# 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_spkb25863 # _entry.id spkb25863 # 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 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" "C3 H7 N O3" 105.093 SER y SERINE C([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 GLY 2 1 n ARG 3 1 n SER 4 1 n LYS 5 1 n ILE 6 1 n VAL 7 1 n LEU 8 1 n GLY 9 1 n ALA 10 1 n VAL 11 1 n VAL 12 1 n LEU 13 1 n ALA 14 1 n SER 15 1 n ALA 16 1 n LEU 17 1 n LEU 18 1 n ALA 19 1 n GLY 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 @ 2025-07-05 04:47:17)" _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 95.62 _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 82.93 1 1 A GLY 2 2 96.46 1 2 A ARG 3 2 90.02 1 3 A SER 4 2 96.69 1 4 A LYS 5 2 94.48 1 5 A ILE 6 2 97.03 1 6 A VAL 7 2 98.28 1 7 A LEU 8 2 96.86 1 8 A GLY 9 2 98.52 1 9 A ALA 10 2 98.62 1 10 A VAL 11 2 98.10 1 11 A VAL 12 2 98.26 1 12 A LEU 13 2 96.50 1 13 A ALA 14 2 98.60 1 14 A SER 15 2 97.07 1 15 A ALA 16 2 98.69 1 16 A LEU 17 2 97.04 1 17 A LEU 18 2 96.65 1 18 A ALA 19 2 98.10 1 19 A GLY 20 2 92.40 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 GLY . 2 A 2 A 3 1 n ARG . 3 A 3 A 4 1 n SER . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n ILE . 6 A 6 A 7 1 n VAL . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n GLY . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n VAL . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n ALA . 19 A 19 A 20 1 n GLY . 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 ? -3.386 -4.310 15.502 1.00 89.04 1 A 1 ATOM 2 C CA . MET A 1 1 ? -2.261 -3.349 15.474 1.00 90.54 1 A 1 ATOM 3 C C . MET A 1 1 ? -1.593 -3.340 14.106 1.00 91.12 1 A 1 ATOM 4 O O . MET A 1 1 ? -1.720 -4.293 13.342 1.00 84.98 1 A 1 ATOM 5 C CB . MET A 1 1 ? -1.233 -3.731 16.545 1.00 84.90 1 A 1 ATOM 6 C CG . MET A 1 1 ? -1.779 -3.530 17.947 1.00 80.82 1 A 1 ATOM 7 S SD . MET A 1 1 ? -0.630 -4.072 19.203 1.00 77.02 1 A 1 ATOM 8 C CE . MET A 1 1 ? -1.563 -3.695 20.668 1.00 65.04 1 A 1 ATOM 9 N N . GLY A 1 2 ? -0.892 -2.276 13.820 1.00 95.82 2 A 1 ATOM 10 C CA . GLY A 1 2 ? -0.226 -2.167 12.527 1.00 96.51 2 A 1 ATOM 11 C C . GLY A 1 2 ? -1.100 -1.499 11.482 1.00 97.27 2 A 1 ATOM 12 O O . GLY A 1 2 ? -1.184 -1.968 10.348 1.00 96.26 2 A 1 ATOM 13 N N . ARG A 1 3 ? -1.751 -0.424 11.876 1.00 97.59 3 A 1 ATOM 14 C CA . ARG A 1 3 ? -2.608 0.314 10.940 1.00 97.96 3 A 1 ATOM 15 C C . ARG A 1 3 ? -1.809 0.779 9.733 1.00 98.23 3 A 1 ATOM 16 O O . ARG A 1 3 ? -2.317 0.787 8.611 1.00 97.45 3 A 1 ATOM 17 C CB . ARG A 1 3 ? -3.228 1.523 11.641 1.00 97.10 3 A 1 ATOM 18 C CG . ARG A 1 3 ? -4.576 1.211 12.246 1.00 92.89 3 A 1 ATOM 19 C CD . ARG A 1 3 ? -5.051 2.378 13.103 1.00 89.84 3 A 1 ATOM 20 N NE . ARG A 1 3 ? -6.128 3.119 12.443 1.00 83.81 3 A 1 ATOM 21 C CZ . ARG A 1 3 ? -6.439 4.366 12.746 1.00 83.25 3 A 1 ATOM 22 N NH1 . ARG A 1 3 ? -5.723 5.060 13.604 1.00 76.13 3 A 1 ATOM 23 N NH2 . ARG A 1 3 ? -7.481 4.940 12.173 1.00 75.94 3 A 1 ATOM 24 N N . SER A 1 4 ? -0.561 1.166 9.970 1.00 98.12 4 A 1 ATOM 25 C CA . SER A 1 4 ? 0.318 1.627 8.896 1.00 98.39 4 A 1 ATOM 26 C C . SER A 1 4 ? 0.486 0.552 7.829 1.00 98.59 4 A 1 ATOM 27 O O . SER A 1 4 ? 0.550 0.852 6.637 1.00 98.17 4 A 1 ATOM 28 C CB . SER A 1 4 ? 1.679 2.017 9.461 1.00 97.81 4 A 1 ATOM 29 O OG . SER A 1 4 ? 1.534 3.060 10.406 1.00 89.03 4 A 1 ATOM 30 N N . LYS A 1 5 ? 0.551 -0.695 8.270 1.00 98.19 5 A 1 ATOM 31 C CA . LYS A 1 5 ? 0.711 -1.817 7.340 1.00 98.44 5 A 1 ATOM 32 C C . LYS A 1 5 ? -0.516 -1.934 6.441 1.00 98.60 5 A 1 ATOM 33 O O . LYS A 1 5 ? -0.393 -2.166 5.235 1.00 98.40 5 A 1 ATOM 34 C CB . LYS A 1 5 ? 0.917 -3.118 8.124 1.00 98.22 5 A 1 ATOM 35 C CG . LYS A 1 5 ? 2.146 -3.094 9.013 1.00 95.93 5 A 1 ATOM 36 C CD . LYS A 1 5 ? 3.435 -3.176 8.217 1.00 92.79 5 A 1 ATOM 37 C CE . LYS A 1 5 ? 3.741 -4.594 7.779 1.00 87.62 5 A 1 ATOM 38 N NZ . LYS A 1 5 ? 4.203 -5.430 8.920 1.00 82.09 5 A 1 ATOM 39 N N . ILE A 1 6 ? -1.690 -1.777 7.029 1.00 98.48 6 A 1 ATOM 40 C CA . ILE A 1 6 ? -2.941 -1.851 6.279 1.00 98.54 6 A 1 ATOM 41 C C . ILE A 1 6 ? -3.030 -0.708 5.277 1.00 98.62 6 A 1 ATOM 42 O O . ILE A 1 6 ? -3.381 -0.909 4.111 1.00 98.44 6 A 1 ATOM 43 C CB . ILE A 1 6 ? -4.144 -1.816 7.228 1.00 98.38 6 A 1 ATOM 44 C CG1 . ILE A 1 6 ? -4.052 -2.961 8.248 1.00 96.52 6 A 1 ATOM 45 C CG2 . ILE A 1 6 ? -5.446 -1.924 6.428 1.00 96.14 6 A 1 ATOM 46 C CD1 . ILE A 1 6 ? -4.078 -4.338 7.606 1.00 91.13 6 A 1 ATOM 47 N N . VAL A 1 7 ? -2.724 0.485 5.750 1.00 98.68 7 A 1 ATOM 48 C CA . VAL A 1 7 ? -2.758 1.672 4.897 1.00 98.72 7 A 1 ATOM 49 C C . VAL A 1 7 ? -1.744 1.543 3.770 1.00 98.75 7 A 1 ATOM 50 O O . VAL A 1 7 ? -2.041 1.854 2.612 1.00 98.61 7 A 1 ATOM 51 C CB . VAL A 1 7 ? -2.472 2.942 5.715 1.00 98.57 7 A 1 ATOM 52 C CG1 . VAL A 1 7 ? -2.449 4.171 4.815 1.00 97.37 7 A 1 ATOM 53 C CG2 . VAL A 1 7 ? -3.518 3.115 6.806 1.00 97.29 7 A 1 ATOM 54 N N . LEU A 1 8 ? -0.551 1.077 4.121 1.00 98.52 8 A 1 ATOM 55 C CA . LEU A 1 8 ? 0.508 0.896 3.137 1.00 98.56 8 A 1 ATOM 56 C C . LEU A 1 8 ? 0.079 -0.101 2.069 1.00 98.64 8 A 1 ATOM 57 O O . LEU A 1 8 ? 0.300 0.109 0.878 1.00 98.42 8 A 1 ATOM 58 C CB . LEU A 1 8 ? 1.788 0.405 3.824 1.00 98.33 8 A 1 ATOM 59 C CG . LEU A 1 8 ? 3.054 1.014 3.220 1.00 95.87 8 A 1 ATOM 60 C CD1 . LEU A 1 8 ? 3.329 2.378 3.833 1.00 93.37 8 A 1 ATOM 61 C CD2 . LEU A 1 8 ? 4.240 0.089 3.424 1.00 93.21 8 A 1 ATOM 62 N N . GLY A 1 9 ? -0.530 -1.184 2.521 1.00 98.47 9 A 1 ATOM 63 C CA . GLY A 1 9 ? -1.002 -2.209 1.596 1.00 98.50 9 A 1 ATOM 64 C C . GLY A 1 9 ? -2.023 -1.651 0.620 1.00 98.64 9 A 1 ATOM 65 O O . GLY A 1 9 ? -1.986 -1.944 -0.576 1.00 98.45 9 A 1 ATOM 66 N N . ALA A 1 10 ? -2.930 -0.839 1.146 1.00 98.66 10 A 1 ATOM 67 C CA . ALA A 1 10 ? -3.957 -0.220 0.313 1.00 98.70 10 A 1 ATOM 68 C C . ALA A 1 10 ? -3.331 0.723 -0.708 1.00 98.76 10 A 1 ATOM 69 O O . ALA A 1 10 ? -3.747 0.759 -1.869 1.00 98.49 10 A 1 ATOM 70 C CB . ALA A 1 10 ? -4.944 0.538 1.194 1.00 98.48 10 A 1 ATOM 71 N N . VAL A 1 11 ? -2.334 1.478 -0.270 1.00 98.70 11 A 1 ATOM 72 C CA . VAL A 1 11 ? -1.637 2.418 -1.151 1.00 98.68 11 A 1 ATOM 73 C C . VAL A 1 11 ? -0.913 1.669 -2.259 1.00 98.72 11 A 1 ATOM 74 O O . VAL A 1 11 ? -0.954 2.072 -3.425 1.00 98.49 11 A 1 ATOM 75 C CB . VAL A 1 11 ? -0.636 3.275 -0.359 1.00 98.46 11 A 1 ATOM 76 C CG1 . VAL A 1 11 ? 0.181 4.161 -1.296 1.00 96.78 11 A 1 ATOM 77 C CG2 . VAL A 1 11 ? -1.368 4.134 0.658 1.00 96.85 11 A 1 ATOM 78 N N . VAL A 1 12 ? -0.248 0.591 -1.884 1.00 98.72 12 A 1 ATOM 79 C CA . VAL A 1 12 ? 0.490 -0.218 -2.854 1.00 98.69 12 A 1 ATOM 80 C C . VAL A 1 12 ? -0.466 -0.800 -3.888 1.00 98.75 12 A 1 ATOM 81 O O . VAL A 1 12 ? -0.174 -0.810 -5.088 1.00 98.60 12 A 1 ATOM 82 C CB . VAL A 1 12 ? 1.256 -1.350 -2.152 1.00 98.47 12 A 1 ATOM 83 C CG1 . VAL A 1 12 ? 1.901 -2.283 -3.171 1.00 97.31 12 A 1 ATOM 84 C CG2 . VAL A 1 12 ? 2.326 -0.772 -1.237 1.00 97.25 12 A 1 ATOM 85 N N . LEU A 1 13 ? -1.593 -1.274 -3.410 1.00 98.64 13 A 1 ATOM 86 C CA . LEU A 1 13 ? -2.596 -1.855 -4.296 1.00 98.61 13 A 1 ATOM 87 C C . LEU A 1 13 ? -3.121 -0.809 -5.271 1.00 98.70 13 A 1 ATOM 88 O O . LEU A 1 13 ? -3.245 -1.062 -6.476 1.00 98.51 13 A 1 ATOM 89 C CB . LEU A 1 13 ? -3.745 -2.427 -3.464 1.00 98.30 13 A 1 ATOM 90 C CG . LEU A 1 13 ? -4.338 -3.696 -4.065 1.00 93.83 13 A 1 ATOM 91 C CD1 . LEU A 1 13 ? -4.568 -4.736 -2.981 1.00 92.49 13 A 1 ATOM 92 C CD2 . LEU A 1 13 ? -5.637 -3.391 -4.784 1.00 92.91 13 A 1 ATOM 93 N N . ALA A 1 14 ? -3.430 0.365 -4.741 1.00 98.70 14 A 1 ATOM 94 C CA . ALA A 1 14 ? -3.914 1.461 -5.574 1.00 98.67 14 A 1 ATOM 95 C C . ALA A 1 14 ? -2.850 1.884 -6.579 1.00 98.74 14 A 1 ATOM 96 O O . ALA A 1 14 ? -3.156 2.173 -7.739 1.00 98.47 14 A 1 ATOM 97 C CB . ALA A 1 14 ? -4.303 2.641 -4.694 1.00 98.41 14 A 1 ATOM 98 N N . SER A 1 15 ? -1.603 1.912 -6.124 1.00 98.69 15 A 1 ATOM 99 C CA . SER A 1 15 ? -0.481 2.286 -6.983 1.00 98.65 15 A 1 ATOM 100 C C . SER A 1 15 ? -0.313 1.276 -8.109 1.00 98.75 15 A 1 ATOM 101 O O . SER A 1 15 ? -0.045 1.648 -9.254 1.00 98.51 15 A 1 ATOM 102 C CB . SER A 1 15 ? 0.806 2.373 -6.162 1.00 98.28 15 A 1 ATOM 103 O OG . SER A 1 15 ? 1.859 2.864 -6.947 1.00 89.55 15 A 1 ATOM 104 N N . ALA A 1 16 ? -0.471 0.004 -7.777 1.00 98.76 16 A 1 ATOM 105 C CA . ALA A 1 16 ? -0.343 -1.060 -8.770 1.00 98.75 16 A 1 ATOM 106 C C . ALA A 1 16 ? -1.409 -0.915 -9.852 1.00 98.81 16 A 1 ATOM 107 O O . ALA A 1 16 ? -1.139 -1.116 -11.036 1.00 98.58 16 A 1 ATOM 108 C CB . ALA A 1 16 ? -0.462 -2.419 -8.094 1.00 98.54 16 A 1 ATOM 109 N N . LEU A 1 17 ? -2.611 -0.561 -9.431 1.00 98.73 17 A 1 ATOM 110 C CA . LEU A 1 17 ? -3.711 -0.363 -10.370 1.00 98.69 17 A 1 ATOM 111 C C . LEU A 1 17 ? -3.466 0.862 -11.241 1.00 98.72 17 A 1 ATOM 112 O O . LEU A 1 17 ? -3.733 0.844 -12.447 1.00 98.44 17 A 1 ATOM 113 C CB . LEU A 1 17 ? -5.020 -0.199 -9.598 1.00 98.49 17 A 1 ATOM 114 C CG . LEU A 1 17 ? -5.684 -1.535 -9.260 1.00 95.98 17 A 1 ATOM 115 C CD1 . LEU A 1 17 ? -6.676 -1.372 -8.123 1.00 93.79 17 A 1 ATOM 116 C CD2 . LEU A 1 17 ? -6.394 -2.081 -10.500 1.00 93.48 17 A 1 ATOM 117 N N . LEU A 1 18 ? -2.977 1.921 -10.613 1.00 98.73 18 A 1 ATOM 118 C CA . LEU A 1 18 ? -2.687 3.162 -11.328 1.00 98.62 18 A 1 ATOM 119 C C . LEU A 1 18 ? -1.506 2.985 -12.267 1.00 98.64 18 A 1 ATOM 120 O O . LEU A 1 18 ? -1.563 3.384 -13.435 1.00 98.24 18 A 1 ATOM 121 C CB . LEU A 1 18 ? -2.401 4.286 -10.332 1.00 98.28 18 A 1 ATOM 122 C CG . LEU A 1 18 ? -2.563 5.677 -10.940 1.00 95.58 18 A 1 ATOM 123 C CD1 . LEU A 1 18 ? -3.522 6.515 -10.106 1.00 92.82 18 A 1 ATOM 124 C CD2 . LEU A 1 18 ? -1.226 6.377 -11.055 1.00 92.27 18 A 1 ATOM 125 N N . ALA A 1 19 ? -0.431 2.394 -11.752 1.00 98.52 19 A 1 ATOM 126 C CA . ALA A 1 19 ? 0.771 2.163 -12.552 1.00 98.31 19 A 1 ATOM 127 C C . ALA A 1 19 ? 0.497 1.163 -13.660 1.00 98.33 19 A 1 ATOM 128 O O . ALA A 1 19 ? 0.835 1.401 -14.821 1.00 97.56 19 A 1 ATOM 129 C CB . ALA A 1 19 ? 1.907 1.676 -11.661 1.00 97.76 19 A 1 ATOM 130 N N . GLY A 1 20 ? -0.132 0.040 -13.269 1.00 96.84 20 A 1 ATOM 131 C CA . GLY A 1 20 ? -0.462 -1.002 -14.241 1.00 95.02 20 A 1 ATOM 132 C C . GLY A 1 20 ? 0.723 -1.350 -15.130 1.00 92.61 20 A 1 ATOM 133 O O . GLY A 1 20 ? 0.582 -1.338 -16.354 1.00 85.35 20 A 1 ATOM 134 O OXT . GLY A 1 20 ? 1.808 -1.638 -14.601 1.00 92.20 20 A 1 #