# 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_ral # _entry.id ral # 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" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[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" "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" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "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" "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" "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 THR 2 1 n THR 3 1 n THR 4 1 n ILE 5 1 n ASP 6 1 n LYS 7 1 n ASN 8 1 n GLN 9 1 n TRP 10 1 n CYS 11 1 n GLY 12 1 n GLN 13 1 n PHE 14 1 n LYS 15 1 n ARG 16 1 n CYS 17 1 n ASN 18 1 n GLY 19 1 n CYS 20 1 n LYS 21 1 n LEU 22 1 n GLN 23 1 n SER 24 1 n GLU 25 1 n CYS 26 1 n MET 27 1 n VAL 28 1 n LYS 29 1 n PRO 30 1 n GLU 31 1 n GLU 32 1 n MET 33 1 n PHE 34 1 n PRO 35 1 n VAL 36 1 n MET 37 1 n GLU 38 1 n ASP 39 1 n GLY 40 1 n LYS 41 1 n TYR 42 1 n VAL 43 1 n ASP 44 1 n LYS 45 1 n TRP 46 1 n ALA 47 1 n ILE 48 1 n ARG 49 1 n THR 50 1 n THR 51 1 n ALA 52 1 n MET 53 1 n ILE 54 1 n ALA 55 1 n ARG 56 1 n GLU 57 1 n LEU 58 1 n GLY 59 1 n LYS 60 1 n GLN 61 1 n ASN 62 1 n ASN 63 1 n LYS 64 1 n ALA 65 1 n ALA 66 # _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 (3.0.1 @ 2025-04-07 01:09:38)" _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 84.30 _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 34.35 1 1 A THR 2 2 40.02 1 2 A THR 3 2 49.79 1 3 A THR 4 2 53.73 1 4 A ILE 5 2 59.71 1 5 A ASP 6 2 63.99 1 6 A LYS 7 2 75.67 1 7 A ASN 8 2 80.40 1 8 A GLN 9 2 82.12 1 9 A TRP 10 2 92.52 1 10 A CYS 11 2 91.14 1 11 A GLY 12 2 91.89 1 12 A GLN 13 2 89.91 1 13 A PHE 14 2 93.61 1 14 A LYS 15 2 84.20 1 15 A ARG 16 2 79.17 1 16 A CYS 17 2 90.46 1 17 A ASN 18 2 88.63 1 18 A GLY 19 2 93.51 1 19 A CYS 20 2 93.84 1 20 A LYS 21 2 86.11 1 21 A LEU 22 2 93.42 1 22 A GLN 23 2 87.62 1 23 A SER 24 2 90.53 1 24 A GLU 25 2 85.76 1 25 A CYS 26 2 91.01 1 26 A MET 27 2 86.07 1 27 A VAL 28 2 92.69 1 28 A LYS 29 2 90.12 1 29 A PRO 30 2 93.94 1 30 A GLU 31 2 85.01 1 31 A GLU 32 2 91.29 1 32 A MET 33 2 87.57 1 33 A PHE 34 2 86.51 1 34 A PRO 35 2 90.49 1 35 A VAL 36 2 89.47 1 36 A MET 37 2 87.13 1 37 A GLU 38 2 86.57 1 38 A ASP 39 2 87.80 1 39 A GLY 40 2 94.12 1 40 A LYS 41 2 84.55 1 41 A TYR 42 2 85.15 1 42 A VAL 43 2 90.42 1 43 A ASP 44 2 89.12 1 44 A LYS 45 2 86.19 1 45 A TRP 46 2 91.16 1 46 A ALA 47 2 90.40 1 47 A ILE 48 2 89.31 1 48 A ARG 49 2 89.72 1 49 A THR 50 2 90.44 1 50 A THR 51 2 88.06 1 51 A ALA 52 2 91.60 1 52 A MET 53 2 88.51 1 53 A ILE 54 2 91.70 1 54 A ALA 55 2 90.65 1 55 A ARG 56 2 80.30 1 56 A GLU 57 2 89.88 1 57 A LEU 58 2 89.10 1 58 A GLY 59 2 90.62 1 59 A LYS 60 2 89.04 1 60 A GLN 61 2 86.74 1 61 A ASN 62 2 82.49 1 62 A ASN 63 2 83.16 1 63 A LYS 64 2 76.20 1 64 A ALA 65 2 76.73 1 65 A ALA 66 2 71.72 1 66 # _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 THR . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n ILE . 5 A 5 A 6 1 n ASP . 6 A 6 A 7 1 n LYS . 7 A 7 A 8 1 n ASN . 8 A 8 A 9 1 n GLN . 9 A 9 A 10 1 n TRP . 10 A 10 A 11 1 n CYS . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n GLN . 13 A 13 A 14 1 n PHE . 14 A 14 A 15 1 n LYS . 15 A 15 A 16 1 n ARG . 16 A 16 A 17 1 n CYS . 17 A 17 A 18 1 n ASN . 18 A 18 A 19 1 n GLY . 19 A 19 A 20 1 n CYS . 20 A 20 A 21 1 n LYS . 21 A 21 A 22 1 n LEU . 22 A 22 A 23 1 n GLN . 23 A 23 A 24 1 n SER . 24 A 24 A 25 1 n GLU . 25 A 25 A 26 1 n CYS . 26 A 26 A 27 1 n MET . 27 A 27 A 28 1 n VAL . 28 A 28 A 29 1 n LYS . 29 A 29 A 30 1 n PRO . 30 A 30 A 31 1 n GLU . 31 A 31 A 32 1 n GLU . 32 A 32 A 33 1 n MET . 33 A 33 A 34 1 n PHE . 34 A 34 A 35 1 n PRO . 35 A 35 A 36 1 n VAL . 36 A 36 A 37 1 n MET . 37 A 37 A 38 1 n GLU . 38 A 38 A 39 1 n ASP . 39 A 39 A 40 1 n GLY . 40 A 40 A 41 1 n LYS . 41 A 41 A 42 1 n TYR . 42 A 42 A 43 1 n VAL . 43 A 43 A 44 1 n ASP . 44 A 44 A 45 1 n LYS . 45 A 45 A 46 1 n TRP . 46 A 46 A 47 1 n ALA . 47 A 47 A 48 1 n ILE . 48 A 48 A 49 1 n ARG . 49 A 49 A 50 1 n THR . 50 A 50 A 51 1 n THR . 51 A 51 A 52 1 n ALA . 52 A 52 A 53 1 n MET . 53 A 53 A 54 1 n ILE . 54 A 54 A 55 1 n ALA . 55 A 55 A 56 1 n ARG . 56 A 56 A 57 1 n GLU . 57 A 57 A 58 1 n LEU . 58 A 58 A 59 1 n GLY . 59 A 59 A 60 1 n LYS . 60 A 60 A 61 1 n GLN . 61 A 61 A 62 1 n ASN . 62 A 62 A 63 1 n ASN . 63 A 63 A 64 1 n LYS . 64 A 64 A 65 1 n ALA . 65 A 65 A 66 1 n ALA . 66 A 66 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fa08f1a239cfd4fd49a5c37bef32bd41139da97e359ba389d3209450484ef018)" # _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 ? 0.191 -2.335 -17.014 1.00 34.84 1 A 1 ATOM 2 C CA . MET A 1 1 ? 0.057 -0.943 -16.544 1.00 38.66 1 A 1 ATOM 3 C C . MET A 1 1 ? 0.205 -0.974 -15.038 1.00 41.22 1 A 1 ATOM 4 O O . MET A 1 1 ? -0.693 -1.453 -14.359 1.00 38.69 1 A 1 ATOM 5 C CB . MET A 1 1 ? -1.297 -0.339 -16.946 1.00 36.12 1 A 1 ATOM 6 C CG . MET A 1 1 ? -1.423 -0.160 -18.466 1.00 31.34 1 A 1 ATOM 7 S SD . MET A 1 1 ? -3.035 0.502 -18.952 1.00 28.78 1 A 1 ATOM 8 C CE . MET A 1 1 ? -2.878 0.477 -20.752 1.00 25.15 1 A 1 ATOM 9 N N . THR A 1 2 ? 1.370 -0.591 -14.532 1.00 40.40 2 A 1 ATOM 10 C CA . THR A 1 2 ? 1.636 -0.571 -13.092 1.00 42.93 2 A 1 ATOM 11 C C . THR A 1 2 ? 0.903 0.635 -12.521 1.00 44.68 2 A 1 ATOM 12 O O . THR A 1 2 ? 1.328 1.768 -12.722 1.00 42.13 2 A 1 ATOM 13 C CB . THR A 1 2 ? 3.145 -0.486 -12.821 1.00 40.09 2 A 1 ATOM 14 O OG1 . THR A 1 2 ? 3.828 -1.396 -13.659 1.00 35.21 2 A 1 ATOM 15 C CG2 . THR A 1 2 ? 3.500 -0.848 -11.383 1.00 34.70 2 A 1 ATOM 16 N N . THR A 1 3 ? -0.230 0.400 -11.864 1.00 52.30 3 A 1 ATOM 17 C CA . THR A 1 3 ? -0.939 1.435 -11.114 1.00 52.99 3 A 1 ATOM 18 C C . THR A 1 3 ? -0.099 1.773 -9.888 1.00 54.21 3 A 1 ATOM 19 O O . THR A 1 3 ? -0.292 1.224 -8.808 1.00 51.34 3 A 1 ATOM 20 C CB . THR A 1 3 ? -2.376 1.014 -10.728 1.00 49.80 3 A 1 ATOM 21 O OG1 . THR A 1 3 ? -2.661 -0.313 -11.123 1.00 44.74 3 A 1 ATOM 22 C CG2 . THR A 1 3 ? -3.415 1.899 -11.407 1.00 43.17 3 A 1 ATOM 23 N N . THR A 1 4 ? 0.889 2.643 -10.077 1.00 56.91 4 A 1 ATOM 24 C CA . THR A 1 4 ? 1.632 3.234 -8.966 1.00 57.75 4 A 1 ATOM 25 C C . THR A 1 4 ? 0.675 4.180 -8.261 1.00 58.65 4 A 1 ATOM 26 O O . THR A 1 4 ? 0.492 5.323 -8.663 1.00 55.82 4 A 1 ATOM 27 C CB . THR A 1 4 ? 2.893 3.970 -9.443 1.00 53.66 4 A 1 ATOM 28 O OG1 . THR A 1 4 ? 3.671 3.108 -10.244 1.00 47.58 4 A 1 ATOM 29 C CG2 . THR A 1 4 ? 3.776 4.403 -8.271 1.00 45.75 4 A 1 ATOM 30 N N . ILE A 1 5 ? -0.008 3.658 -7.247 1.00 62.51 5 A 1 ATOM 31 C CA . ILE A 1 5 ? -0.864 4.479 -6.397 1.00 63.89 5 A 1 ATOM 32 C C . ILE A 1 5 ? 0.066 5.355 -5.580 1.00 67.32 5 A 1 ATOM 33 O O . ILE A 1 5 ? 0.879 4.853 -4.800 1.00 63.57 5 A 1 ATOM 34 C CB . ILE A 1 5 ? -1.790 3.599 -5.539 1.00 60.32 5 A 1 ATOM 35 C CG1 . ILE A 1 5 ? -2.768 2.847 -6.471 1.00 55.48 5 A 1 ATOM 36 C CG2 . ILE A 1 5 ? -2.560 4.454 -4.512 1.00 53.93 5 A 1 ATOM 37 C CD1 . ILE A 1 5 ? -3.362 1.615 -5.833 1.00 50.64 5 A 1 ATOM 38 N N . ASP A 1 6 ? -0.043 6.652 -5.791 1.00 68.37 6 A 1 ATOM 39 C CA . ASP A 1 6 ? 0.794 7.619 -5.110 1.00 70.98 6 A 1 ATOM 40 C C . ASP A 1 6 ? 0.358 7.718 -3.645 1.00 76.59 6 A 1 ATOM 41 O O . ASP A 1 6 ? -0.547 8.455 -3.259 1.00 74.81 6 A 1 ATOM 42 C CB . ASP A 1 6 ? 0.781 8.956 -5.860 1.00 64.04 6 A 1 ATOM 43 C CG . ASP A 1 6 ? 2.011 9.785 -5.487 1.00 56.04 6 A 1 ATOM 44 O OD1 . ASP A 1 6 ? 2.435 9.694 -4.306 1.00 50.60 6 A 1 ATOM 45 O OD2 . ASP A 1 6 ? 2.537 10.477 -6.380 1.00 50.48 6 A 1 ATOM 46 N N . LYS A 1 7 ? 1.016 6.899 -2.809 1.00 81.80 7 A 1 ATOM 47 C CA . LYS A 1 7 ? 0.782 6.894 -1.359 1.00 84.40 7 A 1 ATOM 48 C C . LYS A 1 7 ? 1.039 8.269 -0.749 1.00 87.96 7 A 1 ATOM 49 O O . LYS A 1 7 ? 0.409 8.612 0.248 1.00 87.30 7 A 1 ATOM 50 C CB . LYS A 1 7 ? 1.663 5.832 -0.686 1.00 81.26 7 A 1 ATOM 51 C CG . LYS A 1 7 ? 1.264 4.399 -1.085 1.00 72.25 7 A 1 ATOM 52 C CD . LYS A 1 7 ? 2.048 3.332 -0.308 1.00 68.98 7 A 1 ATOM 53 C CE . LYS A 1 7 ? 3.522 3.278 -0.738 1.00 61.83 7 A 1 ATOM 54 N NZ . LYS A 1 7 ? 4.242 2.172 -0.072 1.00 55.25 7 A 1 ATOM 55 N N . ASN A 1 8 ? 1.916 9.065 -1.355 1.00 85.09 8 A 1 ATOM 56 C CA . ASN A 1 8 ? 2.223 10.409 -0.879 1.00 86.56 8 A 1 ATOM 57 C C . ASN A 1 8 ? 1.037 11.352 -1.072 1.00 88.58 8 A 1 ATOM 58 O O . ASN A 1 8 ? 0.803 12.199 -0.218 1.00 87.80 8 A 1 ATOM 59 C CB . ASN A 1 8 ? 3.464 10.948 -1.592 1.00 84.46 8 A 1 ATOM 60 C CG . ASN A 1 8 ? 4.697 10.104 -1.339 1.00 75.93 8 A 1 ATOM 61 O OD1 . ASN A 1 8 ? 4.973 9.670 -0.229 1.00 67.50 8 A 1 ATOM 62 N ND2 . ASN A 1 8 ? 5.473 9.838 -2.365 1.00 67.31 8 A 1 ATOM 63 N N . GLN A 1 9 ? 0.233 11.158 -2.127 1.00 88.73 9 A 1 ATOM 64 C CA . GLN A 1 9 ? -0.967 11.964 -2.361 1.00 89.39 9 A 1 ATOM 65 C C . GLN A 1 9 ? -1.996 11.795 -1.235 1.00 90.90 9 A 1 ATOM 66 O O . GLN A 1 9 ? -2.628 12.769 -0.826 1.00 90.52 9 A 1 ATOM 67 C CB . GLN A 1 9 ? -1.570 11.579 -3.715 1.00 88.21 9 A 1 ATOM 68 C CG . GLN A 1 9 ? -2.663 12.563 -4.151 1.00 80.33 9 A 1 ATOM 69 C CD . GLN A 1 9 ? -3.279 12.201 -5.501 1.00 75.52 9 A 1 ATOM 70 O OE1 . GLN A 1 9 ? -3.152 11.109 -6.020 1.00 69.77 9 A 1 ATOM 71 N NE2 . GLN A 1 9 ? -3.998 13.109 -6.120 1.00 65.74 9 A 1 ATOM 72 N N . TRP A 1 10 ? -2.151 10.565 -0.704 1.00 91.36 10 A 1 ATOM 73 C CA . TRP A 1 10 ? -3.037 10.315 0.431 1.00 92.73 10 A 1 ATOM 74 C C . TRP A 1 10 ? -2.376 10.686 1.757 1.00 93.15 10 A 1 ATOM 75 O O . TRP A 1 10 ? -2.916 11.489 2.518 1.00 92.61 10 A 1 ATOM 76 C CB . TRP A 1 10 ? -3.491 8.851 0.428 1.00 92.97 10 A 1 ATOM 77 C CG . TRP A 1 10 ? -4.409 8.516 1.567 1.00 92.89 10 A 1 ATOM 78 C CD1 . TRP A 1 10 ? -4.052 7.908 2.720 1.00 92.14 10 A 1 ATOM 79 C CD2 . TRP A 1 10 ? -5.829 8.830 1.702 1.00 93.51 10 A 1 ATOM 80 N NE1 . TRP A 1 10 ? -5.152 7.820 3.561 1.00 92.28 10 A 1 ATOM 81 C CE2 . TRP A 1 10 ? -6.268 8.384 2.984 1.00 93.05 10 A 1 ATOM 82 C CE3 . TRP A 1 10 ? -6.782 9.458 0.873 1.00 92.69 10 A 1 ATOM 83 C CZ2 . TRP A 1 10 ? -7.588 8.565 3.431 1.00 92.12 10 A 1 ATOM 84 C CZ3 . TRP A 1 10 ? -8.114 9.639 1.309 1.00 92.02 10 A 1 ATOM 85 C CH2 . TRP A 1 10 ? -8.513 9.202 2.582 1.00 91.77 10 A 1 ATOM 86 N N . CYS A 1 11 ? -1.195 10.145 2.019 1.00 92.35 11 A 1 ATOM 87 C CA . CYS A 1 11 ? -0.514 10.335 3.300 1.00 92.01 11 A 1 ATOM 88 C C . CYS A 1 11 ? -0.082 11.792 3.530 1.00 92.02 11 A 1 ATOM 89 O O . CYS A 1 11 ? -0.079 12.248 4.667 1.00 90.59 11 A 1 ATOM 90 C CB . CYS A 1 11 ? 0.695 9.391 3.378 1.00 91.00 11 A 1 ATOM 91 S SG . CYS A 1 11 ? 0.160 7.650 3.389 1.00 88.84 11 A 1 ATOM 92 N N . GLY A 1 12 ? 0.238 12.531 2.469 1.00 91.99 12 A 1 ATOM 93 C CA . GLY A 1 12 ? 0.633 13.942 2.532 1.00 91.51 12 A 1 ATOM 94 C C . GLY A 1 12 ? -0.474 14.886 3.013 1.00 92.64 12 A 1 ATOM 95 O O . GLY A 1 12 ? -0.178 15.982 3.484 1.00 91.43 12 A 1 ATOM 96 N N . GLN A 1 13 ? -1.740 14.445 2.966 1.00 92.25 13 A 1 ATOM 97 C CA . GLN A 1 13 ? -2.878 15.210 3.500 1.00 93.03 13 A 1 ATOM 98 C C . GLN A 1 13 ? -2.926 15.207 5.033 1.00 94.27 13 A 1 ATOM 99 O O . GLN A 1 13 ? -3.588 16.053 5.639 1.00 93.61 13 A 1 ATOM 100 C CB . GLN A 1 13 ? -4.186 14.634 2.940 1.00 92.30 13 A 1 ATOM 101 C CG . GLN A 1 13 ? -4.271 14.727 1.409 1.00 90.70 13 A 1 ATOM 102 C CD . GLN A 1 13 ? -5.551 14.099 0.881 1.00 88.93 13 A 1 ATOM 103 O OE1 . GLN A 1 13 ? -6.652 14.472 1.245 1.00 83.56 13 A 1 ATOM 104 N NE2 . GLN A 1 13 ? -5.453 13.119 0.009 1.00 80.53 13 A 1 ATOM 105 N N . PHE A 1 14 ? -2.231 14.271 5.672 1.00 93.98 14 A 1 ATOM 106 C CA . PHE A 1 14 ? -2.306 14.058 7.115 1.00 94.33 14 A 1 ATOM 107 C C . PHE A 1 14 ? -0.937 14.263 7.765 1.00 94.20 14 A 1 ATOM 108 O O . PHE A 1 14 ? 0.024 13.556 7.472 1.00 92.46 14 A 1 ATOM 109 C CB . PHE A 1 14 ? -2.869 12.658 7.399 1.00 94.42 14 A 1 ATOM 110 C CG . PHE A 1 14 ? -4.199 12.374 6.719 1.00 94.75 14 A 1 ATOM 111 C CD1 . PHE A 1 14 ? -5.391 12.909 7.229 1.00 93.15 14 A 1 ATOM 112 C CD2 . PHE A 1 14 ? -4.230 11.605 5.541 1.00 93.71 14 A 1 ATOM 113 C CE1 . PHE A 1 14 ? -6.610 12.685 6.570 1.00 92.71 14 A 1 ATOM 114 C CE2 . PHE A 1 14 ? -5.449 11.381 4.879 1.00 93.21 14 A 1 ATOM 115 C CZ . PHE A 1 14 ? -6.640 11.922 5.391 1.00 92.83 14 A 1 ATOM 116 N N . LYS A 1 15 ? -0.841 15.183 8.718 1.00 93.80 15 A 1 ATOM 117 C CA . LYS A 1 15 ? 0.366 15.312 9.547 1.00 93.24 15 A 1 ATOM 118 C C . LYS A 1 15 ? 0.440 14.140 10.525 1.00 92.82 15 A 1 ATOM 119 O O . LYS A 1 15 ? -0.423 14.005 11.388 1.00 90.37 15 A 1 ATOM 120 C CB . LYS A 1 15 ? 0.405 16.663 10.278 1.00 92.48 15 A 1 ATOM 121 C CG . LYS A 1 15 ? 0.928 17.789 9.376 1.00 82.77 15 A 1 ATOM 122 C CD . LYS A 1 15 ? 1.099 19.097 10.158 1.00 78.82 15 A 1 ATOM 123 C CE . LYS A 1 15 ? 1.698 20.182 9.260 1.00 71.20 15 A 1 ATOM 124 N NZ . LYS A 1 15 ? 1.877 21.474 9.973 1.00 62.29 15 A 1 ATOM 125 N N . ARG A 1 16 ? 1.479 13.306 10.405 1.00 91.36 16 A 1 ATOM 126 C CA . ARG A 1 16 ? 1.721 12.137 11.280 1.00 90.81 16 A 1 ATOM 127 C C . ARG A 1 16 ? 0.499 11.198 11.397 1.00 90.54 16 A 1 ATOM 128 O O . ARG A 1 16 ? 0.209 10.690 12.475 1.00 87.15 16 A 1 ATOM 129 C CB . ARG A 1 16 ? 2.229 12.586 12.669 1.00 90.12 16 A 1 ATOM 130 C CG . ARG A 1 16 ? 3.552 13.366 12.641 1.00 84.96 16 A 1 ATOM 131 C CD . ARG A 1 16 ? 3.972 13.682 14.081 1.00 80.39 16 A 1 ATOM 132 N NE . ARG A 1 16 ? 5.299 14.323 14.148 1.00 72.75 16 A 1 ATOM 133 C CZ . ARG A 1 16 ? 5.920 14.706 15.255 1.00 65.29 16 A 1 ATOM 134 N NH1 . ARG A 1 16 ? 5.380 14.567 16.437 1.00 60.52 16 A 1 ATOM 135 N NH2 . ARG A 1 16 ? 7.113 15.237 15.197 1.00 57.01 16 A 1 ATOM 136 N N . CYS A 1 17 ? -0.227 10.998 10.301 1.00 91.53 17 A 1 ATOM 137 C CA . CYS A 1 17 ? -1.451 10.187 10.247 1.00 91.67 17 A 1 ATOM 138 C C . CYS A 1 17 ? -2.605 10.685 11.147 1.00 92.69 17 A 1 ATOM 139 O O . CYS A 1 17 ? -3.641 10.031 11.214 1.00 90.86 17 A 1 ATOM 140 C CB . CYS A 1 17 ? -1.118 8.700 10.476 1.00 89.88 17 A 1 ATOM 141 S SG . CYS A 1 17 ? 0.150 8.138 9.302 1.00 86.15 17 A 1 ATOM 142 N N . ASN A 1 18 ? -2.493 11.834 11.792 1.00 92.07 18 A 1 ATOM 143 C CA . ASN A 1 18 ? -3.564 12.394 12.617 1.00 93.44 18 A 1 ATOM 144 C C . ASN A 1 18 ? -4.782 12.741 11.755 1.00 94.02 18 A 1 ATOM 145 O O . ASN A 1 18 ? -4.685 13.497 10.792 1.00 92.44 18 A 1 ATOM 146 C CB . ASN A 1 18 ? -3.059 13.625 13.386 1.00 92.78 18 A 1 ATOM 147 C CG . ASN A 1 18 ? -2.241 13.261 14.610 1.00 86.56 18 A 1 ATOM 148 O OD1 . ASN A 1 18 ? -2.403 12.219 15.219 1.00 79.11 18 A 1 ATOM 149 N ND2 . ASN A 1 18 ? -1.354 14.127 15.044 1.00 78.60 18 A 1 ATOM 150 N N . GLY A 1 19 ? -5.941 12.173 12.100 1.00 93.91 19 A 1 ATOM 151 C CA . GLY A 1 19 ? -7.186 12.343 11.348 1.00 93.65 19 A 1 ATOM 152 C C . GLY A 1 19 ? -7.332 11.421 10.133 1.00 94.22 19 A 1 ATOM 153 O O . GLY A 1 19 ? -8.374 11.450 9.475 1.00 92.26 19 A 1 ATOM 154 N N . CYS A 1 20 ? -6.348 10.580 9.844 1.00 94.00 20 A 1 ATOM 155 C CA . CYS A 1 20 ? -6.459 9.587 8.783 1.00 94.61 20 A 1 ATOM 156 C C . CYS A 1 20 ? -7.382 8.442 9.223 1.00 94.57 20 A 1 ATOM 157 O O . CYS A 1 20 ? -7.077 7.715 10.164 1.00 93.39 20 A 1 ATOM 158 C CB . CYS A 1 20 ? -5.063 9.084 8.402 1.00 93.77 20 A 1 ATOM 159 S SG . CYS A 1 20 ? -5.198 7.906 7.023 1.00 92.70 20 A 1 ATOM 160 N N . LYS A 1 21 ? -8.480 8.231 8.491 1.00 93.99 21 A 1 ATOM 161 C CA . LYS A 1 21 ? -9.416 7.117 8.748 1.00 93.57 21 A 1 ATOM 162 C C . LYS A 1 21 ? -8.761 5.743 8.612 1.00 94.27 21 A 1 ATOM 163 O O . LYS A 1 21 ? -9.224 4.785 9.215 1.00 92.86 21 A 1 ATOM 164 C CB . LYS A 1 21 ? -10.614 7.206 7.791 1.00 91.38 21 A 1 ATOM 165 C CG . LYS A 1 21 ? -11.500 8.428 8.061 1.00 85.25 21 A 1 ATOM 166 C CD . LYS A 1 21 ? -12.719 8.400 7.136 1.00 82.99 21 A 1 ATOM 167 C CE . LYS A 1 21 ? -13.623 9.593 7.422 1.00 74.20 21 A 1 ATOM 168 N NZ . LYS A 1 21 ? -14.833 9.567 6.562 1.00 66.47 21 A 1 ATOM 169 N N . LEU A 1 22 ? -7.688 5.671 7.832 1.00 93.91 22 A 1 ATOM 170 C CA . LEU A 1 22 ? -6.956 4.432 7.585 1.00 94.45 22 A 1 ATOM 171 C C . LEU A 1 22 ? -5.839 4.188 8.604 1.00 94.58 22 A 1 ATOM 172 O O . LEU A 1 22 ? -5.141 3.193 8.487 1.00 93.58 22 A 1 ATOM 173 C CB . LEU A 1 22 ? -6.405 4.438 6.146 1.00 94.40 22 A 1 ATOM 174 C CG . LEU A 1 22 ? -7.467 4.584 5.044 1.00 93.39 22 A 1 ATOM 175 C CD1 . LEU A 1 22 ? -6.764 4.600 3.688 1.00 91.60 22 A 1 ATOM 176 C CD2 . LEU A 1 22 ? -8.483 3.443 5.065 1.00 91.44 22 A 1 ATOM 177 N N . GLN A 1 23 ? -5.640 5.057 9.589 1.00 93.94 23 A 1 ATOM 178 C CA . GLN A 1 23 ? -4.522 4.953 10.535 1.00 93.37 23 A 1 ATOM 179 C C . GLN A 1 23 ? -4.487 3.597 11.247 1.00 93.22 23 A 1 ATOM 180 O O . GLN A 1 23 ? -3.444 2.946 11.268 1.00 92.50 23 A 1 ATOM 181 C CB . GLN A 1 23 ? -4.611 6.105 11.545 1.00 92.20 23 A 1 ATOM 182 C CG . GLN A 1 23 ? -3.414 6.121 12.511 1.00 88.05 23 A 1 ATOM 183 C CD . GLN A 1 23 ? -3.466 7.294 13.488 1.00 83.49 23 A 1 ATOM 184 O OE1 . GLN A 1 23 ? -4.485 7.907 13.734 1.00 77.77 23 A 1 ATOM 185 N NE2 . GLN A 1 23 ? -2.355 7.659 14.090 1.00 74.05 23 A 1 ATOM 186 N N . SER A 1 24 ? -5.628 3.154 11.784 1.00 93.15 24 A 1 ATOM 187 C CA . SER A 1 24 ? -5.734 1.867 12.482 1.00 92.83 24 A 1 ATOM 188 C C . SER A 1 24 ? -5.577 0.682 11.527 1.00 93.09 24 A 1 ATOM 189 O O . SER A 1 24 ? -4.922 -0.301 11.857 1.00 91.54 24 A 1 ATOM 190 C CB . SER A 1 24 ? -7.089 1.771 13.194 1.00 91.86 24 A 1 ATOM 191 O OG . SER A 1 24 ? -7.300 2.911 14.007 1.00 80.72 24 A 1 ATOM 192 N N . GLU A 1 25 ? -6.131 0.804 10.332 1.00 92.38 25 A 1 ATOM 193 C CA . GLU A 1 25 ? -6.065 -0.240 9.310 1.00 92.26 25 A 1 ATOM 194 C C . GLU A 1 25 ? -4.660 -0.361 8.701 1.00 93.04 25 A 1 ATOM 195 O O . GLU A 1 25 ? -4.232 -1.456 8.339 1.00 91.82 25 A 1 ATOM 196 C CB . GLU A 1 25 ? -7.096 0.063 8.215 1.00 91.28 25 A 1 ATOM 197 C CG . GLU A 1 25 ? -8.555 -0.045 8.691 1.00 84.52 25 A 1 ATOM 198 C CD . GLU A 1 25 ? -8.944 -1.497 8.982 1.00 80.11 25 A 1 ATOM 199 O OE1 . GLU A 1 25 ? -9.097 -1.819 10.179 1.00 73.26 25 A 1 ATOM 200 O OE2 . GLU A 1 25 ? -9.055 -2.279 8.013 1.00 73.19 25 A 1 ATOM 201 N N . CYS A 1 26 ? -3.907 0.739 8.620 1.00 92.96 26 A 1 ATOM 202 C CA . CYS A 1 26 ? -2.531 0.740 8.127 1.00 92.74 26 A 1 ATOM 203 C C . CYS A 1 26 ? -1.532 0.112 9.109 1.00 93.12 26 A 1 ATOM 204 O O . CYS A 1 26 ? -0.384 -0.112 8.728 1.00 91.55 26 A 1 ATOM 205 C CB . CYS A 1 26 ? -2.107 2.171 7.771 1.00 91.12 26 A 1 ATOM 206 S SG . CYS A 1 26 ? -2.896 2.716 6.227 1.00 84.56 26 A 1 ATOM 207 N N . MET A 1 27 ? -1.926 -0.167 10.353 1.00 92.61 27 A 1 ATOM 208 C CA . MET A 1 27 ? -1.039 -0.862 11.284 1.00 92.74 27 A 1 ATOM 209 C C . MET A 1 27 ? -0.703 -2.259 10.755 1.00 93.81 27 A 1 ATOM 210 O O . MET A 1 27 ? -1.565 -2.983 10.253 1.00 92.77 27 A 1 ATOM 211 C CB . MET A 1 27 ? -1.635 -0.930 12.698 1.00 91.28 27 A 1 ATOM 212 C CG . MET A 1 27 ? -1.652 0.462 13.350 1.00 83.90 27 A 1 ATOM 213 S SD . MET A 1 27 ? -1.963 0.421 15.136 1.00 75.75 27 A 1 ATOM 214 C CE . MET A 1 27 ? -1.697 2.164 15.538 1.00 65.72 27 A 1 ATOM 215 N N . VAL A 1 28 ? 0.573 -2.611 10.849 1.00 93.64 28 A 1 ATOM 216 C CA . VAL A 1 28 ? 1.065 -3.935 10.459 1.00 94.29 28 A 1 ATOM 217 C C . VAL A 1 28 ? 0.511 -4.959 11.440 1.00 94.91 28 A 1 ATOM 218 O O . VAL A 1 28 ? 0.720 -4.842 12.648 1.00 94.46 28 A 1 ATOM 219 C CB . VAL A 1 28 ? 2.603 -3.973 10.431 1.00 93.33 28 A 1 ATOM 220 C CG1 . VAL A 1 28 ? 3.121 -5.336 9.961 1.00 88.77 28 A 1 ATOM 221 C CG2 . VAL A 1 28 ? 3.182 -2.912 9.490 1.00 89.40 28 A 1 ATOM 222 N N . LYS A 1 29 ? -0.199 -5.961 10.920 1.00 93.54 29 A 1 ATOM 223 C CA . LYS A 1 29 ? -0.650 -7.086 11.737 1.00 93.95 29 A 1 ATOM 224 C C . LYS A 1 29 ? 0.506 -8.070 11.939 1.00 94.86 29 A 1 ATOM 225 O O . LYS A 1 29 ? 1.347 -8.191 11.049 1.00 94.48 29 A 1 ATOM 226 C CB . LYS A 1 29 ? -1.853 -7.768 11.085 1.00 92.97 29 A 1 ATOM 227 C CG . LYS A 1 29 ? -3.072 -6.840 11.000 1.00 91.30 29 A 1 ATOM 228 C CD . LYS A 1 29 ? -4.223 -7.628 10.379 1.00 88.43 29 A 1 ATOM 229 C CE . LYS A 1 29 ? -5.485 -6.776 10.273 1.00 84.20 29 A 1 ATOM 230 N NZ . LYS A 1 29 ? -6.575 -7.598 9.699 1.00 77.34 29 A 1 ATOM 231 N N . PRO A 1 30 ? 0.540 -8.810 13.057 1.00 94.91 30 A 1 ATOM 232 C CA . PRO A 1 30 ? 1.597 -9.801 13.306 1.00 94.83 30 A 1 ATOM 233 C C . PRO A 1 30 ? 1.770 -10.813 12.163 1.00 94.22 30 A 1 ATOM 234 O O . PRO A 1 30 ? 2.887 -11.199 11.838 1.00 91.98 30 A 1 ATOM 235 C CB . PRO A 1 30 ? 1.182 -10.503 14.606 1.00 94.40 30 A 1 ATOM 236 C CG . PRO A 1 30 ? 0.324 -9.471 15.328 1.00 92.55 30 A 1 ATOM 237 C CD . PRO A 1 30 ? -0.372 -8.731 14.192 1.00 94.68 30 A 1 ATOM 238 N N . GLU A 1 31 ? 0.669 -11.193 11.522 1.00 93.81 31 A 1 ATOM 239 C CA . GLU A 1 31 ? 0.627 -12.103 10.368 1.00 92.54 31 A 1 ATOM 240 C C . GLU A 1 31 ? 1.192 -11.488 9.071 1.00 93.08 31 A 1 ATOM 241 O O . GLU A 1 31 ? 1.506 -12.208 8.125 1.00 91.03 31 A 1 ATOM 242 C CB . GLU A 1 31 ? -0.836 -12.550 10.179 1.00 90.51 31 A 1 ATOM 243 C CG . GLU A 1 31 ? -1.786 -11.387 9.842 1.00 82.67 31 A 1 ATOM 244 C CD . GLU A 1 31 ? -3.269 -11.728 10.027 1.00 78.34 31 A 1 ATOM 245 O OE1 . GLU A 1 31 ? -3.969 -10.931 10.693 1.00 71.01 31 A 1 ATOM 246 O OE2 . GLU A 1 31 ? -3.714 -12.757 9.490 1.00 72.11 31 A 1 ATOM 247 N N . GLU A 1 32 ? 1.328 -10.171 9.013 1.00 93.31 32 A 1 ATOM 248 C CA . GLU A 1 32 ? 1.811 -9.411 7.852 1.00 93.50 32 A 1 ATOM 249 C C . GLU A 1 32 ? 3.228 -8.856 8.073 1.00 93.52 32 A 1 ATOM 250 O O . GLU A 1 32 ? 3.738 -8.100 7.245 1.00 91.62 32 A 1 ATOM 251 C CB . GLU A 1 32 ? 0.833 -8.259 7.547 1.00 92.63 32 A 1 ATOM 252 C CG . GLU A 1 32 ? -0.598 -8.706 7.209 1.00 91.11 32 A 1 ATOM 253 C CD . GLU A 1 32 ? -1.546 -7.506 7.036 1.00 91.60 32 A 1 ATOM 254 O OE1 . GLU A 1 32 ? -2.521 -7.582 6.261 1.00 86.41 32 A 1 ATOM 255 O OE2 . GLU A 1 32 ? -1.365 -6.460 7.706 1.00 87.89 32 A 1 ATOM 256 N N . MET A 1 33 ? 3.852 -9.201 9.203 1.00 94.22 33 A 1 ATOM 257 C CA . MET A 1 33 ? 5.161 -8.665 9.599 1.00 93.39 33 A 1 ATOM 258 C C . MET A 1 33 ? 6.289 -9.092 8.653 1.00 93.10 33 A 1 ATOM 259 O O . MET A 1 33 ? 7.298 -8.402 8.544 1.00 90.41 33 A 1 ATOM 260 C CB . MET A 1 33 ? 5.468 -9.114 11.039 1.00 92.46 33 A 1 ATOM 261 C CG . MET A 1 33 ? 5.943 -7.951 11.906 1.00 85.87 33 A 1 ATOM 262 S SD . MET A 1 33 ? 6.289 -8.445 13.613 1.00 80.23 33 A 1 ATOM 263 C CE . MET A 1 33 ? 6.835 -6.861 14.289 1.00 70.90 33 A 1 ATOM 264 N N . PHE A 1 34 ? 6.102 -10.218 7.959 1.00 93.53 34 A 1 ATOM 265 C CA . PHE A 1 34 ? 7.082 -10.762 7.027 1.00 93.07 34 A 1 ATOM 266 C C . PHE A 1 34 ? 6.438 -11.035 5.664 1.00 93.07 34 A 1 ATOM 267 O O . PHE A 1 34 ? 5.319 -11.555 5.606 1.00 90.41 34 A 1 ATOM 268 C CB . PHE A 1 34 ? 7.714 -12.028 7.620 1.00 91.94 34 A 1 ATOM 269 C CG . PHE A 1 34 ? 8.428 -11.776 8.936 1.00 89.45 34 A 1 ATOM 270 C CD1 . PHE A 1 34 ? 9.713 -11.205 8.946 1.00 83.63 34 A 1 ATOM 271 C CD2 . PHE A 1 34 ? 7.792 -12.071 10.154 1.00 82.58 34 A 1 ATOM 272 C CE1 . PHE A 1 34 ? 10.356 -10.930 10.165 1.00 78.67 34 A 1 ATOM 273 C CE2 . PHE A 1 34 ? 8.433 -11.795 11.375 1.00 78.50 34 A 1 ATOM 274 C CZ . PHE A 1 34 ? 9.714 -11.224 11.380 1.00 76.80 34 A 1 ATOM 275 N N . PRO A 1 35 ? 7.128 -10.703 4.555 1.00 92.59 35 A 1 ATOM 276 C CA . PRO A 1 35 ? 6.669 -11.067 3.226 1.00 91.95 35 A 1 ATOM 277 C C . PRO A 1 35 ? 6.648 -12.594 3.088 1.00 92.46 35 A 1 ATOM 278 O O . PRO A 1 35 ? 7.595 -13.284 3.466 1.00 90.27 35 A 1 ATOM 279 C CB . PRO A 1 35 ? 7.635 -10.390 2.251 1.00 89.89 35 A 1 ATOM 280 C CG . PRO A 1 35 ? 8.923 -10.246 3.059 1.00 86.76 35 A 1 ATOM 281 C CD . PRO A 1 35 ? 8.433 -10.068 4.494 1.00 89.48 35 A 1 ATOM 282 N N . VAL A 1 36 ? 5.553 -13.115 2.544 1.00 92.25 36 A 1 ATOM 283 C CA . VAL A 1 36 ? 5.407 -14.545 2.260 1.00 92.57 36 A 1 ATOM 284 C C . VAL A 1 36 ? 5.825 -14.817 0.823 1.00 93.60 36 A 1 ATOM 285 O O . VAL A 1 36 ? 5.667 -13.966 -0.053 1.00 92.50 36 A 1 ATOM 286 C CB . VAL A 1 36 ? 3.992 -15.071 2.572 1.00 90.77 36 A 1 ATOM 287 C CG1 . VAL A 1 36 ? 3.711 -15.008 4.079 1.00 82.25 36 A 1 ATOM 288 C CG2 . VAL A 1 36 ? 2.889 -14.318 1.827 1.00 82.36 36 A 1 ATOM 289 N N . MET A 1 37 ? 6.374 -15.991 0.572 1.00 93.59 37 A 1 ATOM 290 C CA . MET A 1 37 ? 6.724 -16.403 -0.784 1.00 94.35 37 A 1 ATOM 291 C C . MET A 1 37 ? 5.573 -17.234 -1.349 1.00 94.53 37 A 1 ATOM 292 O O . MET A 1 37 ? 5.337 -18.353 -0.898 1.00 93.42 37 A 1 ATOM 293 C CB . MET A 1 37 ? 8.079 -17.126 -0.767 1.00 93.55 37 A 1 ATOM 294 C CG . MET A 1 37 ? 8.768 -17.047 -2.131 1.00 83.20 37 A 1 ATOM 295 S SD . MET A 1 37 ? 10.553 -17.401 -2.083 1.00 77.34 37 A 1 ATOM 296 C CE . MET A 1 37 ? 10.541 -19.190 -1.823 1.00 67.04 37 A 1 ATOM 297 N N . GLU A 1 38 ? 4.842 -16.679 -2.310 1.00 93.42 38 A 1 ATOM 298 C CA . GLU A 1 38 ? 3.770 -17.359 -3.041 1.00 92.75 38 A 1 ATOM 299 C C . GLU A 1 38 ? 4.147 -17.394 -4.524 1.00 93.14 38 A 1 ATOM 300 O O . GLU A 1 38 ? 4.567 -16.386 -5.098 1.00 90.92 38 A 1 ATOM 301 C CB . GLU A 1 38 ? 2.400 -16.695 -2.806 1.00 90.96 38 A 1 ATOM 302 C CG . GLU A 1 38 ? 1.873 -16.919 -1.381 1.00 84.73 38 A 1 ATOM 303 C CD . GLU A 1 38 ? 0.425 -16.449 -1.168 1.00 82.09 38 A 1 ATOM 304 O OE1 . GLU A 1 38 ? -0.495 -17.238 -1.460 1.00 75.53 38 A 1 ATOM 305 O OE2 . GLU A 1 38 ? 0.223 -15.326 -0.642 1.00 75.62 38 A 1 ATOM 306 N N . ASP A 1 39 ? 4.049 -18.567 -5.151 1.00 93.69 39 A 1 ATOM 307 C CA . ASP A 1 39 ? 4.340 -18.756 -6.580 1.00 93.69 39 A 1 ATOM 308 C C . ASP A 1 39 ? 5.739 -18.253 -7.024 1.00 94.38 39 A 1 ATOM 309 O O . ASP A 1 39 ? 5.931 -17.693 -8.104 1.00 91.63 39 A 1 ATOM 310 C CB . ASP A 1 39 ? 3.176 -18.197 -7.422 1.00 92.10 39 A 1 ATOM 311 C CG . ASP A 1 39 ? 2.385 -19.321 -8.078 1.00 83.28 39 A 1 ATOM 312 O OD1 . ASP A 1 39 ? 2.829 -19.752 -9.170 1.00 77.72 39 A 1 ATOM 313 O OD2 . ASP A 1 39 ? 1.377 -19.739 -7.480 1.00 75.91 39 A 1 ATOM 314 N N . GLY A 1 40 ? 6.737 -18.406 -6.161 1.00 94.54 40 A 1 ATOM 315 C CA . GLY A 1 40 ? 8.114 -17.960 -6.420 1.00 94.76 40 A 1 ATOM 316 C C . GLY A 1 40 ? 8.313 -16.438 -6.369 1.00 94.95 40 A 1 ATOM 317 O O . GLY A 1 40 ? 9.383 -15.949 -6.736 1.00 92.23 40 A 1 ATOM 318 N N . LYS A 1 41 ? 7.317 -15.681 -5.914 1.00 94.04 41 A 1 ATOM 319 C CA . LYS A 1 41 ? 7.379 -14.227 -5.747 1.00 93.46 41 A 1 ATOM 320 C C . LYS A 1 41 ? 7.218 -13.848 -4.278 1.00 93.32 41 A 1 ATOM 321 O O . LYS A 1 41 ? 6.419 -14.434 -3.556 1.00 91.18 41 A 1 ATOM 322 C CB . LYS A 1 41 ? 6.318 -13.545 -6.617 1.00 91.28 41 A 1 ATOM 323 C CG . LYS A 1 41 ? 6.592 -13.765 -8.112 1.00 82.61 41 A 1 ATOM 324 C CD . LYS A 1 41 ? 5.498 -13.126 -8.968 1.00 79.58 41 A 1 ATOM 325 C CE . LYS A 1 41 ? 5.761 -13.458 -10.436 1.00 70.89 41 A 1 ATOM 326 N NZ . LYS A 1 41 ? 4.625 -13.058 -11.295 1.00 64.58 41 A 1 ATOM 327 N N . TYR A 1 42 ? 7.968 -12.844 -3.848 1.00 93.60 42 A 1 ATOM 328 C CA . TYR A 1 42 ? 7.758 -12.248 -2.533 1.00 93.27 42 A 1 ATOM 329 C C . TYR A 1 42 ? 6.481 -11.408 -2.558 1.00 93.00 42 A 1 ATOM 330 O O . TYR A 1 42 ? 6.378 -10.433 -3.304 1.00 90.60 42 A 1 ATOM 331 C CB . TYR A 1 42 ? 8.976 -11.426 -2.116 1.00 91.58 42 A 1 ATOM 332 C CG . TYR A 1 42 ? 10.164 -12.289 -1.741 1.00 86.99 42 A 1 ATOM 333 C CD1 . TYR A 1 42 ? 10.237 -12.860 -0.457 1.00 81.86 42 A 1 ATOM 334 C CD2 . TYR A 1 42 ? 11.188 -12.540 -2.680 1.00 80.98 42 A 1 ATOM 335 C CE1 . TYR A 1 42 ? 11.329 -13.673 -0.104 1.00 78.80 42 A 1 ATOM 336 C CE2 . TYR A 1 42 ? 12.279 -13.357 -2.333 1.00 78.52 42 A 1 ATOM 337 C CZ . TYR A 1 42 ? 12.348 -13.922 -1.042 1.00 77.43 42 A 1 ATOM 338 O OH . TYR A 1 42 ? 13.407 -14.713 -0.699 1.00 75.18 42 A 1 ATOM 339 N N . VAL A 1 43 ? 5.510 -11.803 -1.746 1.00 92.98 43 A 1 ATOM 340 C CA . VAL A 1 43 ? 4.221 -11.135 -1.601 1.00 92.66 43 A 1 ATOM 341 C C . VAL A 1 43 ? 4.181 -10.459 -0.236 1.00 92.71 43 A 1 ATOM 342 O O . VAL A 1 43 ? 4.163 -11.111 0.807 1.00 91.46 43 A 1 ATOM 343 C CB . VAL A 1 43 ? 3.060 -12.129 -1.795 1.00 91.28 43 A 1 ATOM 344 C CG1 . VAL A 1 43 ? 1.712 -11.424 -1.661 1.00 85.62 43 A 1 ATOM 345 C CG2 . VAL A 1 43 ? 3.114 -12.782 -3.186 1.00 86.25 43 A 1 ATOM 346 N N . ASP A 1 44 ? 4.146 -9.137 -0.252 1.00 92.51 44 A 1 ATOM 347 C CA . ASP A 1 44 ? 3.930 -8.337 0.950 1.00 92.12 44 A 1 ATOM 348 C C . ASP A 1 44 ? 2.421 -8.088 1.116 1.00 92.19 44 A 1 ATOM 349 O O . ASP A 1 44 ? 1.827 -7.225 0.463 1.00 91.51 44 A 1 ATOM 350 C CB . ASP A 1 44 ? 4.760 -7.048 0.867 1.00 90.38 44 A 1 ATOM 351 C CG . ASP A 1 44 ? 4.706 -6.215 2.152 1.00 87.57 44 A 1 ATOM 352 O OD1 . ASP A 1 44 ? 3.674 -6.281 2.858 1.00 84.02 44 A 1 ATOM 353 O OD2 . ASP A 1 44 ? 5.671 -5.459 2.388 1.00 82.65 44 A 1 ATOM 354 N N . LYS A 1 45 ? 1.785 -8.890 1.978 1.00 91.81 45 A 1 ATOM 355 C CA . LYS A 1 45 ? 0.337 -8.808 2.239 1.00 91.80 45 A 1 ATOM 356 C C . LYS A 1 45 ? -0.059 -7.454 2.820 1.00 92.16 45 A 1 ATOM 357 O O . LYS A 1 45 ? -1.111 -6.917 2.470 1.00 91.23 45 A 1 ATOM 358 C CB . LYS A 1 45 ? -0.111 -9.953 3.163 1.00 91.43 45 A 1 ATOM 359 C CG . LYS A 1 45 ? -0.010 -11.313 2.463 1.00 88.64 45 A 1 ATOM 360 C CD . LYS A 1 45 ? -0.629 -12.455 3.283 1.00 82.33 45 A 1 ATOM 361 C CE . LYS A 1 45 ? -0.528 -13.727 2.429 1.00 77.46 45 A 1 ATOM 362 N NZ . LYS A 1 45 ? -1.134 -14.926 3.052 1.00 68.84 45 A 1 ATOM 363 N N . TRP A 1 46 ? 0.798 -6.862 3.637 1.00 93.37 46 A 1 ATOM 364 C CA . TRP A 1 46 ? 0.569 -5.535 4.200 1.00 93.29 46 A 1 ATOM 365 C C . TRP A 1 46 ? 0.590 -4.458 3.113 1.00 93.08 46 A 1 ATOM 366 O O . TRP A 1 46 ? -0.327 -3.638 3.042 1.00 92.21 46 A 1 ATOM 367 C CB . TRP A 1 46 ? 1.609 -5.252 5.285 1.00 92.99 46 A 1 ATOM 368 C CG . TRP A 1 46 ? 1.537 -3.858 5.828 1.00 92.50 46 A 1 ATOM 369 C CD1 . TRP A 1 46 ? 0.699 -3.446 6.804 1.00 91.06 46 A 1 ATOM 370 C CD2 . TRP A 1 46 ? 2.286 -2.677 5.412 1.00 91.60 46 A 1 ATOM 371 N NE1 . TRP A 1 46 ? 0.874 -2.095 7.030 1.00 90.21 46 A 1 ATOM 372 C CE2 . TRP A 1 46 ? 1.841 -1.570 6.195 1.00 91.04 46 A 1 ATOM 373 C CE3 . TRP A 1 46 ? 3.294 -2.429 4.448 1.00 89.42 46 A 1 ATOM 374 C CZ2 . TRP A 1 46 ? 2.370 -0.276 6.037 1.00 88.94 46 A 1 ATOM 375 C CZ3 . TRP A 1 46 ? 3.827 -1.138 4.283 1.00 88.41 46 A 1 ATOM 376 C CH2 . TRP A 1 46 ? 3.369 -0.063 5.073 1.00 88.16 46 A 1 ATOM 377 N N . ALA A 1 47 ? 1.578 -4.491 2.222 1.00 91.65 47 A 1 ATOM 378 C CA . ALA A 1 47 ? 1.688 -3.531 1.126 1.00 90.53 47 A 1 ATOM 379 C C . ALA A 1 47 ? 0.492 -3.626 0.170 1.00 90.77 47 A 1 ATOM 380 O O . ALA A 1 47 ? -0.076 -2.600 -0.209 1.00 89.96 47 A 1 ATOM 381 C CB . ALA A 1 47 ? 3.010 -3.751 0.384 1.00 89.10 47 A 1 ATOM 382 N N . ILE A 1 48 ? 0.053 -4.840 -0.179 1.00 90.26 48 A 1 ATOM 383 C CA . ILE A 1 48 ? -1.127 -5.053 -1.031 1.00 90.45 48 A 1 ATOM 384 C C . ILE A 1 48 ? -2.378 -4.480 -0.361 1.00 90.84 48 A 1 ATOM 385 O O . ILE A 1 48 ? -3.107 -3.689 -0.971 1.00 90.52 48 A 1 ATOM 386 C CB . ILE A 1 48 ? -1.290 -6.554 -1.373 1.00 90.34 48 A 1 ATOM 387 C CG1 . ILE A 1 48 ? -0.123 -7.011 -2.278 1.00 89.03 48 A 1 ATOM 388 C CG2 . ILE A 1 48 ? -2.640 -6.821 -2.068 1.00 88.50 48 A 1 ATOM 389 C CD1 . ILE A 1 48 ? -0.064 -8.525 -2.492 1.00 84.52 48 A 1 ATOM 390 N N . ARG A 1 49 ? -2.619 -4.830 0.910 1.00 91.74 49 A 1 ATOM 391 C CA . ARG A 1 49 ? -3.804 -4.403 1.661 1.00 92.29 49 A 1 ATOM 392 C C . ARG A 1 49 ? -3.855 -2.887 1.828 1.00 92.66 49 A 1 ATOM 393 O O . ARG A 1 49 ? -4.878 -2.272 1.530 1.00 92.42 49 A 1 ATOM 394 C CB . ARG A 1 49 ? -3.805 -5.134 3.014 1.00 92.31 49 A 1 ATOM 395 C CG . ARG A 1 49 ? -5.048 -4.808 3.853 1.00 91.33 49 A 1 ATOM 396 C CD . ARG A 1 49 ? -5.092 -5.669 5.126 1.00 90.39 49 A 1 ATOM 397 N NE . ARG A 1 49 ? -3.967 -5.376 6.037 1.00 88.18 49 A 1 ATOM 398 C CZ . ARG A 1 49 ? -3.886 -4.416 6.942 1.00 89.18 49 A 1 ATOM 399 N NH1 . ARG A 1 49 ? -4.825 -3.538 7.131 1.00 82.38 49 A 1 ATOM 400 N NH2 . ARG A 1 49 ? -2.835 -4.340 7.700 1.00 84.05 49 A 1 ATOM 401 N N . THR A 1 50 ? -2.766 -2.273 2.247 1.00 92.17 50 A 1 ATOM 402 C CA . THR A 1 50 ? -2.690 -0.816 2.449 1.00 92.01 50 A 1 ATOM 403 C C . THR A 1 50 ? -2.824 -0.051 1.136 1.00 92.33 50 A 1 ATOM 404 O O . THR A 1 50 ? -3.566 0.928 1.068 1.00 91.99 50 A 1 ATOM 405 C CB . THR A 1 50 ? -1.390 -0.404 3.155 1.00 91.57 50 A 1 ATOM 406 O OG1 . THR A 1 50 ? -0.271 -0.913 2.479 1.00 87.23 50 A 1 ATOM 407 C CG2 . THR A 1 50 ? -1.346 -0.894 4.600 1.00 85.78 50 A 1 ATOM 408 N N . THR A 1 51 ? -2.201 -0.530 0.062 1.00 90.78 51 A 1 ATOM 409 C CA . THR A 1 51 ? -2.310 0.073 -1.272 1.00 90.41 51 A 1 ATOM 410 C C . THR A 1 51 ? -3.748 0.022 -1.789 1.00 91.19 51 A 1 ATOM 411 O O . THR A 1 51 ? -4.258 1.032 -2.271 1.00 90.81 51 A 1 ATOM 412 C CB . THR A 1 51 ? -1.351 -0.618 -2.253 1.00 89.01 51 A 1 ATOM 413 O OG1 . THR A 1 51 ? -0.025 -0.469 -1.789 1.00 83.07 51 A 1 ATOM 414 C CG2 . THR A 1 51 ? -1.375 -0.013 -3.649 1.00 81.13 51 A 1 ATOM 415 N N . ALA A 1 52 ? -4.439 -1.115 -1.634 1.00 91.54 52 A 1 ATOM 416 C CA . ALA A 1 52 ? -5.838 -1.261 -2.039 1.00 91.61 52 A 1 ATOM 417 C C . ALA A 1 52 ? -6.777 -0.329 -1.248 1.00 92.04 52 A 1 ATOM 418 O O . ALA A 1 52 ? -7.663 0.303 -1.831 1.00 91.48 52 A 1 ATOM 419 C CB . ALA A 1 52 ? -6.238 -2.732 -1.869 1.00 91.31 52 A 1 ATOM 420 N N . MET A 1 53 ? -6.563 -0.189 0.059 1.00 92.89 53 A 1 ATOM 421 C CA . MET A 1 53 ? -7.349 0.729 0.892 1.00 92.89 53 A 1 ATOM 422 C C . MET A 1 53 ? -7.140 2.191 0.492 1.00 93.29 53 A 1 ATOM 423 O O . MET A 1 53 ? -8.114 2.926 0.321 1.00 92.63 53 A 1 ATOM 424 C CB . MET A 1 53 ? -7.000 0.538 2.370 1.00 92.13 53 A 1 ATOM 425 C CG . MET A 1 53 ? -7.538 -0.787 2.919 1.00 85.44 53 A 1 ATOM 426 S SD . MET A 1 53 ? -7.351 -0.974 4.710 1.00 84.21 53 A 1 ATOM 427 C CE . MET A 1 53 ? -5.557 -0.896 4.895 1.00 74.58 53 A 1 ATOM 428 N N . ILE A 1 54 ? -5.891 2.604 0.277 1.00 92.66 54 A 1 ATOM 429 C CA . ILE A 1 54 ? -5.556 3.965 -0.156 1.00 92.43 54 A 1 ATOM 430 C C . ILE A 1 54 ? -6.167 4.263 -1.528 1.00 92.33 54 A 1 ATOM 431 O O . ILE A 1 54 ? -6.788 5.309 -1.704 1.00 92.14 54 A 1 ATOM 432 C CB . ILE A 1 54 ? -4.023 4.167 -0.138 1.00 92.14 54 A 1 ATOM 433 C CG1 . ILE A 1 54 ? -3.521 4.207 1.326 1.00 91.39 54 A 1 ATOM 434 C CG2 . ILE A 1 54 ? -3.618 5.460 -0.875 1.00 91.26 54 A 1 ATOM 435 C CD1 . ILE A 1 54 ? -1.997 4.091 1.459 1.00 89.25 54 A 1 ATOM 436 N N . ALA A 1 55 ? -6.067 3.333 -2.480 1.00 91.91 55 A 1 ATOM 437 C CA . ALA A 1 55 ? -6.680 3.480 -3.798 1.00 90.87 55 A 1 ATOM 438 C C . ALA A 1 55 ? -8.192 3.693 -3.717 1.00 90.85 55 A 1 ATOM 439 O O . ALA A 1 55 ? -8.748 4.559 -4.397 1.00 89.85 55 A 1 ATOM 440 C CB . ALA A 1 55 ? -6.401 2.212 -4.610 1.00 89.76 55 A 1 ATOM 441 N N . ARG A 1 56 ? -8.867 2.910 -2.861 1.00 92.07 56 A 1 ATOM 442 C CA . ARG A 1 56 ? -10.315 3.004 -2.663 1.00 91.77 56 A 1 ATOM 443 C C . ARG A 1 56 ? -10.722 4.354 -2.077 1.00 92.28 56 A 1 ATOM 444 O O . ARG A 1 56 ? -11.710 4.932 -2.529 1.00 91.50 56 A 1 ATOM 445 C CB . ARG A 1 56 ? -10.771 1.834 -1.779 1.00 91.04 56 A 1 ATOM 446 C CG . ARG A 1 56 ? -12.299 1.757 -1.688 1.00 82.51 56 A 1 ATOM 447 C CD . ARG A 1 56 ? -12.707 0.588 -0.787 1.00 80.97 56 A 1 ATOM 448 N NE . ARG A 1 56 ? -14.177 0.454 -0.724 1.00 73.11 56 A 1 ATOM 449 C CZ . ARG A 1 56 ? -14.842 -0.386 0.050 1.00 67.77 56 A 1 ATOM 450 N NH1 . ARG A 1 56 ? -14.232 -1.182 0.883 1.00 62.23 56 A 1 ATOM 451 N NH2 . ARG A 1 56 ? -16.145 -0.444 -0.005 1.00 58.03 56 A 1 ATOM 452 N N . GLU A 1 57 ? -9.985 4.852 -1.100 1.00 91.98 57 A 1 ATOM 453 C CA . GLU A 1 57 ? -10.298 6.140 -0.470 1.00 92.21 57 A 1 ATOM 454 C C . GLU A 1 57 ? -9.963 7.328 -1.385 1.00 92.57 57 A 1 ATOM 455 O O . GLU A 1 57 ? -10.779 8.244 -1.491 1.00 91.95 57 A 1 ATOM 456 C CB . GLU A 1 57 ? -9.608 6.245 0.893 1.00 92.52 57 A 1 ATOM 457 C CG . GLU A 1 57 ? -10.197 5.280 1.940 1.00 89.30 57 A 1 ATOM 458 C CD . GLU A 1 57 ? -11.709 5.466 2.166 1.00 89.45 57 A 1 ATOM 459 O OE1 . GLU A 1 57 ? -12.484 4.484 1.998 1.00 84.40 57 A 1 ATOM 460 O OE2 . GLU A 1 57 ? -12.150 6.595 2.458 1.00 84.51 57 A 1 ATOM 461 N N . LEU A 1 58 ? -8.861 7.276 -2.144 1.00 91.51 58 A 1 ATOM 462 C CA . LEU A 1 58 ? -8.558 8.275 -3.176 1.00 90.84 58 A 1 ATOM 463 C C . LEU A 1 58 ? -9.635 8.299 -4.265 1.00 90.66 58 A 1 ATOM 464 O O . LEU A 1 58 ? -10.103 9.370 -4.648 1.00 89.69 58 A 1 ATOM 465 C CB . LEU A 1 58 ? -7.186 7.976 -3.807 1.00 90.30 58 A 1 ATOM 466 C CG . LEU A 1 58 ? -5.982 8.369 -2.935 1.00 87.06 58 A 1 ATOM 467 C CD1 . LEU A 1 58 ? -4.697 7.838 -3.572 1.00 86.13 58 A 1 ATOM 468 C CD2 . LEU A 1 58 ? -5.849 9.887 -2.792 1.00 86.58 58 A 1 ATOM 469 N N . GLY A 1 59 ? -10.093 7.128 -4.719 1.00 90.86 59 A 1 ATOM 470 C CA . GLY A 1 59 ? -11.193 7.025 -5.681 1.00 90.13 59 A 1 ATOM 471 C C . GLY A 1 59 ? -12.485 7.664 -5.163 1.00 91.23 59 A 1 ATOM 472 O O . GLY A 1 59 ? -13.142 8.415 -5.889 1.00 90.26 59 A 1 ATOM 473 N N . LYS A 1 60 ? -12.834 7.446 -3.889 1.00 91.51 60 A 1 ATOM 474 C CA . LYS A 1 60 ? -13.992 8.104 -3.261 1.00 92.50 60 A 1 ATOM 475 C C . LYS A 1 60 ? -13.809 9.617 -3.154 1.00 93.02 60 A 1 ATOM 476 O O . LYS A 1 60 ? -14.765 10.354 -3.383 1.00 91.48 60 A 1 ATOM 477 C CB . LYS A 1 60 ? -14.227 7.549 -1.859 1.00 92.43 60 A 1 ATOM 478 C CG . LYS A 1 60 ? -14.780 6.118 -1.837 1.00 90.10 60 A 1 ATOM 479 C CD . LYS A 1 60 ? -14.782 5.682 -0.371 1.00 87.96 60 A 1 ATOM 480 C CE . LYS A 1 60 ? -15.173 4.227 -0.171 1.00 83.92 60 A 1 ATOM 481 N NZ . LYS A 1 60 ? -14.937 3.879 1.252 1.00 78.45 60 A 1 ATOM 482 N N . GLN A 1 61 ? -12.613 10.074 -2.817 1.00 91.83 61 A 1 ATOM 483 C CA . GLN A 1 61 ? -12.309 11.493 -2.671 1.00 91.08 61 A 1 ATOM 484 C C . GLN A 1 61 ? -12.416 12.225 -4.012 1.00 91.13 61 A 1 ATOM 485 O O . GLN A 1 61 ? -13.050 13.277 -4.079 1.00 89.11 61 A 1 ATOM 486 C CB . GLN A 1 61 ? -10.921 11.634 -2.033 1.00 90.04 61 A 1 ATOM 487 C CG . GLN A 1 61 ? -10.703 13.020 -1.418 1.00 85.14 61 A 1 ATOM 488 C CD . GLN A 1 61 ? -9.381 13.108 -0.651 1.00 84.11 61 A 1 ATOM 489 O OE1 . GLN A 1 61 ? -8.479 12.296 -0.782 1.00 80.57 61 A 1 ATOM 490 N NE2 . GLN A 1 61 ? -9.215 14.096 0.199 1.00 77.69 61 A 1 ATOM 491 N N . ASN A 1 62 ? -11.897 11.616 -5.087 1.00 89.02 62 A 1 ATOM 492 C CA . ASN A 1 62 ? -11.989 12.163 -6.439 1.00 88.33 62 A 1 ATOM 493 C C . ASN A 1 62 ? -13.435 12.187 -6.958 1.00 89.24 62 A 1 ATOM 494 O O . ASN A 1 62 ? -13.851 13.173 -7.556 1.00 86.26 62 A 1 ATOM 495 C CB . ASN A 1 62 ? -11.076 11.344 -7.363 1.00 85.05 62 A 1 ATOM 496 C CG . ASN A 1 62 ? -9.593 11.564 -7.083 1.00 78.94 62 A 1 ATOM 497 O OD1 . ASN A 1 62 ? -9.172 12.515 -6.447 1.00 71.11 62 A 1 ATOM 498 N ND2 . ASN A 1 62 ? -8.740 10.683 -7.567 1.00 71.96 62 A 1 ATOM 499 N N . ASN A 1 63 ? -14.231 11.139 -6.680 1.00 88.58 63 A 1 ATOM 500 C CA . ASN A 1 63 ? -15.647 11.099 -7.078 1.00 89.80 63 A 1 ATOM 501 C C . ASN A 1 63 ? -16.537 12.059 -6.266 1.00 89.36 63 A 1 ATOM 502 O O . ASN A 1 63 ? -17.625 12.405 -6.713 1.00 85.69 63 A 1 ATOM 503 C CB . ASN A 1 63 ? -16.163 9.659 -6.945 1.00 87.77 63 A 1 ATOM 504 C CG . ASN A 1 63 ? -15.651 8.747 -8.049 1.00 79.99 63 A 1 ATOM 505 O OD1 . ASN A 1 63 ? -15.686 9.055 -9.226 1.00 72.48 63 A 1 ATOM 506 N ND2 . ASN A 1 63 ? -15.167 7.574 -7.715 1.00 71.58 63 A 1 ATOM 507 N N . LYS A 1 64 ? -16.112 12.465 -5.074 1.00 86.16 64 A 1 ATOM 508 C CA . LYS A 1 64 ? -16.871 13.389 -4.211 1.00 85.32 64 A 1 ATOM 509 C C . LYS A 1 64 ? -16.551 14.862 -4.494 1.00 83.49 64 A 1 ATOM 510 O O . LYS A 1 64 ? -17.253 15.735 -3.990 1.00 78.66 64 A 1 ATOM 511 C CB . LYS A 1 64 ? -16.616 13.009 -2.746 1.00 83.77 64 A 1 ATOM 512 C CG . LYS A 1 64 ? -17.794 13.361 -1.843 1.00 74.58 64 A 1 ATOM 513 C CD . LYS A 1 64 ? -17.521 12.899 -0.410 1.00 71.65 64 A 1 ATOM 514 C CE . LYS A 1 64 ? -18.767 13.131 0.432 1.00 64.96 64 A 1 ATOM 515 N NZ . LYS A 1 64 ? -18.545 12.776 1.847 1.00 57.25 64 A 1 ATOM 516 N N . ALA A 1 65 ? -15.491 15.116 -5.263 1.00 79.38 65 A 1 ATOM 517 C CA . ALA A 1 65 ? -15.074 16.449 -5.699 1.00 79.09 65 A 1 ATOM 518 C C . ALA A 1 65 ? -15.610 16.818 -7.101 1.00 78.08 65 A 1 ATOM 519 O O . ALA A 1 65 ? -15.305 17.900 -7.592 1.00 71.75 65 A 1 ATOM 520 C CB . ALA A 1 65 ? -13.544 16.514 -5.615 1.00 75.35 65 A 1 ATOM 521 N N . ALA A 1 66 ? -16.367 15.918 -7.737 1.00 78.68 66 A 1 ATOM 522 C CA . ALA A 1 66 ? -17.058 16.121 -9.008 1.00 78.78 66 A 1 ATOM 523 C C . ALA A 1 66 ? -18.550 16.401 -8.782 1.00 73.76 66 A 1 ATOM 524 O O . ALA A 1 66 ? -19.141 15.779 -7.872 1.00 67.10 66 A 1 ATOM 525 C CB . ALA A 1 66 ? -16.819 14.906 -9.908 1.00 72.11 66 A 1 ATOM 526 O OXT . ALA A 1 66 ? -19.106 17.233 -9.547 1.00 59.91 66 A 1 #