# 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_spkb42094 # _entry.id spkb42094 # 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" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=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" "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" "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" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)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 LYS 2 1 n SER 3 1 n TRP 4 1 n CYS 5 1 n LYS 6 1 n ASN 7 1 n LEU 8 1 n LEU 9 1 n ALA 10 1 n ALA 11 1 n GLY 12 1 n LEU 13 1 n SER 14 1 n LEU 15 1 n ALA 16 1 n MET 17 1 n LEU 18 1 n SER 19 1 n ALA 20 # _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 @ 2025-07-09 01:27:48)" _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 89.67 _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 78.61 1 1 A LYS 2 2 80.95 1 2 A SER 3 2 88.70 1 3 A TRP 4 2 86.67 1 4 A CYS 5 2 93.21 1 5 A LYS 6 2 86.80 1 6 A ASN 7 2 90.74 1 7 A LEU 8 2 92.30 1 8 A LEU 9 2 91.66 1 9 A ALA 10 2 95.22 1 10 A ALA 11 2 95.50 1 11 A GLY 12 2 95.74 1 12 A LEU 13 2 92.11 1 13 A SER 14 2 94.46 1 14 A LEU 15 2 91.35 1 15 A ALA 16 2 96.19 1 16 A MET 17 2 90.25 1 17 A LEU 18 2 90.76 1 18 A SER 19 2 90.50 1 19 A ALA 20 2 86.36 1 20 # _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 SER . 3 A 3 A 4 1 n TRP . 4 A 4 A 5 1 n CYS . 5 A 5 A 6 1 n LYS . 6 A 6 A 7 1 n ASN . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n ALA . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n SER . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n MET . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n SER . 19 A 19 A 20 1 n ALA . 20 A 20 # _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 ? -11.290 2.582 9.584 1.00 84.03 1 A 1 ATOM 2 C CA . MET A 1 1 ? -11.511 1.722 8.392 1.00 85.86 1 A 1 ATOM 3 C C . MET A 1 1 ? -10.287 0.840 8.152 1.00 87.16 1 A 1 ATOM 4 O O . MET A 1 1 ? -9.180 1.350 8.062 1.00 82.21 1 A 1 ATOM 5 C CB . MET A 1 1 ? -11.761 2.578 7.158 1.00 79.54 1 A 1 ATOM 6 C CG . MET A 1 1 ? -13.095 3.304 7.218 1.00 75.24 1 A 1 ATOM 7 S SD . MET A 1 1 ? -13.484 4.047 5.618 1.00 71.42 1 A 1 ATOM 8 C CE . MET A 1 1 ? -14.867 5.071 6.060 1.00 63.38 1 A 1 ATOM 9 N N . LYS A 1 2 ? -10.478 -0.477 8.025 1.00 89.87 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -9.365 -1.410 7.764 1.00 91.09 2 A 1 ATOM 11 C C . LYS A 1 2 ? -8.766 -1.206 6.367 1.00 91.81 2 A 1 ATOM 12 O O . LYS A 1 2 ? -7.554 -1.296 6.200 1.00 88.73 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -9.853 -2.849 7.922 1.00 86.87 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -9.560 -3.404 9.309 1.00 77.34 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -9.999 -4.852 9.411 1.00 75.62 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -9.511 -5.469 10.707 1.00 66.93 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -9.924 -6.888 10.810 1.00 60.27 2 A 1 ATOM 18 N N . SER A 1 3 ? -9.586 -0.916 5.373 1.00 90.28 3 A 1 ATOM 19 C CA . SER A 1 3 ? -9.147 -0.705 3.988 1.00 91.86 3 A 1 ATOM 20 C C . SER A 1 3 ? -8.268 0.538 3.854 1.00 93.66 3 A 1 ATOM 21 O O . SER A 1 3 ? -7.295 0.548 3.105 1.00 91.56 3 A 1 ATOM 22 C CB . SER A 1 3 ? -10.370 -0.587 3.087 1.00 88.41 3 A 1 ATOM 23 O OG . SER A 1 3 ? -10.016 -0.872 1.761 1.00 76.43 3 A 1 ATOM 24 N N . TRP A 1 4 ? -8.577 1.577 4.615 1.00 92.74 4 A 1 ATOM 25 C CA . TRP A 1 4 ? -7.820 2.830 4.576 1.00 93.48 4 A 1 ATOM 26 C C . TRP A 1 4 ? -6.427 2.664 5.192 1.00 94.63 4 A 1 ATOM 27 O O . TRP A 1 4 ? -5.445 3.177 4.651 1.00 93.17 4 A 1 ATOM 28 C CB . TRP A 1 4 ? -8.622 3.914 5.288 1.00 92.25 4 A 1 ATOM 29 C CG . TRP A 1 4 ? -8.381 5.286 4.754 1.00 88.38 4 A 1 ATOM 30 C CD1 . TRP A 1 4 ? -8.132 5.611 3.464 1.00 83.83 4 A 1 ATOM 31 C CD2 . TRP A 1 4 ? -8.369 6.544 5.495 1.00 87.18 4 A 1 ATOM 32 N NE1 . TRP A 1 4 ? -7.969 6.983 3.355 1.00 82.92 4 A 1 ATOM 33 C CE2 . TRP A 1 4 ? -8.113 7.583 4.582 1.00 87.75 4 A 1 ATOM 34 C CE3 . TRP A 1 4 ? -8.559 6.876 6.850 1.00 81.60 4 A 1 ATOM 35 C CZ2 . TRP A 1 4 ? -8.039 8.927 4.996 1.00 82.32 4 A 1 ATOM 36 C CZ3 . TRP A 1 4 ? -8.490 8.212 7.257 1.00 76.55 4 A 1 ATOM 37 C CH2 . TRP A 1 4 ? -8.225 9.224 6.336 1.00 76.63 4 A 1 ATOM 38 N N . CYS A 1 5 ? -6.302 1.901 6.270 1.00 94.09 5 A 1 ATOM 39 C CA . CYS A 1 5 ? -5.007 1.597 6.886 1.00 94.80 5 A 1 ATOM 40 C C . CYS A 1 5 ? -4.090 0.846 5.913 1.00 95.28 5 A 1 ATOM 41 O O . CYS A 1 5 ? -2.898 1.122 5.836 1.00 94.27 5 A 1 ATOM 42 C CB . CYS A 1 5 ? -5.236 0.758 8.143 1.00 93.60 5 A 1 ATOM 43 S SG . CYS A 1 5 ? -5.987 1.759 9.443 1.00 87.25 5 A 1 ATOM 44 N N . LYS A 1 6 ? -4.657 -0.079 5.161 1.00 92.95 6 A 1 ATOM 45 C CA . LYS A 1 6 ? -3.910 -0.848 4.167 1.00 93.49 6 A 1 ATOM 46 C C . LYS A 1 6 ? -3.456 0.038 3.002 1.00 94.18 6 A 1 ATOM 47 O O . LYS A 1 6 ? -2.351 -0.145 2.495 1.00 93.73 6 A 1 ATOM 48 C CB . LYS A 1 6 ? -4.778 -2.007 3.690 1.00 92.64 6 A 1 ATOM 49 C CG . LYS A 1 6 ? -3.924 -3.135 3.126 1.00 86.57 6 A 1 ATOM 50 C CD . LYS A 1 6 ? -4.796 -4.197 2.481 1.00 83.03 6 A 1 ATOM 51 C CE . LYS A 1 6 ? -3.995 -4.957 1.432 1.00 75.53 6 A 1 ATOM 52 N NZ . LYS A 1 6 ? -4.854 -5.336 0.302 1.00 69.12 6 A 1 ATOM 53 N N . ASN A 1 7 ? -4.262 1.002 2.591 1.00 93.78 7 A 1 ATOM 54 C CA . ASN A 1 7 ? -3.910 1.937 1.521 1.00 93.99 7 A 1 ATOM 55 C C . ASN A 1 7 ? -2.709 2.800 1.907 1.00 95.31 7 A 1 ATOM 56 O O . ASN A 1 7 ? -1.811 3.007 1.093 1.00 94.46 7 A 1 ATOM 57 C CB . ASN A 1 7 ? -5.117 2.818 1.198 1.00 92.74 7 A 1 ATOM 58 C CG . ASN A 1 7 ? -6.098 2.135 0.273 1.00 89.44 7 A 1 ATOM 59 O OD1 . ASN A 1 7 ? -5.869 1.065 -0.246 1.00 83.00 7 A 1 ATOM 60 N ND2 . ASN A 1 7 ? -7.221 2.762 0.030 1.00 83.17 7 A 1 ATOM 61 N N . LEU A 1 8 ? -2.658 3.270 3.144 1.00 94.34 8 A 1 ATOM 62 C CA . LEU A 1 8 ? -1.534 4.064 3.644 1.00 94.92 8 A 1 ATOM 63 C C . LEU A 1 8 ? -0.242 3.244 3.680 1.00 95.71 8 A 1 ATOM 64 O O . LEU A 1 8 ? 0.814 3.739 3.283 1.00 95.33 8 A 1 ATOM 65 C CB . LEU A 1 8 ? -1.887 4.578 5.043 1.00 95.19 8 A 1 ATOM 66 C CG . LEU A 1 8 ? -2.801 5.805 4.999 1.00 90.95 8 A 1 ATOM 67 C CD1 . LEU A 1 8 ? -3.578 5.937 6.300 1.00 85.91 8 A 1 ATOM 68 C CD2 . LEU A 1 8 ? -1.975 7.070 4.793 1.00 86.06 8 A 1 ATOM 69 N N . LEU A 1 9 ? -0.326 1.995 4.107 1.00 95.17 9 A 1 ATOM 70 C CA . LEU A 1 9 ? 0.828 1.097 4.145 1.00 94.72 9 A 1 ATOM 71 C C . LEU A 1 9 ? 1.309 0.743 2.738 1.00 95.50 9 A 1 ATOM 72 O O . LEU A 1 9 ? 2.512 0.763 2.479 1.00 95.43 9 A 1 ATOM 73 C CB . LEU A 1 9 ? 0.443 -0.164 4.922 1.00 94.41 9 A 1 ATOM 74 C CG . LEU A 1 9 ? 0.599 0.018 6.432 1.00 88.39 9 A 1 ATOM 75 C CD1 . LEU A 1 9 ? -0.313 -0.935 7.185 1.00 84.53 9 A 1 ATOM 76 C CD2 . LEU A 1 9 ? 2.041 -0.243 6.847 1.00 85.11 9 A 1 ATOM 77 N N . ALA A 1 10 ? 0.397 0.454 1.820 1.00 95.26 10 A 1 ATOM 78 C CA . ALA A 1 10 ? 0.739 0.107 0.441 1.00 95.30 10 A 1 ATOM 79 C C . ALA A 1 10 ? 1.387 1.287 -0.292 1.00 95.98 10 A 1 ATOM 80 O O . ALA A 1 10 ? 2.380 1.108 -0.996 1.00 95.16 10 A 1 ATOM 81 C CB . ALA A 1 10 ? -0.526 -0.360 -0.280 1.00 94.40 10 A 1 ATOM 82 N N . ALA A 1 11 ? 0.861 2.488 -0.110 1.00 95.68 11 A 1 ATOM 83 C CA . ALA A 1 11 ? 1.414 3.691 -0.728 1.00 95.68 11 A 1 ATOM 84 C C . ALA A 1 11 ? 2.818 3.994 -0.193 1.00 96.41 11 A 1 ATOM 85 O O . ALA A 1 11 ? 3.718 4.308 -0.966 1.00 95.15 11 A 1 ATOM 86 C CB . ALA A 1 11 ? 0.457 4.858 -0.477 1.00 94.57 11 A 1 ATOM 87 N N . GLY A 1 12 ? 3.016 3.865 1.112 1.00 95.56 12 A 1 ATOM 88 C CA . GLY A 1 12 ? 4.320 4.088 1.732 1.00 95.51 12 A 1 ATOM 89 C C . GLY A 1 12 ? 5.368 3.076 1.277 1.00 96.18 12 A 1 ATOM 90 O O . GLY A 1 12 ? 6.506 3.450 1.008 1.00 95.71 12 A 1 ATOM 91 N N . LEU A 1 13 ? 4.990 1.804 1.153 1.00 95.44 13 A 1 ATOM 92 C CA . LEU A 1 13 ? 5.894 0.740 0.705 1.00 95.21 13 A 1 ATOM 93 C C . LEU A 1 13 ? 6.342 0.951 -0.738 1.00 96.12 13 A 1 ATOM 94 O O . LEU A 1 13 ? 7.532 0.850 -1.034 1.00 95.47 13 A 1 ATOM 95 C CB . LEU A 1 13 ? 5.189 -0.613 0.868 1.00 94.58 13 A 1 ATOM 96 C CG . LEU A 1 13 ? 5.842 -1.474 1.947 1.00 90.18 13 A 1 ATOM 97 C CD1 . LEU A 1 13 ? 4.803 -2.323 2.657 1.00 84.71 13 A 1 ATOM 98 C CD2 . LEU A 1 13 ? 6.896 -2.376 1.341 1.00 85.17 13 A 1 ATOM 99 N N . SER A 1 14 ? 5.423 1.268 -1.636 1.00 96.00 14 A 1 ATOM 100 C CA . SER A 1 14 ? 5.736 1.506 -3.048 1.00 96.09 14 A 1 ATOM 101 C C . SER A 1 14 ? 6.633 2.731 -3.222 1.00 96.58 14 A 1 ATOM 102 O O . SER A 1 14 ? 7.586 2.697 -3.998 1.00 95.71 14 A 1 ATOM 103 C CB . SER A 1 14 ? 4.447 1.694 -3.842 1.00 95.17 14 A 1 ATOM 104 O OG . SER A 1 14 ? 3.709 0.498 -3.869 1.00 87.19 14 A 1 ATOM 105 N N . LEU A 1 15 ? 6.359 3.784 -2.487 1.00 95.77 15 A 1 ATOM 106 C CA . LEU A 1 15 ? 7.146 5.015 -2.555 1.00 95.06 15 A 1 ATOM 107 C C . LEU A 1 15 ? 8.540 4.820 -1.961 1.00 95.84 15 A 1 ATOM 108 O O . LEU A 1 15 ? 9.522 5.302 -2.523 1.00 95.06 15 A 1 ATOM 109 C CB . LEU A 1 15 ? 6.381 6.135 -1.841 1.00 93.90 15 A 1 ATOM 110 C CG . LEU A 1 15 ? 6.392 7.442 -2.635 1.00 87.80 15 A 1 ATOM 111 C CD1 . LEU A 1 15 ? 4.973 7.976 -2.793 1.00 83.40 15 A 1 ATOM 112 C CD2 . LEU A 1 15 ? 7.246 8.489 -1.952 1.00 83.94 15 A 1 ATOM 113 N N . ALA A 1 16 ? 8.647 4.095 -0.864 1.00 96.51 16 A 1 ATOM 114 C CA . ALA A 1 16 ? 9.932 3.820 -0.219 1.00 96.37 16 A 1 ATOM 115 C C . ALA A 1 16 ? 10.854 2.991 -1.119 1.00 96.89 16 A 1 ATOM 116 O O . ALA A 1 16 ? 12.048 3.267 -1.194 1.00 95.80 16 A 1 ATOM 117 C CB . ALA A 1 16 ? 9.678 3.107 1.108 1.00 95.37 16 A 1 ATOM 118 N N . MET A 1 17 ? 10.311 1.995 -1.823 1.00 96.28 17 A 1 ATOM 119 C CA . MET A 1 17 ? 11.096 1.162 -2.742 1.00 95.98 17 A 1 ATOM 120 C C . MET A 1 17 ? 11.584 1.946 -3.963 1.00 96.14 17 A 1 ATOM 121 O O . MET A 1 17 ? 12.696 1.732 -4.426 1.00 94.40 17 A 1 ATOM 122 C CB . MET A 1 17 ? 10.260 -0.035 -3.201 1.00 95.11 17 A 1 ATOM 123 C CG . MET A 1 17 ? 10.231 -1.122 -2.136 1.00 90.57 17 A 1 ATOM 124 S SD . MET A 1 17 ? 9.636 -2.685 -2.798 1.00 81.26 17 A 1 ATOM 125 C CE . MET A 1 17 ? 10.083 -3.774 -1.454 1.00 72.30 17 A 1 ATOM 126 N N . LEU A 1 18 ? 10.771 2.848 -4.485 1.00 94.87 18 A 1 ATOM 127 C CA . LEU A 1 18 ? 11.133 3.667 -5.650 1.00 94.35 18 A 1 ATOM 128 C C . LEU A 1 18 ? 12.036 4.842 -5.276 1.00 95.13 18 A 1 ATOM 129 O O . LEU A 1 18 ? 12.808 5.313 -6.115 1.00 93.61 18 A 1 ATOM 130 C CB . LEU A 1 18 ? 9.844 4.166 -6.315 1.00 93.12 18 A 1 ATOM 131 C CG . LEU A 1 18 ? 9.193 3.112 -7.210 1.00 89.13 18 A 1 ATOM 132 C CD1 . LEU A 1 18 ? 7.703 3.391 -7.359 1.00 83.31 18 A 1 ATOM 133 C CD2 . LEU A 1 18 ? 9.831 3.119 -8.594 1.00 82.56 18 A 1 ATOM 134 N N . SER A 1 19 ? 11.959 5.308 -4.053 1.00 93.28 19 A 1 ATOM 135 C CA . SER A 1 19 ? 12.742 6.454 -3.574 1.00 93.14 19 A 1 ATOM 136 C C . SER A 1 19 ? 14.174 6.069 -3.180 1.00 93.09 19 A 1 ATOM 137 O O . SER A 1 19 ? 15.052 6.928 -3.144 1.00 90.90 19 A 1 ATOM 138 C CB . SER A 1 19 ? 12.021 7.101 -2.391 1.00 91.05 19 A 1 ATOM 139 O OG . SER A 1 19 ? 12.345 8.459 -2.281 1.00 81.55 19 A 1 ATOM 140 N N . ALA A 1 20 ? 14.431 4.808 -2.879 1.00 92.12 20 A 1 ATOM 141 C CA . ALA A 1 20 ? 15.741 4.308 -2.478 1.00 90.20 20 A 1 ATOM 142 C C . ALA A 1 20 ? 16.664 4.078 -3.678 1.00 88.52 20 A 1 ATOM 143 O O . ALA A 1 20 ? 16.167 3.789 -4.781 1.00 84.23 20 A 1 ATOM 144 C CB . ALA A 1 20 ? 15.571 3.042 -1.645 1.00 85.63 20 A 1 ATOM 145 O OXT . ALA A 1 20 ? 17.892 4.167 -3.502 1.00 77.46 20 A 1 #