# 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_spkb36435 # _entry.id spkb36435 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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 LEU y LEUCINE CC(C)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" "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 ALA 2 1 n ALA 3 1 n GLY 4 1 n ARG 5 1 n LEU 6 1 n LEU 7 1 n LEU 8 1 n TYR 9 1 n THR 10 1 n GLY 11 1 n LEU 12 1 n SER 13 1 n LEU 14 1 n ALA 15 1 n LEU 16 1 n CYS 17 1 n ALA 18 1 n LEU 19 1 n GLY 20 1 n MET 21 1 n LEU 22 1 n ALA 23 # _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 @ 2025-07-05 09:36:22)" _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 91.49 _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 79.31 1 1 A ALA 2 2 88.11 1 2 A ALA 3 2 92.03 1 3 A GLY 4 2 95.08 1 4 A ARG 5 2 84.84 1 5 A LEU 6 2 93.81 1 6 A LEU 7 2 94.10 1 7 A LEU 8 2 94.01 1 8 A TYR 9 2 91.72 1 9 A THR 10 2 93.64 1 10 A GLY 11 2 95.85 1 11 A LEU 12 2 93.87 1 12 A SER 13 2 94.66 1 13 A LEU 14 2 94.07 1 14 A ALA 15 2 96.66 1 15 A LEU 16 2 94.18 1 16 A CYS 17 2 95.60 1 17 A ALA 18 2 96.89 1 18 A LEU 19 2 94.01 1 19 A GLY 20 2 95.91 1 20 A MET 21 2 86.55 1 21 A LEU 22 2 88.65 1 22 A ALA 23 2 81.78 1 23 # _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 ALA . 2 A 2 A 3 1 n ALA . 3 A 3 A 4 1 n GLY . 4 A 4 A 5 1 n ARG . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n TYR . 9 A 9 A 10 1 n THR . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n SER . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n CYS . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n LEU . 19 A 19 A 20 1 n GLY . 20 A 20 A 21 1 n MET . 21 A 21 A 22 1 n LEU . 22 A 22 A 23 1 n ALA . 23 A 23 # _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 ? 1.334 -9.446 15.557 1.00 86.45 1 A 1 ATOM 2 C CA . MET A 1 1 ? 1.272 -8.008 15.218 1.00 86.89 1 A 1 ATOM 3 C C . MET A 1 1 ? 1.415 -7.790 13.705 1.00 88.29 1 A 1 ATOM 4 O O . MET A 1 1 ? 2.171 -6.939 13.266 1.00 83.04 1 A 1 ATOM 5 C CB . MET A 1 1 ? 2.351 -7.239 15.991 1.00 80.61 1 A 1 ATOM 6 C CG . MET A 1 1 ? 2.084 -7.228 17.497 1.00 75.21 1 A 1 ATOM 7 S SD . MET A 1 1 ? 3.376 -6.336 18.390 1.00 71.13 1 A 1 ATOM 8 C CE . MET A 1 1 ? 2.701 -6.372 20.047 1.00 62.82 1 A 1 ATOM 9 N N . ALA A 1 2 ? 0.693 -8.572 12.910 1.00 84.66 2 A 1 ATOM 10 C CA . ALA A 1 2 ? 0.725 -8.436 11.449 1.00 89.54 2 A 1 ATOM 11 C C . ALA A 1 2 ? -0.142 -7.269 10.955 1.00 92.16 2 A 1 ATOM 12 O O . ALA A 1 2 ? -0.061 -6.886 9.792 1.00 89.41 2 A 1 ATOM 13 C CB . ALA A 1 2 ? 0.283 -9.765 10.836 1.00 84.76 2 A 1 ATOM 14 N N . ALA A 1 3 ? -0.946 -6.687 11.845 1.00 90.73 3 A 1 ATOM 15 C CA . ALA A 1 3 ? -1.828 -5.568 11.514 1.00 92.95 3 A 1 ATOM 16 C C . ALA A 1 3 ? -1.058 -4.360 10.971 1.00 94.30 3 A 1 ATOM 17 O O . ALA A 1 3 ? -1.535 -3.692 10.059 1.00 92.14 3 A 1 ATOM 18 C CB . ALA A 1 3 ? -2.629 -5.200 12.766 1.00 90.02 3 A 1 ATOM 19 N N . GLY A 1 4 ? 0.142 -4.106 11.489 1.00 94.67 4 A 1 ATOM 20 C CA . GLY A 1 4 ? 0.983 -3.007 10.999 1.00 95.00 4 A 1 ATOM 21 C C . GLY A 1 4 ? 1.417 -3.201 9.547 1.00 95.83 4 A 1 ATOM 22 O O . GLY A 1 4 ? 1.419 -2.253 8.766 1.00 94.81 4 A 1 ATOM 23 N N . ARG A 1 5 ? 1.759 -4.438 9.169 1.00 95.25 5 A 1 ATOM 24 C CA . ARG A 1 5 ? 2.125 -4.766 7.774 1.00 95.68 5 A 1 ATOM 25 C C . ARG A 1 5 ? 0.920 -4.635 6.848 1.00 96.76 5 A 1 ATOM 26 O O . ARG A 1 5 ? 1.056 -4.115 5.744 1.00 95.60 5 A 1 ATOM 27 C CB . ARG A 1 5 ? 2.703 -6.190 7.710 1.00 94.01 5 A 1 ATOM 28 C CG . ARG A 1 5 ? 4.128 -6.269 8.276 1.00 87.02 5 A 1 ATOM 29 C CD . ARG A 1 5 ? 5.156 -5.682 7.291 1.00 83.53 5 A 1 ATOM 30 N NE . ARG A 1 5 ? 5.348 -6.552 6.105 1.00 76.68 5 A 1 ATOM 31 C CZ . ARG A 1 5 ? 6.300 -7.460 5.947 1.00 74.39 5 A 1 ATOM 32 N NH1 . ARG A 1 5 ? 7.189 -7.685 6.874 1.00 66.34 5 A 1 ATOM 33 N NH2 . ARG A 1 5 ? 6.377 -8.161 4.845 1.00 68.02 5 A 1 ATOM 34 N N . LEU A 1 6 ? -0.255 -5.073 7.299 1.00 96.00 6 A 1 ATOM 35 C CA . LEU A 1 6 ? -1.501 -4.926 6.543 1.00 96.15 6 A 1 ATOM 36 C C . LEU A 1 6 ? -1.872 -3.454 6.371 1.00 96.67 6 A 1 ATOM 37 O O . LEU A 1 6 ? -2.231 -3.045 5.270 1.00 96.05 6 A 1 ATOM 38 C CB . LEU A 1 6 ? -2.618 -5.691 7.263 1.00 96.17 6 A 1 ATOM 39 C CG . LEU A 1 6 ? -2.551 -7.200 7.016 1.00 92.49 6 A 1 ATOM 40 C CD1 . LEU A 1 6 ? -3.393 -7.931 8.057 1.00 88.53 6 A 1 ATOM 41 C CD2 . LEU A 1 6 ? -3.083 -7.552 5.624 1.00 88.46 6 A 1 ATOM 42 N N . LEU A 1 7 ? -1.723 -2.649 7.422 1.00 96.47 7 A 1 ATOM 43 C CA . LEU A 1 7 ? -1.952 -1.202 7.355 1.00 96.33 7 A 1 ATOM 44 C C . LEU A 1 7 ? -1.000 -0.528 6.368 1.00 96.73 7 A 1 ATOM 45 O O . LEU A 1 7 ? -1.432 0.318 5.587 1.00 96.22 7 A 1 ATOM 46 C CB . LEU A 1 7 ? -1.783 -0.604 8.757 1.00 96.39 7 A 1 ATOM 47 C CG . LEU A 1 7 ? -3.092 -0.612 9.552 1.00 92.54 7 A 1 ATOM 48 C CD1 . LEU A 1 7 ? -2.803 -0.514 11.048 1.00 89.02 7 A 1 ATOM 49 C CD2 . LEU A 1 7 ? -3.968 0.573 9.147 1.00 89.10 7 A 1 ATOM 50 N N . LEU A 1 8 ? 0.268 -0.928 6.365 1.00 96.72 8 A 1 ATOM 51 C CA . LEU A 1 8 ? 1.254 -0.424 5.405 1.00 96.61 8 A 1 ATOM 52 C C . LEU A 1 8 ? 0.863 -0.787 3.974 1.00 96.85 8 A 1 ATOM 53 O O . LEU A 1 8 ? 0.906 0.064 3.087 1.00 96.52 8 A 1 ATOM 54 C CB . LEU A 1 8 ? 2.638 -0.988 5.760 1.00 96.59 8 A 1 ATOM 55 C CG . LEU A 1 8 ? 3.518 0.057 6.449 1.00 91.34 8 A 1 ATOM 56 C CD1 . LEU A 1 8 ? 4.502 -0.614 7.409 1.00 88.53 8 A 1 ATOM 57 C CD2 . LEU A 1 8 ? 4.309 0.852 5.416 1.00 88.92 8 A 1 ATOM 58 N N . TYR A 1 9 ? 0.446 -2.036 3.753 1.00 96.16 9 A 1 ATOM 59 C CA . TYR A 1 9 ? 0.017 -2.497 2.433 1.00 95.70 9 A 1 ATOM 60 C C . TYR A 1 9 ? -1.248 -1.767 1.972 1.00 95.85 9 A 1 ATOM 61 O O . TYR A 1 9 ? -1.323 -1.309 0.830 1.00 95.09 9 A 1 ATOM 62 C CB . TYR A 1 9 ? -0.200 -4.009 2.494 1.00 95.04 9 A 1 ATOM 63 C CG . TYR A 1 9 ? -0.222 -4.627 1.117 1.00 92.79 9 A 1 ATOM 64 C CD1 . TYR A 1 9 ? -1.435 -4.836 0.448 1.00 89.26 9 A 1 ATOM 65 C CD2 . TYR A 1 9 ? 0.985 -4.978 0.490 1.00 88.88 9 A 1 ATOM 66 C CE1 . TYR A 1 9 ? -1.447 -5.397 -0.834 1.00 88.22 9 A 1 ATOM 67 C CE2 . TYR A 1 9 ? 0.981 -5.539 -0.794 1.00 88.19 9 A 1 ATOM 68 C CZ . TYR A 1 9 ? -0.240 -5.746 -1.450 1.00 88.69 9 A 1 ATOM 69 O OH . TYR A 1 9 ? -0.250 -6.296 -2.710 1.00 86.77 9 A 1 ATOM 70 N N . THR A 1 10 ? -2.204 -1.590 2.863 1.00 96.23 10 A 1 ATOM 71 C CA . THR A 1 10 ? -3.441 -0.849 2.570 1.00 95.85 10 A 1 ATOM 72 C C . THR A 1 10 ? -3.142 0.623 2.284 1.00 96.30 10 A 1 ATOM 73 O O . THR A 1 10 ? -3.700 1.186 1.344 1.00 95.50 10 A 1 ATOM 74 C CB . THR A 1 10 ? -4.427 -0.966 3.740 1.00 94.95 10 A 1 ATOM 75 O OG1 . THR A 1 10 ? -4.619 -2.317 4.083 1.00 89.25 10 A 1 ATOM 76 C CG2 . THR A 1 10 ? -5.804 -0.418 3.378 1.00 87.40 10 A 1 ATOM 77 N N . GLY A 1 11 ? -2.248 1.228 3.041 1.00 95.76 11 A 1 ATOM 78 C CA . GLY A 1 11 ? -1.821 2.610 2.801 1.00 95.54 11 A 1 ATOM 79 C C . GLY A 1 11 ? -1.135 2.776 1.446 1.00 96.27 11 A 1 ATOM 80 O O . GLY A 1 11 ? -1.395 3.743 0.735 1.00 95.85 11 A 1 ATOM 81 N N . LEU A 1 12 ? -0.305 1.807 1.069 1.00 96.11 12 A 1 ATOM 82 C CA . LEU A 1 12 ? 0.363 1.803 -0.235 1.00 95.91 12 A 1 ATOM 83 C C . LEU A 1 12 ? -0.651 1.657 -1.370 1.00 96.66 12 A 1 ATOM 84 O O . LEU A 1 12 ? -0.562 2.361 -2.375 1.00 96.55 12 A 1 ATOM 85 C CB . LEU A 1 12 ? 1.403 0.673 -0.241 1.00 95.70 12 A 1 ATOM 86 C CG . LEU A 1 12 ? 2.697 1.065 -0.958 1.00 91.80 12 A 1 ATOM 87 C CD1 . LEU A 1 12 ? 3.901 0.479 -0.227 1.00 88.92 12 A 1 ATOM 88 C CD2 . LEU A 1 12 ? 2.704 0.583 -2.392 1.00 89.30 12 A 1 ATOM 89 N N . SER A 1 13 ? -1.636 0.792 -1.203 1.00 96.35 13 A 1 ATOM 90 C CA . SER A 1 13 ? -2.717 0.620 -2.175 1.00 96.22 13 A 1 ATOM 91 C C . SER A 1 13 ? -3.558 1.892 -2.315 1.00 96.89 13 A 1 ATOM 92 O O . SER A 1 13 ? -3.892 2.294 -3.428 1.00 96.42 13 A 1 ATOM 93 C CB . SER A 1 13 ? -3.593 -0.560 -1.758 1.00 95.16 13 A 1 ATOM 94 O OG . SER A 1 13 ? -4.449 -0.908 -2.820 1.00 86.93 13 A 1 ATOM 95 N N . LEU A 1 14 ? -3.846 2.558 -1.206 1.00 96.53 14 A 1 ATOM 96 C CA . LEU A 1 14 ? -4.558 3.838 -1.212 1.00 96.45 14 A 1 ATOM 97 C C . LEU A 1 14 ? -3.750 4.924 -1.917 1.00 97.20 14 A 1 ATOM 98 O O . LEU A 1 14 ? -4.317 5.698 -2.692 1.00 97.03 14 A 1 ATOM 99 C CB . LEU A 1 14 ? -4.858 4.249 0.233 1.00 95.95 14 A 1 ATOM 100 C CG . LEU A 1 14 ? -6.160 3.639 0.757 1.00 90.63 14 A 1 ATOM 101 C CD1 . LEU A 1 14 ? -6.165 3.636 2.276 1.00 89.02 14 A 1 ATOM 102 C CD2 . LEU A 1 14 ? -7.360 4.441 0.259 1.00 89.76 14 A 1 ATOM 103 N N . ALA A 1 15 ? -2.444 4.964 -1.699 1.00 96.72 15 A 1 ATOM 104 C CA . ALA A 1 15 ? -1.567 5.918 -2.376 1.00 96.65 15 A 1 ATOM 105 C C . ALA A 1 15 ? -1.546 5.679 -3.893 1.00 97.23 15 A 1 ATOM 106 O O . ALA A 1 15 ? -1.632 6.634 -4.667 1.00 96.50 15 A 1 ATOM 107 C CB . ALA A 1 15 ? -0.163 5.809 -1.776 1.00 96.19 15 A 1 ATOM 108 N N . LEU A 1 16 ? -1.494 4.418 -4.319 1.00 96.42 16 A 1 ATOM 109 C CA . LEU A 1 16 ? -1.572 4.060 -5.738 1.00 96.18 16 A 1 ATOM 110 C C . LEU A 1 16 ? -2.925 4.444 -6.336 1.00 96.98 16 A 1 ATOM 111 O O . LEU A 1 16 ? -2.980 4.951 -7.459 1.00 96.72 16 A 1 ATOM 112 C CB . LEU A 1 16 ? -1.328 2.551 -5.886 1.00 95.57 16 A 1 ATOM 113 C CG . LEU A 1 16 ? 0.144 2.161 -5.749 1.00 92.13 16 A 1 ATOM 114 C CD1 . LEU A 1 16 ? 0.264 0.660 -5.520 1.00 89.87 16 A 1 ATOM 115 C CD2 . LEU A 1 16 ? 0.924 2.525 -7.013 1.00 89.58 16 A 1 ATOM 116 N N . CYS A 1 17 ? -4.001 4.253 -5.595 1.00 96.64 17 A 1 ATOM 117 C CA . CYS A 1 17 ? -5.339 4.659 -6.022 1.00 96.42 17 A 1 ATOM 118 C C . CYS A 1 17 ? -5.429 6.186 -6.166 1.00 96.87 17 A 1 ATOM 119 O O . CYS A 1 17 ? -5.980 6.687 -7.144 1.00 96.15 17 A 1 ATOM 120 C CB . CYS A 1 17 ? -6.358 4.120 -5.010 1.00 95.66 17 A 1 ATOM 121 S SG . CYS A 1 17 ? -8.027 4.245 -5.687 1.00 91.85 17 A 1 ATOM 122 N N . ALA A 1 18 ? -4.847 6.924 -5.230 1.00 97.03 18 A 1 ATOM 123 C CA . ALA A 1 18 ? -4.812 8.387 -5.285 1.00 96.98 18 A 1 ATOM 124 C C . ALA A 1 18 ? -3.997 8.894 -6.485 1.00 97.36 18 A 1 ATOM 125 O O . ALA A 1 18 ? -4.357 9.901 -7.091 1.00 96.61 18 A 1 ATOM 126 C CB . ALA A 1 18 ? -4.238 8.913 -3.968 1.00 96.47 18 A 1 ATOM 127 N N . LEU A 1 19 ? -2.937 8.180 -6.847 1.00 96.79 19 A 1 ATOM 128 C CA . LEU A 1 19 ? -2.133 8.491 -8.034 1.00 96.59 19 A 1 ATOM 129 C C . LEU A 1 19 ? -2.824 8.074 -9.337 1.00 96.89 19 A 1 ATOM 130 O O . LEU A 1 19 ? -2.356 8.434 -10.418 1.00 95.93 19 A 1 ATOM 131 C CB . LEU A 1 19 ? -0.763 7.808 -7.889 1.00 95.93 19 A 1 ATOM 132 C CG . LEU A 1 19 ? 0.180 8.574 -6.958 1.00 92.77 19 A 1 ATOM 133 C CD1 . LEU A 1 19 ? 1.287 7.655 -6.455 1.00 89.32 19 A 1 ATOM 134 C CD2 . LEU A 1 19 ? 0.819 9.749 -7.689 1.00 87.86 19 A 1 ATOM 135 N N . GLY A 1 20 ? -3.927 7.336 -9.254 1.00 96.04 20 A 1 ATOM 136 C CA . GLY A 1 20 ? -4.643 6.846 -10.437 1.00 95.80 20 A 1 ATOM 137 C C . GLY A 1 20 ? -3.954 5.652 -11.088 1.00 96.28 20 A 1 ATOM 138 O O . GLY A 1 20 ? -4.303 5.285 -12.204 1.00 95.52 20 A 1 ATOM 139 N N . MET A 1 21 ? -2.977 5.046 -10.389 1.00 92.67 21 A 1 ATOM 140 C CA . MET A 1 21 ? -2.287 3.848 -10.891 1.00 91.90 21 A 1 ATOM 141 C C . MET A 1 21 ? -3.115 2.582 -10.708 1.00 92.89 21 A 1 ATOM 142 O O . MET A 1 21 ? -2.853 1.584 -11.376 1.00 90.46 21 A 1 ATOM 143 C CB . MET A 1 21 ? -0.934 3.690 -10.194 1.00 89.87 21 A 1 ATOM 144 C CG . MET A 1 21 ? 0.164 4.425 -10.950 1.00 85.38 21 A 1 ATOM 145 S SD . MET A 1 21 ? 1.812 3.828 -10.532 1.00 80.02 21 A 1 ATOM 146 C CE . MET A 1 21 ? 2.635 4.085 -12.106 1.00 69.23 21 A 1 ATOM 147 N N . LEU A 1 22 ? -4.102 2.625 -9.820 1.00 92.59 22 A 1 ATOM 148 C CA . LEU A 1 22 ? -4.989 1.495 -9.547 1.00 92.36 22 A 1 ATOM 149 C C . LEU A 1 22 ? -6.177 1.537 -10.515 1.00 93.22 22 A 1 ATOM 150 O O . LEU A 1 22 ? -7.313 1.697 -10.089 1.00 90.95 22 A 1 ATOM 151 C CB . LEU A 1 22 ? -5.383 1.526 -8.058 1.00 90.63 22 A 1 ATOM 152 C CG . LEU A 1 22 ? -5.710 0.165 -7.418 1.00 87.05 22 A 1 ATOM 153 C CD1 . LEU A 1 22 ? -6.939 -0.497 -7.990 1.00 82.37 22 A 1 ATOM 154 C CD2 . LEU A 1 22 ? -4.522 -0.783 -7.528 1.00 79.99 22 A 1 ATOM 155 N N . ALA A 1 23 ? -5.895 1.442 -11.823 1.00 88.06 23 A 1 ATOM 156 C CA . ALA A 1 23 ? -6.881 1.371 -12.915 1.00 86.22 23 A 1 ATOM 157 C C . ALA A 1 23 ? -8.212 2.069 -12.612 1.00 84.24 23 A 1 ATOM 158 O O . ALA A 1 23 ? -9.249 1.406 -12.490 1.00 79.86 23 A 1 ATOM 159 C CB . ALA A 1 23 ? -7.069 -0.088 -13.315 1.00 79.77 23 A 1 ATOM 160 O OXT . ALA A 1 23 ? -8.189 3.299 -12.410 1.00 72.54 23 A 1 #