# 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_spkb36269 # _entry.id spkb36269 # 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 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" "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 LEU 2 1 n LYS 3 1 n LYS 4 1 n VAL 5 1 n TYR 6 1 n TYR 7 1 n PHE 8 1 n LEU 9 1 n ILE 10 1 n PHE 11 1 n LEU 12 1 n PHE 13 1 n ILE 14 1 n VAL 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 @ 2025-07-02 23:10:53)" _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 94.81 _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 91.78 1 1 A LEU 2 2 92.60 1 2 A LYS 3 2 90.77 1 3 A LYS 4 2 92.19 1 4 A VAL 5 2 97.10 1 5 A TYR 6 2 94.62 1 6 A TYR 7 2 95.86 1 7 A PHE 8 2 95.64 1 8 A LEU 9 2 95.82 1 9 A ILE 10 2 96.61 1 10 A PHE 11 2 95.18 1 11 A LEU 12 2 96.26 1 12 A PHE 13 2 95.16 1 13 A ILE 14 2 96.96 1 14 A VAL 15 2 96.44 1 15 A ALA 16 2 94.03 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 LEU . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n LYS . 4 A 4 A 5 1 n VAL . 5 A 5 A 6 1 n TYR . 6 A 6 A 7 1 n TYR . 7 A 7 A 8 1 n PHE . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n ILE . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n ILE . 14 A 14 A 15 1 n VAL . 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 ? -11.796 0.680 10.099 1.00 96.20 1 A 1 ATOM 2 C CA . MET A 1 1 ? -10.623 1.570 9.954 1.00 96.88 1 A 1 ATOM 3 C C . MET A 1 1 ? -10.002 1.415 8.569 1.00 97.11 1 A 1 ATOM 4 O O . MET A 1 1 ? -9.921 0.301 8.056 1.00 95.58 1 A 1 ATOM 5 C CB . MET A 1 1 ? -9.581 1.232 11.017 1.00 94.82 1 A 1 ATOM 6 C CG . MET A 1 1 ? -10.055 1.600 12.416 1.00 87.86 1 A 1 ATOM 7 S SD . MET A 1 1 ? -8.869 1.136 13.672 1.00 85.84 1 A 1 ATOM 8 C CE . MET A 1 1 ? -9.673 1.781 15.131 1.00 79.98 1 A 1 ATOM 9 N N . LEU A 1 2 ? -9.571 2.519 7.969 1.00 95.91 2 A 1 ATOM 10 C CA . LEU A 1 2 ? -8.982 2.514 6.635 1.00 96.70 2 A 1 ATOM 11 C C . LEU A 1 2 ? -7.457 2.358 6.677 1.00 97.21 2 A 1 ATOM 12 O O . LEU A 1 2 ? -6.796 2.438 5.642 1.00 96.39 2 A 1 ATOM 13 C CB . LEU A 1 2 ? -9.363 3.813 5.925 1.00 95.39 2 A 1 ATOM 14 C CG . LEU A 1 2 ? -9.761 3.595 4.469 1.00 89.73 2 A 1 ATOM 15 C CD1 . LEU A 1 2 ? -11.252 3.279 4.382 1.00 85.70 2 A 1 ATOM 16 C CD2 . LEU A 1 2 ? -9.439 4.830 3.647 1.00 83.80 2 A 1 ATOM 17 N N . LYS A 1 3 ? -6.909 2.136 7.854 1.00 97.39 3 A 1 ATOM 18 C CA . LYS A 1 3 ? -5.459 2.015 8.024 1.00 97.65 3 A 1 ATOM 19 C C . LYS A 1 3 ? -4.898 0.831 7.238 1.00 97.88 3 A 1 ATOM 20 O O . LYS A 1 3 ? -3.765 0.884 6.760 1.00 97.04 3 A 1 ATOM 21 C CB . LYS A 1 3 ? -5.114 1.873 9.511 1.00 96.65 3 A 1 ATOM 22 C CG . LYS A 1 3 ? -4.939 3.221 10.214 1.00 90.38 3 A 1 ATOM 23 C CD . LYS A 1 3 ? -6.273 3.884 10.532 1.00 86.89 3 A 1 ATOM 24 C CE . LYS A 1 3 ? -6.072 5.170 11.323 1.00 80.03 3 A 1 ATOM 25 N NZ . LYS A 1 3 ? -7.359 5.845 11.590 1.00 73.06 3 A 1 ATOM 26 N N . LYS A 1 4 ? -5.698 -0.210 7.081 1.00 97.80 4 A 1 ATOM 27 C CA . LYS A 1 4 ? -5.260 -1.398 6.348 1.00 97.99 4 A 1 ATOM 28 C C . LYS A 1 4 ? -4.923 -1.049 4.898 1.00 98.23 4 A 1 ATOM 29 O O . LYS A 1 4 ? -3.975 -1.593 4.334 1.00 97.67 4 A 1 ATOM 30 C CB . LYS A 1 4 ? -6.359 -2.464 6.399 1.00 97.47 4 A 1 ATOM 31 C CG . LYS A 1 4 ? -6.564 -3.031 7.794 1.00 93.26 4 A 1 ATOM 32 C CD . LYS A 1 4 ? -5.960 -4.421 7.924 1.00 88.52 4 A 1 ATOM 33 C CE . LYS A 1 4 ? -6.175 -4.991 9.317 1.00 83.49 4 A 1 ATOM 34 N NZ . LYS A 1 4 ? -6.032 -6.467 9.342 1.00 75.26 4 A 1 ATOM 35 N N . VAL A 1 5 ? -5.685 -0.147 4.314 1.00 97.94 5 A 1 ATOM 36 C CA . VAL A 1 5 ? -5.461 0.274 2.933 1.00 98.09 5 A 1 ATOM 37 C C . VAL A 1 5 ? -4.119 0.996 2.804 1.00 98.28 5 A 1 ATOM 38 O O . VAL A 1 5 ? -3.428 0.862 1.793 1.00 97.96 5 A 1 ATOM 39 C CB . VAL A 1 5 ? -6.609 1.180 2.451 1.00 97.67 5 A 1 ATOM 40 C CG1 . VAL A 1 5 ? -6.427 1.556 0.994 1.00 94.97 5 A 1 ATOM 41 C CG2 . VAL A 1 5 ? -7.948 0.485 2.642 1.00 94.80 5 A 1 ATOM 42 N N . TYR A 1 6 ? -3.748 1.738 3.825 1.00 97.98 6 A 1 ATOM 43 C CA . TYR A 1 6 ? -2.481 2.466 3.822 1.00 98.00 6 A 1 ATOM 44 C C . TYR A 1 6 ? -1.304 1.500 3.772 1.00 98.07 6 A 1 ATOM 45 O O . TYR A 1 6 ? -0.346 1.719 3.033 1.00 97.85 6 A 1 ATOM 46 C CB . TYR A 1 6 ? -2.387 3.353 5.066 1.00 97.71 6 A 1 ATOM 47 C CG . TYR A 1 6 ? -2.468 4.830 4.736 1.00 94.82 6 A 1 ATOM 48 C CD1 . TYR A 1 6 ? -3.665 5.406 4.322 1.00 91.48 6 A 1 ATOM 49 C CD2 . TYR A 1 6 ? -1.340 5.630 4.835 1.00 93.18 6 A 1 ATOM 50 C CE1 . TYR A 1 6 ? -3.740 6.758 4.014 1.00 91.58 6 A 1 ATOM 51 C CE2 . TYR A 1 6 ? -1.404 6.991 4.530 1.00 92.58 6 A 1 ATOM 52 C CZ . TYR A 1 6 ? -2.608 7.548 4.121 1.00 92.68 6 A 1 ATOM 53 O OH . TYR A 1 6 ? -2.668 8.882 3.819 1.00 89.47 6 A 1 ATOM 54 N N . TYR A 1 7 ? -1.392 0.434 4.539 1.00 98.09 7 A 1 ATOM 55 C CA . TYR A 1 7 ? -0.324 -0.565 4.552 1.00 98.14 7 A 1 ATOM 56 C C . TYR A 1 7 ? -0.212 -1.251 3.190 1.00 98.14 7 A 1 ATOM 57 O O . TYR A 1 7 ? 0.886 -1.566 2.732 1.00 97.81 7 A 1 ATOM 58 C CB . TYR A 1 7 ? -0.597 -1.603 5.640 1.00 97.92 7 A 1 ATOM 59 C CG . TYR A 1 7 ? -0.471 -1.037 7.041 1.00 96.54 7 A 1 ATOM 60 C CD1 . TYR A 1 7 ? 0.732 -0.502 7.484 1.00 93.99 7 A 1 ATOM 61 C CD2 . TYR A 1 7 ? -1.559 -1.049 7.908 1.00 95.18 7 A 1 ATOM 62 C CE1 . TYR A 1 7 ? 0.854 0.016 8.771 1.00 93.87 7 A 1 ATOM 63 C CE2 . TYR A 1 7 ? -1.445 -0.533 9.200 1.00 94.17 7 A 1 ATOM 64 C CZ . TYR A 1 7 ? -0.235 -0.006 9.620 1.00 94.51 7 A 1 ATOM 65 O OH . TYR A 1 7 ? -0.125 0.503 10.891 1.00 91.93 7 A 1 ATOM 66 N N . PHE A 1 8 ? -1.347 -1.460 2.544 1.00 98.16 8 A 1 ATOM 67 C CA . PHE A 1 8 ? -1.371 -2.079 1.221 1.00 98.14 8 A 1 ATOM 68 C C . PHE A 1 8 ? -0.735 -1.153 0.185 1.00 98.22 8 A 1 ATOM 69 O O . PHE A 1 8 ? 0.013 -1.606 -0.685 1.00 97.90 8 A 1 ATOM 70 C CB . PHE A 1 8 ? -2.816 -2.399 0.838 1.00 97.92 8 A 1 ATOM 71 C CG . PHE A 1 8 ? -2.913 -3.541 -0.144 1.00 96.68 8 A 1 ATOM 72 C CD1 . PHE A 1 8 ? -2.708 -4.847 0.271 1.00 93.73 8 A 1 ATOM 73 C CD2 . PHE A 1 8 ? -3.204 -3.291 -1.477 1.00 94.38 8 A 1 ATOM 74 C CE1 . PHE A 1 8 ? -2.792 -5.899 -0.632 1.00 92.43 8 A 1 ATOM 75 C CE2 . PHE A 1 8 ? -3.287 -4.341 -2.389 1.00 92.49 8 A 1 ATOM 76 C CZ . PHE A 1 8 ? -3.083 -5.643 -1.962 1.00 91.95 8 A 1 ATOM 77 N N . LEU A 1 9 ? -1.037 0.132 0.294 1.00 98.15 9 A 1 ATOM 78 C CA . LEU A 1 9 ? -0.472 1.119 -0.625 1.00 98.07 9 A 1 ATOM 79 C C . LEU A 1 9 ? 1.041 1.205 -0.458 1.00 98.20 9 A 1 ATOM 80 O O . LEU A 1 9 ? 1.777 1.264 -1.443 1.00 98.07 9 A 1 ATOM 81 C CB . LEU A 1 9 ? -1.115 2.484 -0.357 1.00 97.78 9 A 1 ATOM 82 C CG . LEU A 1 9 ? -2.455 2.682 -1.068 1.00 92.72 9 A 1 ATOM 83 C CD1 . LEU A 1 9 ? -3.267 3.769 -0.392 1.00 90.87 9 A 1 ATOM 84 C CD2 . LEU A 1 9 ? -2.216 3.053 -2.532 1.00 92.67 9 A 1 ATOM 85 N N . ILE A 1 10 ? 1.493 1.205 0.783 1.00 98.14 10 A 1 ATOM 86 C CA . ILE A 1 10 ? 2.923 1.271 1.072 1.00 98.04 10 A 1 ATOM 87 C C . ILE A 1 10 ? 3.618 0.014 0.546 1.00 98.11 10 A 1 ATOM 88 O O . ILE A 1 10 ? 4.713 0.086 -0.017 1.00 97.74 10 A 1 ATOM 89 C CB . ILE A 1 10 ? 3.151 1.441 2.587 1.00 97.71 10 A 1 ATOM 90 C CG1 . ILE A 1 10 ? 2.641 2.811 3.060 1.00 95.82 10 A 1 ATOM 91 C CG2 . ILE A 1 10 ? 4.643 1.305 2.916 1.00 95.84 10 A 1 ATOM 92 C CD1 . ILE A 1 10 ? 2.357 2.860 4.545 1.00 91.50 10 A 1 ATOM 93 N N . PHE A 1 11 ? 2.972 -1.120 0.715 1.00 98.23 11 A 1 ATOM 94 C CA . PHE A 1 11 ? 3.516 -2.388 0.240 1.00 98.14 11 A 1 ATOM 95 C C . PHE A 1 11 ? 3.692 -2.360 -1.278 1.00 98.23 11 A 1 ATOM 96 O O . PHE A 1 11 ? 4.721 -2.794 -1.795 1.00 97.76 11 A 1 ATOM 97 C CB . PHE A 1 11 ? 2.577 -3.524 0.651 1.00 97.79 11 A 1 ATOM 98 C CG . PHE A 1 11 ? 3.031 -4.868 0.150 1.00 95.81 11 A 1 ATOM 99 C CD1 . PHE A 1 11 ? 4.186 -5.452 0.646 1.00 92.89 11 A 1 ATOM 100 C CD2 . PHE A 1 11 ? 2.297 -5.535 -0.823 1.00 93.35 11 A 1 ATOM 101 C CE1 . PHE A 1 11 ? 4.606 -6.692 0.181 1.00 91.48 11 A 1 ATOM 102 C CE2 . PHE A 1 11 ? 2.717 -6.777 -1.294 1.00 91.92 11 A 1 ATOM 103 C CZ . PHE A 1 11 ? 3.871 -7.351 -0.788 1.00 91.41 11 A 1 ATOM 104 N N . LEU A 1 12 ? 2.693 -1.846 -1.979 1.00 98.28 12 A 1 ATOM 105 C CA . LEU A 1 12 ? 2.758 -1.742 -3.436 1.00 98.17 12 A 1 ATOM 106 C C . LEU A 1 12 ? 3.842 -0.758 -3.866 1.00 98.29 12 A 1 ATOM 107 O O . LEU A 1 12 ? 4.549 -0.992 -4.846 1.00 97.92 12 A 1 ATOM 108 C CB . LEU A 1 12 ? 1.392 -1.297 -3.967 1.00 97.77 12 A 1 ATOM 109 C CG . LEU A 1 12 ? 0.525 -2.457 -4.449 1.00 94.67 12 A 1 ATOM 110 C CD1 . LEU A 1 12 ? -0.951 -2.119 -4.312 1.00 92.19 12 A 1 ATOM 111 C CD2 . LEU A 1 12 ? 0.851 -2.783 -5.898 1.00 92.83 12 A 1 ATOM 112 N N . PHE A 1 13 ? 3.974 0.318 -3.133 1.00 98.21 13 A 1 ATOM 113 C CA . PHE A 1 13 ? 4.970 1.345 -3.425 1.00 98.21 13 A 1 ATOM 114 C C . PHE A 1 13 ? 6.387 0.794 -3.277 1.00 98.36 13 A 1 ATOM 115 O O . PHE A 1 13 ? 7.276 1.150 -4.048 1.00 97.65 13 A 1 ATOM 116 C CB . PHE A 1 13 ? 4.754 2.534 -2.490 1.00 97.76 13 A 1 ATOM 117 C CG . PHE A 1 13 ? 5.730 3.653 -2.740 1.00 95.16 13 A 1 ATOM 118 C CD1 . PHE A 1 13 ? 5.726 4.342 -3.944 1.00 92.48 13 A 1 ATOM 119 C CD2 . PHE A 1 13 ? 6.648 4.007 -1.763 1.00 92.94 13 A 1 ATOM 120 C CE1 . PHE A 1 13 ? 6.631 5.371 -4.174 1.00 91.80 13 A 1 ATOM 121 C CE2 . PHE A 1 13 ? 7.556 5.040 -1.989 1.00 92.21 13 A 1 ATOM 122 C CZ . PHE A 1 13 ? 7.546 5.720 -3.196 1.00 91.95 13 A 1 ATOM 123 N N . ILE A 1 14 ? 6.592 -0.054 -2.298 1.00 98.32 14 A 1 ATOM 124 C CA . ILE A 1 14 ? 7.907 -0.642 -2.060 1.00 98.32 14 A 1 ATOM 125 C C . ILE A 1 14 ? 8.189 -1.771 -3.049 1.00 98.40 14 A 1 ATOM 126 O O . ILE A 1 14 ? 9.316 -1.917 -3.528 1.00 97.89 14 A 1 ATOM 127 C CB . ILE A 1 14 ? 8.004 -1.155 -0.610 1.00 97.91 14 A 1 ATOM 128 C CG1 . ILE A 1 14 ? 7.931 0.013 0.379 1.00 96.18 14 A 1 ATOM 129 C CG2 . ILE A 1 14 ? 9.309 -1.927 -0.409 1.00 95.64 14 A 1 ATOM 130 C CD1 . ILE A 1 14 ? 7.570 -0.424 1.779 1.00 93.05 14 A 1 ATOM 131 N N . VAL A 1 15 ? 7.179 -2.555 -3.348 1.00 98.28 15 A 1 ATOM 132 C CA . VAL A 1 15 ? 7.324 -3.685 -4.266 1.00 98.09 15 A 1 ATOM 133 C C . VAL A 1 15 ? 7.507 -3.210 -5.707 1.00 98.19 15 A 1 ATOM 134 O O . VAL A 1 15 ? 8.272 -3.813 -6.468 1.00 97.44 15 A 1 ATOM 135 C CB . VAL A 1 15 ? 6.106 -4.631 -4.153 1.00 97.22 15 A 1 ATOM 136 C CG1 . VAL A 1 15 ? 6.134 -5.692 -5.237 1.00 93.16 15 A 1 ATOM 137 C CG2 . VAL A 1 15 ? 6.086 -5.304 -2.791 1.00 92.71 15 A 1 ATOM 138 N N . ALA A 1 16 ? 6.817 -2.159 -6.076 1.00 97.10 16 A 1 ATOM 139 C CA . ALA A 1 16 ? 6.875 -1.633 -7.436 1.00 96.45 16 A 1 ATOM 140 C C . ALA A 1 16 ? 7.991 -0.601 -7.570 1.00 95.71 16 A 1 ATOM 141 O O . ALA A 1 16 ? 7.905 0.455 -6.918 1.00 93.58 16 A 1 ATOM 142 C CB . ALA A 1 16 ? 5.530 -1.035 -7.825 1.00 94.87 16 A 1 ATOM 143 O OXT . ALA A 1 16 ? 8.934 -0.840 -8.327 1.00 86.48 16 A 1 #