 87.48 11 A 1 ATOM 91 C CD1 . LEU A 1 11 ? 4.133 6.276 -0.690 1.00 83.36 11 A 1 ATOM 92 C CD2 . LEU A 1 11 ? 4.721 5.449 1.589 1.00 82.57 11 A 1 ATOM 93 N N . MET A 1 12 ? 3.287 1.308 -1.037 1.00 91.91 12 A 1 ATOM 94 C CA . MET A 1 12 ? 4.187 0.191 -1.326 1.00 90.84 12 A 1 ATOM 95 C C . MET A 1 12 ? 4.375 -0.041 -2.828 1.00 92.00 12 A 1 ATOM 96 O O . MET A 1 12 ? 5.504 -0.023 -3.307 1.00 89.51 12 A 1 ATOM 97 C CB . MET A 1 12 ? 3.678 -1.084 -0.645 1.00 88.01 12 A 1 ATOM 98 C CG . MET A 1 12 ? 4.768 -2.140 -0.540 1.00 84.55 12 A 1 ATOM 99 S SD . MET A 1 12 ? 6.050 -1.641 0.606 1.00 78.54 12 A 1 ATOM 100 C CE . MET A 1 12 ? 7.209 -2.991 0.400 1.00 71.10 12 A 1 ATOM 101 N N . PRO A 1 13 ? 3.298 -0.261 -3.576 1.00 92.68 13 A 1 ATOM 102 C CA . PRO A 1 13 ? 3.405 -0.489 -5.020 1.00 92.54 13 A 1 ATOM 103 C C . PRO A 1 13 ? 3.894 0.742 -5.771 1.00 93.42 13 A 1 ATOM 104 O O . PRO A 1 13 ? 4.575 0.630 -6.790 1.00 91.66 13 A 1 ATOM 105 C CB . PRO A 1 13 ? 1.974 -0.853 -5.433 1.00 90.44 13 A 1 ATOM 106 C CG . PRO A 1 13 ? 1.117 -0.259 -4.377 1.00 88.75 13 A 1 ATOM 107 C CD . PRO A 1 13 ? 1.924 -0.289 -3.104 1.00 91.84 13 A 1 ATOM 108 N N . MET A 1 14 ? 3.554 1.906 -5.276 1.00 91.67 14 A 1 ATOM 109 C CA . MET A 1 14 ? 3.936 3.173 -5.894 1.00 91.91 14 A 1 ATOM 110 C C . MET A 1 14 ? 4.798 3.995 -4.937 1.00 93.08 14 A 1 ATOM 111 O O . MET A 1 14 ? 4.662 5.212 -4.850 1.00 90.79 14 A 1 ATOM 112 C CB . MET A 1 14 ? 2.686 3.958 -6.284 1.00 89.51 14 A 1 ATOM 113 C CG . MET A 1 14 ? 1.718 3.149 -7.121 1.00 85.85 14 A 1 ATOM 114 S SD . MET A 1 14 ? 0.211 4.053 -7.460 1.00 79.65 14 A 1 ATOM 115 C CE . MET A 1 14 ? -0.804 2.739 -8.119 1.00 71.89 14 A 1 ATOM 116 N N . THR A 1 15 ? 5.667 3.309 -4.237 1.00 90.04 15 A 1 ATOM 117 C CA . THR A 1 15 ? 6.507 3.969 -3.249 1.00 89.69 15 A 1 ATOM 118 C C . THR A 1 15 ? 7.542 4.878 -3.894 1.00 90.83 15 A 1 ATOM 119 O O . THR A 1 15 ? 7.870 5.939 -3.361 1.00 88.67 15 A 1 ATOM 120 C CB . THR A 1 15 ? 7.203 2.932 -2.354 1.00 88.06 15 A 1 ATOM 121 O OG1 . THR A 1 15 ? 7.867 3.605 -1.294 1.00 83.15 15 A 1 ATOM 122 C CG2 . THR A 1 15 ? 8.204 2.096 -3.128 1.00 82.11 15 A 1 ATOM 123 N N . ALA A 1 16 ? 8.047 4.470 -5.063 1.00 91.35 16 A 1 ATOM 124 C CA . ALA A 1 16 ? 9.055 5.262 -5.771 1.00 90.82 16 A 1 ATOM 125 C C . ALA A 1 16 ? 10.218 5.595 -4.847 1.00 91.78 16 A 1 ATOM 126 O O . ALA A 1 16 ? 10.725 6.721 -4.833 1.00 89.79 16 A 1 ATOM 127 C CB . ALA A 1 16 ? 8.422 6.534 -6.328 1.00 89.02 16 A 1 ATOM 128 N N . LEU A 1 17 ? 10.617 4.588 -4.068 1.00 89.05 17 A 1 ATOM 129 C CA . LEU A 1 17 ? 11.686 4.761 -3.094 1.00 88.89 17 A 1 ATOM 130 C C . LEU A 1 17 ? 13.039 4.878 -3.780 1.00 90.02 17 A 1 ATOM 131 O O . LEU A 1 17 ? 13.866 5.712 -3.404 1.00 87.39 17 A 1 ATOM 132 C CB . LEU A 1 17 ? 11.690 3.585 -2.115 1.00 86.83 17 A 1 ATOM 133 C CG . LEU A 1 17 ? 12.575 3.770 -0.886 1.00 82.89 17 A 1 ATOM 134 C CD1 . LEU A 1 17 ? 12.039 4.879 0.003 1.00 78.10 17 A 1 ATOM 135 C CD2 . LEU A 1 17 ? 12.665 2.466 -0.108 1.00 76.32 17 A 1 ATOM 136 N N . ALA A 1 18 ? 13.265 4.031 -4.788 1.00 89.38 18 A 1 ATOM 137 C CA . ALA A 1 18 ? 14.528 4.026 -5.519 1.00 86.57 18 A 1 ATOM 138 C C . ALA A 1 18 ? 14.623 5.246 -6.435 1.00 83.75 18 A 1 ATOM 139 O O . ALA A 1 18 ? 15.222 6.254 -6.031 1.00 77.78 18 A 1 ATOM 140 C CB . ALA A 1 18 ? 14.663 2.734 -6.315 1.00 81.17 18 A 1 ATOM 141 O OXT . ALA A 1 18 ? 14.114 5.180 -7.555 1.00 74.17 18 A 1 #