# 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_spkb26991 # _entry.id spkb26991 # 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" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)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" "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 SER 2 1 n ILE 3 1 n LEU 4 1 n PHE 5 1 n TYR 6 1 n VAL 7 1 n ILE 8 1 n PHE 9 1 n LEU 10 1 n ALA 11 1 n TYR 12 1 n LEU 13 1 n ARG 14 1 n GLY 15 1 n ILE 16 1 n GLN 17 1 n SER 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 @ 2025-07-03 12:57:04)" _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 93.04 _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 84.81 1 1 A SER 2 2 92.51 1 2 A ILE 3 2 95.20 1 3 A LEU 4 2 95.04 1 4 A PHE 5 2 93.88 1 5 A TYR 6 2 95.69 1 6 A VAL 7 2 97.40 1 7 A ILE 8 2 96.22 1 8 A PHE 9 2 95.00 1 9 A LEU 10 2 94.48 1 10 A ALA 11 2 98.06 1 11 A TYR 12 2 94.68 1 12 A LEU 13 2 95.91 1 13 A ARG 14 2 87.81 1 14 A GLY 15 2 97.23 1 15 A ILE 16 2 92.25 1 16 A GLN 17 2 86.87 1 17 A SER 18 2 84.49 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 SER . 2 A 2 A 3 1 n ILE . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n PHE . 5 A 5 A 6 1 n TYR . 6 A 6 A 7 1 n VAL . 7 A 7 A 8 1 n ILE . 8 A 8 A 9 1 n PHE . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n ALA . 11 A 11 A 12 1 n TYR . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n ARG . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n ILE . 16 A 16 A 17 1 n GLN . 17 A 17 A 18 1 n SER . 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 ? -13.076 3.159 0.459 1.00 91.43 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.441 2.591 1.663 1.00 93.43 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.213 1.763 1.300 1.00 94.28 1 A 1 ATOM 4 O O . MET A 1 1 ? -10.193 1.827 1.982 1.00 92.05 1 A 1 ATOM 5 C CB . MET A 1 1 ? -13.439 1.714 2.426 1.00 86.66 1 A 1 ATOM 6 C CG . MET A 1 1 ? -14.443 2.542 3.208 1.00 78.70 1 A 1 ATOM 7 S SD . MET A 1 1 ? -15.525 1.526 4.207 1.00 75.25 1 A 1 ATOM 8 C CE . MET A 1 1 ? -16.349 2.795 5.155 1.00 66.71 1 A 1 ATOM 9 N N . SER A 1 2 ? -11.322 1.005 0.228 1.00 91.51 2 A 1 ATOM 10 C CA . SER A 1 2 ? -10.199 0.184 -0.225 1.00 95.80 2 A 1 ATOM 11 C C . SER A 1 2 ? -9.004 1.048 -0.604 1.00 97.24 2 A 1 ATOM 12 O O . SER A 1 2 ? -7.857 0.698 -0.328 1.00 96.20 2 A 1 ATOM 13 C CB . SER A 1 2 ? -10.614 -0.675 -1.416 1.00 91.92 2 A 1 ATOM 14 O OG . SER A 1 2 ? -11.656 -1.554 -1.070 1.00 82.41 2 A 1 ATOM 15 N N . ILE A 1 3 ? -9.293 2.176 -1.233 1.00 97.33 3 A 1 ATOM 16 C CA . ILE A 1 3 ? -8.238 3.099 -1.639 1.00 97.75 3 A 1 ATOM 17 C C . ILE A 1 3 ? -7.526 3.669 -0.416 1.00 98.11 3 A 1 ATOM 18 O O . ILE A 1 3 ? -6.330 3.965 -0.465 1.00 97.70 3 A 1 ATOM 19 C CB . ILE A 1 3 ? -8.806 4.239 -2.509 1.00 97.19 3 A 1 ATOM 20 C CG1 . ILE A 1 3 ? -7.681 5.061 -3.123 1.00 93.74 3 A 1 ATOM 21 C CG2 . ILE A 1 3 ? -9.732 5.139 -1.685 1.00 92.73 3 A 1 ATOM 22 C CD1 . ILE A 1 3 ? -6.969 4.349 -4.244 1.00 87.03 3 A 1 ATOM 23 N N . LEU A 1 4 ? -8.249 3.815 0.669 1.00 97.91 4 A 1 ATOM 24 C CA . LEU A 1 4 ? -7.691 4.338 1.913 1.00 97.96 4 A 1 ATOM 25 C C . LEU A 1 4 ? -6.594 3.410 2.428 1.00 98.16 4 A 1 ATOM 26 O O . LEU A 1 4 ? -5.527 3.851 2.851 1.00 97.98 4 A 1 ATOM 27 C CB . LEU A 1 4 ? -8.791 4.484 2.967 1.00 97.60 4 A 1 ATOM 28 C CG . LEU A 1 4 ? -8.740 5.770 3.789 1.00 92.25 4 A 1 ATOM 29 C CD1 . LEU A 1 4 ? -7.386 5.936 4.462 1.00 89.08 4 A 1 ATOM 30 C CD2 . LEU A 1 4 ? -9.039 6.964 2.893 1.00 89.41 4 A 1 ATOM 31 N N . PHE A 1 5 ? -6.876 2.110 2.382 1.00 97.92 5 A 1 ATOM 32 C CA . PHE A 1 5 ? -5.921 1.097 2.823 1.00 97.95 5 A 1 ATOM 33 C C . PHE A 1 5 ? -4.677 1.138 1.939 1.00 98.08 5 A 1 ATOM 34 O O . PHE A 1 5 ? -3.551 1.000 2.416 1.00 97.66 5 A 1 ATOM 35 C CB . PHE A 1 5 ? -6.560 -0.287 2.754 1.00 97.48 5 A 1 ATOM 36 C CG . PHE A 1 5 ? -5.940 -1.274 3.709 1.00 94.87 5 A 1 ATOM 37 C CD1 . PHE A 1 5 ? -4.586 -1.267 3.978 1.00 91.19 5 A 1 ATOM 38 C CD2 . PHE A 1 5 ? -6.735 -2.217 4.344 1.00 90.96 5 A 1 ATOM 39 C CE1 . PHE A 1 5 ? -4.019 -2.173 4.859 1.00 89.20 5 A 1 ATOM 40 C CE2 . PHE A 1 5 ? -6.180 -3.130 5.221 1.00 88.42 5 A 1 ATOM 41 C CZ . PHE A 1 5 ? -4.817 -3.106 5.478 1.00 88.95 5 A 1 ATOM 42 N N . TYR A 1 6 ? -4.890 1.321 0.650 1.00 98.10 6 A 1 ATOM 43 C CA . TYR A 1 6 ? -3.793 1.383 -0.313 1.00 98.16 6 A 1 ATOM 44 C C . TYR A 1 6 ? -2.881 2.576 -0.026 1.00 98.20 6 A 1 ATOM 45 O O . TYR A 1 6 ? -1.657 2.468 -0.124 1.00 97.90 6 A 1 ATOM 46 C CB . TYR A 1 6 ? -4.352 1.477 -1.733 1.00 98.00 6 A 1 ATOM 47 C CG . TYR A 1 6 ? -3.284 1.339 -2.791 1.00 96.77 6 A 1 ATOM 48 C CD1 . TYR A 1 6 ? -2.676 0.110 -3.029 1.00 94.33 6 A 1 ATOM 49 C CD2 . TYR A 1 6 ? -2.891 2.431 -3.550 1.00 94.45 6 A 1 ATOM 50 C CE1 . TYR A 1 6 ? -1.698 -0.021 -4.001 1.00 92.94 6 A 1 ATOM 51 C CE2 . TYR A 1 6 ? -1.909 2.306 -4.522 1.00 92.95 6 A 1 ATOM 52 C CZ . TYR A 1 6 ? -1.316 1.079 -4.744 1.00 93.83 6 A 1 ATOM 53 O OH . TYR A 1 6 ? -0.346 0.951 -5.706 1.00 92.60 6 A 1 ATOM 54 N N . VAL A 1 7 ? -3.477 3.696 0.320 1.00 98.11 7 A 1 ATOM 55 C CA . VAL A 1 7 ? -2.717 4.911 0.626 1.00 98.13 7 A 1 ATOM 56 C C . VAL A 1 7 ? -1.809 4.699 1.834 1.00 98.22 7 A 1 ATOM 57 O O . VAL A 1 7 ? -0.633 5.063 1.810 1.00 97.82 7 A 1 ATOM 58 C CB . VAL A 1 7 ? -3.658 6.099 0.899 1.00 97.78 7 A 1 ATOM 59 C CG1 . VAL A 1 7 ? -2.864 7.328 1.318 1.00 96.03 7 A 1 ATOM 60 C CG2 . VAL A 1 7 ? -4.487 6.410 -0.335 1.00 95.68 7 A 1 ATOM 61 N N . ILE A 1 8 ? -2.365 4.116 2.863 1.00 97.94 8 A 1 ATOM 62 C CA . ILE A 1 8 ? -1.605 3.848 4.084 1.00 97.82 8 A 1 ATOM 63 C C . ILE A 1 8 ? -0.508 2.820 3.822 1.00 97.84 8 A 1 ATOM 64 O O . ILE A 1 8 ? 0.630 2.976 4.276 1.00 97.57 8 A 1 ATOM 65 C CB . ILE A 1 8 ? -2.527 3.338 5.203 1.00 97.65 8 A 1 ATOM 66 C CG1 . ILE A 1 8 ? -3.616 4.363 5.511 1.00 96.03 8 A 1 ATOM 67 C CG2 . ILE A 1 8 ? -1.710 3.045 6.459 1.00 95.36 8 A 1 ATOM 68 C CD1 . ILE A 1 8 ? -4.705 3.825 6.411 1.00 89.55 8 A 1 ATOM 69 N N . PHE A 1 9 ? -0.868 1.767 3.098 1.00 97.66 9 A 1 ATOM 70 C CA . PHE A 1 9 ? 0.077 0.702 2.771 1.00 97.54 9 A 1 ATOM 71 C C . PHE A 1 9 ? 1.221 1.230 1.910 1.00 97.65 9 A 1 ATOM 72 O O . PHE A 1 9 ? 2.386 0.917 2.153 1.00 97.35 9 A 1 ATOM 73 C CB . PHE A 1 9 ? -0.649 -0.422 2.034 1.00 97.26 9 A 1 ATOM 74 C CG . PHE A 1 9 ? 0.236 -1.605 1.739 1.00 95.89 9 A 1 ATOM 75 C CD1 . PHE A 1 9 ? 0.764 -2.363 2.768 1.00 92.59 9 A 1 ATOM 76 C CD2 . PHE A 1 9 ? 0.525 -1.953 0.430 1.00 93.34 9 A 1 ATOM 77 C CE1 . PHE A 1 9 ? 1.576 -3.454 2.497 1.00 91.81 9 A 1 ATOM 78 C CE2 . PHE A 1 9 ? 1.338 -3.042 0.153 1.00 91.97 9 A 1 ATOM 79 C CZ . PHE A 1 9 ? 1.865 -3.796 1.187 1.00 91.98 9 A 1 ATOM 80 N N . LEU A 1 10 ? 0.881 2.023 0.912 1.00 97.74 10 A 1 ATOM 81 C CA . LEU A 1 10 ? 1.876 2.593 0.007 1.00 97.58 10 A 1 ATOM 82 C C . LEU A 1 10 ? 2.816 3.534 0.753 1.00 97.67 10 A 1 ATOM 83 O O . LEU A 1 10 ? 4.028 3.504 0.545 1.00 97.37 10 A 1 ATOM 84 C CB . LEU A 1 10 ? 1.180 3.346 -1.126 1.00 97.21 10 A 1 ATOM 85 C CG . LEU A 1 10 ? 2.123 3.962 -2.155 1.00 91.27 10 A 1 ATOM 86 C CD1 . LEU A 1 10 ? 2.889 2.876 -2.898 1.00 88.10 10 A 1 ATOM 87 C CD2 . LEU A 1 10 ? 1.345 4.821 -3.133 1.00 88.89 10 A 1 ATOM 88 N N . ALA A 1 11 ? 2.263 4.366 1.602 1.00 98.20 11 A 1 ATOM 89 C CA . ALA A 1 11 ? 3.054 5.308 2.386 1.00 98.19 11 A 1 ATOM 90 C C . ALA A 1 11 ? 3.983 4.573 3.347 1.00 98.25 11 A 1 ATOM 91 O O . ALA A 1 11 ? 5.111 5.004 3.580 1.00 97.78 11 A 1 ATOM 92 C CB . ALA A 1 11 ? 2.134 6.240 3.164 1.00 97.90 11 A 1 ATOM 93 N N . TYR A 1 12 ? 3.493 3.478 3.890 1.00 98.30 12 A 1 ATOM 94 C CA . TYR A 1 12 ? 4.274 2.666 4.818 1.00 98.23 12 A 1 ATOM 95 C C . TYR A 1 12 ? 5.491 2.060 4.124 1.00 98.21 12 A 1 ATOM 96 O O . TYR A 1 12 ? 6.612 2.150 4.629 1.00 97.70 12 A 1 ATOM 97 C CB . TYR A 1 12 ? 3.399 1.556 5.397 1.00 97.92 12 A 1 ATOM 98 C CG . TYR A 1 12 ? 4.164 0.611 6.299 1.00 95.83 12 A 1 ATOM 99 C CD1 . TYR A 1 12 ? 4.626 1.032 7.537 1.00 92.10 12 A 1 ATOM 100 C CD2 . TYR A 1 12 ? 4.418 -0.695 5.905 1.00 92.65 12 A 1 ATOM 101 C CE1 . TYR A 1 12 ? 5.325 0.168 8.365 1.00 90.89 12 A 1 ATOM 102 C CE2 . TYR A 1 12 ? 5.121 -1.563 6.729 1.00 91.89 12 A 1 ATOM 103 C CZ . TYR A 1 12 ? 5.571 -1.125 7.955 1.00 91.84 12 A 1 ATOM 104 O OH . TYR A 1 12 ? 6.268 -1.981 8.772 1.00 90.55 12 A 1 ATOM 105 N N . LEU A 1 13 ? 5.265 1.442 2.974 1.00 98.00 13 A 1 ATOM 106 C CA . LEU A 1 13 ? 6.338 0.815 2.212 1.00 97.84 13 A 1 ATOM 107 C C . LEU A 1 13 ? 7.354 1.843 1.736 1.00 97.78 13 A 1 ATOM 108 O O . LEU A 1 13 ? 8.561 1.613 1.804 1.00 97.20 13 A 1 ATOM 109 C CB . LEU A 1 13 ? 5.764 0.068 1.003 1.00 97.52 13 A 1 ATOM 110 C CG . LEU A 1 13 ? 5.001 -1.210 1.324 1.00 95.67 13 A 1 ATOM 111 C CD1 . LEU A 1 13 ? 4.393 -1.786 0.054 1.00 91.74 13 A 1 ATOM 112 C CD2 . LEU A 1 13 ? 5.912 -2.239 1.975 1.00 91.55 13 A 1 ATOM 113 N N . ARG A 1 14 ? 6.871 2.967 1.256 1.00 98.07 14 A 1 ATOM 114 C CA . ARG A 1 14 ? 7.743 4.032 0.767 1.00 97.77 14 A 1 ATOM 115 C C . ARG A 1 14 ? 8.556 4.648 1.895 1.00 97.70 14 A 1 ATOM 116 O O . ARG A 1 14 ? 9.689 5.073 1.684 1.00 95.72 14 A 1 ATOM 117 C CB . ARG A 1 14 ? 6.919 5.119 0.076 1.00 96.86 14 A 1 ATOM 118 C CG . ARG A 1 14 ? 6.593 4.783 -1.365 1.00 89.27 14 A 1 ATOM 119 C CD . ARG A 1 14 ? 6.276 6.039 -2.146 1.00 87.59 14 A 1 ATOM 120 N NE . ARG A 1 14 ? 6.277 5.792 -3.583 1.00 82.22 14 A 1 ATOM 121 C CZ . ARG A 1 14 ? 6.310 6.754 -4.497 1.00 77.50 14 A 1 ATOM 122 N NH1 . ARG A 1 14 ? 6.338 8.025 -4.135 1.00 72.57 14 A 1 ATOM 123 N NH2 . ARG A 1 14 ? 6.317 6.445 -5.782 1.00 70.63 14 A 1 ATOM 124 N N . GLY A 1 15 ? 7.980 4.699 3.062 1.00 97.56 15 A 1 ATOM 125 C CA . GLY A 1 15 ? 8.652 5.275 4.212 1.00 97.44 15 A 1 ATOM 126 C C . GLY A 1 15 ? 9.731 4.378 4.785 1.00 97.57 15 A 1 ATOM 127 O O . GLY A 1 15 ? 10.815 4.844 5.129 1.00 96.34 15 A 1 ATOM 128 N N . ILE A 1 16 ? 9.437 3.093 4.880 1.00 97.34 16 A 1 ATOM 129 C CA . ILE A 1 16 ? 10.381 2.130 5.439 1.00 96.71 16 A 1 ATOM 130 C C . ILE A 1 16 ? 11.399 1.648 4.414 1.00 96.46 16 A 1 ATOM 131 O O . ILE A 1 16 ? 12.561 1.418 4.748 1.00 94.52 16 A 1 ATOM 132 C CB . ILE A 1 16 ? 9.648 0.905 6.019 1.00 95.31 16 A 1 ATOM 133 C CG1 . ILE A 1 16 ? 8.811 0.206 4.952 1.00 89.26 16 A 1 ATOM 134 C CG2 . ILE A 1 16 ? 8.785 1.327 7.198 1.00 87.29 16 A 1 ATOM 135 C CD1 . ILE A 1 16 ? 8.407 -1.191 5.339 1.00 81.15 16 A 1 ATOM 136 N N . GLN A 1 17 ? 10.951 1.484 3.178 1.00 95.61 17 A 1 ATOM 137 C CA . GLN A 1 17 ? 11.815 0.985 2.112 1.00 94.89 17 A 1 ATOM 138 C C . GLN A 1 17 ? 12.731 2.075 1.559 1.00 93.36 17 A 1 ATOM 139 O O . GLN A 1 17 ? 13.946 1.900 1.478 1.00 88.40 17 A 1 ATOM 140 C CB . GLN A 1 17 ? 10.976 0.379 0.983 1.00 92.29 17 A 1 ATOM 141 C CG . GLN A 1 17 ? 11.398 -1.037 0.652 1.00 86.02 17 A 1 ATOM 142 C CD . GLN A 1 17 ? 10.618 -1.634 -0.500 1.00 81.84 17 A 1 ATOM 143 O OE1 . GLN A 1 17 ? 9.410 -1.799 -0.432 1.00 76.38 17 A 1 ATOM 144 N NE2 . GLN A 1 17 ? 11.302 -1.967 -1.578 1.00 73.00 17 A 1 ATOM 145 N N . SER A 1 18 ? 12.135 3.181 1.176 1.00 93.18 18 A 1 ATOM 146 C CA . SER A 1 18 ? 12.891 4.298 0.600 1.00 90.70 18 A 1 ATOM 147 C C . SER A 1 18 ? 12.156 5.606 0.801 1.00 86.99 18 A 1 ATOM 148 O O . SER A 1 18 ? 12.817 6.649 0.932 1.00 79.45 18 A 1 ATOM 149 C CB . SER A 1 18 ? 13.135 4.059 -0.894 1.00 85.52 18 A 1 ATOM 150 O OG . SER A 1 18 ? 14.082 3.036 -1.097 1.00 77.44 18 A 1 ATOM 151 O OXT . SER A 1 18 ? 10.926 5.589 0.819 1.00 78.15 18 A 1 #