data_0 # _entry.id 0 # _struct_asym.id A _struct_asym.entity_id 0 # _entity_poly.entity_id 0 _entity_poly.type polypeptide(L) _entity_poly.pdbx_strand_id A # _entity.id 0 _entity.type polymer # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id 0 1 GLN 0 2 ILE 0 3 LEU 0 4 LYS 0 5 GLU 0 6 PHE 0 7 ASP 0 8 GLU 0 9 ASN 0 10 ASN 0 11 LEU 0 12 GLN 0 13 SER 0 14 TRP 0 15 ILE 0 16 TYR 0 17 TYR 0 18 ARG 0 19 TYR 0 20 LYS 0 21 CYS 0 22 LEU 0 23 ASP 0 24 LYS 0 25 GLN 0 26 ASN 0 27 VAL 0 28 SER 0 29 VAL 0 30 PRO 0 31 GLU 0 32 PRO 0 33 TYR 0 34 ASN 0 35 ARG 0 36 ILE 0 37 GLN 0 38 ILE 0 39 PRO 0 40 LYS 0 41 LYS 0 42 PHE 0 43 ILE 0 44 LYS 0 45 SER 0 46 ARG 0 47 ILE 0 48 LEU 0 49 VAL 0 50 GLU 0 51 PHE 0 52 GLU 0 53 PRO 0 54 ASN 0 55 THR 0 56 GLU 0 57 SER 0 58 CYS 0 59 PHE 0 60 MET 0 61 LYS 0 62 VAL 0 63 SER 0 64 ASN 0 65 GLU 0 66 THR 0 67 CYS 0 68 LEU 0 69 ASP 0 70 ALA 0 71 SER 0 72 LYS 0 73 PRO 0 74 ASP 0 75 MET 0 76 GLU 0 77 CYS 0 78 HIS 0 79 TRP 0 80 CYS 0 81 LEU 0 82 THR 0 83 ALA 0 84 ASN 0 85 LEU 0 86 CYS 0 87 SER 0 88 ASN 0 89 GLY 0 90 ARG 0 91 ASP 0 92 THR 0 93 HIS 0 94 SER 0 95 LYS 0 96 ALA 0 97 TRP 0 98 MET 0 99 ILE 0 100 LYS 0 101 ASN 0 102 CYS 0 103 PRO 0 104 LYS 0 105 ILE 0 106 ASP 0 107 ASN 0 108 LYS 0 109 PRO 0 110 MET 0 111 PHE 0 112 ASN 0 113 TYR 0 114 LEU 0 115 TYR 0 116 VAL 0 117 LEU 0 118 ILE 0 119 PRO 0 120 SER 0 121 VAL 0 122 ILE 0 123 GLY 0 124 LEU 0 125 VAL 0 126 ILE 0 127 VAL 0 128 CYS 0 129 VAL 0 130 GLY 0 131 PHE 0 132 ILE 0 133 VAL 0 134 TRP 0 135 PHE 0 136 TRP 0 137 LEU 0 138 SER 0 139 LYS 0 140 ARG 0 141 GLN # loop_ _chem_comp.id _chem_comp.type _chem_comp.name ALA 'L-peptide linking' ALANINE ARG 'L-peptide linking' ARGININE ASN 'L-peptide linking' ASPARAGINE ASP 'L-peptide linking' 'ASPARTIC ACID' CYS 'L-peptide linking' CYSTEINE GLN 'L-peptide linking' GLUTAMINE GLU 'L-peptide linking' 'GLUTAMIC ACID' HIS 'L-peptide linking' HISTIDINE ILE 'L-peptide linking' ISOLEUCINE LEU 'L-peptide linking' LEUCINE LYS 'L-peptide linking' LYSINE MET 'L-peptide linking' METHIONINE PHE 'L-peptide linking' PHENYLALANINE PRO 'L-peptide linking' PROLINE SER 'L-peptide linking' SERINE THR 'L-peptide linking' THREONINE TRP 'L-peptide linking' TRYPTOPHAN TYR 'L-peptide linking' TYROSINE VAL 'L-peptide linking' VALINE GLY 'peptide linking' GLYCINE # 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 . GLN A 0 1 . 16.190 40.867 -4.453 1.00 49.62 1 A 1 ATOM 2 C CA . GLN A 0 1 . 14.744 40.563 -4.378 1.00 49.62 1 A 1 ATOM 3 C C . GLN A 0 1 . 14.488 39.900 -3.034 1.00 49.62 1 A 1 ATOM 4 C CB . GLN A 0 1 . 14.317 39.647 -5.543 1.00 49.62 1 A 1 ATOM 5 O O . GLN A 0 1 . 15.020 38.824 -2.803 1.00 49.62 1 A 1 ATOM 6 C CG . GLN A 0 1 . 13.500 40.389 -6.614 1.00 49.62 1 A 1 ATOM 7 C CD . GLN A 0 1 . 13.270 39.533 -7.859 1.00 49.62 1 A 1 ATOM 8 N NE2 . GLN A 0 1 . 12.441 39.959 -8.781 1.00 49.62 1 A 1 ATOM 9 O OE1 . GLN A 0 1 . 13.849 38.480 -8.031 1.00 49.62 1 A 1 ATOM 10 N N . ILE A 0 2 . 13.781 40.570 -2.123 1.00 48.49 2 A 1 ATOM 11 C CA . ILE A 0 2 . 13.398 39.994 -0.825 1.00 48.49 2 A 1 ATOM 12 C C . ILE A 0 2 . 12.264 39.003 -1.103 1.00 48.49 2 A 1 ATOM 13 C CB . ILE A 0 2 . 13.001 41.115 0.170 1.00 48.49 2 A 1 ATOM 14 O O . ILE A 0 2 . 11.231 39.394 -1.650 1.00 48.49 2 A 1 ATOM 15 C CG1 . ILE A 0 2 . 14.221 42.028 0.454 1.00 48.49 2 A 1 ATOM 16 C CG2 . ILE A 0 2 . 12.452 40.528 1.483 1.00 48.49 2 A 1 ATOM 17 C CD1 . ILE A 0 2 . 13.886 43.309 1.230 1.00 48.49 2 A 1 ATOM 18 N N . LEU A 0 3 . 12.486 37.721 -0.808 1.00 55.98 3 A 1 ATOM 19 C CA . LEU A 0 3 . 11.463 36.683 -0.923 1.00 55.98 3 A 1 ATOM 20 C C . LEU A 0 3 . 10.352 37.032 0.079 1.00 55.98 3 A 1 ATOM 21 C CB . LEU A 0 3 . 12.099 35.300 -0.634 1.00 55.98 3 A 1 ATOM 22 O O . LEU A 0 3 . 10.628 37.118 1.274 1.00 55.98 3 A 1 ATOM 23 C CG . LEU A 0 3 . 11.583 34.168 -1.542 1.00 55.98 3 A 1 ATOM 24 C CD1 . LEU A 0 3 . 12.314 34.177 -2.888 1.00 55.98 3 A 1 ATOM 25 C CD2 . LEU A 0 3 . 11.818 32.806 -0.889 1.00 55.98 3 A 1 ATOM 26 N N . LYS A 0 4 . 9.124 37.284 -0.392 1.00 62.22 4 A 1 ATOM 27 C CA . LYS A 0 4 . 7.965 37.403 0.503 1.00 62.22 4 A 1 ATOM 28 C C . LYS A 0 4 . 7.870 36.111 1.312 1.00 62.22 4 A 1 ATOM 29 C CB . LYS A 0 4 . 6.662 37.652 -0.277 1.00 62.22 4 A 1 ATOM 30 O O . LYS A 0 4 . 7.907 35.029 0.731 1.00 62.22 4 A 1 ATOM 31 C CG . LYS A 0 4 . 6.450 39.134 -0.621 1.00 62.22 4 A 1 ATOM 32 C CD . LYS A 0 4 . 5.133 39.331 -1.387 1.00 62.22 4 A 1 ATOM 33 C CE . LYS A 0 4 . 4.844 40.823 -1.594 1.00 62.22 4 A 1 ATOM 34 N NZ . LYS A 0 4 . 3.575 41.037 -2.335 1.00 62.22 4 A 1 ATOM 35 N N . GLU A 0 5 . 7.784 36.243 2.628 1.00 60.96 5 A 1 ATOM 36 C CA . GLU A 0 5 . 7.535 35.132 3.538 1.00 60.96 5 A 1 ATOM 37 C C . GLU A 0 5 . 6.208 34.477 3.128 1.00 60.96 5 A 1 ATOM 38 C CB . GLU A 0 5 . 7.554 35.697 4.966 1.00 60.96 5 A 1 ATOM 39 O O . GLU A 0 5 . 5.156 35.120 3.117 1.00 60.96 5 A 1 ATOM 40 C CG . GLU A 0 5 . 7.677 34.638 6.068 1.00 60.96 5 A 1 ATOM 41 C CD . GLU A 0 5 . 7.978 35.265 7.444 1.00 60.96 5 A 1 ATOM 42 O OE1 . GLU A 0 5 . 8.339 34.491 8.356 1.00 60.96 5 A 1 ATOM 43 O OE2 . GLU A 0 5 . 7.889 36.510 7.564 1.00 60.96 5 A 1 ATOM 44 N N . PHE A 0 6 . 6.278 33.239 2.640 1.00 67.18 6 A 1 ATOM 45 C CA . PHE A 0 6 . 5.098 32.489 2.228 1.00 67.18 6 A 1 ATOM 46 C C . PHE A 0 6 . 4.418 31.953 3.484 1.00 67.18 6 A 1 ATOM 47 C CB . PHE A 0 6 . 5.483 31.351 1.269 1.00 67.18 6 A 1 ATOM 48 O O . PHE A 0 6 . 5.073 31.327 4.312 1.00 67.18 6 A 1 ATOM 49 C CG . PHE A 0 6 . 6.069 31.803 -0.058 1.00 67.18 6 A 1 ATOM 50 C CD1 . PHE A 0 6 . 5.219 32.152 -1.125 1.00 67.18 6 A 1 ATOM 51 C CD2 . PHE A 0 6 . 7.464 31.861 -0.234 1.00 67.18 6 A 1 ATOM 52 C CE1 . PHE A 0 6 . 5.761 32.558 -2.359 1.00 67.18 6 A 1 ATOM 53 C CE2 . PHE A 0 6 . 8.005 32.265 -1.468 1.00 67.18 6 A 1 ATOM 54 C CZ . PHE A 0 6 . 7.155 32.615 -2.530 1.00 67.18 6 A 1 ATOM 55 N N . ASP A 0 7 . 3.110 32.165 3.618 1.00 69.92 7 A 1 ATOM 56 C CA . ASP A 0 7 . 2.340 31.538 4.690 1.00 69.92 7 A 1 ATOM 57 C C . ASP A 0 7 . 2.251 30.027 4.439 1.00 69.92 7 A 1 ATOM 58 C CB . ASP A 0 7 . 0.965 32.203 4.799 1.00 69.92 7 A 1 ATOM 59 O O . ASP A 0 7 . 1.452 29.554 3.622 1.00 69.92 7 A 1 ATOM 60 C CG . ASP A 0 7 . 0.071 31.585 5.880 1.00 69.92 7 A 1 ATOM 61 O OD1 . ASP A 0 7 . 0.524 30.709 6.656 1.00 69.92 7 A 1 ATOM 62 O OD2 . ASP A 0 7 . -1.118 31.966 5.876 1.00 69.92 7 A 1 ATOM 63 N N . GLU A 0 8 . 3.098 29.269 5.138 1.00 68.59 8 A 1 ATOM 64 C CA . GLU A 0 8 . 3.218 27.815 5.011 1.00 68.59 8 A 1 ATOM 65 C C . GLU A 0 8 . 1.880 27.091 5.252 1.00 68.59 8 A 1 ATOM 66 C CB . GLU A 0 8 . 4.314 27.283 5.961 1.00 68.59 8 A 1 ATOM 67 O O . GLU A 0 8 . 1.630 26.038 4.661 1.00 68.59 8 A 1 ATOM 68 C CG . GLU A 0 8 . 5.729 27.814 5.642 1.00 68.59 8 A 1 ATOM 69 C CD . GLU A 0 8 . 6.858 27.105 6.424 1.00 68.59 8 A 1 ATOM 70 O OE1 . GLU A 0 8 . 8.005 27.075 5.901 1.00 68.59 8 A 1 ATOM 71 O OE2 . GLU A 0 8 . 6.589 26.550 7.516 1.00 68.59 8 A 1 ATOM 72 N N . ASN A 0 9 . 0.955 27.676 6.027 1.00 70.57 9 A 1 ATOM 73 C CA . ASN A 0 9 . -0.352 27.069 6.312 1.00 70.57 9 A 1 ATOM 74 C C . ASN A 0 9 . -1.284 27.027 5.092 1.00 70.57 9 A 1 ATOM 75 C CB . ASN A 0 9 . -1.017 27.845 7.453 1.00 70.57 9 A 1 ATOM 76 O O . ASN A 0 9 . -2.190 26.179 5.012 1.00 70.57 9 A 1 ATOM 77 C CG . ASN A 0 9 . -0.226 27.742 8.736 1.00 70.57 9 A 1 ATOM 78 N ND2 . ASN A 0 9 . 0.067 28.857 9.355 1.00 70.57 9 A 1 ATOM 79 O OD1 . ASN A 0 9 . 0.117 26.661 9.187 1.00 70.57 9 A 1 ATOM 80 N N . ASN A 0 10 . -1.048 27.928 4.137 1.00 80.42 10 A 1 ATOM 81 C CA . ASN A 0 10 . -1.823 28.076 2.912 1.00 80.42 10 A 1 ATOM 82 C C . ASN A 0 10 . -1.192 27.366 1.711 1.00 80.42 10 A 1 ATOM 83 C CB . ASN A 0 10 . -2.071 29.575 2.686 1.00 80.42 10 A 1 ATOM 84 O O . ASN A 0 10 . -1.805 27.296 0.644 1.00 80.42 10 A 1 ATOM 85 C CG . ASN A 0 10 . -3.182 30.086 3.586 1.00 80.42 10 A 1 ATOM 86 N ND2 . ASN A 0 10 . -3.098 31.284 4.100 1.00 80.42 10 A 1 ATOM 87 O OD1 . ASN A 0 10 . -4.172 29.410 3.820 1.00 80.42 10 A 1 ATOM 88 N N . LEU A 0 11 . -0.008 26.778 1.882 1.00 83.56 11 A 1 ATOM 89 C CA . LEU A 0 11 . 0.628 26.010 0.827 1.00 83.56 11 A 1 ATOM 90 C C . LEU A 0 11 . -0.016 24.626 0.693 1.00 83.56 11 A 1 ATOM 91 C CB . LEU A 0 11 . 2.147 25.954 1.039 1.00 83.56 11 A 1 ATOM 92 O O . LEU A 0 11 . -0.308 23.919 1.662 1.00 83.56 11 A 1 ATOM 93 C CG . LEU A 0 11 . 2.845 27.328 1.019 1.00 83.56 11 A 1 ATOM 94 C CD1 . LEU A 0 11 . 4.340 27.143 1.274 1.00 83.56 11 A 1 ATOM 95 C CD2 . LEU A 0 11 . 2.680 28.049 -0.323 1.00 83.56 11 A 1 ATOM 96 N N . GLN A 0 12 . -0.232 24.235 -0.556 1.00 87.48 12 A 1 ATOM 97 C CA . GLN A 0 12 . -0.621 22.889 -0.938 1.00 87.48 12 A 1 ATOM 98 C C . GLN A 0 12 . 0.349 22.414 -2.006 1.00 87.48 12 A 1 ATOM 99 C CB . GLN A 0 12 . -2.062 22.846 -1.457 1.00 87.48 12 A 1 ATOM 100 O O . GLN A 0 12 . 0.706 23.164 -2.911 1.00 87.48 12 A 1 ATOM 101 C CG . GLN A 0 12 . -3.089 23.263 -0.395 1.00 87.48 12 A 1 ATOM 102 C CD . GLN A 0 12 . -4.527 23.121 -0.883 1.00 87.48 12 A 1 ATOM 103 N NE2 . GLN A 0 12 . -5.476 23.733 -0.211 1.00 87.48 12 A 1 ATOM 104 O OE1 . GLN A 0 12 . -4.838 22.447 -1.850 1.00 87.48 12 A 1 ATOM 105 N N . SER A 0 13 . 0.768 21.162 -1.893 1.00 87.60 13 A 1 ATOM 106 C CA . SER A 0 13 . 1.629 20.529 -2.877 1.00 87.60 13 A 1 ATOM 107 C C . SER A 0 13 . 1.141 19.109 -3.114 1.00 87.60 13 A 1 ATOM 108 C CB . SER A 0 13 . 3.086 20.593 -2.418 1.00 87.60 13 A 1 ATOM 109 O O . SER A 0 13 . 0.612 18.456 -2.209 1.00 87.60 13 A 1 ATOM 110 O OG . SER A 0 13 . 3.917 20.205 -3.489 1.00 87.60 13 A 1 ATOM 111 N N . TRP A 0 14 . 1.262 18.640 -4.348 1.00 88.48 14 A 1 ATOM 112 C CA . TRP A 0 14 . 0.883 17.290 -4.730 1.00 88.48 14 A 1 ATOM 113 C C . TRP A 0 14 . 1.718 16.819 -5.911 1.00 88.48 14 A 1 ATOM 114 C CB . TRP A 0 14 . -0.620 17.215 -5.056 1.00 88.48 14 A 1 ATOM 115 O O . TRP A 0 14 . 2.089 17.597 -6.789 1.00 88.48 14 A 1 ATOM 116 C CG . TRP A 0 14 . -1.098 18.140 -6.134 1.00 88.48 14 A 1 ATOM 117 C CD1 . TRP A 0 14 . -1.023 17.906 -7.462 1.00 88.48 14 A 1 ATOM 118 C CD2 . TRP A 0 14 . -1.640 19.487 -5.997 1.00 88.48 14 A 1 ATOM 119 C CE2 . TRP A 0 14 . -1.873 20.015 -7.303 1.00 88.48 14 A 1 ATOM 120 C CE3 . TRP A 0 14 . -1.932 20.325 -4.899 1.00 88.48 14 A 1 ATOM 121 N NE1 . TRP A 0 14 . -1.487 19.005 -8.160 1.00 88.48 14 A 1 ATOM 122 C CH2 . TRP A 0 14 . -2.652 22.117 -6.398 1.00 88.48 14 A 1 ATOM 123 C CZ2 . TRP A 0 14 . -2.369 21.309 -7.512 1.00 88.48 14 A 1 ATOM 124 C CZ3 . TRP A 0 14 . -2.438 21.623 -5.099 1.00 88.48 14 A 1 ATOM 125 N N . ILE A 0 15 . 1.939 15.513 -5.962 1.00 85.89 15 A 1 ATOM 126 C CA . ILE A 0 15 . 2.429 14.828 -7.152 1.00 85.89 15 A 1 ATOM 127 C C . ILE A 0 15 . 1.201 14.317 -7.895 1.00 85.89 15 A 1 ATOM 128 C CB . ILE A 0 15 . 3.428 13.717 -6.777 1.00 85.89 15 A 1 ATOM 129 O O . ILE A 0 15 . 0.304 13.716 -7.301 1.00 85.89 15 A 1 ATOM 130 C CG1 . ILE A 0 15 . 4.625 14.331 -6.014 1.00 85.89 15 A 1 ATOM 131 C CG2 . ILE A 0 15 . 3.891 12.966 -8.039 1.00 85.89 15 A 1 ATOM 132 C CD1 . ILE A 0 15 . 5.626 13.293 -5.506 1.00 85.89 15 A 1 ATOM 133 N N . TYR A 0 16 . 1.124 14.574 -9.195 1.00 85.46 16 A 1 ATOM 134 C CA . TYR A 0 16 . 0.067 14.016 -10.027 1.00 85.46 16 A 1 ATOM 135 C C . TYR A 0 16 . 0.663 13.410 -11.286 1.00 85.46 16 A 1 ATOM 136 C CB . TYR A 0 16 . -1.019 15.059 -10.324 1.00 85.46 16 A 1 ATOM 137 O O . TYR A 0 16 . 1.584 13.962 -11.883 1.00 85.46 16 A 1 ATOM 138 C CG . TYR A 0 16 . -0.659 16.109 -11.358 1.00 85.46 16 A 1 ATOM 139 C CD1 . TYR A 0 16 . 0.078 17.253 -10.992 1.00 85.46 16 A 1 ATOM 140 C CD2 . TYR A 0 16 . -1.050 15.921 -12.699 1.00 85.46 16 A 1 ATOM 141 C CE1 . TYR A 0 16 . 0.417 18.215 -11.963 1.00 85.46 16 A 1 ATOM 142 C CE2 . TYR A 0 16 . -0.708 16.878 -13.673 1.00 85.46 16 A 1 ATOM 143 O OH . TYR A 0 16 . 0.344 18.941 -14.257 1.00 85.46 16 A 1 ATOM 144 C CZ . TYR A 0 16 . 0.024 18.026 -13.306 1.00 85.46 16 A 1 ATOM 145 N N . TYR A 0 17 . 0.099 12.279 -11.693 1.00 80.67 17 A 1 ATOM 146 C CA . TYR A 0 17 . 0.408 11.647 -12.963 1.00 80.67 17 A 1 ATOM 147 C C . TYR A 0 17 . -0.812 11.724 -13.878 1.00 80.67 17 A 1 ATOM 148 C CB . TYR A 0 17 . 0.896 10.217 -12.732 1.00 80.67 17 A 1 ATOM 149 O O . TYR A 0 17 . -1.951 11.486 -13.459 1.00 80.67 17 A 1 ATOM 150 C CG . TYR A 0 17 . 1.260 9.507 -14.017 1.00 80.67 17 A 1 ATOM 151 C CD1 . TYR A 0 17 . 0.435 8.478 -14.505 1.00 80.67 17 A 1 ATOM 152 C CD2 . TYR A 0 17 . 2.422 9.877 -14.725 1.00 80.67 17 A 1 ATOM 153 C CE1 . TYR A 0 17 . 0.775 7.812 -15.694 1.00 80.67 17 A 1 ATOM 154 C CE2 . TYR A 0 17 . 2.753 9.223 -15.928 1.00 80.67 17 A 1 ATOM 155 O OH . TYR A 0 17 . 2.231 7.546 -17.572 1.00 80.67 17 A 1 ATOM 156 C CZ . TYR A 0 17 . 1.924 8.190 -16.416 1.00 80.67 17 A 1 ATOM 157 N N . ARG A 0 18 . -0.565 12.086 -15.135 1.00 80.87 18 A 1 ATOM 158 C CA . ARG A 0 18 . -1.568 12.172 -16.191 1.00 80.87 18 A 1 ATOM 159 C C . ARG A 0 18 . -1.120 11.255 -17.315 1.00 80.87 18 A 1 ATOM 160 C CB . ARG A 0 18 . -1.695 13.634 -16.629 1.00 80.87 18 A 1 ATOM 161 O O . ARG A 0 18 . -0.033 11.435 -17.855 1.00 80.87 18 A 1 ATOM 162 C CG . ARG A 0 18 . -2.718 13.860 -17.750 1.00 80.87 18 A 1 ATOM 163 C CD . ARG A 0 18 . -2.580 15.307 -18.244 1.00 80.87 18 A 1 ATOM 164 N NE . ARG A 0 18 . -3.221 16.285 -17.347 1.00 80.87 18 A 1 ATOM 165 N NH1 . ARG A 0 18 . -3.301 18.035 -18.838 1.00 80.87 18 A 1 ATOM 166 N NH2 . ARG A 0 18 . -3.874 18.373 -16.712 1.00 80.87 18 A 1 ATOM 167 C CZ . ARG A 0 18 . -3.465 17.552 -17.637 1.00 80.87 18 A 1 ATOM 168 N N . TYR A 0 19 . -1.973 10.313 -17.676 1.00 81.64 19 A 1 ATOM 169 C CA . TYR A 0 19 . -1.764 9.438 -18.821 1.00 81.64 19 A 1 ATOM 170 C C . TYR A 0 19 . -2.758 9.803 -19.916 1.00 81.64 19 A 1 ATOM 171 C CB . TYR A 0 19 . -1.816 7.964 -18.408 1.00 81.64 19 A 1 ATOM 172 O O . TYR A 0 19 . -3.746 10.499 -19.673 1.00 81.64 19 A 1 ATOM 173 C CG . TYR A 0 19 . -3.142 7.470 -17.869 1.00 81.64 19 A 1 ATOM 174 C CD1 . TYR A 0 19 . -3.632 7.947 -16.637 1.00 81.64 19 A 1 ATOM 175 C CD2 . TYR A 0 19 . -3.862 6.491 -18.577 1.00 81.64 19 A 1 ATOM 176 C CE1 . TYR A 0 19 . -4.868 7.502 -16.147 1.00 81.64 19 A 1 ATOM 177 C CE2 . TYR A 0 19 . -5.053 5.975 -18.036 1.00 81.64 19 A 1 ATOM 178 O OH . TYR A 0 19 . -6.728 6.040 -16.316 1.00 81.64 19 A 1 ATOM 179 C CZ . TYR A 0 19 . -5.572 6.505 -16.842 1.00 81.64 19 A 1 ATOM 180 N N . LYS A 0 20 . -2.454 9.400 -21.147 1.00 83.15 20 A 1 ATOM 181 C CA . LYS A 0 20 . -3.328 9.624 -22.297 1.00 83.15 20 A 1 ATOM 182 C C . LYS A 0 20 . -4.058 8.322 -22.602 1.00 83.15 20 A 1 ATOM 183 C CB . LYS A 0 20 . -2.517 10.132 -23.497 1.00 83.15 20 A 1 ATOM 184 O O . LYS A 0 20 . -3.408 7.314 -22.862 1.00 83.15 20 A 1 ATOM 185 C CG . LYS A 0 20 . -1.922 11.532 -23.265 1.00 83.15 20 A 1 ATOM 186 C CD . LYS A 0 20 . -1.158 11.989 -24.515 1.00 83.15 20 A 1 ATOM 187 C CE . LYS A 0 20 . -0.546 13.382 -24.328 1.00 83.15 20 A 1 ATOM 188 N NZ . LYS A 0 20 . 0.143 13.826 -25.566 1.00 83.15 20 A 1 ATOM 189 N N . CYS A 0 21 . -5.383 8.364 -22.585 1.00 82.49 21 A 1 ATOM 190 C CA . CYS A 0 21 . -6.242 7.304 -23.106 1.00 82.49 21 A 1 ATOM 191 C C . CYS A 0 21 . -6.746 7.701 -24.491 1.00 82.49 21 A 1 ATOM 192 C CB . CYS A 0 21 . -7.421 7.086 -22.154 1.00 82.49 21 A 1 ATOM 193 O O . CYS A 0 21 . -6.840 8.890 -24.786 1.00 82.49 21 A 1 ATOM 194 S SG . CYS A 0 21 . -6.826 6.407 -20.594 1.00 82.49 21 A 1 ATOM 195 N N . LEU A 0 22 . -7.103 6.729 -25.325 1.00 86.64 22 A 1 ATOM 196 C CA . LEU A 0 22 . -7.907 6.991 -26.516 1.00 86.64 22 A 1 ATOM 197 C C . LEU A 0 22 . -9.381 6.921 -26.123 1.00 86.64 22 A 1 ATOM 198 C CB . LEU A 0 22 . -7.553 5.994 -27.631 1.00 86.64 22 A 1 ATOM 199 O O . LEU A 0 22 . -9.801 5.965 -25.468 1.00 86.64 22 A 1 ATOM 200 C CG . LEU A 0 22 . -6.104 6.104 -28.139 1.00 86.64 22 A 1 ATOM 201 C CD1 . LEU A 0 22 . -5.826 4.987 -29.143 1.00 86.64 22 A 1 ATOM 202 C CD2 . LEU A 0 22 . -5.816 7.444 -28.819 1.00 86.64 22 A 1 ATOM 203 N N . ASP A 0 23 . -10.154 7.937 -26.490 1.00 86.12 23 A 1 ATOM 204 C CA . ASP A 0 23 . -11.606 7.889 -26.358 1.00 86.12 23 A 1 ATOM 205 C C . ASP A 0 23 . -12.249 7.049 -27.481 1.00 86.12 23 A 1 ATOM 206 C CB . ASP A 0 23 . -12.167 9.316 -26.241 1.00 86.12 23 A 1 ATOM 207 O O . ASP A 0 23 . -11.574 6.457 -28.326 1.00 86.12 23 A 1 ATOM 208 C CG . ASP A 0 23 . -12.249 10.099 -27.556 1.00 86.12 23 A 1 ATOM 209 O OD1 . ASP A 0 23 . -11.811 9.575 -28.604 1.00 86.12 23 A 1 ATOM 210 O OD2 . ASP A 0 23 . -12.849 11.188 -27.516 1.00 86.12 23 A 1 ATOM 211 N N . LYS A 0 24 . -13.587 7.005 -27.516 1.00 86.75 24 A 1 ATOM 212 C CA . LYS A 0 24 . -14.340 6.267 -28.546 1.00 86.75 24 A 1 ATOM 213 C C . LYS A 0 24 . -14.133 6.801 -29.974 1.00 86.75 24 A 1 ATOM 214 C CB . LYS A 0 24 . -15.839 6.264 -28.208 1.00 86.75 24 A 1 ATOM 215 O O . LYS A 0 24 . -14.510 6.115 -30.917 1.00 86.75 24 A 1 ATOM 216 C CG . LYS A 0 24 . -16.169 5.512 -26.911 1.00 86.75 24 A 1 ATOM 217 C CD . LYS A 0 24 . -17.689 5.469 -26.704 1.00 86.75 24 A 1 ATOM 218 C CE . LYS A 0 24 . -18.036 4.718 -25.415 1.00 86.75 24 A 1 ATOM 219 N NZ . LYS A 0 24 . -19.505 4.651 -25.209 1.00 86.75 24 A 1 ATOM 220 N N . GLN A 0 25 . -13.587 8.006 -30.137 1.00 90.94 25 A 1 ATOM 221 C CA . GLN A 0 25 . -13.308 8.657 -31.420 1.00 90.94 25 A 1 ATOM 222 C C . GLN A 0 25 . -11.810 8.594 -31.781 1.00 90.94 25 A 1 ATOM 223 C CB . GLN A 0 25 . -13.835 10.106 -31.392 1.00 90.94 25 A 1 ATOM 224 O O . GLN A 0 25 . -11.381 9.272 -32.712 1.00 90.94 25 A 1 ATOM 225 C CG . GLN A 0 25 . -15.352 10.195 -31.159 1.00 90.94 25 A 1 ATOM 226 C CD . GLN A 0 25 . -15.871 11.630 -31.091 1.00 90.94 25 A 1 ATOM 227 N NE2 . GLN A 0 25 . -17.089 11.831 -30.634 1.00 90.94 25 A 1 ATOM 228 O OE1 . GLN A 0 25 . -15.234 12.600 -31.457 1.00 90.94 25 A 1 ATOM 229 N N . ASN A 0 26 . -11.011 7.777 -31.076 1.00 85.36 26 A 1 ATOM 230 C CA . ASN A 0 26 . -9.549 7.697 -31.202 1.00 85.36 26 A 1 ATOM 231 C C . ASN A 0 26 . -8.819 9.021 -30.909 1.00 85.36 26 A 1 ATOM 232 C CB . ASN A 0 26 . -9.140 7.053 -32.545 1.00 85.36 26 A 1 ATOM 233 O O . ASN A 0 26 . -7.701 9.243 -31.379 1.00 85.36 26 A 1 ATOM 234 C CG . ASN A 0 26 . -9.385 5.562 -32.617 1.00 85.36 26 A 1 ATOM 235 N ND2 . ASN A 0 26 . -9.363 5.009 -33.806 1.00 85.36 26 A 1 ATOM 236 O OD1 . ASN A 0 26 . -9.542 4.863 -31.632 1.00 85.36 26 A 1 ATOM 237 N N . VAL A 0 27 . -9.411 9.894 -30.096 1.00 89.72 27 A 1 ATOM 238 C CA . VAL A 0 27 . -8.779 11.136 -29.648 1.00 89.72 27 A 1 ATOM 239 C C . VAL A 0 27 . -8.047 10.878 -28.338 1.00 89.72 27 A 1 ATOM 240 C CB . VAL A 0 27 . -9.809 12.272 -29.527 1.00 89.72 27 A 1 ATOM 241 O O . VAL A 0 27 . -8.582 10.260 -27.417 1.00 89.72 27 A 1 ATOM 242 C CG1 . VAL A 0 27 . -9.142 13.587 -29.098 1.00 89.72 27 A 1 ATOM 243 C CG2 . VAL A 0 27 . -10.505 12.515 -30.874 1.00 89.72 27 A 1 ATOM 244 N N . SER A 0 28 . -6.803 11.355 -28.231 1.00 88.48 28 A 1 ATOM 245 C CA . SER A 0 28 . -6.027 11.213 -26.999 1.00 88.48 28 A 1 ATOM 246 C C . SER A 0 28 . -6.556 12.164 -25.920 1.00 88.48 28 A 1 ATOM 247 C CB . SER A 0 28 . -4.526 11.401 -27.252 1.00 88.48 28 A 1 ATOM 248 O O . SER A 0 28 . -6.323 13.374 -25.995 1.00 88.48 28 A 1 ATOM 249 O OG . SER A 0 28 . -4.181 12.758 -27.470 1.00 88.48 28 A 1 ATOM 250 N N . VAL A 0 29 . -7.222 11.631 -24.901 1.00 86.66 29 A 1 ATOM 251 C CA . VAL A 0 29 . -7.750 12.395 -23.768 1.00 86.66 29 A 1 ATOM 252 C C . VAL A 0 29 . -6.842 12.195 -22.551 1.00 86.66 29 A 1 ATOM 253 C CB . VAL A 0 29 . -9.213 12.031 -23.458 1.00 86.66 29 A 1 ATOM 254 O O . VAL A 0 29 . -6.504 11.059 -22.207 1.00 86.66 29 A 1 ATOM 255 C CG1 . VAL A 0 29 . -9.773 12.879 -22.307 1.00 86.66 29 A 1 ATOM 256 C CG2 . VAL A 0 29 . -10.103 12.282 -24.682 1.00 86.66 29 A 1 ATOM 257 N N . PRO A 0 30 . -6.404 13.278 -21.887 1.00 81.41 30 A 1 ATOM 258 C CA . PRO A 0 30 . -5.656 13.170 -20.645 1.00 81.41 30 A 1 ATOM 259 C C . PRO A 0 30 . -6.562 12.743 -19.483 1.00 81.41 30 A 1 ATOM 260 C CB . PRO A 0 30 . -5.068 14.561 -20.435 1.00 81.41 30 A 1 ATOM 261 O O . PRO A 0 30 . -7.437 13.505 -19.076 1.00 81.41 30 A 1 ATOM 262 C CG . PRO A 0 30 . -6.012 15.514 -21.160 1.00 81.41 30 A 1 ATOM 263 C CD . PRO A 0 30 . -6.556 14.666 -22.300 1.00 81.41 30 A 1 ATOM 264 N N . GLU A 0 31 . -6.303 11.578 -18.889 1.00 72.62 31 A 1 ATOM 265 C CA . GLU A 0 31 . -6.970 11.137 -17.662 1.00 72.62 31 A 1 ATOM 266 C C . GLU A 0 31 . -6.060 11.363 -16.439 1.00 72.62 31 A 1 ATOM 267 C CB . GLU A 0 31 . -7.439 9.674 -17.751 1.00 72.62 31 A 1 ATOM 268 O O . GLU A 0 31 . -4.876 10.997 -16.458 1.00 72.62 31 A 1 ATOM 269 C CG . GLU A 0 31 . -8.653 9.509 -18.683 1.00 72.62 31 A 1 ATOM 270 C CD . GLU A 0 31 . -9.318 8.119 -18.608 1.00 72.62 31 A 1 ATOM 271 O OE1 . GLU A 0 31 . -10.279 7.892 -19.367 1.00 72.62 31 A 1 ATOM 272 O OE2 . GLU A 0 31 . -8.900 7.252 -17.798 1.00 72.62 31 A 1 ATOM 273 N N . PRO A 0 32 . -6.568 11.976 -15.353 1.00 70.47 32 A 1 ATOM 274 C CA . PRO A 0 32 . -5.854 11.996 -14.083 1.00 70.47 32 A 1 ATOM 275 C C . PRO A 0 32 . -5.859 10.579 -13.490 1.00 70.47 32 A 1 ATOM 276 C CB . PRO A 0 32 . -6.608 13.016 -13.224 1.00 70.47 32 A 1 ATOM 277 O O . PRO A 0 32 . -6.923 9.991 -13.324 1.00 70.47 32 A 1 ATOM 278 C CG . PRO A 0 32 . -8.046 12.953 -13.746 1.00 70.47 32 A 1 ATOM 279 C CD . PRO A 0 32 . -7.887 12.586 -15.221 1.00 70.47 32 A 1 ATOM 280 N N . TYR A 0 33 . -4.686 10.017 -13.176 1.00 67.42 33 A 1 ATOM 281 C CA . TYR A 0 33 . -4.612 8.685 -12.558 1.00 67.42 33 A 1 ATOM 282 C C . TYR A 0 33 . -4.997 8.749 -11.080 1.00 67.42 33 A 1 ATOM 283 C CB . TYR A 0 33 . -3.227 8.063 -12.778 1.00 67.42 33 A 1 ATOM 284 O O . TYR A 0 33 . -5.967 8.131 -10.674 1.00 67.42 33 A 1 ATOM 285 C CG . TYR A 0 33 . -3.107 6.656 -12.226 1.00 67.42 33 A 1 ATOM 286 C CD1 . TYR A 0 33 . -2.379 6.421 -11.042 1.00 67.42 33 A 1 ATOM 287 C CD2 . TYR A 0 33 . -3.751 5.587 -12.881 1.00 67.42 33 A 1 ATOM 288 C CE1 . TYR A 0 33 . -2.310 5.124 -10.501 1.00 67.42 33 A 1 ATOM 289 C CE2 . TYR A 0 33 . -3.688 4.289 -12.340 1.00 67.42 33 A 1 ATOM 290 O OH . TYR A 0 33 . -2.963 2.823 -10.599 1.00 67.42 33 A 1 ATOM 291 C CZ . TYR A 0 33 . -2.979 4.061 -11.145 1.00 67.42 33 A 1 ATOM 292 N N . ASN A 0 34 . -4.257 9.538 -10.300 1.00 74.23 34 A 1 ATOM 293 C CA . ASN A 0 34 . -4.541 9.909 -8.915 1.00 74.23 34 A 1 ATOM 294 C C . ASN A 0 34 . -3.575 11.034 -8.507 1.00 74.23 34 A 1 ATOM 295 C CB . ASN A 0 34 . -4.415 8.672 -7.996 1.00 74.23 34 A 1 ATOM 296 O O . ASN A 0 34 . -2.536 11.237 -9.145 1.00 74.23 34 A 1 ATOM 297 C CG . ASN A 0 34 . -5.735 7.923 -7.854 1.00 74.23 34 A 1 ATOM 298 N ND2 . ASN A 0 34 . -5.710 6.617 -7.729 1.00 74.23 34 A 1 ATOM 299 O OD1 . ASN A 0 34 . -6.797 8.522 -7.800 1.00 74.23 34 A 1 ATOM 300 N N . ARG A 0 35 . -3.921 11.786 -7.458 1.00 81.37 35 A 1 ATOM 301 C CA . ARG A 0 35 . -3.043 12.810 -6.869 1.00 81.37 35 A 1 ATOM 302 C C . ARG A 0 35 . -2.522 12.309 -5.532 1.00 81.37 35 A 1 ATOM 303 C CB . ARG A 0 35 . -3.770 14.153 -6.701 1.00 81.37 35 A 1 ATOM 304 O O . ARG A 0 35 . -3.316 11.931 -4.677 1.00 81.37 35 A 1 ATOM 305 C CG . ARG A 0 35 . -4.217 14.753 -8.041 1.00 81.37 35 A 1 ATOM 306 C CD . ARG A 0 35 . -4.819 16.154 -7.874 1.00 81.37 35 A 1 ATOM 307 N NE . ARG A 0 35 . -6.110 16.113 -7.157 1.00 81.37 35 A 1 ATOM 308 N NH1 . ARG A 0 35 . -7.033 18.028 -8.032 1.00 81.37 35 A 1 ATOM 309 N NH2 . ARG A 0 35 . -8.211 16.792 -6.596 1.00 81.37 35 A 1 ATOM 310 C CZ . ARG A 0 35 . -7.107 16.975 -7.266 1.00 81.37 35 A 1 ATOM 311 N N . ILE A 0 36 . -1.211 12.359 -5.342 1.00 86.15 36 A 1 ATOM 312 C CA . ILE A 0 36 . -0.576 12.139 -4.046 1.00 86.15 36 A 1 ATOM 313 C C . ILE A 0 36 . -0.420 13.511 -3.401 1.00 86.15 36 A 1 ATOM 314 C CB . ILE A 0 36 . 0.767 11.399 -4.193 1.00 86.15 36 A 1 ATOM 315 O O . ILE A 0 36 . 0.415 14.311 -3.820 1.00 86.15 36 A 1 ATOM 316 C CG1 . ILE A 0 36 . 0.583 10.058 -4.940 1.00 86.15 36 A 1 ATOM 317 C CG2 . ILE A 0 36 . 1.371 11.174 -2.796 1.00 86.15 36 A 1 ATOM 318 C CD1 . ILE A 0 36 . 1.899 9.325 -5.227 1.00 86.15 36 A 1 ATOM 319 N N . GLN A 0 37 . -1.265 13.810 -2.420 1.00 88.76 37 A 1 ATOM 320 C CA . GLN A 0 37 . -1.196 15.071 -1.692 1.00 88.76 37 A 1 ATOM 321 C C . GLN A 0 37 . -0.064 15.016 -0.665 1.00 88.76 37 A 1 ATOM 322 C CB . GLN A 0 37 . -2.558 15.362 -1.054 1.00 88.76 37 A 1 ATOM 323 O O . GLN A 0 37 . -0.018 14.101 0.154 1.00 88.76 37 A 1 ATOM 324 C CG . GLN A 0 37 . -2.595 16.748 -0.394 1.00 88.76 37 A 1 ATOM 325 C CD . GLN A 0 37 . -3.983 17.127 0.109 1.00 88.76 37 A 1 ATOM 326 N NE2 . GLN A 0 37 . -4.118 18.265 0.751 1.00 88.76 37 A 1 ATOM 327 O OE1 . GLN A 0 37 . -4.972 16.436 -0.069 1.00 88.76 37 A 1 ATOM 328 N N . ILE A 0 38 . 0.820 16.013 -0.681 1.00 89.71 38 A 1 ATOM 329 C CA . ILE A 0 38 . 1.866 16.154 0.331 1.00 89.71 38 A 1 ATOM 330 C C . ILE A 0 38 . 1.211 16.702 1.606 1.00 89.71 38 A 1 ATOM 331 C CB . ILE A 0 38 . 3.019 17.042 -0.183 1.00 89.71 38 A 1 ATOM 332 O O . ILE A 0 38 . 0.596 17.775 1.565 1.00 89.71 38 A 1 ATOM 333 C CG1 . ILE A 0 38 . 3.746 16.335 -1.350 1.00 89.71 38 A 1 ATOM 334 C CG2 . ILE A 0 38 . 4.039 17.327 0.937 1.00 89.71 38 A 1 ATOM 335 C CD1 . ILE A 0 38 . 4.441 17.287 -2.320 1.00 89.71 38 A 1 ATOM 336 N N . PRO A 0 39 . 1.308 15.995 2.748 1.00 88.55 39 A 1 ATOM 337 C CA . PRO A 0 39 . 0.790 16.500 4.012 1.00 88.55 39 A 1 ATOM 338 C C . PRO A 0 39 . 1.386 17.869 4.348 1.00 88.55 39 A 1 ATOM 339 C CB . PRO A 0 39 . 1.161 15.445 5.060 1.00 88.55 39 A 1 ATOM 340 O O . PRO A 0 39 . 2.605 18.029 4.330 1.00 88.55 39 A 1 ATOM 341 C CG . PRO A 0 39 . 1.252 14.155 4.246 1.00 88.55 39 A 1 ATOM 342 C CD . PRO A 0 39 . 1.779 14.624 2.894 1.00 88.55 39 A 1 ATOM 343 N N . LYS A 0 40 . 0.537 18.835 4.727 1.00 87.41 40 A 1 ATOM 344 C CA . LYS A 0 40 . 0.949 20.224 5.017 1.00 87.41 40 A 1 ATOM 345 C C . LYS A 0 40 . 2.147 20.322 5.966 1.00 87.41 40 A 1 ATOM 346 C CB . LYS A 0 40 . -0.221 21.025 5.606 1.00 87.41 40 A 1 ATOM 347 O O . LYS A 0 40 . 3.027 21.140 5.755 1.00 87.41 40 A 1 ATOM 348 C CG . LYS A 0 40 . -1.351 21.307 4.603 1.00 87.41 40 A 1 ATOM 349 C CD . LYS A 0 40 . -2.325 22.316 5.228 1.00 87.41 40 A 1 ATOM 350 C CE . LYS A 0 40 . -3.406 22.770 4.244 1.00 87.41 40 A 1 ATOM 351 N NZ . LYS A 0 40 . -4.072 23.999 4.750 1.00 87.41 40 A 1 ATOM 352 N N . LYS A 0 41 . 2.231 19.425 6.958 1.00 88.10 41 A 1 ATOM 353 C CA . LYS A 0 41 . 3.339 19.353 7.930 1.00 88.10 41 A 1 ATOM 354 C C . LYS A 0 41 . 4.735 19.184 7.308 1.00 88.10 41 A 1 ATOM 355 C CB . LYS A 0 41 . 3.058 18.238 8.954 1.00 88.10 41 A 1 ATOM 356 O O . LYS A 0 41 . 5.722 19.490 7.973 1.00 88.10 41 A 1 ATOM 357 C CG . LYS A 0 41 . 3.065 16.820 8.350 1.00 88.10 41 A 1 ATOM 358 C CD . LYS A 0 41 . 2.834 15.751 9.427 1.00 88.10 41 A 1 ATOM 359 C CE . LYS A 0 41 . 2.897 14.355 8.794 1.00 88.10 41 A 1 ATOM 360 N NZ . LYS A 0 41 . 2.783 13.271 9.805 1.00 88.10 41 A 1 ATOM 361 N N . PHE A 0 42 . 4.815 18.673 6.079 1.00 88.79 42 A 1 ATOM 362 C CA . PHE A 0 42 . 6.064 18.473 5.343 1.00 88.79 42 A 1 ATOM 363 C C . PHE A 0 42 . 6.384 19.614 4.367 1.00 88.79 42 A 1 ATOM 364 C CB . PHE A 0 42 . 6.002 17.128 4.605 1.00 88.79 42 A 1 ATOM 365 O O . PHE A 0 42 . 7.483 19.654 3.824 1.00 88.79 42 A 1 ATOM 366 C CG . PHE A 0 42 . 5.829 15.903 5.486 1.00 88.79 42 A 1 ATOM 367 C CD1 . PHE A 0 42 . 6.723 15.652 6.543 1.00 88.79 42 A 1 ATOM 368 C CD2 . PHE A 0 42 . 4.833 14.958 5.187 1.00 88.79 42 A 1 ATOM 369 C CE1 . PHE A 0 42 . 6.627 14.461 7.284 1.00 88.79 42 A 1 ATOM 370 C CE2 . PHE A 0 42 . 4.741 13.760 5.917 1.00 88.79 42 A 1 ATOM 371 C CZ . PHE A 0 42 . 5.649 13.505 6.959 1.00 88.79 42 A 1 ATOM 372 N N . ILE A 0 43 . 5.454 20.546 4.142 1.00 86.77 43 A 1 ATOM 373 C CA . ILE A 0 43 . 5.652 21.683 3.240 1.00 86.77 43 A 1 ATOM 374 C C . ILE A 0 43 . 6.338 22.798 4.028 1.00 86.77 43 A 1 ATOM 375 C CB . ILE A 0 43 . 4.317 22.142 2.609 1.00 86.77 43 A 1 ATOM 376 O O . ILE A 0 43 . 5.678 23.560 4.727 1.00 86.77 43 A 1 ATOM 377 C CG1 . ILE A 0 43 . 3.579 20.964 1.929 1.00 86.77 43 A 1 ATOM 378 C CG2 . ILE A 0 43 . 4.617 23.258 1.593 1.00 86.77 43 A 1 ATOM 379 C CD1 . ILE A 0 43 . 2.215 21.330 1.331 1.00 86.77 43 A 1 ATOM 380 N N . LYS A 0 44 . 7.668 22.860 3.940 1.00 85.50 44 A 1 ATOM 381 C CA . LYS A 0 44 . 8.495 23.864 4.620 1.00 85.50 44 A 1 ATOM 382 C C . LYS A 0 44 . 9.609 24.356 3.712 1.00 85.50 44 A 1 ATOM 383 C CB . LYS A 0 44 . 9.091 23.283 5.906 1.00 85.50 44 A 1 ATOM 384 O O . LYS A 0 44 . 10.061 23.638 2.816 1.00 85.50 44 A 1 ATOM 385 C CG . LYS A 0 44 . 8.032 22.955 6.961 1.00 85.50 44 A 1 ATOM 386 C CD . LYS A 0 44 . 8.708 22.421 8.222 1.00 85.50 44 A 1 ATOM 387 C CE . LYS A 0 44 . 7.622 22.078 9.239 1.00 85.50 44 A 1 ATOM 388 N NZ . LYS A 0 44 . 8.220 21.627 10.516 1.00 85.50 44 A 1 ATOM 389 N N . SER A 0 45 . 10.078 25.573 3.966 1.00 84.76 45 A 1 ATOM 390 C CA . SER A 0 45 . 11.220 26.129 3.238 1.00 84.76 45 A 1 ATOM 391 C C . SER A 0 45 . 12.452 25.214 3.326 1.00 84.76 45 A 1 ATOM 392 C CB . SER A 0 45 . 11.542 27.520 3.777 1.00 84.76 45 A 1 ATOM 393 O O . SER A 0 45 . 12.828 24.766 4.407 1.00 84.76 45 A 1 ATOM 394 O OG . SER A 0 45 . 12.482 28.172 2.940 1.00 84.76 45 A 1 ATOM 395 N N . ARG A 0 46 . 13.095 24.961 2.175 1.00 86.54 46 A 1 ATOM 396 C CA . ARG A 0 46 . 14.319 24.140 2.030 1.00 86.54 46 A 1 ATOM 397 C C . ARG A 0 46 . 14.183 22.670 2.458 1.00 86.54 46 A 1 ATOM 398 C CB . ARG A 0 46 . 15.518 24.817 2.722 1.00 86.54 46 A 1 ATOM 399 O O . ARG A 0 46 . 15.185 22.048 2.801 1.00 86.54 46 A 1 ATOM 400 C CG . ARG A 0 46 . 15.756 26.264 2.283 1.00 86.54 46 A 1 ATOM 401 C CD . ARG A 0 46 . 16.934 26.831 3.075 1.00 86.54 46 A 1 ATOM 402 N NE . ARG A 0 46 . 17.201 28.229 2.692 1.00 86.54 46 A 1 ATOM 403 N NH1 . ARG A 0 46 . 19.488 28.088 2.488 1.00 86.54 46 A 1 ATOM 404 N NH2 . ARG A 0 46 . 18.461 30.032 2.117 1.00 86.54 46 A 1 ATOM 405 C CZ . ARG A 0 46 . 18.378 28.770 2.435 1.00 86.54 46 A 1 ATOM 406 N N . ILE A 0 47 . 12.978 22.104 2.405 1.00 88.08 47 A 1 ATOM 407 C CA . ILE A 0 47 . 12.745 20.672 2.631 1.00 88.08 47 A 1 ATOM 408 C C . ILE A 0 47 . 12.520 19.944 1.303 1.00 88.08 47 A 1 ATOM 409 C CB . ILE A 0 47 . 11.591 20.469 3.636 1.00 88.08 47 A 1 ATOM 410 O O . ILE A 0 47 . 11.783 20.421 0.440 1.00 88.08 47 A 1 ATOM 411 C CG1 . ILE A 0 47 . 11.912 21.079 5.021 1.00 88.08 47 A 1 ATOM 412 C CG2 . ILE A 0 47 . 11.218 18.985 3.802 1.00 88.08 47 A 1 ATOM 413 C CD1 . ILE A 0 47 . 13.207 20.611 5.696 1.00 88.08 47 A 1 ATOM 414 N N . LEU A 0 48 . 13.138 18.770 1.164 1.00 89.65 48 A 1 ATOM 415 C CA . LEU A 0 48 . 12.865 17.804 0.104 1.00 89.65 48 A 1 ATOM 416 C C . LEU A 0 48 . 11.948 16.709 0.661 1.00 89.65 48 A 1 ATOM 417 C CB . LEU A 0 48 . 14.201 17.249 -0.424 1.00 89.65 48 A 1 ATOM 418 O O . LEU A 0 48 . 12.219 16.153 1.723 1.00 89.65 48 A 1 ATOM 419 C CG . LEU A 0 48 . 14.065 16.209 -1.551 1.00 89.65 48 A 1 ATOM 420 C CD1 . LEU A 0 48 . 13.427 16.793 -2.814 1.00 89.65 48 A 1 ATOM 421 C CD2 . LEU A 0 48 . 15.450 15.682 -1.913 1.00 89.65 48 A 1 ATOM 422 N N . VAL A 0 49 . 10.859 16.419 -0.050 1.00 89.04 49 A 1 ATOM 423 C CA . VAL A 0 49 . 9.938 15.327 0.280 1.00 89.04 49 A 1 ATOM 424 C C . VAL A 0 49 . 10.078 14.264 -0.797 1.00 89.04 49 A 1 ATOM 425 C CB . VAL A 0 49 . 8.482 15.818 0.405 1.00 89.04 49 A 1 ATOM 426 O O . VAL A 0 49 . 9.709 14.502 -1.947 1.00 89.04 49 A 1 ATOM 427 C CG1 . VAL A 0 49 . 7.536 14.673 0.795 1.00 89.04 49 A 1 ATOM 428 C CG2 . VAL A 0 49 . 8.349 16.916 1.470 1.00 89.04 49 A 1 ATOM 429 N N . GLU A 0 50 . 10.605 13.105 -0.420 1.00 90.17 50 A 1 ATOM 430 C CA . GLU A 0 50 . 10.739 11.945 -1.298 1.00 90.17 50 A 1 ATOM 431 C C . GLU A 0 50 . 9.638 10.927 -1.000 1.00 90.17 50 A 1 ATOM 432 C CB . GLU A 0 50 . 12.141 11.328 -1.190 1.00 90.17 50 A 1 ATOM 433 O O . GLU A 0 50 . 9.227 10.741 0.146 1.00 90.17 50 A 1 ATOM 434 C CG . GLU A 0 50 . 13.200 12.296 -1.740 1.00 90.17 50 A 1 ATOM 435 C CD . GLU A 0 50 . 14.628 11.737 -1.737 1.00 90.17 50 A 1 ATOM 436 O OE1 . GLU A 0 50 . 15.496 12.421 -2.326 1.00 90.17 50 A 1 ATOM 437 O OE2 . GLU A 0 50 . 14.849 10.664 -1.141 1.00 90.17 50 A 1 ATOM 438 N N . PHE A 0 51 . 9.140 10.289 -2.056 1.00 87.48 51 A 1 ATOM 439 C CA . PHE A 0 51 . 8.156 9.220 -1.965 1.00 87.48 51 A 1 ATOM 440 C C . PHE A 0 51 . 8.805 7.931 -2.438 1.00 87.48 51 A 1 ATOM 441 C CB . PHE A 0 51 . 6.917 9.545 -2.807 1.00 87.48 51 A 1 ATOM 442 O O . PHE A 0 51 . 9.241 7.840 -3.585 1.00 87.48 51 A 1 ATOM 443 C CG . PHE A 0 51 . 6.063 10.663 -2.249 1.00 87.48 51 A 1 ATOM 444 C CD1 . PHE A 0 51 . 4.967 10.364 -1.420 1.00 87.48 51 A 1 ATOM 445 C CD2 . PHE A 0 51 . 6.369 12.003 -2.546 1.00 87.48 51 A 1 ATOM 446 C CE1 . PHE A 0 51 . 4.167 11.399 -0.909 1.00 87.48 51 A 1 ATOM 447 C CE2 . PHE A 0 51 . 5.559 13.039 -2.050 1.00 87.48 51 A 1 ATOM 448 C CZ . PHE A 0 51 . 4.452 12.735 -1.238 1.00 87.48 51 A 1 ATOM 449 N N . GLU A 0 52 . 8.819 6.929 -1.570 1.00 89.17 52 A 1 ATOM 450 C CA . GLU A 0 52 . 9.220 5.581 -1.941 1.00 89.17 52 A 1 ATOM 451 C C . GLU A 0 52 . 7.993 4.817 -2.449 1.00 89.17 52 A 1 ATOM 452 C CB . GLU A 0 52 . 9.893 4.875 -0.764 1.00 89.17 52 A 1 ATOM 453 O O . GLU A 0 52 . 6.925 4.874 -1.827 1.00 89.17 52 A 1 ATOM 454 C CG . GLU A 0 52 . 11.232 5.550 -0.422 1.00 89.17 52 A 1 ATOM 455 C CD . GLU A 0 52 . 11.970 4.872 0.740 1.00 89.17 52 A 1 ATOM 456 O OE1 . GLU A 0 52 . 13.128 5.269 0.988 1.00 89.17 52 A 1 ATOM 457 O OE2 . GLU A 0 52 . 11.377 3.974 1.380 1.00 89.17 52 A 1 ATOM 458 N N . PRO A 0 53 . 8.090 4.128 -3.597 1.00 84.82 53 A 1 ATOM 459 C CA . PRO A 0 53 . 7.004 3.284 -4.055 1.00 84.82 53 A 1 ATOM 460 C C . PRO A 0 53 . 6.816 2.124 -3.075 1.00 84.82 53 A 1 ATOM 461 C CB . PRO A 0 53 . 7.415 2.812 -5.451 1.00 84.82 53 A 1 ATOM 462 O O . PRO A 0 53 . 7.785 1.507 -2.634 1.00 84.82 53 A 1 ATOM 463 C CG . PRO A 0 53 . 8.944 2.818 -5.391 1.00 84.82 53 A 1 ATOM 464 C CD . PRO A 0 53 . 9.261 3.981 -4.452 1.00 84.82 53 A 1 ATOM 465 N N . ASN A 0 54 . 5.561 1.783 -2.782 1.00 83.54 54 A 1 ATOM 466 C CA . ASN A 0 54 . 5.270 0.578 -2.015 1.00 83.54 54 A 1 ATOM 467 C C . ASN A 0 54 . 5.846 -0.637 -2.751 1.00 83.54 54 A 1 ATOM 468 C CB . ASN A 0 54 . 3.755 0.422 -1.801 1.00 83.54 54 A 1 ATOM 469 O O . ASN A 0 54 . 5.522 -0.874 -3.916 1.00 83.54 54 A 1 ATOM 470 C CG . ASN A 0 54 . 3.156 1.439 -0.849 1.00 83.54 54 A 1 ATOM 471 N ND2 . ASN A 0 54 . 1.851 1.459 -0.728 1.00 83.54 54 A 1 ATOM 472 O OD1 . ASN A 0 54 . 3.820 2.218 -0.195 1.00 83.54 54 A 1 ATOM 473 N N . THR A 0 55 . 6.670 -1.417 -2.058 1.00 88.21 55 A 1 ATOM 474 C CA . THR A 0 55 . 7.270 -2.652 -2.585 1.00 88.21 55 A 1 ATOM 475 C C . THR A 0 55 . 6.280 -3.816 -2.620 1.00 88.21 55 A 1 ATOM 476 C CB . THR A 0 55 . 8.491 -3.044 -1.745 1.00 88.21 55 A 1 ATOM 477 O O . THR A 0 55 . 6.517 -4.813 -3.295 1.00 88.21 55 A 1 ATOM 478 C CG2 . THR A 0 55 . 9.621 -2.023 -1.882 1.00 88.21 55 A 1 ATOM 479 O OG1 . THR A 0 55 . 8.134 -3.094 -0.381 1.00 88.21 55 A 1 ATOM 480 N N . GLU A 0 56 . 5.151 -3.681 -1.922 1.00 89.16 56 A 1 ATOM 481 C CA . GLU A 0 56 . 4.082 -4.668 -1.874 1.00 89.16 56 A 1 ATOM 482 C C . GLU A 0 56 . 2.719 -4.001 -2.065 1.00 89.16 56 A 1 ATOM 483 C CB . GLU A 0 56 . 4.106 -5.422 -0.540 1.00 89.16 56 A 1 ATOM 484 O O . GLU A 0 56 . 2.399 -2.990 -1.438 1.00 89.16 56 A 1 ATOM 485 C CG . GLU A 0 56 . 5.408 -6.200 -0.304 1.00 89.16 56 A 1 ATOM 486 C CD . GLU A 0 56 . 5.335 -7.063 0.960 1.00 89.16 56 A 1 ATOM 487 O OE1 . GLU A 0 56 . 6.072 -8.067 1.002 1.00 89.16 56 A 1 ATOM 488 O OE2 . GLU A 0 56 . 4.496 -6.761 1.850 1.00 89.16 56 A 1 ATOM 489 N N . SER A 0 57 . 1.890 -4.591 -2.922 1.00 91.60 57 A 1 ATOM 490 C CA . SER A 0 57 . 0.492 -4.210 -3.104 1.00 91.60 57 A 1 ATOM 491 C C . SER A 0 57 . -0.311 -5.398 -3.629 1.00 91.60 57 A 1 ATOM 492 C CB . SER A 0 57 . 0.402 -3.030 -4.075 1.00 91.60 57 A 1 ATOM 493 O O . SER A 0 57 . 0.267 -6.341 -4.176 1.00 91.60 57 A 1 ATOM 494 O OG . SER A 0 57 . -0.892 -2.461 -4.025 1.00 91.60 57 A 1 ATOM 495 N N . CYS A 0 58 . -1.636 -5.349 -3.487 1.00 95.56 58 A 1 ATOM 496 C CA . CYS A 0 58 . -2.535 -6.415 -3.925 1.00 95.56 58 A 1 ATOM 497 C C . CYS A 0 58 . -2.380 -6.704 -5.422 1.00 95.56 58 A 1 ATOM 498 C CB . CYS A 0 58 . -3.974 -6.021 -3.590 1.00 95.56 58 A 1 ATOM 499 O O . CYS A 0 58 . -2.147 -7.846 -5.797 1.00 95.56 58 A 1 ATOM 500 S SG . CYS A 0 58 . -4.251 -5.599 -1.858 1.00 95.56 58 A 1 ATOM 501 N N . PHE A 0 59 . -2.394 -5.675 -6.279 1.00 94.05 59 A 1 ATOM 502 C CA . PHE A 0 59 . -2.297 -5.859 -7.735 1.00 94.05 59 A 1 ATOM 503 C C . PHE A 0 59 . -1.016 -6.565 -8.214 1.00 94.05 59 A 1 ATOM 504 C CB . PHE A 0 59 . -2.449 -4.505 -8.440 1.00 94.05 59 A 1 ATOM 505 O O . PHE A 0 59 . -0.977 -7.061 -9.335 1.00 94.05 59 A 1 ATOM 506 C CG . PHE A 0 59 . -1.184 -3.670 -8.492 1.00 94.05 59 A 1 ATOM 507 C CD1 . PHE A 0 59 . -0.891 -2.748 -7.472 1.00 94.05 59 A 1 ATOM 508 C CD2 . PHE A 0 59 . -0.294 -3.822 -9.574 1.00 94.05 59 A 1 ATOM 509 C CE1 . PHE A 0 59 . 0.277 -1.969 -7.542 1.00 94.05 59 A 1 ATOM 510 C CE2 . PHE A 0 59 . 0.876 -3.048 -9.641 1.00 94.05 59 A 1 ATOM 511 C CZ . PHE A 0 59 . 1.160 -2.118 -8.626 1.00 94.05 59 A 1 ATOM 512 N N . MET A 0 60 . 0.033 -6.614 -7.383 1.00 94.85 60 A 1 ATOM 513 C CA . MET A 0 60 . 1.285 -7.306 -7.705 1.00 94.85 60 A 1 ATOM 514 C C . MET A 0 60 . 1.200 -8.825 -7.481 1.00 94.85 60 A 1 ATOM 515 C CB . MET A 0 60 . 2.436 -6.726 -6.870 1.00 94.85 60 A 1 ATOM 516 O O . MET A 0 60 . 2.101 -9.554 -7.892 1.00 94.85 60 A 1 ATOM 517 C CG . MET A 0 60 . 2.633 -5.217 -7.042 1.00 94.85 60 A 1 ATOM 518 S SD . MET A 0 60 . 4.003 -4.598 -6.034 1.00 94.85 60 A 1 ATOM 519 C CE . MET A 0 60 . 3.908 -2.826 -6.388 1.00 94.85 60 A 1 ATOM 520 N N . LYS A 0 61 . 0.159 -9.317 -6.798 1.00 96.46 61 A 1 ATOM 521 C CA . LYS A 0 61 . -0.017 -10.736 -6.468 1.00 96.46 61 A 1 ATOM 522 C C . LYS A 0 61 . -0.709 -11.467 -7.616 1.00 96.46 61 A 1 ATOM 523 C CB . LYS A 0 61 . -0.770 -10.894 -5.136 1.00 96.46 61 A 1 ATOM 524 O O . LYS A 0 61 . -1.698 -10.988 -8.170 1.00 96.46 61 A 1 ATOM 525 C CG . LYS A 0 61 . -0.162 -10.091 -3.970 1.00 96.46 61 A 1 ATOM 526 C CD . LYS A 0 61 . 1.286 -10.485 -3.629 1.00 96.46 61 A 1 ATOM 527 C CE . LYS A 0 61 . 1.845 -9.545 -2.553 1.00 96.46 61 A 1 ATOM 528 N NZ . LYS A 0 61 . 3.192 -9.960 -2.078 1.00 96.46 61 A 1 ATOM 529 N N . VAL A 0 62 . -0.172 -12.636 -7.961 1.00 95.73 62 A 1 ATOM 530 C CA . VAL A 0 62 . -0.527 -13.386 -9.181 1.00 95.73 62 A 1 ATOM 531 C C . VAL A 0 62 . -1.319 -14.666 -8.913 1.00 95.73 62 A 1 ATOM 532 C CB . VAL A 0 62 . 0.722 -13.693 -10.031 1.00 95.73 62 A 1 ATOM 533 O O . VAL A 0 62 . -1.773 -15.299 -9.860 1.00 95.73 62 A 1 ATOM 534 C CG1 . VAL A 0 62 . 1.409 -12.404 -10.499 1.00 95.73 62 A 1 ATOM 535 C CG2 . VAL A 0 62 . 1.745 -14.558 -9.280 1.00 95.73 62 A 1 ATOM 536 N N . SER A 0 63 . -1.497 -15.055 -7.648 1.00 96.88 63 A 1 ATOM 537 C CA . SER A 0 63 . -2.321 -16.202 -7.253 1.00 96.88 63 A 1 ATOM 538 C C . SER A 0 63 . -3.335 -15.803 -6.186 1.00 96.88 63 A 1 ATOM 539 C CB . SER A 0 63 . -1.452 -17.388 -6.803 1.00 96.88 63 A 1 ATOM 540 O O . SER A 0 63 . -3.159 -14.793 -5.501 1.00 96.88 63 A 1 ATOM 541 O OG . SER A 0 63 . -1.186 -17.378 -5.412 1.00 96.88 63 A 1 ATOM 542 N N . ASN A 0 64 . -4.381 -16.613 -6.023 1.00 97.03 64 A 1 ATOM 543 C CA . ASN A 0 64 . -5.391 -16.400 -4.992 1.00 97.03 64 A 1 ATOM 544 C C . ASN A 0 64 . -4.767 -16.421 -3.590 1.00 97.03 64 A 1 ATOM 545 C CB . ASN A 0 64 . -6.460 -17.490 -5.155 1.00 97.03 64 A 1 ATOM 546 O O . ASN A 0 64 . -4.966 -15.501 -2.806 1.00 97.03 64 A 1 ATOM 547 C CG . ASN A 0 64 . -7.612 -17.338 -4.180 1.00 97.03 64 A 1 ATOM 548 N ND2 . ASN A 0 64 . -8.374 -18.384 -3.977 1.00 97.03 64 A 1 ATOM 549 O OD1 . ASN A 0 64 . -7.876 -16.295 -3.614 1.00 97.03 64 A 1 ATOM 550 N N . GLU A 0 65 . -3.940 -17.425 -3.309 1.00 97.05 65 A 1 ATOM 551 C CA . GLU A 0 65 . -3.292 -17.617 -2.009 1.00 97.05 65 A 1 ATOM 552 C C . GLU A 0 65 . -2.406 -16.411 -1.678 1.00 97.05 65 A 1 ATOM 553 C CB . GLU A 0 65 . -2.462 -18.919 -1.994 1.00 97.05 65 A 1 ATOM 554 O O . GLU A 0 65 . -2.610 -15.735 -0.674 1.00 97.05 65 A 1 ATOM 555 C CG . GLU A 0 65 . -3.214 -20.194 -2.428 1.00 97.05 65 A 1 ATOM 556 C CD . GLU A 0 65 . -3.497 -20.273 -3.941 1.00 97.05 65 A 1 ATOM 557 O OE1 . GLU A 0 65 . -4.468 -20.964 -4.316 1.00 97.05 65 A 1 ATOM 558 O OE2 . GLU A 0 65 . -2.817 -19.552 -4.723 1.00 97.05 65 A 1 ATOM 559 N N . THR A 0 66 . -1.507 -16.047 -2.600 1.00 97.04 66 A 1 ATOM 560 C CA . THR A 0 66 . -0.597 -14.906 -2.411 1.00 97.04 66 A 1 ATOM 561 C C . THR A 0 66 . -1.318 -13.561 -2.343 1.00 97.04 66 A 1 ATOM 562 C CB . THR A 0 66 . 0.471 -14.834 -3.512 1.00 97.04 66 A 1 ATOM 563 O O . THR A 0 66 . -0.786 -12.619 -1.756 1.00 97.04 66 A 1 ATOM 564 C CG2 . THR A 0 66 . 1.393 -16.052 -3.512 1.00 97.04 66 A 1 ATOM 565 O OG1 . THR A 0 66 . -0.090 -14.732 -4.805 1.00 97.04 66 A 1 ATOM 566 N N . CYS A 0 67 . -2.503 -13.446 -2.947 1.00 97.24 67 A 1 ATOM 567 C CA . CYS A 0 67 . -3.353 -12.265 -2.863 1.00 97.24 67 A 1 ATOM 568 C C . CYS A 0 67 . -3.964 -12.114 -1.473 1.00 97.24 67 A 1 ATOM 569 C CB . CYS A 0 67 . -4.459 -12.377 -3.912 1.00 97.24 67 A 1 ATOM 570 O O . CYS A 0 67 . -3.854 -11.049 -0.869 1.00 97.24 67 A 1 ATOM 571 S SG . CYS A 0 67 . -5.659 -11.025 -3.887 1.00 97.24 67 A 1 ATOM 572 N N . LEU A 0 68 . -4.591 -13.176 -0.967 1.00 95.94 68 A 1 ATOM 573 C CA . LEU A 0 68 . -5.264 -13.152 0.327 1.00 95.94 68 A 1 ATOM 574 C C . LEU A 0 68 . -4.254 -12.988 1.468 1.00 95.94 68 A 1 ATOM 575 C CB . LEU A 0 68 . -6.117 -14.421 0.478 1.00 95.94 68 A 1 ATOM 576 O O . LEU A 0 68 . -4.471 -12.144 2.340 1.00 95.94 68 A 1 ATOM 577 C CG . LEU A 0 68 . -7.263 -14.547 -0.546 1.00 95.94 68 A 1 ATOM 578 C CD1 . LEU A 0 68 . -8.004 -15.864 -0.309 1.00 95.94 68 A 1 ATOM 579 C CD2 . LEU A 0 68 . -8.274 -13.400 -0.465 1.00 95.94 68 A 1 ATOM 580 N N . ASP A 0 69 . -3.115 -13.681 1.391 1.00 96.01 69 A 1 ATOM 581 C CA . ASP A 0 69 . -2.012 -13.582 2.357 1.00 96.01 69 A 1 ATOM 582 C C . ASP A 0 69 . -1.373 -12.185 2.402 1.00 96.01 69 A 1 ATOM 583 C CB . ASP A 0 69 . -0.924 -14.610 1.998 1.00 96.01 69 A 1 ATOM 584 O O . ASP A 0 69 . -0.756 -11.803 3.395 1.00 96.01 69 A 1 ATOM 585 C CG . ASP A 0 69 . -1.311 -16.072 2.247 1.00 96.01 69 A 1 ATOM 586 O OD1 . ASP A 0 69 . -2.348 -16.319 2.905 1.00 96.01 69 A 1 ATOM 587 O OD2 . ASP A 0 69 . -0.520 -16.937 1.803 1.00 96.01 69 A 1 ATOM 588 N N . ALA A 0 70 . -1.517 -11.394 1.334 1.00 95.10 70 A 1 ATOM 589 C CA . ALA A 0 70 . -0.995 -10.032 1.275 1.00 95.10 70 A 1 ATOM 590 C C . ALA A 0 70 . -1.862 -9.002 2.016 1.00 95.10 70 A 1 ATOM 591 C CB . ALA A 0 70 . -0.804 -9.648 -0.191 1.00 95.10 70 A 1 ATOM 592 O O . ALA A 0 70 . -1.454 -7.841 2.124 1.00 95.10 70 A 1 ATOM 593 N N . SER A 0 71 . -3.040 -9.402 2.504 1.00 94.27 71 A 1 ATOM 594 C CA . SER A 0 71 . -3.946 -8.514 3.230 1.00 94.27 71 A 1 ATOM 595 C C . SER A 0 71 . -3.344 -8.067 4.562 1.00 94.27 71 A 1 ATOM 596 C CB . SER A 0 71 . -5.302 -9.175 3.475 1.00 94.27 71 A 1 ATOM 597 O O . SER A 0 71 . -2.853 -8.869 5.355 1.00 94.27 71 A 1 ATOM 598 O OG . SER A 0 71 . -5.912 -9.483 2.242 1.00 94.27 71 A 1 ATOM 599 N N . LYS A 0 72 . -3.418 -6.764 4.831 1.00 91.45 72 A 1 ATOM 600 C CA . LYS A 0 72 . -2.945 -6.102 6.056 1.00 91.45 72 A 1 ATOM 601 C C . LYS A 0 72 . -4.075 -5.242 6.642 1.00 91.45 72 A 1 ATOM 602 C CB . LYS A 0 72 . -1.686 -5.270 5.736 1.00 91.45 72 A 1 ATOM 603 O O . LYS A 0 72 . -5.012 -4.913 5.914 1.00 91.45 72 A 1 ATOM 604 C CG . LYS A 0 72 . -0.507 -6.149 5.279 1.00 91.45 72 A 1 ATOM 605 C CD . LYS A 0 72 . 0.728 -5.327 4.885 1.00 91.45 72 A 1 ATOM 606 C CE . LYS A 0 72 . 1.754 -6.268 4.231 1.00 91.45 72 A 1 ATOM 607 N NZ . LYS A 0 72 . 2.962 -5.563 3.732 1.00 91.45 72 A 1 ATOM 608 N N . PRO A 0 73 . -4.016 -4.833 7.927 1.00 88.05 73 A 1 ATOM 609 C CA . PRO A 0 73 . -5.079 -4.035 8.554 1.00 88.05 73 A 1 ATOM 610 C C . PRO A 0 73 . -5.461 -2.741 7.810 1.00 88.05 73 A 1 ATOM 611 C CB . PRO A 0 73 . -4.554 -3.718 9.959 1.00 88.05 73 A 1 ATOM 612 O O . PRO A 0 73 . -6.586 -2.266 7.943 1.00 88.05 73 A 1 ATOM 613 C CG . PRO A 0 73 . -3.641 -4.902 10.271 1.00 88.05 73 A 1 ATOM 614 C CD . PRO A 0 73 . -3.011 -5.207 8.915 1.00 88.05 73 A 1 ATOM 615 N N . ASP A 0 74 . -4.536 -2.165 7.042 1.00 84.32 74 A 1 ATOM 616 C CA . ASP A 0 74 . -4.695 -0.943 6.247 1.00 84.32 74 A 1 ATOM 617 C C . ASP A 0 74 . -4.882 -1.193 4.736 1.00 84.32 74 A 1 ATOM 618 C CB . ASP A 0 74 . -3.480 -0.040 6.518 1.00 84.32 74 A 1 ATOM 619 O O . ASP A 0 74 . -5.206 -0.265 3.990 1.00 84.32 74 A 1 ATOM 620 C CG . ASP A 0 74 . -2.135 -0.639 6.069 1.00 84.32 74 A 1 ATOM 621 O OD1 . ASP A 0 74 . -1.953 -1.875 6.206 1.00 84.32 74 A 1 ATOM 622 O OD2 . ASP A 0 74 . -1.283 0.160 5.629 1.00 84.32 74 A 1 ATOM 623 N N . MET A 0 75 . -4.715 -2.436 4.276 1.00 88.31 75 A 1 ATOM 624 C CA . MET A 0 75 . -4.811 -2.833 2.873 1.00 88.31 75 A 1 ATOM 625 C C . MET A 0 75 . -5.414 -4.234 2.769 1.00 88.31 75 A 1 ATOM 626 C CB . MET A 0 75 . -3.418 -2.765 2.226 1.00 88.31 75 A 1 ATOM 627 O O . MET A 0 75 . -4.706 -5.236 2.818 1.00 88.31 75 A 1 ATOM 628 C CG . MET A 0 75 . -3.476 -3.106 0.729 1.00 88.31 75 A 1 ATOM 629 S SD . MET A 0 75 . -1.874 -3.111 -0.125 1.00 88.31 75 A 1 ATOM 630 C CE . MET A 0 75 . -1.214 -4.693 0.487 1.00 88.31 75 A 1 ATOM 631 N N . GLU A 0 76 . -6.727 -4.299 2.596 1.00 93.07 76 A 1 ATOM 632 C CA . GLU A 0 76 . -7.437 -5.555 2.361 1.00 93.07 76 A 1 ATOM 633 C C . GLU A 0 76 . -7.354 -5.929 0.875 1.00 93.07 76 A 1 ATOM 634 C CB . GLU A 0 76 . -8.873 -5.402 2.875 1.00 93.07 76 A 1 ATOM 635 O O . GLU A 0 76 . -7.695 -5.119 0.006 1.00 93.07 76 A 1 ATOM 636 C CG . GLU A 0 76 . -9.576 -6.750 3.072 1.00 93.07 76 A 1 ATOM 637 C CD . GLU A 0 76 . -10.975 -6.608 3.704 1.00 93.07 76 A 1 ATOM 638 O OE1 . GLU A 0 76 . -11.681 -7.640 3.774 1.00 93.07 76 A 1 ATOM 639 O OE2 . GLU A 0 76 . -11.326 -5.497 4.180 1.00 93.07 76 A 1 ATOM 640 N N . CYS A 0 77 . -6.853 -7.129 0.577 1.00 95.21 77 A 1 ATOM 641 C CA . CYS A 0 77 . -6.730 -7.644 -0.780 1.00 95.21 77 A 1 ATOM 642 C C . CYS A 0 77 . -7.833 -8.664 -1.061 1.00 95.21 77 A 1 ATOM 643 C CB . CYS A 0 77 . -5.359 -8.296 -0.985 1.00 95.21 77 A 1 ATOM 644 O O . CYS A 0 77 . -8.106 -9.552 -0.256 1.00 95.21 77 A 1 ATOM 645 S SG . CYS A 0 77 . -3.882 -7.269 -0.784 1.00 95.21 77 A 1 ATOM 646 N N . HIS A 0 78 . -8.417 -8.587 -2.252 1.00 96.33 78 A 1 ATOM 647 C CA . HIS A 0 78 . -9.434 -9.519 -2.713 1.00 96.33 78 A 1 ATOM 648 C C . HIS A 0 78 . -9.010 -10.147 -4.034 1.00 96.33 78 A 1 ATOM 649 C CB . HIS A 0 78 . -10.781 -8.803 -2.838 1.00 96.33 78 A 1 ATOM 650 O O . HIS A 0 78 . -8.473 -9.480 -4.923 1.00 96.33 78 A 1 ATOM 651 C CG . HIS A 0 78 . -11.216 -8.139 -1.559 1.00 96.33 78 A 1 ATOM 652 C CD2 . HIS A 0 78 . -10.933 -6.853 -1.188 1.00 96.33 78 A 1 ATOM 653 N ND1 . HIS A 0 78 . -11.896 -8.722 -0.512 1.00 96.33 78 A 1 ATOM 654 C CE1 . HIS A 0 78 . -12.031 -7.801 0.459 1.00 96.33 78 A 1 ATOM 655 N NE2 . HIS A 0 78 . -11.480 -6.641 0.075 1.00 96.33 78 A 1 ATOM 656 N N . TRP A 0 79 . -9.293 -11.437 -4.178 1.00 97.04 79 A 1 ATOM 657 C CA . TRP A 0 79 . -9.076 -12.164 -5.419 1.00 97.04 79 A 1 ATOM 658 C C . TRP A 0 79 . -10.358 -12.207 -6.248 1.00 97.04 79 A 1 ATOM 659 C CB . TRP A 0 79 . -8.570 -13.570 -5.106 1.00 97.04 79 A 1 ATOM 660 O O . TRP A 0 79 . -11.422 -12.568 -5.742 1.00 97.04 79 A 1 ATOM 661 C CG . TRP A 0 79 . -8.192 -14.331 -6.333 1.00 97.04 79 A 1 ATOM 662 C CD1 . TRP A 0 79 . -8.900 -15.333 -6.900 1.00 97.04 79 A 1 ATOM 663 C CD2 . TRP A 0 79 . -7.009 -14.153 -7.164 1.00 97.04 79 A 1 ATOM 664 C CE2 . TRP A 0 79 . -7.058 -15.100 -8.227 1.00 97.04 79 A 1 ATOM 665 C CE3 . TRP A 0 79 . -5.889 -13.300 -7.110 1.00 97.04 79 A 1 ATOM 666 N NE1 . TRP A 0 79 . -8.238 -15.782 -8.028 1.00 97.04 79 A 1 ATOM 667 C CH2 . TRP A 0 79 . -4.945 -14.327 -9.111 1.00 97.04 79 A 1 ATOM 668 C CZ2 . TRP A 0 79 . -6.047 -15.195 -9.190 1.00 97.04 79 A 1 ATOM 669 C CZ3 . TRP A 0 79 . -4.862 -13.387 -8.069 1.00 97.04 79 A 1 ATOM 670 N N . CYS A 0 80 . -10.268 -11.878 -7.537 1.00 96.83 80 A 1 ATOM 671 C CA . CYS A 0 80 . -11.373 -12.070 -8.468 1.00 96.83 80 A 1 ATOM 672 C C . CYS A 0 80 . -11.138 -13.296 -9.348 1.00 96.83 80 A 1 ATOM 673 C CB . CYS A 0 80 . -11.608 -10.817 -9.302 1.00 96.83 80 A 1 ATOM 674 O O . CYS A 0 80 . -10.349 -13.249 -10.291 1.00 96.83 80 A 1 ATOM 675 S SG . CYS A 0 80 . -12.984 -11.031 -10.458 1.00 96.83 80 A 1 ATOM 676 N N . LEU A 0 81 . -11.902 -14.361 -9.094 1.00 94.96 81 A 1 ATOM 677 C CA . LEU A 0 81 . -11.858 -15.606 -9.872 1.00 94.96 81 A 1 ATOM 678 C C . LEU A 0 81 . -12.158 -15.380 -11.363 1.00 94.96 81 A 1 ATOM 679 C CB . LEU A 0 81 . -12.862 -16.604 -9.263 1.00 94.96 81 A 1 ATOM 680 O O . LEU A 0 81 . -11.455 -15.901 -12.218 1.00 94.96 81 A 1 ATOM 681 C CG . LEU A 0 81 . -12.459 -17.147 -7.879 1.00 94.96 81 A 1 ATOM 682 C CD1 . LEU A 0 81 . -13.647 -17.862 -7.238 1.00 94.96 81 A 1 ATOM 683 C CD2 . LEU A 0 81 . -11.296 -18.137 -7.976 1.00 94.96 81 A 1 ATOM 684 N N . THR A 0 82 . -13.156 -14.554 -11.692 1.00 93.89 82 A 1 ATOM 685 C CA . THR A 0 82 . -13.557 -14.278 -13.086 1.00 93.89 82 A 1 ATOM 686 C C . THR A 0 82 . -12.466 -13.570 -13.892 1.00 93.89 82 A 1 ATOM 687 C CB . THR A 0 82 . -14.820 -13.399 -13.107 1.00 93.89 82 A 1 ATOM 688 O O . THR A 0 82 . -12.376 -13.732 -15.108 1.00 93.89 82 A 1 ATOM 689 C CG2 . THR A 0 82 . -15.480 -13.314 -14.482 1.00 93.89 82 A 1 ATOM 690 O OG1 . THR A 0 82 . -15.783 -13.920 -12.221 1.00 93.89 82 A 1 ATOM 691 N N . ALA A 0 83 . -11.650 -12.755 -13.224 1.00 94.90 83 A 1 ATOM 692 C CA . ALA A 0 83 . -10.625 -11.934 -13.857 1.00 94.90 83 A 1 ATOM 693 C C . ALA A 0 83 . -9.199 -12.476 -13.663 1.00 94.90 83 A 1 ATOM 694 C CB . ALA A 0 83 . -10.793 -10.509 -13.328 1.00 94.90 83 A 1 ATOM 695 O O . ALA A 0 83 . -8.293 -11.981 -14.329 1.00 94.90 83 A 1 ATOM 696 N N . ASN A 0 84 . -9.009 -13.470 -12.786 1.00 96.15 84 A 1 ATOM 697 C CA . ASN A 0 84 . -7.710 -13.995 -12.353 1.00 96.15 84 A 1 ATOM 698 C C . ASN A 0 84 . -6.728 -12.891 -11.937 1.00 96.15 84 A 1 ATOM 699 C CB . ASN A 0 84 . -7.153 -14.966 -13.406 1.00 96.15 84 A 1 ATOM 700 O O . ASN A 0 84 . -5.585 -12.851 -12.389 1.00 96.15 84 A 1 ATOM 701 C CG . ASN A 0 84 . -7.943 -16.254 -13.463 1.00 96.15 84 A 1 ATOM 702 N ND2 . ASN A 0 84 . -8.222 -16.757 -14.641 1.00 96.15 84 A 1 ATOM 703 O OD1 . ASN A 0 84 . -8.297 -16.838 -12.454 1.00 96.15 84 A 1 ATOM 704 N N . LEU A 0 85 . -7.196 -11.965 -11.099 1.00 96.38 85 A 1 ATOM 705 C CA . LEU A 0 85 . -6.381 -10.865 -10.594 1.00 96.38 85 A 1 ATOM 706 C C . LEU A 0 85 . -6.703 -10.543 -9.135 1.00 96.38 85 A 1 ATOM 707 C CB . LEU A 0 85 . -6.476 -9.652 -11.545 1.00 96.38 85 A 1 ATOM 708 O O . LEU A 0 85 . -7.812 -10.787 -8.651 1.00 96.38 85 A 1 ATOM 709 C CG . LEU A 0 85 . -7.863 -9.006 -11.719 1.00 96.38 85 A 1 ATOM 710 C CD1 . LEU A 0 85 . -8.294 -8.134 -10.540 1.00 96.38 85 A 1 ATOM 711 C CD2 . LEU A 0 85 . -7.876 -8.114 -12.963 1.00 96.38 85 A 1 ATOM 712 N N . CYS A 0 86 . -5.719 -9.962 -8.459 1.00 97.02 86 A 1 ATOM 713 C CA . CYS A 0 86 . -5.825 -9.460 -7.098 1.00 97.02 86 A 1 ATOM 714 C C . CYS A 0 86 . -6.034 -7.941 -7.102 1.00 97.02 86 A 1 ATOM 715 C CB . CYS A 0 86 . -4.538 -9.833 -6.371 1.00 97.02 86 A 1 ATOM 716 O O . CYS A 0 86 . -5.442 -7.249 -7.935 1.00 97.02 86 A 1 ATOM 717 S SG . CYS A 0 86 . -4.565 -9.491 -4.598 1.00 97.02 86 A 1 ATOM 718 N N . SER A 0 87 . -6.855 -7.409 -6.194 1.00 95.27 87 A 1 ATOM 719 C CA . SER A 0 87 . -7.029 -5.960 -6.033 1.00 95.27 87 A 1 ATOM 720 C C . SER A 0 87 . -7.498 -5.575 -4.627 1.00 95.27 87 A 1 ATOM 721 C CB . SER A 0 87 . -8.037 -5.433 -7.060 1.00 95.27 87 A 1 ATOM 722 O O . SER A 0 87 . -8.190 -6.347 -3.972 1.00 95.27 87 A 1 ATOM 723 O OG . SER A 0 87 . -8.118 -4.017 -7.065 1.00 95.27 87 A 1 ATOM 724 N N . ASN A 0 88 . -7.181 -4.356 -4.186 1.00 92.24 88 A 1 ATOM 725 C CA . ASN A 0 88 . -7.813 -3.700 -3.027 1.00 92.24 88 A 1 ATOM 726 C C . ASN A 0 88 . -8.950 -2.730 -3.409 1.00 92.24 88 A 1 ATOM 727 C CB . ASN A 0 88 . -6.749 -2.990 -2.178 1.00 92.24 88 A 1 ATOM 728 O O . ASN A 0 88 . -9.365 -1.898 -2.600 1.00 92.24 88 A 1 ATOM 729 C CG . ASN A 0 88 . -6.056 -1.836 -2.876 1.00 92.24 88 A 1 ATOM 730 N ND2 . ASN A 0 88 . -5.001 -1.320 -2.292 1.00 92.24 88 A 1 ATOM 731 O OD1 . ASN A 0 88 . -6.454 -1.348 -3.923 1.00 92.24 88 A 1 ATOM 732 N N . GLY A 0 89 . -9.386 -2.739 -4.673 1.00 88.49 89 A 1 ATOM 733 C CA . GLY A 0 89 . -10.432 -1.855 -5.194 1.00 88.49 89 A 1 ATOM 734 C C . GLY A 0 89 . -9.986 -0.415 -5.478 1.00 88.49 89 A 1 ATOM 735 O O . GLY A 0 89 . -10.750 0.350 -6.067 1.00 88.49 89 A 1 ATOM 736 N N . ARG A 0 90 . -8.756 -0.034 -5.108 1.00 85.28 90 A 1 ATOM 737 C CA . ARG A 0 90 . -8.181 1.315 -5.291 1.00 85.28 90 A 1 ATOM 738 C C . ARG A 0 90 . -6.846 1.327 -6.040 1.00 85.28 90 A 1 ATOM 739 C CB . ARG A 0 90 . -8.049 1.987 -3.916 1.00 85.28 90 A 1 ATOM 740 O O . ARG A 0 90 . -6.280 2.394 -6.271 1.00 85.28 90 A 1 ATOM 741 C CG . ARG A 0 90 . -9.425 2.361 -3.350 1.00 85.28 90 A 1 ATOM 742 C CD . ARG A 0 90 . -9.292 3.061 -1.995 1.00 85.28 90 A 1 ATOM 743 N NE . ARG A 0 90 . -9.201 2.093 -0.888 1.00 85.28 90 A 1 ATOM 744 N NH1 . ARG A 0 90 . -9.130 3.618 0.816 1.00 85.28 90 A 1 ATOM 745 N NH2 . ARG A 0 90 . -9.406 1.473 1.298 1.00 85.28 90 A 1 ATOM 746 C CZ . ARG A 0 90 . -9.238 2.392 0.396 1.00 85.28 90 A 1 ATOM 747 N N . ASP A 0 91 . -6.347 0.159 -6.413 1.00 88.40 91 A 1 ATOM 748 C CA . ASP A 0 91 . -5.107 -0.020 -7.159 1.00 88.40 91 A 1 ATOM 749 C C . ASP A 0 91 . -5.318 0.003 -8.686 1.00 88.40 91 A 1 ATOM 750 C CB . ASP A 0 91 . -4.402 -1.289 -6.651 1.00 88.40 91 A 1 ATOM 751 O O . ASP A 0 91 . -6.399 0.317 -9.201 1.00 88.40 91 A 1 ATOM 752 C CG . ASP A 0 91 . -5.224 -2.567 -6.815 1.00 88.40 91 A 1 ATOM 753 O OD1 . ASP A 0 91 . -5.972 -2.688 -7.813 1.00 88.40 91 A 1 ATOM 754 O OD2 . ASP A 0 91 . -5.109 -3.437 -5.930 1.00 88.40 91 A 1 ATOM 755 N N . THR A 0 92 . -4.251 -0.314 -9.422 1.00 87.51 92 A 1 ATOM 756 C CA . THR A 0 92 . -4.209 -0.369 -10.892 1.00 87.51 92 A 1 ATOM 757 C C . THR A 0 92 . -5.250 -1.325 -11.487 1.00 87.51 92 A 1 ATOM 758 C CB . THR A 0 92 . -2.826 -0.854 -11.363 1.00 87.51 92 A 1 ATOM 759 O O . THR A 0 92 . -5.687 -1.114 -12.619 1.00 87.51 92 A 1 ATOM 760 C CG2 . THR A 0 92 . -1.664 0.087 -11.050 1.00 87.51 92 A 1 ATOM 761 O OG1 . THR A 0 92 . -2.542 -2.053 -10.697 1.00 87.51 92 A 1 ATOM 762 N N . HIS A 0 93 . -5.685 -2.350 -10.745 1.00 91.95 93 A 1 ATOM 763 C CA . HIS A 0 93 . -6.662 -3.333 -11.206 1.00 91.95 93 A 1 ATOM 764 C C . HIS A 0 93 . -8.116 -2.903 -10.980 1.00 91.95 93 A 1 ATOM 765 C CB . HIS A 0 93 . -6.368 -4.699 -10.573 1.00 91.95 93 A 1 ATOM 766 O O . HIS A 0 93 . -9.013 -3.564 -11.495 1.00 91.95 93 A 1 ATOM 767 C CG . HIS A 0 93 . -5.118 -5.381 -11.070 1.00 91.95 93 A 1 ATOM 768 C CD2 . HIS A 0 93 . -4.300 -5.001 -12.102 1.00 91.95 93 A 1 ATOM 769 N ND1 . HIS A 0 93 . -4.592 -6.538 -10.549 1.00 91.95 93 A 1 ATOM 770 C CE1 . HIS A 0 93 . -3.492 -6.855 -11.252 1.00 91.95 93 A 1 ATOM 771 N NE2 . HIS A 0 93 . -3.278 -5.944 -12.216 1.00 91.95 93 A 1 ATOM 772 N N . SER A 0 94 . -8.378 -1.776 -10.308 1.00 88.40 94 A 1 ATOM 773 C CA . SER A 0 94 . -9.738 -1.270 -10.034 1.00 88.40 94 A 1 ATOM 774 C C . SER A 0 94 . -10.634 -1.176 -11.283 1.00 88.40 94 A 1 ATOM 775 C CB . SER A 0 94 . -9.654 0.102 -9.355 1.00 88.40 94 A 1 ATOM 776 O O . SER A 0 94 . -11.779 -1.631 -11.267 1.00 88.40 94 A 1 ATOM 777 O OG . SER A 0 94 . -8.880 0.997 -10.135 1.00 88.40 94 A 1 ATOM 778 N N . LYS A 0 95 . -10.114 -0.662 -12.408 1.00 87.34 95 A 1 ATOM 779 C CA . LYS A 0 95 . -10.856 -0.613 -13.685 1.00 87.34 95 A 1 ATOM 780 C C . LYS A 0 95 . -11.158 -2.014 -14.230 1.00 87.34 95 A 1 ATOM 781 C CB . LYS A 0 95 . -10.096 0.219 -14.737 1.00 87.34 95 A 1 ATOM 782 O O . LYS A 0 95 . -12.292 -2.291 -14.618 1.00 87.34 95 A 1 ATOM 783 C CG . LYS A 0 95 . -10.115 1.738 -14.478 1.00 87.34 95 A 1 ATOM 784 C CD . LYS A 0 95 . -9.468 2.502 -15.652 1.00 87.34 95 A 1 ATOM 785 C CE . LYS A 0 95 . -9.606 4.032 -15.520 1.00 87.34 95 A 1 ATOM 786 N NZ . LYS A 0 95 . -9.124 4.748 -16.737 1.00 87.34 95 A 1 ATOM 787 N N . ALA A 0 96 . -10.161 -2.901 -14.255 1.00 91.22 96 A 1 ATOM 788 C CA . ALA A 0 96 . -10.323 -4.274 -14.739 1.00 91.22 96 A 1 ATOM 789 C C . ALA A 0 96 . -11.308 -5.069 -13.867 1.00 91.22 96 A 1 ATOM 790 C CB . ALA A 0 96 . -8.945 -4.944 -14.796 1.00 91.22 96 A 1 ATOM 791 O O . ALA A 0 96 . -12.148 -5.793 -14.399 1.00 91.22 96 A 1 ATOM 792 N N . TRP A 0 97 . -11.261 -4.859 -12.550 1.00 93.41 97 A 1 ATOM 793 C CA . TRP A 0 97 . -12.179 -5.423 -11.563 1.00 93.41 97 A 1 ATOM 794 C C . TRP A 0 97 . -13.638 -5.088 -11.890 1.00 93.41 97 A 1 ATOM 795 C CB . TRP A 0 97 . -11.787 -4.878 -10.182 1.00 93.41 97 A 1 ATOM 796 O O . TRP A 0 97 . -14.489 -5.977 -11.950 1.00 93.41 97 A 1 ATOM 797 C CG . TRP A 0 97 . -12.465 -5.539 -9.032 1.00 93.41 97 A 1 ATOM 798 C CD1 . TRP A 0 97 . -13.712 -5.284 -8.574 1.00 93.41 97 A 1 ATOM 799 C CD2 . TRP A 0 97 . -11.937 -6.606 -8.195 1.00 93.41 97 A 1 ATOM 800 C CE2 . TRP A 0 97 . -12.947 -6.998 -7.274 1.00 93.41 97 A 1 ATOM 801 C CE3 . TRP A 0 97 . -10.708 -7.289 -8.132 1.00 93.41 97 A 1 ATOM 802 N NE1 . TRP A 0 97 . -13.994 -6.146 -7.532 1.00 93.41 97 A 1 ATOM 803 C CH2 . TRP A 0 97 . -11.535 -8.719 -6.337 1.00 93.41 97 A 1 ATOM 804 C CZ2 . TRP A 0 97 . -12.772 -8.053 -6.370 1.00 93.41 97 A 1 ATOM 805 C CZ3 . TRP A 0 97 . -10.501 -8.326 -7.206 1.00 93.41 97 A 1 ATOM 806 N N . MET A 0 98 . -13.920 -3.813 -12.181 1.00 90.56 98 A 1 ATOM 807 C CA . MET A 0 98 . -15.255 -3.364 -12.583 1.00 90.56 98 A 1 ATOM 808 C C . MET A 0 98 . -15.678 -3.941 -13.940 1.00 90.56 98 A 1 ATOM 809 C CB . MET A 0 98 . -15.308 -1.832 -12.634 1.00 90.56 98 A 1 ATOM 810 O O . MET A 0 98 . -16.784 -4.459 -14.062 1.00 90.56 98 A 1 ATOM 811 C CG . MET A 0 98 . -15.210 -1.179 -11.252 1.00 90.56 98 A 1 ATOM 812 S SD . MET A 0 98 . -15.248 0.635 -11.307 1.00 90.56 98 A 1 ATOM 813 C CE . MET A 0 98 . -16.998 0.929 -11.687 1.00 90.56 98 A 1 ATOM 814 N N . ILE A 0 99 . -14.805 -3.889 -14.954 1.00 92.11 99 A 1 ATOM 815 C CA . ILE A 0 99 . -15.108 -4.370 -16.317 1.00 92.11 99 A 1 ATOM 816 C C . ILE A 0 99 . -15.413 -5.874 -16.330 1.00 92.11 99 A 1 ATOM 817 C CB . ILE A 0 99 . -13.937 -4.025 -17.270 1.00 92.11 99 A 1 ATOM 818 O O . ILE A 0 99 . -16.244 -6.335 -17.110 1.00 92.11 99 A 1 ATOM 819 C CG1 . ILE A 0 99 . -13.876 -2.498 -17.506 1.00 92.11 99 A 1 ATOM 820 C CG2 . ILE A 0 99 . -14.050 -4.752 -18.627 1.00 92.11 99 A 1 ATOM 821 C CD1 . ILE A 0 99 . -12.572 -2.024 -18.162 1.00 92.11 99 A 1 ATOM 822 N N . LYS A 0 100 . -14.740 -6.650 -15.475 1.00 94.05 100 A 1 ATOM 823 C CA . LYS A 0 100 . -14.904 -8.106 -15.384 1.00 94.05 100 A 1 ATOM 824 C C . LYS A 0 100 . -16.005 -8.546 -14.416 1.00 94.05 100 A 1 ATOM 825 C CB . LYS A 0 100 . -13.545 -8.753 -15.076 1.00 94.05 100 A 1 ATOM 826 O O . LYS A 0 100 . -16.116 -9.741 -14.153 1.00 94.05 100 A 1 ATOM 827 C CG . LYS A 0 100 . -12.498 -8.577 -16.191 1.00 94.05 100 A 1 ATOM 828 C CD . LYS A 0 100 . -12.880 -9.328 -17.473 1.00 94.05 100 A 1 ATOM 829 C CE . LYS A 0 100 . -11.726 -9.265 -18.477 1.00 94.05 100 A 1 ATOM 830 N NZ . LYS A 0 100 . -12.024 -10.067 -19.689 1.00 94.05 100 A 1 ATOM 831 N N . ASN A 0 101 . -16.837 -7.617 -13.933 1.00 92.05 101 A 1 ATOM 832 C CA . ASN A 0 101 . -17.964 -7.885 -13.032 1.00 92.05 101 A 1 ATOM 833 C C . ASN A 0 101 . -17.559 -8.667 -11.771 1.00 92.05 101 A 1 ATOM 834 C CB . ASN A 0 101 . -19.124 -8.536 -13.808 1.00 92.05 101 A 1 ATOM 835 O O . ASN A 0 101 . -18.275 -9.560 -11.318 1.00 92.05 101 A 1 ATOM 836 C CG . ASN A 0 101 . -19.646 -7.655 -14.923 1.00 92.05 101 A 1 ATOM 837 N ND2 . ASN A 0 101 . -19.781 -8.183 -16.116 1.00 92.05 101 A 1 ATOM 838 O OD1 . ASN A 0 101 . -19.946 -6.490 -14.740 1.00 92.05 101 A 1 ATOM 839 N N . CYS A 0 102 . -16.395 -8.344 -11.210 1.00 94.51 102 A 1 ATOM 840 C CA . CYS A 0 102 . -15.965 -8.902 -9.936 1.00 94.51 102 A 1 ATOM 841 C C . CYS A 0 102 . -16.858 -8.381 -8.786 1.00 94.51 102 A 1 ATOM 842 C CB . CYS A 0 102 . -14.496 -8.538 -9.738 1.00 94.51 102 A 1 ATOM 843 O O . CYS A 0 102 . -17.412 -7.279 -8.897 1.00 94.51 102 A 1 ATOM 844 S SG . CYS A 0 102 . -13.373 -9.137 -11.024 1.00 94.51 102 A 1 ATOM 845 N N . PRO A 0 103 . -17.005 -9.131 -7.674 1.00 91.55 103 A 1 ATOM 846 C CA . PRO A 0 103 . -17.791 -8.690 -6.521 1.00 91.55 103 A 1 ATOM 847 C C . PRO A 0 103 . -17.345 -7.315 -6.019 1.00 91.55 103 A 1 ATOM 848 C CB . PRO A 0 103 . -17.604 -9.765 -5.446 1.00 91.55 103 A 1 ATOM 849 O O . PRO A 0 103 . -16.157 -6.995 -6.042 1.00 91.55 103 A 1 ATOM 850 C CG . PRO A 0 103 . -17.275 -11.016 -6.257 1.00 91.55 103 A 1 ATOM 851 C CD . PRO A 0 103 . -16.469 -10.462 -7.431 1.00 91.55 103 A 1 ATOM 852 N N . LYS A 0 104 . -18.287 -6.481 -5.572 1.00 88.26 104 A 1 ATOM 853 C CA . LYS A 0 104 . -17.943 -5.164 -5.022 1.00 88.26 104 A 1 ATOM 854 C C . LYS A 0 104 . -17.078 -5.347 -3.775 1.00 88.26 104 A 1 ATOM 855 C CB . LYS A 0 104 . -19.197 -4.345 -4.698 1.00 88.26 104 A 1 ATOM 856 O O . LYS A 0 104 . -17.459 -6.081 -2.872 1.00 88.26 104 A 1 ATOM 857 C CG . LYS A 0 104 . -19.931 -3.896 -5.968 1.00 88.26 104 A 1 ATOM 858 C CD . LYS A 0 104 . -21.128 -3.014 -5.598 1.00 88.26 104 A 1 ATOM 859 C CE . LYS A 0 104 . -21.861 -2.554 -6.860 1.00 88.26 104 A 1 ATOM 860 N NZ . LYS A 0 104 . -23.054 -1.743 -6.514 1.00 88.26 104 A 1 ATOM 861 N N . ILE A 0 105 . -15.936 -4.669 -3.753 1.00 86.94 105 A 1 ATOM 862 C CA . ILE A 0 105 . -15.079 -4.570 -2.574 1.00 86.94 105 A 1 ATOM 863 C C . ILE A 0 105 . -15.651 -3.460 -1.693 1.00 86.94 105 A 1 ATOM 864 C CB . ILE A 0 105 . -13.612 -4.315 -2.990 1.00 86.94 105 A 1 ATOM 865 O O . ILE A 0 105 . -15.838 -2.331 -2.165 1.00 86.94 105 A 1 ATOM 866 C CG1 . ILE A 0 105 . -13.058 -5.532 -3.770 1.00 86.94 105 A 1 ATOM 867 C CG2 . ILE A 0 105 . -12.764 -4.001 -1.745 1.00 86.94 105 A 1 ATOM 868 C CD1 . ILE A 0 105 . -11.707 -5.270 -4.451 1.00 86.94 105 A 1 ATOM 869 N N . ASP A 0 106 . -15.936 -3.772 -0.430 1.00 75.83 106 A 1 ATOM 870 C CA . ASP A 0 106 . -16.371 -2.783 0.551 1.00 75.83 106 A 1 ATOM 871 C C . ASP A 0 106 . -15.201 -1.850 0.863 1.00 75.83 106 A 1 ATOM 872 C CB . ASP A 0 106 . -16.932 -3.456 1.813 1.00 75.83 106 A 1 ATOM 873 O O . ASP A 0 106 . -14.350 -2.108 1.712 1.00 75.83 106 A 1 ATOM 874 C CG . ASP A 0 106 . -18.327 -4.058 1.610 1.00 75.83 106 A 1 ATOM 875 O OD1 . ASP A 0 106 . -19.073 -3.541 0.743 1.00 75.83 106 A 1 ATOM 876 O OD2 . ASP A 0 106 . -18.658 -4.989 2.373 1.00 75.83 106 A 1 ATOM 877 N N . ASN A 0 107 . -15.137 -0.738 0.135 1.00 64.07 107 A 1 ATOM 878 C CA . ASN A 0 107 . -14.106 0.268 0.328 1.00 64.07 107 A 1 ATOM 879 C C . ASN A 0 107 . -14.293 0.936 1.696 1.00 64.07 107 A 1 ATOM 880 C CB . ASN A 0 107 . -14.162 1.283 -0.825 1.00 64.07 107 A 1 ATOM 881 O O . ASN A 0 107 . -14.980 1.954 1.809 1.00 64.07 107 A 1 ATOM 882 C CG . ASN A 0 107 . -13.647 0.722 -2.135 1.00 64.07 107 A 1 ATOM 883 N ND2 . ASN A 0 107 . -14.235 1.100 -3.245 1.00 64.07 107 A 1 ATOM 884 O OD1 . ASN A 0 107 . -12.667 0.007 -2.193 1.00 64.07 107 A 1 ATOM 885 N N . LYS A 0 108 . -13.648 0.410 2.742 1.00 61.72 108 A 1 ATOM 886 C CA . LYS A 0 108 . -13.510 1.167 3.987 1.00 61.72 108 A 1 ATOM 887 C C . LYS A 0 108 . -12.684 2.425 3.699 1.00 61.72 108 A 1 ATOM 888 C CB . LYS A 0 108 . -12.916 0.339 5.132 1.00 61.72 108 A 1 ATOM 889 O O . LYS A 0 108 . -11.616 2.333 3.073 1.00 61.72 108 A 1 ATOM 890 C CG . LYS A 0 108 . -13.930 -0.692 5.643 1.00 61.72 108 A 1 ATOM 891 C CD . LYS A 0 108 . -13.426 -1.388 6.912 1.00 61.72 108 A 1 ATOM 892 C CE . LYS A 0 108 . -14.380 -2.537 7.248 1.00 61.72 108 A 1 ATOM 893 N NZ . LYS A 0 108 . -13.952 -3.276 8.458 1.00 61.72 108 A 1 ATOM 894 N N . PRO A 0 109 . -13.156 3.611 4.121 1.00 57.35 109 A 1 ATOM 895 C CA . PRO A 0 109 . -12.388 4.834 3.961 1.00 57.35 109 A 1 ATOM 896 C C . PRO A 0 109 . -11.009 4.654 4.606 1.00 57.35 109 A 1 ATOM 897 C CB . PRO A 0 109 . -13.226 5.943 4.609 1.00 57.35 109 A 1 ATOM 898 O O . PRO A 0 109 . -10.892 4.116 5.702 1.00 57.35 109 A 1 ATOM 899 C CG . PRO A 0 109 . -14.135 5.198 5.587 1.00 57.35 109 A 1 ATOM 900 C CD . PRO A 0 109 . -14.359 3.853 4.905 1.00 57.35 109 A 1 ATOM 901 N N . MET A 0 110 . -9.957 5.097 3.906 1.00 55.46 110 A 1 ATOM 902 C CA . MET A 0 110 . -8.568 5.017 4.396 1.00 55.46 110 A 1 ATOM 903 C C . MET A 0 110 . -8.390 5.772 5.721 1.00 55.46 110 A 1 ATOM 904 C CB . MET A 0 110 . -7.642 5.613 3.327 1.00 55.46 110 A 1 ATOM 905 O O . MET A 0 110 . -7.542 5.429 6.538 1.00 55.46 110 A 1 ATOM 906 C CG . MET A 0 110 . -6.154 5.364 3.568 1.00 55.46 110 A 1 ATOM 907 S SD . MET A 0 110 . -5.163 5.997 2.189 1.00 55.46 110 A 1 ATOM 908 C CE . MET A 0 110 . -3.689 6.534 3.093 1.00 55.46 110 A 1 ATOM 909 N N . PHE A 0 111 . -9.216 6.797 5.947 1.00 58.69 111 A 1 ATOM 910 C CA . PHE A 0 111 . -9.312 7.450 7.239 1.00 58.69 111 A 1 ATOM 911 C C . PHE A 0 111 . -10.158 6.597 8.168 1.00 58.69 111 A 1 ATOM 912 C CB . PHE A 0 111 . -9.871 8.865 7.081 1.00 58.69 111 A 1 ATOM 913 O O . PHE A 0 111 . -11.369 6.467 7.980 1.00 58.69 111 A 1 ATOM 914 C CG . PHE A 0 111 . -8.862 9.794 6.445 1.00 58.69 111 A 1 ATOM 915 C CD1 . PHE A 0 111 . -7.800 10.297 7.220 1.00 58.69 111 A 1 ATOM 916 C CD2 . PHE A 0 111 . -8.941 10.107 5.075 1.00 58.69 111 A 1 ATOM 917 C CE1 . PHE A 0 111 . -6.821 11.113 6.628 1.00 58.69 111 A 1 ATOM 918 C CE2 . PHE A 0 111 . -7.961 10.924 4.484 1.00 58.69 111 A 1 ATOM 919 C CZ . PHE A 0 111 . -6.902 11.426 5.261 1.00 58.69 111 A 1 ATOM 920 N N . ASN A 0 112 . -9.510 6.048 9.192 1.00 61.93 112 A 1 ATOM 921 C CA . ASN A 0 112 . -10.205 5.377 10.271 1.00 61.93 112 A 1 ATOM 922 C C . ASN A 0 112 . -11.154 6.392 10.930 1.00 61.93 112 A 1 ATOM 923 C CB . ASN A 0 112 . -9.162 4.772 11.229 1.00 61.93 112 A 1 ATOM 924 O O . ASN A 0 112 . -10.711 7.282 11.656 1.00 61.93 112 A 1 ATOM 925 C CG . ASN A 0 112 . -9.771 3.750 12.168 1.00 61.93 112 A 1 ATOM 926 N ND2 . ASN A 0 112 . -8.956 3.010 12.883 1.00 61.93 112 A 1 ATOM 927 O OD1 . ASN A 0 112 . -10.978 3.604 12.268 1.00 61.93 112 A 1 ATOM 928 N N . TYR A 0 113 . -12.453 6.282 10.636 1.00 69.69 113 A 1 ATOM 929 C CA . TYR A 0 113 . -13.504 7.181 11.129 1.00 69.69 113 A 1 ATOM 930 C C . TYR A 0 113 . -13.473 7.301 12.658 1.00 69.69 113 A 1 ATOM 931 C CB . TYR A 0 113 . -14.857 6.645 10.635 1.00 69.69 113 A 1 ATOM 932 O O . TYR A 0 113 . -13.811 8.344 13.213 1.00 69.69 113 A 1 ATOM 933 C CG . TYR A 0 113 . -16.057 7.529 10.924 1.00 69.69 113 A 1 ATOM 934 C CD1 . TYR A 0 113 . -17.135 7.035 11.679 1.00 69.69 113 A 1 ATOM 935 C CD2 . TYR A 0 113 . -16.135 8.821 10.368 1.00 69.69 113 A 1 ATOM 936 C CE1 . TYR A 0 113 . -18.269 7.843 11.897 1.00 69.69 113 A 1 ATOM 937 C CE2 . TYR A 0 113 . -17.248 9.644 10.627 1.00 69.69 113 A 1 ATOM 938 O OH . TYR A 0 113 . -19.380 9.946 11.709 1.00 69.69 113 A 1 ATOM 939 C CZ . TYR A 0 113 . -18.309 9.163 11.420 1.00 69.69 113 A 1 ATOM 940 N N . LEU A 0 114 . -12.947 6.271 13.326 1.00 75.94 114 A 1 ATOM 941 C CA . LEU A 0 114 . -12.665 6.245 14.752 1.00 75.94 114 A 1 ATOM 942 C C . LEU A 0 114 . -11.815 7.442 15.221 1.00 75.94 114 A 1 ATOM 943 C CB . LEU A 0 114 . -11.961 4.905 15.031 1.00 75.94 114 A 1 ATOM 944 O O . LEU A 0 114 . -12.114 8.032 16.254 1.00 75.94 114 A 1 ATOM 945 C CG . LEU A 0 114 . -11.909 4.535 16.516 1.00 75.94 114 A 1 ATOM 946 C CD1 . LEU A 0 114 . -13.302 4.217 17.067 1.00 75.94 114 A 1 ATOM 947 C CD2 . LEU A 0 114 . -11.013 3.316 16.725 1.00 75.94 114 A 1 ATOM 948 N N . TYR A 0 115 . -10.809 7.856 14.446 1.00 78.20 115 A 1 ATOM 949 C CA . TYR A 0 115 . -9.942 8.986 14.800 1.00 78.20 115 A 1 ATOM 950 C C . TYR A 0 115 . -10.656 10.343 14.705 1.00 78.20 115 A 1 ATOM 951 C CB . TYR A 0 115 . -8.687 8.964 13.915 1.00 78.20 115 A 1 ATOM 952 O O . TYR A 0 115 . -10.240 11.303 15.343 1.00 78.20 115 A 1 ATOM 953 C CG . TYR A 0 115 . -7.541 9.783 14.479 1.00 78.20 115 A 1 ATOM 954 C CD1 . TYR A 0 115 . -7.359 11.127 14.095 1.00 78.20 115 A 1 ATOM 955 C CD2 . TYR A 0 115 . -6.672 9.201 15.423 1.00 78.20 115 A 1 ATOM 956 C CE1 . TYR A 0 115 . -6.310 11.885 14.652 1.00 78.20 115 A 1 ATOM 957 C CE2 . TYR A 0 115 . -5.622 9.955 15.982 1.00 78.20 115 A 1 ATOM 958 O OH . TYR A 0 115 . -4.430 12.035 16.131 1.00 78.20 115 A 1 ATOM 959 C CZ . TYR A 0 115 . -5.441 11.301 15.596 1.00 78.20 115 A 1 ATOM 960 N N . VAL A 0 116 . -11.741 10.433 13.930 1.00 82.28 116 A 1 ATOM 961 C CA . VAL A 0 116 . -12.562 11.649 13.809 1.00 82.28 116 A 1 ATOM 962 C C . VAL A 0 116 . -13.701 11.636 14.831 1.00 82.28 116 A 1 ATOM 963 C CB . VAL A 0 116 . -13.088 11.804 12.369 1.00 82.28 116 A 1 ATOM 964 O O . VAL A 0 116 . -13.968 12.647 15.480 1.00 82.28 116 A 1 ATOM 965 C CG1 . VAL A 0 116 . -13.935 13.072 12.204 1.00 82.28 116 A 1 ATOM 966 C CG2 . VAL A 0 116 . -11.929 11.882 11.364 1.00 82.28 116 A 1 ATOM 967 N N . LEU A 0 117 . -14.340 10.482 15.025 1.00 85.60 117 A 1 ATOM 968 C CA . LEU A 0 117 . -15.425 10.305 15.984 1.00 85.60 117 A 1 ATOM 969 C C . LEU A 0 117 . -14.973 10.486 17.431 1.00 85.60 117 A 1 ATOM 970 C CB . LEU A 0 117 . -16.000 8.893 15.853 1.00 85.60 117 A 1 ATOM 971 O O . LEU A 0 117 . -15.648 11.187 18.178 1.00 85.60 117 A 1 ATOM 972 C CG . LEU A 0 117 . -17.045 8.676 14.756 1.00 85.60 117 A 1 ATOM 973 C CD1 . LEU A 0 117 . -17.388 7.183 14.833 1.00 85.60 117 A 1 ATOM 974 C CD2 . LEU A 0 117 . -18.308 9.512 14.992 1.00 85.60 117 A 1 ATOM 975 N N . ILE A 0 118 . -13.861 9.860 17.839 1.00 89.54 118 A 1 ATOM 976 C CA . ILE A 0 118 . -13.445 9.856 19.249 1.00 89.54 118 A 1 ATOM 977 C C . ILE A 0 118 . -13.238 11.292 19.769 1.00 89.54 118 A 1 ATOM 978 C CB . ILE A 0 118 . -12.242 8.908 19.494 1.00 89.54 118 A 1 ATOM 979 O O . ILE A 0 118 . -13.888 11.648 20.754 1.00 89.54 118 A 1 ATOM 980 C CG1 . ILE A 0 118 . -12.678 7.433 19.377 1.00 89.54 118 A 1 ATOM 981 C CG2 . ILE A 0 118 . -11.614 9.167 20.876 1.00 89.54 118 A 1 ATOM 982 C CD1 . ILE A 0 118 . -11.502 6.450 19.476 1.00 89.54 118 A 1 ATOM 983 N N . PRO A 0 119 . -12.433 12.164 19.123 1.00 92.36 119 A 1 ATOM 984 C CA . PRO A 0 119 . -12.271 13.544 19.581 1.00 92.36 119 A 1 ATOM 985 C C . PRO A 0 119 . -13.566 14.359 19.509 1.00 92.36 119 A 1 ATOM 986 C CB . PRO A 0 119 . -11.187 14.161 18.691 1.00 92.36 119 A 1 ATOM 987 O O . PRO A 0 119 . -13.803 15.195 20.377 1.00 92.36 119 A 1 ATOM 988 C CG . PRO A 0 119 . -10.412 12.952 18.179 1.00 92.36 119 A 1 ATOM 989 C CD . PRO A 0 119 . -11.512 11.909 18.026 1.00 92.36 119 A 1 ATOM 990 N N . SER A 0 120 . -14.421 14.109 18.510 1.00 90.99 120 A 1 ATOM 991 C CA . SER A 0 120 . -15.711 14.796 18.379 1.00 90.99 120 A 1 ATOM 992 C C . SER A 0 120 . -16.648 14.473 19.547 1.00 90.99 120 A 1 ATOM 993 C CB . SER A 0 120 . -16.355 14.434 17.038 1.00 90.99 120 A 1 ATOM 994 O O . SER A 0 120 . -17.207 15.388 20.151 1.00 90.99 120 A 1 ATOM 995 O OG . SER A 0 120 . -17.613 15.063 16.896 1.00 90.99 120 A 1 ATOM 996 N N . VAL A 0 121 . -16.765 13.195 19.922 1.00 95.49 121 A 1 ATOM 997 C CA . VAL A 0 121 . -17.584 12.754 21.061 1.00 95.49 121 A 1 ATOM 998 C C . VAL A 0 121 . -17.009 13.274 22.378 1.00 95.49 121 A 1 ATOM 999 C CB . VAL A 0 121 . -17.729 11.219 21.073 1.00 95.49 121 A 1 ATOM 1000 O O . VAL A 0 121 . -17.758 13.803 23.195 1.00 95.49 121 A 1 ATOM 1001 C CG1 . VAL A 0 121 . -18.480 10.717 22.315 1.00 95.49 121 A 1 ATOM 1002 C CG2 . VAL A 0 121 . -18.517 10.734 19.847 1.00 95.49 121 A 1 ATOM 1003 N N . ILE A 0 122 . -15.686 13.202 22.573 1.00 95.52 122 A 1 ATOM 1004 C CA . ILE A 0 122 . -15.026 13.750 23.771 1.00 95.52 122 A 1 ATOM 1005 C C . ILE A 0 122 . -15.287 15.258 23.888 1.00 95.52 122 A 1 ATOM 1006 C CB . ILE A 0 122 . -13.514 13.424 23.754 1.00 95.52 122 A 1 ATOM 1007 O O . ILE A 0 122 . -15.660 15.736 24.959 1.00 95.52 122 A 1 ATOM 1008 C CG1 . ILE A 0 122 . -13.290 11.904 23.933 1.00 95.52 122 A 1 ATOM 1009 C CG2 . ILE A 0 122 . -12.761 14.190 24.860 1.00 95.52 122 A 1 ATOM 1010 C CD1 . ILE A 0 122 . -11.853 11.457 23.634 1.00 95.52 122 A 1 ATOM 1011 N N . GLY A 0 123 . -15.153 16.002 22.786 1.00 94.95 123 A 1 ATOM 1012 C CA . GLY A 0 123 . -15.440 17.435 22.743 1.00 94.95 123 A 1 ATOM 1013 C C . GLY A 0 123 . -16.888 17.755 23.119 1.00 94.95 123 A 1 ATOM 1014 O O . GLY A 0 123 . -17.121 18.617 23.964 1.00 94.95 123 A 1 ATOM 1015 N N . LEU A 0 124 . -17.858 17.023 22.561 1.00 96.10 124 A 1 ATOM 1016 C CA . LEU A 0 124 . -19.277 17.190 22.891 1.00 96.10 124 A 1 ATOM 1017 C C . LEU A 0 124 . -19.564 16.910 24.370 1.00 96.10 124 A 1 ATOM 1018 C CB . LEU A 0 124 . -20.128 16.281 21.988 1.00 96.10 124 A 1 ATOM 1019 O O . LEU A 0 124 . -20.272 17.689 25.000 1.00 96.10 124 A 1 ATOM 1020 C CG . LEU A 0 124 . -20.247 16.777 20.535 1.00 96.10 124 A 1 ATOM 1021 C CD1 . LEU A 0 124 . -20.855 15.677 19.665 1.00 96.10 124 A 1 ATOM 1022 C CD2 . LEU A 0 124 . -21.130 18.024 20.430 1.00 96.10 124 A 1 ATOM 1023 N N . VAL A 0 125 . -18.978 15.858 24.951 1.00 96.35 125 A 1 ATOM 1024 C CA . VAL A 0 125 . -19.147 15.544 26.380 1.00 96.35 125 A 1 ATOM 1025 C C . VAL A 0 125 . -18.586 16.662 27.260 1.00 96.35 125 A 1 ATOM 1026 C CB . VAL A 0 125 . -18.518 14.180 26.729 1.00 96.35 125 A 1 ATOM 1027 O O . VAL A 0 125 . -19.264 17.086 28.194 1.00 96.35 125 A 1 ATOM 1028 C CG1 . VAL A 0 125 . -18.518 13.898 28.239 1.00 96.35 125 A 1 ATOM 1029 C CG2 . VAL A 0 125 . -19.305 13.041 26.066 1.00 96.35 125 A 1 ATOM 1030 N N . ILE A 0 126 . -17.397 17.192 26.951 1.00 96.55 126 A 1 ATOM 1031 C CA . ILE A 0 126 . -16.796 18.306 27.705 1.00 96.55 126 A 1 ATOM 1032 C C . ILE A 0 126 . -17.678 19.556 27.624 1.00 96.55 126 A 1 ATOM 1033 C CB . ILE A 0 126 . -15.360 18.590 27.207 1.00 96.55 126 A 1 ATOM 1034 O O . ILE A 0 126 . -17.935 20.190 28.648 1.00 96.55 126 A 1 ATOM 1035 C CG1 . ILE A 0 126 . -14.430 17.403 27.551 1.00 96.55 126 A 1 ATOM 1036 C CG2 . ILE A 0 126 . -14.796 19.884 27.830 1.00 96.55 126 A 1 ATOM 1037 C CD1 . ILE A 0 126 . -13.088 17.440 26.808 1.00 96.55 126 A 1 ATOM 1038 N N . VAL A 0 127 . -18.186 19.886 26.432 1.00 96.45 127 A 1 ATOM 1039 C CA . VAL A 0 127 . -19.104 21.016 26.234 1.00 96.45 127 A 1 ATOM 1040 C C . VAL A 0 127 . -20.390 20.809 27.037 1.00 96.45 127 A 1 ATOM 1041 C CB . VAL A 0 127 . -19.375 21.240 24.732 1.00 96.45 127 A 1 ATOM 1042 O O . VAL A 0 127 . -20.782 21.701 27.786 1.00 96.45 127 A 1 ATOM 1043 C CG1 . VAL A 0 127 . -20.494 22.253 24.474 1.00 96.45 127 A 1 ATOM 1044 C CG2 . VAL A 0 127 . -18.119 21.787 24.039 1.00 96.45 127 A 1 ATOM 1045 N N . CYS A 0 128 . -21.017 19.632 26.963 1.00 96.07 128 A 1 ATOM 1046 C CA . CYS A 0 128 . -22.228 19.321 27.722 1.00 96.07 128 A 1 ATOM 1047 C C . CYS A 0 128 . -22.006 19.409 29.238 1.00 96.07 128 A 1 ATOM 1048 C CB . CYS A 0 128 . -22.730 17.923 27.334 1.00 96.07 128 A 1 ATOM 1049 O O . CYS A 0 128 . -22.812 20.026 29.932 1.00 96.07 128 A 1 ATOM 1050 S SG . CYS A 0 128 . -23.424 17.935 25.656 1.00 96.07 128 A 1 ATOM 1051 N N . VAL A 0 129 . -20.911 18.846 29.758 1.00 96.22 129 A 1 ATOM 1052 C CA . VAL A 0 129 . -20.568 18.935 31.187 1.00 96.22 129 A 1 ATOM 1053 C C . VAL A 0 129 . -20.325 20.390 31.591 1.00 96.22 129 A 1 ATOM 1054 C CB . VAL A 0 129 . -19.359 18.039 31.525 1.00 96.22 129 A 1 ATOM 1055 O O . VAL A 0 129 . -20.843 20.823 32.618 1.00 96.22 129 A 1 ATOM 1056 C CG1 . VAL A 0 129 . -18.864 18.243 32.964 1.00 96.22 129 A 1 ATOM 1057 C CG2 . VAL A 0 129 . -19.730 16.555 31.392 1.00 96.22 129 A 1 ATOM 1058 N N . GLY A 0 130 . -19.618 21.168 30.768 1.00 95.11 130 A 1 ATOM 1059 C CA . GLY A 0 130 . -19.404 22.599 30.990 1.00 95.11 130 A 1 ATOM 1060 C C . GLY A 0 130 . -20.712 23.395 31.047 1.00 95.11 130 A 1 ATOM 1061 O O . GLY A 0 130 . -20.909 24.176 31.976 1.00 95.11 130 A 1 ATOM 1062 N N . PHE A 0 131 . -21.640 23.146 30.117 1.00 95.63 131 A 1 ATOM 1063 C CA . PHE A 0 131 . -22.972 23.762 30.113 1.00 95.63 131 A 1 ATOM 1064 C C . PHE A 0 131 . -23.795 23.384 31.345 1.00 95.63 131 A 1 ATOM 1065 C CB . PHE A 0 131 . -23.738 23.379 28.836 1.00 95.63 131 A 1 ATOM 1066 O O . PHE A 0 131 . -24.430 24.253 31.938 1.00 95.63 131 A 1 ATOM 1067 C CG . PHE A 0 131 . -23.571 24.376 27.709 1.00 95.63 131 A 1 ATOM 1068 C CD1 . PHE A 0 131 . -24.269 25.597 27.750 1.00 95.63 131 A 1 ATOM 1069 C CD2 . PHE A 0 131 . -22.733 24.095 26.617 1.00 95.63 131 A 1 ATOM 1070 C CE1 . PHE A 0 131 . -24.119 26.531 26.710 1.00 95.63 131 A 1 ATOM 1071 C CE2 . PHE A 0 131 . -22.577 25.029 25.579 1.00 95.63 131 A 1 ATOM 1072 C CZ . PHE A 0 131 . -23.270 26.249 25.626 1.00 95.63 131 A 1 ATOM 1073 N N . ILE A 0 132 . -23.765 22.113 31.759 1.00 94.82 132 A 1 ATOM 1074 C CA . ILE A 0 132 . -24.460 21.653 32.966 1.00 94.82 132 A 1 ATOM 1075 C C . ILE A 0 132 . -23.885 22.374 34.188 1.00 94.82 132 A 1 ATOM 1076 C CB . ILE A 0 132 . -24.398 20.110 33.075 1.00 94.82 132 A 1 ATOM 1077 O O . ILE A 0 132 . -24.635 23.014 34.919 1.00 94.82 132 A 1 ATOM 1078 C CG1 . ILE A 0 132 . -25.269 19.462 31.973 1.00 94.82 132 A 1 ATOM 1079 C CG2 . ILE A 0 132 . -24.876 19.612 34.451 1.00 94.82 132 A 1 ATOM 1080 C CD1 . ILE A 0 132 . -25.012 17.961 31.784 1.00 94.82 132 A 1 ATOM 1081 N N . VAL A 0 133 . -22.565 22.338 34.394 1.00 94.13 133 A 1 ATOM 1082 C CA . VAL A 0 133 . -21.910 22.993 35.541 1.00 94.13 133 A 1 ATOM 1083 C C . VAL A 0 133 . -22.195 24.496 35.563 1.00 94.13 133 A 1 ATOM 1084 C CB . VAL A 0 133 . -20.393 22.717 35.540 1.00 94.13 133 A 1 ATOM 1085 O O . VAL A 0 133 . -22.539 25.028 36.618 1.00 94.13 133 A 1 ATOM 1086 C CG1 . VAL A 0 133 . -19.647 23.520 36.616 1.00 94.13 133 A 1 ATOM 1087 C CG2 . VAL A 0 133 . -20.117 21.232 35.820 1.00 94.13 133 A 1 ATOM 1088 N N . TRP A 0 134 . -22.125 25.174 34.415 1.00 92.26 134 A 1 ATOM 1089 C CA . TRP A 0 134 . -22.468 26.592 34.317 1.00 92.26 134 A 1 ATOM 1090 C C . TRP A 0 134 . -23.930 26.845 34.701 1.00 92.26 134 A 1 ATOM 1091 C CB . TRP A 0 134 . -22.161 27.105 32.907 1.00 92.26 134 A 1 ATOM 1092 O O . TRP A 0 134 . -24.189 27.686 35.558 1.00 92.26 134 A 1 ATOM 1093 C CG . TRP A 0 134 . -22.428 28.561 32.648 1.00 92.26 134 A 1 ATOM 1094 C CD1 . TRP A 0 134 . -22.742 29.514 33.561 1.00 92.26 134 A 1 ATOM 1095 C CD2 . TRP A 0 134 . -22.358 29.261 31.370 1.00 92.26 134 A 1 ATOM 1096 C CE2 . TRP A 0 134 . -22.681 30.635 31.586 1.00 92.26 134 A 1 ATOM 1097 C CE3 . TRP A 0 134 . -22.029 28.879 30.051 1.00 92.26 134 A 1 ATOM 1098 N NE1 . TRP A 0 134 . -22.932 30.725 32.934 1.00 92.26 134 A 1 ATOM 1099 C CH2 . TRP A 0 134 . -22.344 31.170 29.255 1.00 92.26 134 A 1 ATOM 1100 C CZ2 . TRP A 0 134 . -22.683 31.582 30.554 1.00 92.26 134 A 1 ATOM 1101 C CZ3 . TRP A 0 134 . -22.018 29.823 29.006 1.00 92.26 134 A 1 ATOM 1102 N N . PHE A 0 135 . -24.875 26.080 34.154 1.00 92.38 135 A 1 ATOM 1103 C CA . PHE A 0 135 . -26.296 26.215 34.479 1.00 92.38 135 A 1 ATOM 1104 C C . PHE A 0 135 . -26.586 25.986 35.974 1.00 92.38 135 A 1 ATOM 1105 C CB . PHE A 0 135 . -27.077 25.232 33.601 1.00 92.38 135 A 1 ATOM 1106 O O . PHE A 0 135 . -27.408 26.681 36.576 1.00 92.38 135 A 1 ATOM 1107 C CG . PHE A 0 135 . -28.577 25.384 33.710 1.00 92.38 135 A 1 ATOM 1108 C CD1 . PHE A 0 135 . -29.318 24.551 34.569 1.00 92.38 135 A 1 ATOM 1109 C CD2 . PHE A 0 135 . -29.230 26.374 32.955 1.00 92.38 135 A 1 ATOM 1110 C CE1 . PHE A 0 135 . -30.713 24.703 34.662 1.00 92.38 135 A 1 ATOM 1111 C CE2 . PHE A 0 135 . -30.624 26.527 33.050 1.00 92.38 135 A 1 ATOM 1112 C CZ . PHE A 0 135 . -31.366 25.691 33.902 1.00 92.38 135 A 1 ATOM 1113 N N . TRP A 0 136 . -25.884 25.042 36.609 1.00 89.55 136 A 1 ATOM 1114 C CA . TRP A 0 136 . -25.972 24.818 38.055 1.00 89.55 136 A 1 ATOM 1115 C C . TRP A 0 136 . -25.401 25.985 38.871 1.00 89.55 136 A 1 ATOM 1116 C CB . TRP A 0 136 . -25.276 23.501 38.428 1.00 89.55 136 A 1 ATOM 1117 O O . TRP A 0 136 . -25.978 26.335 39.901 1.00 89.55 136 A 1 ATOM 1118 C CG . TRP A 0 136 . -26.111 22.271 38.237 1.00 89.55 136 A 1 ATOM 1119 C CD1 . TRP A 0 136 . -26.046 21.415 37.197 1.00 89.55 136 A 1 ATOM 1120 C CD2 . TRP A 0 136 . -27.109 21.702 39.134 1.00 89.55 136 A 1 ATOM 1121 C CE2 . TRP A 0 136 . -27.624 20.507 38.544 1.00 89.55 136 A 1 ATOM 1122 C CE3 . TRP A 0 136 . -27.611 22.062 40.402 1.00 89.55 136 A 1 ATOM 1123 N NE1 . TRP A 0 136 . -26.957 20.395 37.349 1.00 89.55 136 A 1 ATOM 1124 C CH2 . TRP A 0 136 . -29.054 20.086 40.442 1.00 89.55 136 A 1 ATOM 1125 C CZ2 . TRP A 0 136 . -28.584 19.708 39.174 1.00 89.55 136 A 1 ATOM 1126 C CZ3 . TRP A 0 136 . -28.570 21.259 41.051 1.00 89.55 136 A 1 ATOM 1127 N N . LEU A 0 137 . -24.299 26.598 38.426 1.00 90.22 137 A 1 ATOM 1128 C CA . LEU A 0 137 . -23.702 27.764 39.085 1.00 90.22 137 A 1 ATOM 1129 C C . LEU A 0 137 . -24.558 29.026 38.913 1.00 90.22 137 A 1 ATOM 1130 C CB . LEU A 0 137 . -22.272 27.989 38.558 1.00 90.22 137 A 1 ATOM 1131 O O . LEU A 0 137 . -24.752 29.752 39.884 1.00 90.22 137 A 1 ATOM 1132 C CG . LEU A 0 137 . -21.238 26.953 39.036 1.00 90.22 137 A 1 ATOM 1133 C CD1 . LEU A 0 137 . -19.918 27.169 38.295 1.00 90.22 137 A 1 ATOM 1134 C CD2 . LEU A 0 137 . -20.963 27.058 40.539 1.00 90.22 137 A 1 ATOM 1135 N N . SER A 0 138 . -25.131 29.258 37.728 1.00 87.55 138 A 1 ATOM 1136 C CA . SER A 0 138 . -25.978 30.428 37.458 1.00 87.55 138 A 1 ATOM 1137 C C . SER A 0 138 . -27.301 30.407 38.218 1.00 87.55 138 A 1 ATOM 1138 C CB . SER A 0 138 . -26.267 30.559 35.959 1.00 87.55 138 A 1 ATOM 1139 O O . SER A 0 138 . -27.908 31.450 38.392 1.00 87.55 138 A 1 ATOM 1140 O OG . SER A 0 138 . -27.036 29.475 35.471 1.00 87.55 138 A 1 ATOM 1141 N N . LYS A 0 139 . -27.766 29.228 38.649 1.00 82.84 139 A 1 ATOM 1142 C CA . LYS A 0 139 . -28.977 29.083 39.469 1.00 82.84 139 A 1 ATOM 1143 C C . LYS A 0 139 . -28.704 29.239 40.974 1.00 82.84 139 A 1 ATOM 1144 C CB . LYS A 0 139 . -29.636 27.738 39.118 1.00 82.84 139 A 1 ATOM 1145 O O . LYS A 0 139 . -29.648 29.271 41.757 1.00 82.84 139 A 1 ATOM 1146 C CG . LYS A 0 139 . -31.135 27.714 39.443 1.00 82.84 139 A 1 ATOM 1147 C CD . LYS A 0 139 . -31.751 26.361 39.075 1.00 82.84 139 A 1 ATOM 1148 C CE . LYS A 0 139 . -33.245 26.394 39.407 1.00 82.84 139 A 1 ATOM 1149 N NZ . LYS A 0 139 . -33.897 25.096 39.108 1.00 82.84 139 A 1 ATOM 1150 N N . ARG A 0 140 . -27.429 29.247 41.390 1.00 75.82 140 A 1 ATOM 1151 C CA . ARG A 0 140 . -27.014 29.457 42.790 1.00 75.82 140 A 1 ATOM 1152 C C . ARG A 0 140 . -26.650 30.909 43.111 1.00 75.82 140 A 1 ATOM 1153 C CB . ARG A 0 140 . -25.844 28.533 43.162 1.00 75.82 140 A 1 ATOM 1154 O O . ARG A 0 140 . -26.547 31.215 44.296 1.00 75.82 140 A 1 ATOM 1155 C CG . ARG A 0 140 . -26.265 27.089 43.455 1.00 75.82 140 A 1 ATOM 1156 C CD . ARG A 0 140 . -25.076 26.363 44.098 1.00 75.82 140 A 1 ATOM 1157 N NE . ARG A 0 140 . -25.329 24.921 44.279 1.00 75.82 140 A 1 ATOM 1158 N NH1 . ARG A 0 140 . -23.511 24.477 45.611 1.00 75.82 140 A 1 ATOM 1159 N NH2 . ARG A 0 140 . -24.849 22.806 44.981 1.00 75.82 140 A 1 ATOM 1160 C CZ . ARG A 0 140 . -24.566 24.079 44.954 1.00 75.82 140 A 1 ATOM 1161 N N . GLN A 0 141 . -26.421 31.751 42.102 1.00 60.22 141 A 1 ATOM 1162 C CA . GLN A 0 141 . -26.385 33.210 42.258 1.00 60.22 141 A 1 ATOM 1163 C C . GLN A 0 141 . -27.784 33.790 42.078 1.00 60.22 141 A 1 ATOM 1164 C CB . GLN A 0 141 . -25.392 33.850 41.278 1.00 60.22 141 A 1 ATOM 1165 O O . GLN A 0 141 . -28.061 34.806 42.747 1.00 60.22 141 A 1 ATOM 1166 C CG . GLN A 0 141 . -23.942 33.467 41.605 1.00 60.22 141 A 1 ATOM 1167 C CD . GLN A 0 141 . -22.944 34.595 41.337 1.00 60.22 141 A 1 ATOM 1168 N NE2 . GLN A 0 141 . -21.827 34.617 42.034 1.00 60.22 141 A 1 ATOM 1169 O OE1 . GLN A 0 141 . -23.113 35.475 40.511 1.00 60.22 141 A 1 ATOM 1170 O OXT . GLN A 0 141 . -28.534 33.177 41.288 1.00 60.22 141 A 1 # _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.3.9 _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic # loop_ _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.details _pdbx_data_usage.url _pdbx_data_usage.name 1 license 'Data in this file is available under a CC-BY-4.0 license.' https://creativecommons.org/licenses/by/4.0/ CC-BY-4.0 2 disclaimer ;ALPHAFOLD DATA, COPYRIGHT (2021) DEEPMIND TECHNOLOGIES LIMITED. THE INFORMATION PROVIDED IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. DISCLAIMER: THE INFORMATION IS NOT INTENDED TO BE A SUBSTITUTE FOR PROFESSIONAL MEDICAL ADVICE, DIAGNOSIS, OR TREATMENT, AND DOES NOT CONSTITUTE MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS AVAILABLE FOR ACADEMIC AND COMMERCIAL PURPOSES, UNDER CC-BY 4.0 LICENCE. ; ? ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Jumper, John' 1 'Evans, Richard' 2 'Pritzel, Alexander' 3 'Green, Tim' 4 'Figurnov, Michael' 5 'Ronneberger, Olaf' 6 'Tunyasuvunakool, Kathryn' 7 'Bates, Russ' 8 'Zidek, Augustin' 9 'Potapenko, Anna' 10 'Bridgland, Alex' 11 'Meyer, Clemens' 12 'Kohl, Simon A. A.' 13 'Ballard, Andrew J.' 14 'Cowie, Andrew' 15 'Romera-Paredes, Bernardino' 16 'Nikolov, Stanislav' 17 'Jain, Rishub' 18 'Adler, Jonas' 19 'Back, Trevor' 20 'Petersen, Stig' 21 'Reiman, David' 22 'Clancy, Ellen' 23 'Zielinski, Michal' 24 'Steinegger, Martin' 25 'Pacholska, Michalina' 26 'Berghammer, Tamas' 27 'Silver, David' 28 'Vinyals, Oriol' 29 'Senior, Andrew W.' 30 'Kavukcuoglu, Koray' 31 'Kohli, Pushmeet' 32 'Hassabis, Demis' 33 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Jumper, John' 1 primary 'Evans, Richard' 2 primary 'Pritzel, Alexander' 3 primary 'Green, Tim' 4 primary 'Figurnov, Michael' 5 primary 'Ronneberger, Olaf' 6 primary 'Tunyasuvunakool, Kathryn' 7 primary 'Bates, Russ' 8 primary 'Zidek, Augustin' 9 primary 'Potapenko, Anna' 10 primary 'Bridgland, Alex' 11 primary 'Meyer, Clemens' 12 primary 'Kohl, Simon A. A.' 13 primary 'Ballard, Andrew J.' 14 primary 'Cowie, Andrew' 15 primary 'Romera-Paredes, Bernardino' 16 primary 'Nikolov, Stanislav' 17 primary 'Jain, Rishub' 18 primary 'Adler, Jonas' 19 primary 'Back, Trevor' 20 primary 'Petersen, Stig' 21 primary 'Reiman, David' 22 primary 'Clancy, Ellen' 23 primary 'Zielinski, Michal' 24 primary 'Steinegger, Martin' 25 primary 'Pacholska, Michalina' 26 primary 'Berghammer, Tamas' 27 primary 'Silver, David' 28 primary 'Vinyals, Oriol' 29 primary 'Senior, Andrew W.' 30 primary 'Kavukcuoglu, Koray' 31 primary 'Kohli, Pushmeet' 32 primary 'Hassabis, Demis' 33 # _citation.id primary _citation.title 'Highly accurate protein structure prediction with AlphaFold' _citation.journal_full Nature _citation.journal_volume 596 _citation.page_first 583 _citation.page_last 589 _citation.year 2021 _citation.journal_id_ASTM NATUAS _citation.country UK _citation.journal_id_ISSN 0028-0836 _citation.journal_id_CSD 0006 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 34265844 _citation.pdbx_database_id_DOI 10.1038/s41586-021-03819-2 # _ma_data.id 1 _ma_data.name Model _ma_data.content_type 'model coordinates' # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.entity_id 0 _ma_target_entity_instance.details . # _ma_target_entity.entity_id 0 _ma_target_entity.data_id 1 _ma_target_entity.origin . # _ma_model_list.ordinal_id 1 _ma_model_list.model_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_name 'Top ranked model' _ma_model_list.model_group_name 'AlphaFold Monomer v2.3.2 model' _ma_model_list.data_id 1 _ma_model_list.model_type 'Ab initio model' # _software.pdbx_ordinal 1 _software.name AlphaFold _software.version v2.3.2 _software.type package _software.description 'Structure prediction' _software.classification other _software.date ? # _ma_software_group.ordinal_id 1 _ma_software_group.group_id 1 _ma_software_group.software_id 1 # loop_ _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id _ma_protocol_step.method_type 1 1 1 'coevolution MSA' 2 1 2 'template search' 3 1 3 modeling # loop_ _ma_qa_metric.id _ma_qa_metric.name _ma_qa_metric.type _ma_qa_metric.mode _ma_qa_metric.software_group_id 1 pLDDT pLDDT global 1 2 pLDDT pLDDT local 1 # _ma_qa_metric_global.ordinal_id 1 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 85.40 # loop_ _atom_type.symbol C N O S #