# 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_spkb38249 # _entry.id spkb38249 # 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" "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" "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 THR 2 1 n GLY 3 1 n THR 4 1 n THR 5 1 n ALA 6 1 n ARG 7 1 n ARG 8 1 n THR 9 1 n VAL 10 1 n VAL 11 1 n SER 12 1 n VAL 13 1 n ALA 14 1 n VAL 15 1 n SER 16 1 n ALA 17 1 n ALA 18 1 n LEU 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 @ 2025-07-06 12:59:41)" _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 94.07 _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 84.40 1 1 A THR 2 2 90.73 1 2 A GLY 3 2 94.93 1 3 A THR 4 2 93.61 1 4 A THR 5 2 95.16 1 5 A ALA 6 2 97.44 1 6 A ARG 7 2 88.00 1 7 A ARG 8 2 88.59 1 8 A THR 9 2 96.24 1 9 A VAL 10 2 97.31 1 10 A VAL 11 2 97.51 1 11 A SER 12 2 96.09 1 12 A VAL 13 2 97.63 1 13 A ALA 14 2 98.28 1 14 A VAL 15 2 97.52 1 15 A SER 16 2 96.31 1 16 A ALA 17 2 98.29 1 17 A ALA 18 2 98.17 1 18 A LEU 19 2 96.13 1 19 A ALA 20 2 91.90 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 THR . 2 A 2 A 3 1 n GLY . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n THR . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n ARG . 7 A 7 A 8 1 n ARG . 8 A 8 A 9 1 n THR . 9 A 9 A 10 1 n VAL . 10 A 10 A 11 1 n VAL . 11 A 11 A 12 1 n SER . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n VAL . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n LEU . 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 ? 2.698 13.657 3.055 1.00 89.62 1 A 1 ATOM 2 C CA . MET A 1 1 ? 1.689 12.602 2.866 1.00 90.27 1 A 1 ATOM 3 C C . MET A 1 1 ? 2.203 11.249 3.369 1.00 91.83 1 A 1 ATOM 4 O O . MET A 1 1 ? 2.454 10.333 2.589 1.00 89.49 1 A 1 ATOM 5 C CB . MET A 1 1 ? 1.307 12.488 1.393 1.00 86.16 1 A 1 ATOM 6 C CG . MET A 1 1 ? 2.480 12.223 0.465 1.00 81.02 1 A 1 ATOM 7 S SD . MET A 1 1 ? 2.000 12.271 -1.275 1.00 78.14 1 A 1 ATOM 8 C CE . MET A 1 1 ? 3.006 13.630 -1.837 1.00 68.67 1 A 1 ATOM 9 N N . THR A 1 2 ? 2.362 11.147 4.669 1.00 92.69 2 A 1 ATOM 10 C CA . THR A 1 2 ? 2.878 9.920 5.275 1.00 94.18 2 A 1 ATOM 11 C C . THR A 1 2 ? 1.801 8.840 5.354 1.00 95.45 2 A 1 ATOM 12 O O . THR A 1 2 ? 2.044 7.684 5.007 1.00 93.67 2 A 1 ATOM 13 C CB . THR A 1 2 ? 3.411 10.194 6.681 1.00 91.68 2 A 1 ATOM 14 O OG1 . THR A 1 2 ? 4.270 11.337 6.667 1.00 84.64 2 A 1 ATOM 15 C CG2 . THR A 1 2 ? 4.172 8.997 7.207 1.00 82.80 2 A 1 ATOM 16 N N . GLY A 1 3 ? 0.610 9.225 5.812 1.00 93.33 3 A 1 ATOM 17 C CA . GLY A 1 3 ? -0.491 8.283 5.952 1.00 94.71 3 A 1 ATOM 18 C C . GLY A 1 3 ? -0.962 7.723 4.627 1.00 96.37 3 A 1 ATOM 19 O O . GLY A 1 3 ? -1.125 6.515 4.466 1.00 95.31 3 A 1 ATOM 20 N N . THR A 1 4 ? -1.182 8.609 3.657 1.00 95.62 4 A 1 ATOM 21 C CA . THR A 1 4 ? -1.646 8.209 2.330 1.00 96.24 4 A 1 ATOM 22 C C . THR A 1 4 ? -0.645 7.286 1.649 1.00 97.27 4 A 1 ATOM 23 O O . THR A 1 4 ? -1.010 6.243 1.103 1.00 96.50 4 A 1 ATOM 24 C CB . THR A 1 4 ? -1.880 9.426 1.433 1.00 94.73 4 A 1 ATOM 25 O OG1 . THR A 1 4 ? -2.702 10.377 2.109 1.00 88.25 4 A 1 ATOM 26 C CG2 . THR A 1 4 ? -2.544 9.011 0.137 1.00 86.66 4 A 1 ATOM 27 N N . THR A 1 5 ? 0.617 7.668 1.680 1.00 97.05 5 A 1 ATOM 28 C CA . THR A 1 5 ? 1.676 6.877 1.060 1.00 97.15 5 A 1 ATOM 29 C C . THR A 1 5 ? 1.807 5.520 1.743 1.00 97.57 5 A 1 ATOM 30 O O . THR A 1 5 ? 1.933 4.489 1.080 1.00 97.06 5 A 1 ATOM 31 C CB . THR A 1 5 ? 3.024 7.600 1.131 1.00 96.39 5 A 1 ATOM 32 O OG1 . THR A 1 5 ? 2.900 8.903 0.561 1.00 91.25 5 A 1 ATOM 33 C CG2 . THR A 1 5 ? 4.086 6.827 0.375 1.00 89.67 5 A 1 ATOM 34 N N . ALA A 1 6 ? 1.779 5.518 3.059 1.00 97.41 6 A 1 ATOM 35 C CA . ALA A 1 6 ? 1.892 4.289 3.836 1.00 97.57 6 A 1 ATOM 36 C C . ALA A 1 6 ? 0.743 3.340 3.523 1.00 97.91 6 A 1 ATOM 37 O O . ALA A 1 6 ? 0.943 2.135 3.355 1.00 97.37 6 A 1 ATOM 38 C CB . ALA A 1 6 ? 1.914 4.611 5.321 1.00 96.94 6 A 1 ATOM 39 N N . ARG A 1 7 ? -0.462 3.892 3.431 1.00 97.19 7 A 1 ATOM 40 C CA . ARG A 1 7 ? -1.651 3.102 3.125 1.00 97.35 7 A 1 ATOM 41 C C . ARG A 1 7 ? -1.544 2.480 1.744 1.00 97.86 7 A 1 ATOM 42 O O . ARG A 1 7 ? -1.827 1.297 1.557 1.00 97.24 7 A 1 ATOM 43 C CB . ARG A 1 7 ? -2.905 3.976 3.187 1.00 96.50 7 A 1 ATOM 44 C CG . ARG A 1 7 ? -3.378 4.225 4.602 1.00 90.22 7 A 1 ATOM 45 C CD . ARG A 1 7 ? -4.507 5.239 4.613 1.00 87.50 7 A 1 ATOM 46 N NE . ARG A 1 7 ? -5.616 4.802 5.467 1.00 81.46 7 A 1 ATOM 47 C CZ . ARG A 1 7 ? -6.770 5.450 5.558 1.00 78.84 7 A 1 ATOM 48 N NH1 . ARG A 1 7 ? -6.981 6.565 4.887 1.00 71.33 7 A 1 ATOM 49 N NH2 . ARG A 1 7 ? -7.739 4.969 6.333 1.00 72.50 7 A 1 ATOM 50 N N . ARG A 1 8 ? -1.142 3.277 0.763 1.00 97.45 8 A 1 ATOM 51 C CA . ARG A 1 8 ? -0.989 2.798 -0.605 1.00 97.68 8 A 1 ATOM 52 C C . ARG A 1 8 ? 0.049 1.693 -0.674 1.00 98.12 8 A 1 ATOM 53 O O . ARG A 1 8 ? -0.122 0.707 -1.393 1.00 97.63 8 A 1 ATOM 54 C CB . ARG A 1 8 ? -0.586 3.964 -1.515 1.00 97.12 8 A 1 ATOM 55 C CG . ARG A 1 8 ? -0.550 3.623 -2.986 1.00 91.37 8 A 1 ATOM 56 C CD . ARG A 1 8 ? -1.945 3.508 -3.582 1.00 88.16 8 A 1 ATOM 57 N NE . ARG A 1 8 ? -2.529 2.182 -3.390 1.00 82.47 8 A 1 ATOM 58 C CZ . ARG A 1 8 ? -3.757 1.845 -3.790 1.00 79.00 8 A 1 ATOM 59 N NH1 . ARG A 1 8 ? -4.536 2.715 -4.395 1.00 72.36 8 A 1 ATOM 60 N NH2 . ARG A 1 8 ? -4.201 0.615 -3.574 1.00 73.13 8 A 1 ATOM 61 N N . THR A 1 9 ? 1.126 1.854 0.081 1.00 97.97 9 A 1 ATOM 62 C CA . THR A 1 9 ? 2.210 0.881 0.103 1.00 97.95 9 A 1 ATOM 63 C C . THR A 1 9 ? 1.747 -0.443 0.700 1.00 98.30 9 A 1 ATOM 64 O O . THR A 1 9 ? 1.962 -1.503 0.112 1.00 97.94 9 A 1 ATOM 65 C CB . THR A 1 9 ? 3.401 1.404 0.910 1.00 97.56 9 A 1 ATOM 66 O OG1 . THR A 1 9 ? 3.838 2.648 0.367 1.00 92.97 9 A 1 ATOM 67 C CG2 . THR A 1 9 ? 4.555 0.414 0.868 1.00 91.02 9 A 1 ATOM 68 N N . VAL A 1 10 ? 1.104 -0.388 1.858 1.00 97.91 10 A 1 ATOM 69 C CA . VAL A 1 10 ? 0.640 -1.603 2.525 1.00 98.08 10 A 1 ATOM 70 C C . VAL A 1 10 ? -0.390 -2.331 1.673 1.00 98.27 10 A 1 ATOM 71 O O . VAL A 1 10 ? -0.379 -3.559 1.577 1.00 97.90 10 A 1 ATOM 72 C CB . VAL A 1 10 ? 0.054 -1.298 3.915 1.00 97.76 10 A 1 ATOM 73 C CG1 . VAL A 1 10 ? 1.122 -0.705 4.825 1.00 95.50 10 A 1 ATOM 74 C CG2 . VAL A 1 10 ? -1.136 -0.365 3.816 1.00 95.72 10 A 1 ATOM 75 N N . VAL A 1 11 ? -1.273 -1.566 1.040 1.00 98.16 11 A 1 ATOM 76 C CA . VAL A 1 11 ? -2.299 -2.142 0.174 1.00 98.18 11 A 1 ATOM 77 C C . VAL A 1 11 ? -1.652 -2.820 -1.027 1.00 98.32 11 A 1 ATOM 78 O O . VAL A 1 11 ? -2.026 -3.933 -1.403 1.00 98.03 11 A 1 ATOM 79 C CB . VAL A 1 11 ? -3.292 -1.069 -0.310 1.00 97.89 11 A 1 ATOM 80 C CG1 . VAL A 1 11 ? -4.254 -1.644 -1.348 1.00 96.05 11 A 1 ATOM 81 C CG2 . VAL A 1 11 ? -4.076 -0.510 0.865 1.00 95.94 11 A 1 ATOM 82 N N . SER A 1 12 ? -0.688 -2.147 -1.616 1.00 98.04 12 A 1 ATOM 83 C CA . SER A 1 12 ? 0.025 -2.680 -2.773 1.00 97.97 12 A 1 ATOM 84 C C . SER A 1 12 ? 0.715 -3.995 -2.432 1.00 98.21 12 A 1 ATOM 85 O O . SER A 1 12 ? 0.672 -4.953 -3.205 1.00 97.75 12 A 1 ATOM 86 C CB . SER A 1 12 ? 1.061 -1.676 -3.270 1.00 97.36 12 A 1 ATOM 87 O OG . SER A 1 12 ? 1.700 -2.156 -4.426 1.00 87.20 12 A 1 ATOM 88 N N . VAL A 1 13 ? 1.341 -4.044 -1.270 1.00 98.35 13 A 1 ATOM 89 C CA . VAL A 1 13 ? 2.031 -5.248 -0.814 1.00 98.30 13 A 1 ATOM 90 C C . VAL A 1 13 ? 1.041 -6.391 -0.621 1.00 98.46 13 A 1 ATOM 91 O O . VAL A 1 13 ? 1.284 -7.523 -1.054 1.00 98.19 13 A 1 ATOM 92 C CB . VAL A 1 13 ? 2.789 -4.989 0.500 1.00 97.93 13 A 1 ATOM 93 C CG1 . VAL A 1 13 ? 3.388 -6.280 1.044 1.00 96.15 13 A 1 ATOM 94 C CG2 . VAL A 1 13 ? 3.880 -3.953 0.279 1.00 96.05 13 A 1 ATOM 95 N N . ALA A 1 14 ? -0.067 -6.082 0.025 1.00 98.43 14 A 1 ATOM 96 C CA . ALA A 1 14 ? -1.098 -7.081 0.279 1.00 98.36 14 A 1 ATOM 97 C C . ALA A 1 14 ? -1.672 -7.628 -1.023 1.00 98.45 14 A 1 ATOM 98 O O . ALA A 1 14 ? -1.875 -8.838 -1.166 1.00 98.09 14 A 1 ATOM 99 C CB . ALA A 1 14 ? -2.210 -6.473 1.125 1.00 98.08 14 A 1 ATOM 100 N N . VAL A 1 15 ? -1.932 -6.740 -1.970 1.00 98.28 15 A 1 ATOM 101 C CA . VAL A 1 15 ? -2.470 -7.125 -3.273 1.00 98.20 15 A 1 ATOM 102 C C . VAL A 1 15 ? -1.480 -8.012 -4.016 1.00 98.38 15 A 1 ATOM 103 O O . VAL A 1 15 ? -1.855 -9.041 -4.587 1.00 98.11 15 A 1 ATOM 104 C CB . VAL A 1 15 ? -2.801 -5.887 -4.121 1.00 97.79 15 A 1 ATOM 105 C CG1 . VAL A 1 15 ? -3.208 -6.293 -5.533 1.00 95.92 15 A 1 ATOM 106 C CG2 . VAL A 1 15 ? -3.910 -5.082 -3.469 1.00 95.93 15 A 1 ATOM 107 N N . SER A 1 16 ? -0.221 -7.615 -4.002 1.00 98.28 16 A 1 ATOM 108 C CA . SER A 1 16 ? 0.826 -8.378 -4.676 1.00 98.02 16 A 1 ATOM 109 C C . SER A 1 16 ? 0.929 -9.784 -4.097 1.00 98.28 16 A 1 ATOM 110 O O . SER A 1 16 ? 1.059 -10.765 -4.831 1.00 97.85 16 A 1 ATOM 111 C CB . SER A 1 16 ? 2.173 -7.667 -4.536 1.00 97.22 16 A 1 ATOM 112 O OG . SER A 1 16 ? 2.138 -6.397 -5.154 1.00 88.22 16 A 1 ATOM 113 N N . ALA A 1 17 ? 0.864 -9.875 -2.778 1.00 98.48 17 A 1 ATOM 114 C CA . ALA A 1 17 ? 0.937 -11.161 -2.096 1.00 98.38 17 A 1 ATOM 115 C C . ALA A 1 17 ? -0.255 -12.040 -2.458 1.00 98.52 17 A 1 ATOM 116 O O . ALA A 1 17 ? -0.110 -13.251 -2.649 1.00 98.09 17 A 1 ATOM 117 C CB . ALA A 1 17 ? 0.985 -10.946 -0.589 1.00 97.97 17 A 1 ATOM 118 N N . ALA A 1 18 ? -1.426 -11.432 -2.553 1.00 98.32 18 A 1 ATOM 119 C CA . ALA A 1 18 ? -2.645 -12.152 -2.903 1.00 98.26 18 A 1 ATOM 120 C C . ALA A 1 18 ? -2.596 -12.661 -4.339 1.00 98.43 18 A 1 ATOM 121 O O . ALA A 1 18 ? -3.070 -13.758 -4.638 1.00 97.93 18 A 1 ATOM 122 C CB . ALA A 1 18 ? -3.859 -11.249 -2.714 1.00 97.90 18 A 1 ATOM 123 N N . LEU A 1 19 ? -2.030 -11.853 -5.223 1.00 98.12 19 A 1 ATOM 124 C CA . LEU A 1 19 ? -1.913 -12.214 -6.631 1.00 98.06 19 A 1 ATOM 125 C C . LEU A 1 19 ? -0.987 -13.407 -6.814 1.00 98.18 19 A 1 ATOM 126 O O . LEU A 1 19 ? -1.230 -14.270 -7.664 1.00 97.50 19 A 1 ATOM 127 C CB . LEU A 1 19 ? -1.382 -11.023 -7.438 1.00 97.50 19 A 1 ATOM 128 C CG . LEU A 1 19 ? -2.378 -9.880 -7.626 1.00 94.98 19 A 1 ATOM 129 C CD1 . LEU A 1 19 ? -1.690 -8.661 -8.221 1.00 92.91 19 A 1 ATOM 130 C CD2 . LEU A 1 19 ? -3.534 -10.321 -8.513 1.00 91.79 19 A 1 ATOM 131 N N . ALA A 1 20 ? 0.076 -13.454 -6.013 1.00 96.28 20 A 1 ATOM 132 C CA . ALA A 1 20 ? 1.059 -14.532 -6.080 1.00 95.31 20 A 1 ATOM 133 C C . ALA A 1 20 ? 0.421 -15.863 -5.692 1.00 94.24 20 A 1 ATOM 134 O O . ALA A 1 20 ? 0.335 -16.764 -6.545 1.00 90.32 20 A 1 ATOM 135 C CB . ALA A 1 20 ? 2.244 -14.219 -5.175 1.00 91.95 20 A 1 ATOM 136 O OXT . ALA A 1 20 ? 0.008 -16.009 -4.546 1.00 83.29 20 A 1 #