# 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_spkb12462 # _entry.id spkb12462 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "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" "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" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 LYS 2 1 n GLN 3 1 n PHE 4 1 n ILE 5 1 n PHE 6 1 n PHE 7 1 n ALA 8 1 n LEU 9 1 n LEU 10 1 n CYS 11 1 n THR 12 1 n SER 13 1 n THR 14 1 n TYR 15 1 n ALA 16 # _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 13:27:01)" _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 85.93 _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 81.41 1 1 A LYS 2 2 79.95 1 2 A GLN 3 2 80.93 1 3 A PHE 4 2 83.54 1 4 A ILE 5 2 88.39 1 5 A PHE 6 2 87.37 1 6 A PHE 7 2 88.81 1 7 A ALA 8 2 92.32 1 8 A LEU 9 2 88.38 1 9 A LEU 10 2 88.45 1 10 A CYS 11 2 88.82 1 11 A THR 12 2 88.24 1 12 A SER 13 2 90.60 1 13 A THR 14 2 88.08 1 14 A TYR 15 2 82.70 1 15 A ALA 16 2 83.44 1 16 # _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 LYS . 2 A 2 A 3 1 n GLN . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n PHE . 6 A 6 A 7 1 n PHE . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n CYS . 11 A 11 A 12 1 n THR . 12 A 12 A 13 1 n SER . 13 A 13 A 14 1 n THR . 14 A 14 A 15 1 n TYR . 15 A 15 A 16 1 n ALA . 16 A 16 # _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 ? -4.719 11.165 0.942 1.00 87.10 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.949 9.713 0.799 1.00 89.21 1 A 1 ATOM 3 C C . MET A 1 1 ? -3.678 8.926 1.103 1.00 89.86 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.895 8.638 0.207 1.00 86.96 1 A 1 ATOM 5 C CB . MET A 1 1 ? -5.382 9.399 -0.629 1.00 83.89 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.634 10.148 -1.025 1.00 76.92 1 A 1 ATOM 7 S SD . MET A 1 1 ? -6.989 9.948 -2.773 1.00 72.79 1 A 1 ATOM 8 C CE . MET A 1 1 ? -7.091 11.651 -3.273 1.00 64.52 1 A 1 ATOM 9 N N . LYS A 1 2 ? -3.482 8.599 2.352 1.00 88.12 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -2.295 7.836 2.738 1.00 89.67 2 A 1 ATOM 11 C C . LYS A 1 2 ? -2.603 6.342 2.849 1.00 90.47 2 A 1 ATOM 12 O O . LYS A 1 2 ? -1.703 5.510 2.778 1.00 88.73 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -1.738 8.379 4.051 1.00 86.33 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -2.696 8.286 5.211 1.00 77.75 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -1.957 8.613 6.494 1.00 73.92 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -2.873 9.179 7.543 1.00 65.86 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -2.084 9.910 8.557 1.00 58.73 2 A 1 ATOM 18 N N . GLN A 1 3 ? -3.865 6.024 3.017 1.00 87.70 3 A 1 ATOM 19 C CA . GLN A 1 3 ? -4.285 4.622 3.099 1.00 90.20 3 A 1 ATOM 20 C C . GLN A 1 3 ? -4.118 3.929 1.751 1.00 91.07 3 A 1 ATOM 21 O O . GLN A 1 3 ? -3.801 2.745 1.679 1.00 87.64 3 A 1 ATOM 22 C CB . GLN A 1 3 ? -5.745 4.536 3.550 1.00 86.82 3 A 1 ATOM 23 C CG . GLN A 1 3 ? -5.886 4.386 5.053 1.00 77.98 3 A 1 ATOM 24 C CD . GLN A 1 3 ? -7.102 3.568 5.430 1.00 74.70 3 A 1 ATOM 25 O OE1 . GLN A 1 3 ? -8.107 3.572 4.731 1.00 68.54 3 A 1 ATOM 26 N NE2 . GLN A 1 3 ? -7.023 2.843 6.531 1.00 63.76 3 A 1 ATOM 27 N N . PHE A 1 4 ? -4.339 4.676 0.689 1.00 88.04 4 A 1 ATOM 28 C CA . PHE A 1 4 ? -4.201 4.144 -0.666 1.00 88.78 4 A 1 ATOM 29 C C . PHE A 1 4 ? -2.765 3.739 -0.943 1.00 90.62 4 A 1 ATOM 30 O O . PHE A 1 4 ? -2.500 2.648 -1.444 1.00 89.52 4 A 1 ATOM 31 C CB . PHE A 1 4 ? -4.646 5.198 -1.679 1.00 88.27 4 A 1 ATOM 32 C CG . PHE A 1 4 ? -5.988 4.886 -2.283 1.00 83.84 4 A 1 ATOM 33 C CD1 . PHE A 1 4 ? -7.123 4.846 -1.500 1.00 79.98 4 A 1 ATOM 34 C CD2 . PHE A 1 4 ? -6.096 4.627 -3.642 1.00 79.03 4 A 1 ATOM 35 C CE1 . PHE A 1 4 ? -8.357 4.552 -2.055 1.00 77.26 4 A 1 ATOM 36 C CE2 . PHE A 1 4 ? -7.330 4.336 -4.205 1.00 78.04 4 A 1 ATOM 37 C CZ . PHE A 1 4 ? -8.463 4.298 -3.412 1.00 75.55 4 A 1 ATOM 38 N N . ILE A 1 5 ? -1.853 4.610 -0.628 1.00 89.79 5 A 1 ATOM 39 C CA . ILE A 1 5 ? -0.437 4.332 -0.838 1.00 90.42 5 A 1 ATOM 40 C C . ILE A 1 5 ? 0.025 3.176 0.043 1.00 91.10 5 A 1 ATOM 41 O O . ILE A 1 5 ? 0.853 2.360 -0.363 1.00 90.22 5 A 1 ATOM 42 C CB . ILE A 1 5 ? 0.431 5.578 -0.559 1.00 90.84 5 A 1 ATOM 43 C CG1 . ILE A 1 5 ? -0.223 6.496 0.472 1.00 87.72 5 A 1 ATOM 44 C CG2 . ILE A 1 5 ? 0.703 6.330 -1.855 1.00 86.65 5 A 1 ATOM 45 C CD1 . ILE A 1 5 ? 0.672 7.640 0.903 1.00 80.40 5 A 1 ATOM 46 N N . PHE A 1 6 ? -0.513 3.123 1.235 1.00 91.03 6 A 1 ATOM 47 C CA . PHE A 1 6 ? -0.170 2.055 2.168 1.00 91.11 6 A 1 ATOM 48 C C . PHE A 1 6 ? -0.589 0.701 1.605 1.00 91.77 6 A 1 ATOM 49 O O . PHE A 1 6 ? 0.136 -0.286 1.720 1.00 91.03 6 A 1 ATOM 50 C CB . PHE A 1 6 ? -0.868 2.305 3.500 1.00 90.86 6 A 1 ATOM 51 C CG . PHE A 1 6 ? -0.397 1.371 4.584 1.00 88.58 6 A 1 ATOM 52 C CD1 . PHE A 1 6 ? 0.911 1.423 5.036 1.00 84.60 6 A 1 ATOM 53 C CD2 . PHE A 1 6 ? -1.268 0.446 5.136 1.00 84.53 6 A 1 ATOM 54 C CE1 . PHE A 1 6 ? 1.352 0.561 6.029 1.00 83.23 6 A 1 ATOM 55 C CE2 . PHE A 1 6 ? -0.832 -0.421 6.131 1.00 82.62 6 A 1 ATOM 56 C CZ . PHE A 1 6 ? 0.479 -0.362 6.578 1.00 81.67 6 A 1 ATOM 57 N N . PHE A 1 7 ? -1.761 0.664 1.010 1.00 92.07 7 A 1 ATOM 58 C CA . PHE A 1 7 ? -2.281 -0.561 0.411 1.00 91.89 7 A 1 ATOM 59 C C . PHE A 1 7 ? -1.394 -1.004 -0.744 1.00 92.90 7 A 1 ATOM 60 O O . PHE A 1 7 ? -1.091 -2.187 -0.896 1.00 92.15 7 A 1 ATOM 61 C CB . PHE A 1 7 ? -3.703 -0.323 -0.089 1.00 91.58 7 A 1 ATOM 62 C CG . PHE A 1 7 ? -4.566 -1.553 0.041 1.00 89.65 7 A 1 ATOM 63 C CD1 . PHE A 1 7 ? -4.377 -2.640 -0.792 1.00 86.04 7 A 1 ATOM 64 C CD2 . PHE A 1 7 ? -5.563 -1.604 1.004 1.00 86.43 7 A 1 ATOM 65 C CE1 . PHE A 1 7 ? -5.165 -3.774 -0.669 1.00 85.22 7 A 1 ATOM 66 C CE2 . PHE A 1 7 ? -6.357 -2.733 1.128 1.00 84.78 7 A 1 ATOM 67 C CZ . PHE A 1 7 ? -6.157 -3.817 0.292 1.00 84.17 7 A 1 ATOM 68 N N . ALA A 1 8 ? -0.990 -0.047 -1.552 1.00 92.01 8 A 1 ATOM 69 C CA . ALA A 1 8 ? -0.134 -0.332 -2.703 1.00 92.46 8 A 1 ATOM 70 C C . ALA A 1 8 ? 1.228 -0.841 -2.243 1.00 93.10 8 A 1 ATOM 71 O O . ALA A 1 8 ? 1.786 -1.764 -2.829 1.00 91.75 8 A 1 ATOM 72 C CB . ALA A 1 8 ? 0.030 0.926 -3.543 1.00 92.27 8 A 1 ATOM 73 N N . LEU A 1 9 ? 1.742 -0.252 -1.193 1.00 91.69 9 A 1 ATOM 74 C CA . LEU A 1 9 ? 3.035 -0.648 -0.644 1.00 91.34 9 A 1 ATOM 75 C C . LEU A 1 9 ? 2.977 -2.071 -0.102 1.00 92.10 9 A 1 ATOM 76 O O . LEU A 1 9 ? 3.879 -2.874 -0.337 1.00 90.71 9 A 1 ATOM 77 C CB . LEU A 1 9 ? 3.434 0.318 0.473 1.00 91.00 9 A 1 ATOM 78 C CG . LEU A 1 9 ? 4.865 0.124 0.963 1.00 85.46 9 A 1 ATOM 79 C CD1 . LEU A 1 9 ? 5.820 1.007 0.170 1.00 81.88 9 A 1 ATOM 80 C CD2 . LEU A 1 9 ? 4.972 0.448 2.442 1.00 82.82 9 A 1 ATOM 81 N N . LEU A 1 10 ? 1.931 -2.376 0.619 1.00 92.01 10 A 1 ATOM 82 C CA . LEU A 1 10 ? 1.744 -3.705 1.193 1.00 91.85 10 A 1 ATOM 83 C C . LEU A 1 10 ? 1.592 -4.749 0.101 1.00 92.68 10 A 1 ATOM 84 O O . LEU A 1 10 ? 2.156 -5.841 0.188 1.00 91.70 10 A 1 ATOM 85 C CB . LEU A 1 10 ? 0.509 -3.708 2.091 1.00 91.25 10 A 1 ATOM 86 C CG . LEU A 1 10 ? 0.474 -4.884 3.057 1.00 85.42 10 A 1 ATOM 87 C CD1 . LEU A 1 10 ? 0.567 -4.393 4.495 1.00 80.85 10 A 1 ATOM 88 C CD2 . LEU A 1 10 ? -0.800 -5.693 2.865 1.00 81.81 10 A 1 ATOM 89 N N . CYS A 1 11 ? 0.836 -4.422 -0.923 1.00 91.41 11 A 1 ATOM 90 C CA . CYS A 1 11 ? 0.603 -5.327 -2.042 1.00 91.10 11 A 1 ATOM 91 C C . CYS A 1 11 ? 1.898 -5.576 -2.805 1.00 91.34 11 A 1 ATOM 92 O O . CYS A 1 11 ? 2.208 -6.703 -3.175 1.00 88.82 11 A 1 ATOM 93 C CB . CYS A 1 11 ? -0.453 -4.736 -2.975 1.00 88.51 11 A 1 ATOM 94 S SG . CYS A 1 11 ? -1.720 -5.929 -3.428 1.00 81.75 11 A 1 ATOM 95 N N . THR A 1 12 ? 2.639 -4.524 -3.035 1.00 92.40 12 A 1 ATOM 96 C CA . THR A 1 12 ? 3.902 -4.619 -3.773 1.00 91.70 12 A 1 ATOM 97 C C . THR A 1 12 ? 4.927 -5.430 -2.992 1.00 91.64 12 A 1 ATOM 98 O O . THR A 1 12 ? 5.642 -6.253 -3.560 1.00 88.66 12 A 1 ATOM 99 C CB . THR A 1 12 ? 4.445 -3.214 -4.054 1.00 89.69 12 A 1 ATOM 100 O OG1 . THR A 1 12 ? 3.575 -2.559 -4.966 1.00 82.48 12 A 1 ATOM 101 C CG2 . THR A 1 12 ? 5.830 -3.267 -4.677 1.00 81.08 12 A 1 ATOM 102 N N . SER A 1 13 ? 5.002 -5.207 -1.706 1.00 93.66 13 A 1 ATOM 103 C CA . SER A 1 13 ? 5.942 -5.915 -0.845 1.00 93.34 13 A 1 ATOM 104 C C . SER A 1 13 ? 5.600 -7.396 -0.755 1.00 93.56 13 A 1 ATOM 105 O O . SER A 1 13 ? 6.482 -8.250 -0.823 1.00 90.58 13 A 1 ATOM 106 C CB . SER A 1 13 ? 5.941 -5.299 0.548 1.00 91.38 13 A 1 ATOM 107 O OG . SER A 1 13 ? 7.079 -5.685 1.267 1.00 81.08 13 A 1 ATOM 108 N N . THR A 1 14 ? 4.340 -7.696 -0.593 1.00 91.73 14 A 1 ATOM 109 C CA . THR A 1 14 ? 3.874 -9.078 -0.486 1.00 91.28 14 A 1 ATOM 110 C C . THR A 1 14 ? 3.884 -9.788 -1.827 1.00 91.57 14 A 1 ATOM 111 O O . THR A 1 14 ? 4.383 -10.905 -1.946 1.00 88.79 14 A 1 ATOM 112 C CB . THR A 1 14 ? 2.464 -9.110 0.101 1.00 89.20 14 A 1 ATOM 113 O OG1 . THR A 1 14 ? 2.498 -8.566 1.418 1.00 83.32 14 A 1 ATOM 114 C CG2 . THR A 1 14 ? 1.944 -10.532 0.191 1.00 80.64 14 A 1 ATOM 115 N N . TYR A 1 15 ? 3.317 -9.140 -2.817 1.00 90.58 15 A 1 ATOM 116 C CA . TYR A 1 15 ? 3.240 -9.725 -4.155 1.00 89.09 15 A 1 ATOM 117 C C . TYR A 1 15 ? 4.587 -9.658 -4.860 1.00 88.97 15 A 1 ATOM 118 O O . TYR A 1 15 ? 4.969 -10.580 -5.577 1.00 85.59 15 A 1 ATOM 119 C CB . TYR A 1 15 ? 2.177 -8.989 -4.978 1.00 87.30 15 A 1 ATOM 120 C CG . TYR A 1 15 ? 0.788 -9.537 -4.745 1.00 81.63 15 A 1 ATOM 121 C CD1 . TYR A 1 15 ? 0.185 -9.451 -3.504 1.00 79.29 15 A 1 ATOM 122 C CD2 . TYR A 1 15 ? 0.094 -10.152 -5.780 1.00 79.42 15 A 1 ATOM 123 C CE1 . TYR A 1 15 ? -1.081 -9.963 -3.290 1.00 77.38 15 A 1 ATOM 124 C CE2 . TYR A 1 15 ? -1.181 -10.666 -5.576 1.00 78.99 15 A 1 ATOM 125 C CZ . TYR A 1 15 ? -1.760 -10.564 -4.329 1.00 78.45 15 A 1 ATOM 126 O OH . TYR A 1 15 ? -3.013 -11.070 -4.122 1.00 75.70 15 A 1 ATOM 127 N N . ALA A 1 16 ? 5.302 -8.571 -4.638 1.00 90.10 16 A 1 ATOM 128 C CA . ALA A 1 16 ? 6.612 -8.337 -5.254 1.00 87.97 16 A 1 ATOM 129 C C . ALA A 1 16 ? 6.485 -8.125 -6.755 1.00 85.46 16 A 1 ATOM 130 O O . ALA A 1 16 ? 6.404 -9.114 -7.500 1.00 79.54 16 A 1 ATOM 131 C CB . ALA A 1 16 ? 7.556 -9.492 -4.973 1.00 83.04 16 A 1 ATOM 132 O OXT . ALA A 1 16 ? 6.466 -6.950 -7.170 1.00 74.50 16 A 1 #