# 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_spkb21658 # _entry.id spkb21658 # 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" "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" "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 GLN 2 1 n LYS 3 1 n LEU 4 1 n GLN 5 1 n ILE 6 1 n SER 7 1 n VAL 8 1 n TYR 9 1 n ILE 10 1 n TYR 11 1 n LEU 12 1 n PHE 13 1 n VAL 14 1 n LEU 15 1 n ILE 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 @ 2025-07-04 06:14:08)" _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 93.20 _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 86.15 1 1 A GLN 2 2 85.24 1 2 A LYS 3 2 87.85 1 3 A LEU 4 2 92.54 1 4 A GLN 5 2 90.48 1 5 A ILE 6 2 94.96 1 6 A SER 7 2 95.03 1 7 A VAL 8 2 96.64 1 8 A TYR 9 2 92.98 1 9 A ILE 10 2 95.81 1 10 A TYR 11 2 94.00 1 11 A LEU 12 2 94.92 1 12 A PHE 13 2 94.56 1 13 A VAL 14 2 97.57 1 14 A LEU 15 2 96.20 1 15 A ILE 16 2 96.80 1 16 A LEU 17 2 95.03 1 17 A ALA 18 2 93.60 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 GLN . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n GLN . 5 A 5 A 6 1 n ILE . 6 A 6 A 7 1 n SER . 7 A 7 A 8 1 n VAL . 8 A 8 A 9 1 n TYR . 9 A 9 A 10 1 n ILE . 10 A 10 A 11 1 n TYR . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n ILE . 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 ? -3.857 7.458 12.909 1.00 92.48 1 A 1 ATOM 2 C CA . MET A 1 1 ? -2.679 6.821 12.308 1.00 92.85 1 A 1 ATOM 3 C C . MET A 1 1 ? -2.878 6.626 10.808 1.00 92.92 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.031 7.009 10.006 1.00 89.70 1 A 1 ATOM 5 C CB . MET A 1 1 ? -2.411 5.466 12.974 1.00 89.13 1 A 1 ATOM 6 C CG . MET A 1 1 ? -2.205 5.586 14.473 1.00 84.14 1 A 1 ATOM 7 S SD . MET A 1 1 ? -2.828 4.142 15.322 1.00 78.30 1 A 1 ATOM 8 C CE . MET A 1 1 ? -3.155 4.830 16.927 1.00 69.71 1 A 1 ATOM 9 N N . GLN A 1 2 ? -4.013 6.032 10.449 1.00 93.18 2 A 1 ATOM 10 C CA . GLN A 1 2 ? -4.335 5.824 9.040 1.00 94.92 2 A 1 ATOM 11 C C . GLN A 1 2 ? -3.233 5.068 8.297 1.00 95.38 2 A 1 ATOM 12 O O . GLN A 1 2 ? -2.990 5.312 7.111 1.00 92.40 2 A 1 ATOM 13 C CB . GLN A 1 2 ? -4.587 7.171 8.362 1.00 92.31 2 A 1 ATOM 14 C CG . GLN A 1 2 ? -5.905 7.800 8.771 1.00 80.03 2 A 1 ATOM 15 C CD . GLN A 1 2 ? -5.704 8.912 9.763 1.00 77.52 2 A 1 ATOM 16 O OE1 . GLN A 1 2 ? -5.504 8.678 10.941 1.00 73.82 2 A 1 ATOM 17 N NE2 . GLN A 1 2 ? -5.748 10.150 9.294 1.00 67.63 2 A 1 ATOM 18 N N . LYS A 1 3 ? -2.576 4.168 8.993 1.00 94.60 3 A 1 ATOM 19 C CA . LYS A 1 3 ? -1.490 3.391 8.389 1.00 95.80 3 A 1 ATOM 20 C C . LYS A 1 3 ? -2.046 2.381 7.383 1.00 96.39 3 A 1 ATOM 21 O O . LYS A 1 3 ? -1.385 2.060 6.397 1.00 95.41 3 A 1 ATOM 22 C CB . LYS A 1 3 ? -0.696 2.669 9.483 1.00 94.45 3 A 1 ATOM 23 C CG . LYS A 1 3 ? 0.103 3.612 10.378 1.00 86.86 3 A 1 ATOM 24 C CD . LYS A 1 3 ? 1.402 4.015 9.725 1.00 83.15 3 A 1 ATOM 25 C CE . LYS A 1 3 ? 2.159 5.009 10.587 1.00 75.65 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? 3.265 4.361 11.319 1.00 68.36 3 A 1 ATOM 27 N N . LEU A 1 4 ? -3.241 1.887 7.645 1.00 95.75 4 A 1 ATOM 28 C CA . LEU A 1 4 ? -3.881 0.917 6.762 1.00 96.23 4 A 1 ATOM 29 C C . LEU A 1 4 ? -4.134 1.511 5.381 1.00 96.76 4 A 1 ATOM 30 O O . LEU A 1 4 ? -3.907 0.854 4.366 1.00 96.32 4 A 1 ATOM 31 C CB . LEU A 1 4 ? -5.198 0.434 7.385 1.00 95.80 4 A 1 ATOM 32 C CG . LEU A 1 4 ? -5.096 -0.916 8.094 1.00 90.14 4 A 1 ATOM 33 C CD1 . LEU A 1 4 ? -4.578 -0.743 9.521 1.00 84.59 4 A 1 ATOM 34 C CD2 . LEU A 1 4 ? -6.452 -1.606 8.120 1.00 84.71 4 A 1 ATOM 35 N N . GLN A 1 5 ? -4.601 2.744 5.363 1.00 96.72 5 A 1 ATOM 36 C CA . GLN A 1 5 ? -4.898 3.430 4.106 1.00 97.24 5 A 1 ATOM 37 C C . GLN A 1 5 ? -3.642 3.574 3.252 1.00 97.14 5 A 1 ATOM 38 O O . GLN A 1 5 ? -3.651 3.282 2.057 1.00 96.56 5 A 1 ATOM 39 C CB . GLN A 1 5 ? -5.498 4.802 4.405 1.00 96.67 5 A 1 ATOM 40 C CG . GLN A 1 5 ? -6.848 5.015 3.741 1.00 89.15 5 A 1 ATOM 41 C CD . GLN A 1 5 ? -6.705 5.594 2.352 1.00 85.49 5 A 1 ATOM 42 O OE1 . GLN A 1 5 ? -6.870 4.906 1.357 1.00 80.06 5 A 1 ATOM 43 N NE2 . GLN A 1 5 ? -6.402 6.874 2.274 1.00 75.33 5 A 1 ATOM 44 N N . ILE A 1 6 ? -2.570 4.008 3.877 1.00 96.73 6 A 1 ATOM 45 C CA . ILE A 1 6 ? -1.299 4.195 3.179 1.00 96.75 6 A 1 ATOM 46 C C . ILE A 1 6 ? -0.745 2.856 2.706 1.00 96.84 6 A 1 ATOM 47 O O . ILE A 1 6 ? -0.209 2.748 1.605 1.00 96.59 6 A 1 ATOM 48 C CB . ILE A 1 6 ? -0.277 4.899 4.095 1.00 96.79 6 A 1 ATOM 49 C CG1 . ILE A 1 6 ? -0.866 6.197 4.672 1.00 94.25 6 A 1 ATOM 50 C CG2 . ILE A 1 6 ? 1.024 5.183 3.339 1.00 93.33 6 A 1 ATOM 51 C CD1 . ILE A 1 6 ? -1.277 7.200 3.609 1.00 88.38 6 A 1 ATOM 52 N N . SER A 1 7 ? -0.866 1.854 3.537 1.00 96.64 7 A 1 ATOM 53 C CA . SER A 1 7 ? -0.368 0.521 3.217 1.00 96.90 7 A 1 ATOM 54 C C . SER A 1 7 ? -1.049 -0.034 1.970 1.00 97.15 7 A 1 ATOM 55 O O . SER A 1 7 ? -0.401 -0.655 1.128 1.00 96.75 7 A 1 ATOM 56 C CB . SER A 1 7 ? -0.595 -0.412 4.403 1.00 96.35 7 A 1 ATOM 57 O OG . SER A 1 7 ? 0.187 -1.569 4.273 1.00 86.40 7 A 1 ATOM 58 N N . VAL A 1 8 ? -2.337 0.202 1.859 1.00 97.45 8 A 1 ATOM 59 C CA . VAL A 1 8 ? -3.112 -0.273 0.710 1.00 97.64 8 A 1 ATOM 60 C C . VAL A 1 8 ? -2.627 0.396 -0.574 1.00 97.83 8 A 1 ATOM 61 O O . VAL A 1 8 ? -2.536 -0.248 -1.623 1.00 97.61 8 A 1 ATOM 62 C CB . VAL A 1 8 ? -4.616 -0.010 0.920 1.00 97.36 8 A 1 ATOM 63 C CG1 . VAL A 1 8 ? -5.412 -0.377 -0.322 1.00 94.48 8 A 1 ATOM 64 C CG2 . VAL A 1 8 ? -5.130 -0.810 2.109 1.00 94.11 8 A 1 ATOM 65 N N . TYR A 1 9 ? -2.315 1.665 -0.479 1.00 96.92 9 A 1 ATOM 66 C CA . TYR A 1 9 ? -1.833 2.410 -1.640 1.00 97.03 9 A 1 ATOM 67 C C . TYR A 1 9 ? -0.494 1.857 -2.126 1.00 97.37 9 A 1 ATOM 68 O O . TYR A 1 9 ? -0.278 1.686 -3.325 1.00 97.39 9 A 1 ATOM 69 C CB . TYR A 1 9 ? -1.680 3.890 -1.286 1.00 96.70 9 A 1 ATOM 70 C CG . TYR A 1 9 ? -2.941 4.686 -1.556 1.00 92.12 9 A 1 ATOM 71 C CD1 . TYR A 1 9 ? -3.405 4.854 -2.858 1.00 89.52 9 A 1 ATOM 72 C CD2 . TYR A 1 9 ? -3.644 5.271 -0.513 1.00 90.90 9 A 1 ATOM 73 C CE1 . TYR A 1 9 ? -4.559 5.591 -3.109 1.00 89.12 9 A 1 ATOM 74 C CE2 . TYR A 1 9 ? -4.800 6.011 -0.756 1.00 90.43 9 A 1 ATOM 75 C CZ . TYR A 1 9 ? -5.250 6.164 -2.056 1.00 90.26 9 A 1 ATOM 76 O OH . TYR A 1 9 ? -6.387 6.891 -2.302 1.00 88.05 9 A 1 ATOM 77 N N . ILE A 1 10 ? 0.385 1.576 -1.182 1.00 97.19 10 A 1 ATOM 78 C CA . ILE A 1 10 ? 1.702 1.035 -1.514 1.00 97.35 10 A 1 ATOM 79 C C . ILE A 1 10 ? 1.569 -0.365 -2.107 1.00 97.60 10 A 1 ATOM 80 O O . ILE A 1 10 ? 2.259 -0.718 -3.062 1.00 97.40 10 A 1 ATOM 81 C CB . ILE A 1 10 ? 2.603 1.006 -0.263 1.00 97.12 10 A 1 ATOM 82 C CG1 . ILE A 1 10 ? 2.693 2.400 0.379 1.00 95.11 10 A 1 ATOM 83 C CG2 . ILE A 1 10 ? 4.003 0.491 -0.620 1.00 94.63 10 A 1 ATOM 84 C CD1 . ILE A 1 10 ? 3.298 3.449 -0.546 1.00 90.12 10 A 1 ATOM 85 N N . TYR A 1 11 ? 0.695 -1.149 -1.531 1.00 97.41 11 A 1 ATOM 86 C CA . TYR A 1 11 ? 0.475 -2.518 -1.992 1.00 97.46 11 A 1 ATOM 87 C C . TYR A 1 11 ? -0.026 -2.521 -3.435 1.00 97.78 11 A 1 ATOM 88 O O . TYR A 1 11 ? 0.453 -3.295 -4.267 1.00 97.53 11 A 1 ATOM 89 C CB . TYR A 1 11 ? -0.540 -3.209 -1.084 1.00 97.05 11 A 1 ATOM 90 C CG . TYR A 1 11 ? -0.215 -4.668 -0.841 1.00 94.26 11 A 1 ATOM 91 C CD1 . TYR A 1 11 ? -0.264 -5.596 -1.874 1.00 91.38 11 A 1 ATOM 92 C CD2 . TYR A 1 11 ? 0.134 -5.108 0.434 1.00 92.18 11 A 1 ATOM 93 C CE1 . TYR A 1 11 ? 0.036 -6.931 -1.647 1.00 90.41 11 A 1 ATOM 94 C CE2 . TYR A 1 11 ? 0.430 -6.446 0.670 1.00 91.44 11 A 1 ATOM 95 C CZ . TYR A 1 11 ? 0.380 -7.350 -0.375 1.00 91.41 11 A 1 ATOM 96 O OH . TYR A 1 11 ? 0.672 -8.674 -0.152 1.00 89.74 11 A 1 ATOM 97 N N . LEU A 1 12 ? -0.981 -1.650 -3.710 1.00 97.45 12 A 1 ATOM 98 C CA . LEU A 1 12 ? -1.532 -1.540 -5.059 1.00 97.53 12 A 1 ATOM 99 C C . LEU A 1 12 ? -0.475 -1.063 -6.046 1.00 97.83 12 A 1 ATOM 100 O O . LEU A 1 12 ? -0.395 -1.561 -7.171 1.00 97.78 12 A 1 ATOM 101 C CB . LEU A 1 12 ? -2.714 -0.569 -5.047 1.00 97.26 12 A 1 ATOM 102 C CG . LEU A 1 12 ? -4.064 -1.261 -4.876 1.00 91.67 12 A 1 ATOM 103 C CD1 . LEU A 1 12 ? -5.062 -0.340 -4.202 1.00 88.68 12 A 1 ATOM 104 C CD2 . LEU A 1 12 ? -4.595 -1.690 -6.244 1.00 91.16 12 A 1 ATOM 105 N N . PHE A 1 13 ? 0.321 -0.110 -5.623 1.00 97.64 13 A 1 ATOM 106 C CA . PHE A 1 13 ? 1.382 0.441 -6.464 1.00 97.64 13 A 1 ATOM 107 C C . PHE A 1 13 ? 2.399 -0.633 -6.828 1.00 97.98 13 A 1 ATOM 108 O O . PHE A 1 13 ? 2.812 -0.744 -7.979 1.00 97.69 13 A 1 ATOM 109 C CB . PHE A 1 13 ? 2.066 1.594 -5.732 1.00 97.18 13 A 1 ATOM 110 C CG . PHE A 1 13 ? 2.759 2.543 -6.669 1.00 94.83 13 A 1 ATOM 111 C CD1 . PHE A 1 13 ? 2.022 3.426 -7.448 1.00 91.87 13 A 1 ATOM 112 C CD2 . PHE A 1 13 ? 4.142 2.549 -6.760 1.00 92.84 13 A 1 ATOM 113 C CE1 . PHE A 1 13 ? 2.658 4.301 -8.313 1.00 90.89 13 A 1 ATOM 114 C CE2 . PHE A 1 13 ? 4.785 3.425 -7.629 1.00 91.04 13 A 1 ATOM 115 C CZ . PHE A 1 13 ? 4.040 4.301 -8.407 1.00 90.59 13 A 1 ATOM 116 N N . VAL A 1 14 ? 2.793 -1.415 -5.845 1.00 98.17 14 A 1 ATOM 117 C CA . VAL A 1 14 ? 3.764 -2.488 -6.061 1.00 98.30 14 A 1 ATOM 118 C C . VAL A 1 14 ? 3.152 -3.614 -6.885 1.00 98.49 14 A 1 ATOM 119 O O . VAL A 1 14 ? 3.832 -4.220 -7.716 1.00 98.14 14 A 1 ATOM 120 C CB . VAL A 1 14 ? 4.282 -3.034 -4.720 1.00 97.85 14 A 1 ATOM 121 C CG1 . VAL A 1 14 ? 5.248 -4.187 -4.943 1.00 96.11 14 A 1 ATOM 122 C CG2 . VAL A 1 14 ? 4.974 -1.933 -3.932 1.00 95.96 14 A 1 ATOM 123 N N . LEU A 1 15 ? 1.891 -3.894 -6.645 1.00 98.33 15 A 1 ATOM 124 C CA . LEU A 1 15 ? 1.184 -4.954 -7.360 1.00 98.26 15 A 1 ATOM 125 C C . LEU A 1 15 ? 1.123 -4.662 -8.855 1.00 98.32 15 A 1 ATOM 126 O O . LEU A 1 15 ? 1.373 -5.542 -9.678 1.00 97.91 15 A 1 ATOM 127 C CB . LEU A 1 15 ? -0.231 -5.105 -6.799 1.00 97.99 15 A 1 ATOM 128 C CG . LEU A 1 15 ? -0.752 -6.537 -6.849 1.00 94.76 15 A 1 ATOM 129 C CD1 . LEU A 1 15 ? -0.432 -7.262 -5.548 1.00 91.55 15 A 1 ATOM 130 C CD2 . LEU A 1 15 ? -2.250 -6.546 -7.098 1.00 92.52 15 A 1 ATOM 131 N N . ILE A 1 16 ? 0.791 -3.440 -9.194 1.00 98.13 16 A 1 ATOM 132 C CA . ILE A 1 16 ? 0.695 -3.032 -10.592 1.00 98.09 16 A 1 ATOM 133 C C . ILE A 1 16 ? 2.077 -2.856 -11.210 1.00 98.13 16 A 1 ATOM 134 O O . ILE A 1 16 ? 2.286 -3.161 -12.387 1.00 97.60 16 A 1 ATOM 135 C CB . ILE A 1 16 ? -0.109 -1.723 -10.716 1.00 97.76 16 A 1 ATOM 136 C CG1 . ILE A 1 16 ? -1.535 -1.917 -10.197 1.00 96.24 16 A 1 ATOM 137 C CG2 . ILE A 1 16 ? -0.147 -1.266 -12.176 1.00 95.48 16 A 1 ATOM 138 C CD1 . ILE A 1 16 ? -2.164 -0.621 -9.746 1.00 92.96 16 A 1 ATOM 139 N N . LEU A 1 17 ? 2.998 -2.352 -10.415 1.00 97.96 17 A 1 ATOM 140 C CA . LEU A 1 17 ? 4.363 -2.130 -10.878 1.00 97.70 17 A 1 ATOM 141 C C . LEU A 1 17 ? 5.069 -3.449 -11.157 1.00 97.77 17 A 1 ATOM 142 O O . LEU A 1 17 ? 5.815 -3.565 -12.133 1.00 97.12 17 A 1 ATOM 143 C CB . LEU A 1 17 ? 5.140 -1.324 -9.832 1.00 96.90 17 A 1 ATOM 144 C CG . LEU A 1 17 ? 6.378 -0.627 -10.383 1.00 93.93 17 A 1 ATOM 145 C CD1 . LEU A 1 17 ? 5.993 0.710 -11.017 1.00 89.82 17 A 1 ATOM 146 C CD2 . LEU A 1 17 ? 7.400 -0.406 -9.287 1.00 89.04 17 A 1 ATOM 147 N N . ALA A 1 18 ? 4.837 -4.422 -10.305 1.00 97.08 18 A 1 ATOM 148 C CA . ALA A 1 18 ? 5.462 -5.735 -10.434 1.00 96.34 18 A 1 ATOM 149 C C . ALA A 1 18 ? 4.973 -6.445 -11.695 1.00 95.28 18 A 1 ATOM 150 O O . ALA A 1 18 ? 5.818 -6.824 -12.530 1.00 92.68 18 A 1 ATOM 151 C CB . ALA A 1 18 ? 5.173 -6.569 -9.191 1.00 94.48 18 A 1 ATOM 152 O OXT . ALA A 1 18 ? 3.780 -6.623 -11.842 1.00 85.73 18 A 1 #