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 MET 0 2 ILE 0 3 TYR 0 4 ILE 0 5 LYS 0 6 CYS 0 7 PHE 0 8 MET 0 9 LEU 0 10 ILE 0 11 SER 0 12 PHE 0 13 THR 0 14 ILE 0 15 ILE 0 16 LEU 0 17 TYR 0 18 GLY 0 19 THR 0 20 PHE 0 21 GLY 0 22 GLN 0 23 TYR 0 24 TYR 0 25 LYS 0 26 ILE 0 27 TRP 0 28 ASP 0 29 GLU 0 30 TYR 0 31 PRO 0 32 GLN 0 33 SER 0 34 ILE 0 35 LEU 0 36 GLN 0 37 ASN 0 38 GLU 0 39 GLU 0 40 ARG 0 41 LEU 0 42 THR 0 43 LYS 0 44 ARG 0 45 PRO 0 46 TRP 0 47 THR 0 48 LEU 0 49 ARG 0 50 ASP 0 51 PRO 0 52 LEU 0 53 ASN 0 54 CYS 0 55 CYS 0 56 LEU 0 57 ASP 0 58 ASN 0 59 ALA 0 60 LYS 0 61 CYS 0 62 CYS 0 63 ARG 0 64 ARG 0 65 LYS 0 66 ARG 0 67 TYR 0 68 PHE 0 69 GLU 0 70 ARG 0 71 LYS 0 72 LEU 0 73 ASP 0 74 GLU 0 75 ASP 0 76 GLU 0 77 PHE 0 78 GLY 0 79 MET 0 80 THR 0 81 ARG 0 82 ARG 0 83 GLU 0 84 TYR 0 85 ALA 0 86 TRP 0 87 LYS 0 88 ASN 0 89 ARG 0 90 VAL 0 91 TYR 0 92 GLU 0 93 ILE 0 94 ARG 0 95 ASN 0 96 ARG 0 97 MET 0 98 ASN 0 99 PRO 0 100 LEU 0 101 LEU 0 102 ILE 0 103 LYS 0 104 LYS 0 105 PHE 0 106 THR 0 107 HIS 0 108 GLU 0 109 ARG 0 110 MET 0 111 ASN 0 112 THR 0 113 TYR # 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 . MET A 0 1 . -34.720 7.550 37.568 1.00 62.15 1 A 1 ATOM 2 C CA . MET A 0 1 . -34.015 8.209 36.436 1.00 62.15 1 A 1 ATOM 3 C C . MET A 0 1 . -32.583 7.704 36.179 1.00 62.15 1 A 1 ATOM 4 C CB . MET A 0 1 . -34.017 9.736 36.610 1.00 62.15 1 A 1 ATOM 5 O O . MET A 0 1 . -31.954 8.192 35.250 1.00 62.15 1 A 1 ATOM 6 C CG . MET A 0 1 . -35.405 10.330 36.355 1.00 62.15 1 A 1 ATOM 7 S SD . MET A 0 1 . -35.472 12.118 36.612 1.00 62.15 1 A 1 ATOM 8 C CE . MET A 0 1 . -34.680 12.736 35.101 1.00 62.15 1 A 1 ATOM 9 N N . ILE A 0 2 . -32.057 6.722 36.927 1.00 73.91 2 A 1 ATOM 10 C CA . ILE A 0 2 . -30.702 6.170 36.695 1.00 73.91 2 A 1 ATOM 11 C C . ILE A 0 2 . -30.677 5.182 35.515 1.00 73.91 2 A 1 ATOM 12 C CB . ILE A 0 2 . -30.174 5.575 38.023 1.00 73.91 2 A 1 ATOM 13 O O . ILE A 0 2 . -29.791 5.257 34.670 1.00 73.91 2 A 1 ATOM 14 C CG1 . ILE A 0 2 . -29.802 6.742 38.971 1.00 73.91 2 A 1 ATOM 15 C CG2 . ILE A 0 2 . -28.972 4.638 37.823 1.00 73.91 2 A 1 ATOM 16 C CD1 . ILE A 0 2 . -29.712 6.339 40.446 1.00 73.91 2 A 1 ATOM 17 N N . TYR A 0 3 . -31.707 4.340 35.384 1.00 72.41 3 A 1 ATOM 18 C CA . TYR A 0 3 . -31.783 3.307 34.341 1.00 72.41 3 A 1 ATOM 19 C C . TYR A 0 3 . -31.738 3.849 32.905 1.00 72.41 3 A 1 ATOM 20 C CB . TYR A 0 3 . -33.052 2.479 34.572 1.00 72.41 3 A 1 ATOM 21 O O . TYR A 0 3 . -31.094 3.252 32.048 1.00 72.41 3 A 1 ATOM 22 C CG . TYR A 0 3 . -32.998 1.678 35.856 1.00 72.41 3 A 1 ATOM 23 C CD1 . TYR A 0 3 . -32.215 0.509 35.898 1.00 72.41 3 A 1 ATOM 24 C CD2 . TYR A 0 3 . -33.698 2.100 37.005 1.00 72.41 3 A 1 ATOM 25 C CE1 . TYR A 0 3 . -32.124 -0.243 37.084 1.00 72.41 3 A 1 ATOM 26 C CE2 . TYR A 0 3 . -33.600 1.353 38.196 1.00 72.41 3 A 1 ATOM 27 O OH . TYR A 0 3 . -32.740 -0.530 39.389 1.00 72.41 3 A 1 ATOM 28 C CZ . TYR A 0 3 . -32.816 0.181 38.237 1.00 72.41 3 A 1 ATOM 29 N N . ILE A 0 4 . -32.349 5.012 32.653 1.00 75.70 4 A 1 ATOM 30 C CA . ILE A 0 4 . -32.351 5.642 31.322 1.00 75.70 4 A 1 ATOM 31 C C . ILE A 0 4 . -30.928 6.052 30.916 1.00 75.70 4 A 1 ATOM 32 C CB . ILE A 0 4 . -33.338 6.833 31.292 1.00 75.70 4 A 1 ATOM 33 O O . ILE A 0 4 . -30.525 5.826 29.781 1.00 75.70 4 A 1 ATOM 34 C CG1 . ILE A 0 4 . -34.789 6.338 31.512 1.00 75.70 4 A 1 ATOM 35 C CG2 . ILE A 0 4 . -33.242 7.607 29.963 1.00 75.70 4 A 1 ATOM 36 C CD1 . ILE A 0 4 . -35.775 7.457 31.874 1.00 75.70 4 A 1 ATOM 37 N N . LYS A 0 5 . -30.126 6.583 31.850 1.00 75.29 5 A 1 ATOM 38 C CA . LYS A 0 5 . -28.730 6.958 31.570 1.00 75.29 5 A 1 ATOM 39 C C . LYS A 0 5 . -27.866 5.733 31.262 1.00 75.29 5 A 1 ATOM 40 C CB . LYS A 0 5 . -28.139 7.774 32.729 1.00 75.29 5 A 1 ATOM 41 O O . LYS A 0 5 . -27.070 5.777 30.329 1.00 75.29 5 A 1 ATOM 42 C CG . LYS A 0 5 . -28.776 9.169 32.849 1.00 75.29 5 A 1 ATOM 43 C CD . LYS A 0 5 . -28.041 10.010 33.904 1.00 75.29 5 A 1 ATOM 44 C CE . LYS A 0 5 . -28.586 11.444 33.933 1.00 75.29 5 A 1 ATOM 45 N NZ . LYS A 0 5 . -27.824 12.305 34.877 1.00 75.29 5 A 1 ATOM 46 N N . CYS A 0 6 . -28.059 4.631 31.988 1.00 77.56 6 A 1 ATOM 47 C CA . CYS A 0 6 . -27.350 3.380 31.716 1.00 77.56 6 A 1 ATOM 48 C C . CYS A 0 6 . -27.721 2.793 30.345 1.00 77.56 6 A 1 ATOM 49 C CB . CYS A 0 6 . -27.635 2.383 32.846 1.00 77.56 6 A 1 ATOM 50 O O . CYS A 0 6 . -26.836 2.360 29.614 1.00 77.56 6 A 1 ATOM 51 S SG . CYS A 0 6 . -26.950 3.003 34.410 1.00 77.56 6 A 1 ATOM 52 N N . PHE A 0 7 . -29.000 2.837 29.960 1.00 78.96 7 A 1 ATOM 53 C CA . PHE A 0 7 . -29.450 2.339 28.658 1.00 78.96 7 A 1 ATOM 54 C C . PHE A 0 7 . -28.864 3.144 27.483 1.00 78.96 7 A 1 ATOM 55 C CB . PHE A 0 7 . -30.983 2.337 28.640 1.00 78.96 7 A 1 ATOM 56 O O . PHE A 0 7 . -28.439 2.569 26.479 1.00 78.96 7 A 1 ATOM 57 C CG . PHE A 0 7 . -31.559 1.595 27.454 1.00 78.96 7 A 1 ATOM 58 C CD1 . PHE A 0 7 . -31.946 2.295 26.295 1.00 78.96 7 A 1 ATOM 59 C CD2 . PHE A 0 7 . -31.682 0.193 27.500 1.00 78.96 7 A 1 ATOM 60 C CE1 . PHE A 0 7 . -32.458 1.594 25.189 1.00 78.96 7 A 1 ATOM 61 C CE2 . PHE A 0 7 . -32.194 -0.506 26.393 1.00 78.96 7 A 1 ATOM 62 C CZ . PHE A 0 7 . -32.583 0.195 25.239 1.00 78.96 7 A 1 ATOM 63 N N . MET A 0 8 . -28.758 4.470 27.625 1.00 79.20 8 A 1 ATOM 64 C CA . MET A 0 8 . -28.131 5.332 26.611 1.00 79.20 8 A 1 ATOM 65 C C . MET A 0 8 . -26.622 5.073 26.476 1.00 79.20 8 A 1 ATOM 66 C CB . MET A 0 8 . -28.404 6.810 26.922 1.00 79.20 8 A 1 ATOM 67 O O . MET A 0 8 . -26.092 5.083 25.370 1.00 79.20 8 A 1 ATOM 68 C CG . MET A 0 8 . -29.896 7.164 26.833 1.00 79.20 8 A 1 ATOM 69 S SD . MET A 0 8 . -30.680 6.950 25.213 1.00 79.20 8 A 1 ATOM 70 C CE . MET A 0 8 . -30.128 8.456 24.372 1.00 79.20 8 A 1 ATOM 71 N N . LEU A 0 9 . -25.926 4.784 27.581 1.00 80.97 9 A 1 ATOM 72 C CA . LEU A 0 9 . -24.501 4.437 27.535 1.00 80.97 9 A 1 ATOM 73 C C . LEU A 0 9 . -24.259 3.084 26.853 1.00 80.97 9 A 1 ATOM 74 C CB . LEU A 0 9 . -23.915 4.455 28.957 1.00 80.97 9 A 1 ATOM 75 O O . LEU A 0 9 . -23.358 2.978 26.027 1.00 80.97 9 A 1 ATOM 76 C CG . LEU A 0 9 . -23.751 5.866 29.550 1.00 80.97 9 A 1 ATOM 77 C CD1 . LEU A 0 9 . -23.371 5.756 31.027 1.00 80.97 9 A 1 ATOM 78 C CD2 . LEU A 0 9 . -22.666 6.673 28.834 1.00 80.97 9 A 1 ATOM 79 N N . ILE A 0 10 . -25.076 2.071 27.156 1.00 82.42 10 A 1 ATOM 80 C CA . ILE A 0 10 . -24.951 0.734 26.553 1.00 82.42 10 A 1 ATOM 81 C C . ILE A 0 10 . -25.264 0.776 25.051 1.00 82.42 10 A 1 ATOM 82 C CB . ILE A 0 10 . -25.851 -0.275 27.305 1.00 82.42 10 A 1 ATOM 83 O O . ILE A 0 10 . -24.562 0.166 24.251 1.00 82.42 10 A 1 ATOM 84 C CG1 . ILE A 0 10 . -25.342 -0.478 28.752 1.00 82.42 10 A 1 ATOM 85 C CG2 . ILE A 0 10 . -25.897 -1.632 26.576 1.00 82.42 10 A 1 ATOM 86 C CD1 . ILE A 0 10 . -26.360 -1.169 29.669 1.00 82.42 10 A 1 ATOM 87 N N . SER A 0 11 . -26.293 1.518 24.640 1.00 83.50 11 A 1 ATOM 88 C CA . SER A 0 11 . -26.620 1.654 23.214 1.00 83.50 11 A 1 ATOM 89 C C . SER A 0 11 . -25.524 2.387 22.434 1.00 83.50 11 A 1 ATOM 90 C CB . SER A 0 11 . -27.982 2.324 23.019 1.00 83.50 11 A 1 ATOM 91 O O . SER A 0 11 . -25.159 1.952 21.342 1.00 83.50 11 A 1 ATOM 92 O OG . SER A 0 11 . -28.101 3.494 23.796 1.00 83.50 11 A 1 ATOM 93 N N . PHE A 0 12 . -24.936 3.443 23.006 1.00 83.10 12 A 1 ATOM 94 C CA . PHE A 0 12 . -23.845 4.178 22.365 1.00 83.10 12 A 1 ATOM 95 C C . PHE A 0 12 . -22.587 3.321 22.175 1.00 83.10 12 A 1 ATOM 96 C CB . PHE A 0 12 . -23.541 5.438 23.182 1.00 83.10 12 A 1 ATOM 97 O O . PHE A 0 12 . -21.974 3.358 21.107 1.00 83.10 12 A 1 ATOM 98 C CG . PHE A 0 12 . -22.571 6.378 22.497 1.00 83.10 12 A 1 ATOM 99 C CD1 . PHE A 0 12 . -21.233 6.461 22.922 1.00 83.10 12 A 1 ATOM 100 C CD2 . PHE A 0 12 . -23.015 7.181 21.430 1.00 83.10 12 A 1 ATOM 101 C CE1 . PHE A 0 12 . -20.352 7.361 22.297 1.00 83.10 12 A 1 ATOM 102 C CE2 . PHE A 0 12 . -22.126 8.060 20.786 1.00 83.10 12 A 1 ATOM 103 C CZ . PHE A 0 12 . -20.793 8.149 21.220 1.00 83.10 12 A 1 ATOM 104 N N . THR A 0 13 . -22.220 2.503 23.167 1.00 80.95 13 A 1 ATOM 105 C CA . THR A 0 13 . -21.058 1.613 23.035 1.00 80.95 13 A 1 ATOM 106 C C . THR A 0 13 . -21.287 0.542 21.974 1.00 80.95 13 A 1 ATOM 107 C CB . THR A 0 13 . -20.649 0.970 24.366 1.00 80.95 13 A 1 ATOM 108 O O . THR A 0 13 . -20.393 0.315 21.163 1.00 80.95 13 A 1 ATOM 109 C CG2 . THR A 0 13 . -20.139 2.002 25.371 1.00 80.95 13 A 1 ATOM 110 O OG1 . THR A 0 13 . -21.721 0.290 24.960 1.00 80.95 13 A 1 ATOM 111 N N . ILE A 0 14 . -22.481 -0.059 21.898 1.00 80.78 14 A 1 ATOM 112 C CA . ILE A 0 14 . -22.818 -1.052 20.861 1.00 80.78 14 A 1 ATOM 113 C C . ILE A 0 14 . -22.678 -0.457 19.453 1.00 80.78 14 A 1 ATOM 114 C CB . ILE A 0 14 . -24.235 -1.625 21.101 1.00 80.78 14 A 1 ATOM 115 O O . ILE A 0 14 . -22.108 -1.101 18.572 1.00 80.78 14 A 1 ATOM 116 C CG1 . ILE A 0 14 . -24.252 -2.482 22.387 1.00 80.78 14 A 1 ATOM 117 C CG2 . ILE A 0 14 . -24.709 -2.481 19.908 1.00 80.78 14 A 1 ATOM 118 C CD1 . ILE A 0 14 . -25.665 -2.794 22.900 1.00 80.78 14 A 1 ATOM 119 N N . ILE A 0 15 . -23.147 0.778 19.243 1.00 80.98 15 A 1 ATOM 120 C CA . ILE A 0 15 . -23.038 1.458 17.945 1.00 80.98 15 A 1 ATOM 121 C C . ILE A 0 15 . -21.570 1.688 17.578 1.00 80.98 15 A 1 ATOM 122 C CB . ILE A 0 15 . -23.854 2.771 17.944 1.00 80.98 15 A 1 ATOM 123 O O . ILE A 0 15 . -21.176 1.374 16.457 1.00 80.98 15 A 1 ATOM 124 C CG1 . ILE A 0 15 . -25.364 2.449 18.036 1.00 80.98 15 A 1 ATOM 125 C CG2 . ILE A 0 15 . -23.576 3.602 16.674 1.00 80.98 15 A 1 ATOM 126 C CD1 . ILE A 0 15 . -26.235 3.667 18.370 1.00 80.98 15 A 1 ATOM 127 N N . LEU A 0 16 . -20.751 2.178 18.516 1.00 79.11 16 A 1 ATOM 128 C CA . LEU A 0 16 . -19.321 2.382 18.275 1.00 79.11 16 A 1 ATOM 129 C C . LEU A 0 16 . -18.604 1.068 17.945 1.00 79.11 16 A 1 ATOM 130 C CB . LEU A 0 16 . -18.672 3.061 19.492 1.00 79.11 16 A 1 ATOM 131 O O . LEU A 0 16 . -17.881 0.997 16.956 1.00 79.11 16 A 1 ATOM 132 C CG . LEU A 0 16 . -19.029 4.545 19.686 1.00 79.11 16 A 1 ATOM 133 C CD1 . LEU A 0 16 . -18.377 5.016 20.985 1.00 79.11 16 A 1 ATOM 134 C CD2 . LEU A 0 16 . -18.512 5.435 18.554 1.00 79.11 16 A 1 ATOM 135 N N . TYR A 0 17 . -18.824 0.003 18.718 1.00 75.91 17 A 1 ATOM 136 C CA . TYR A 0 17 . -18.195 -1.289 18.430 1.00 75.91 17 A 1 ATOM 137 C C . TYR A 0 17 . -18.641 -1.866 17.079 1.00 75.91 17 A 1 ATOM 138 C CB . TYR A 0 17 . -18.454 -2.276 19.577 1.00 75.91 17 A 1 ATOM 139 O O . TYR A 0 17 . -17.819 -2.438 16.364 1.00 75.91 17 A 1 ATOM 140 C CG . TYR A 0 17 . -17.544 -2.063 20.773 1.00 75.91 17 A 1 ATOM 141 C CD1 . TYR A 0 17 . -16.171 -2.359 20.663 1.00 75.91 17 A 1 ATOM 142 C CD2 . TYR A 0 17 . -18.058 -1.592 21.996 1.00 75.91 17 A 1 ATOM 143 C CE1 . TYR A 0 17 . -15.315 -2.161 21.762 1.00 75.91 17 A 1 ATOM 144 C CE2 . TYR A 0 17 . -17.204 -1.369 23.091 1.00 75.91 17 A 1 ATOM 145 O OH . TYR A 0 17 . -14.998 -1.466 24.032 1.00 75.91 17 A 1 ATOM 146 C CZ . TYR A 0 17 . -15.828 -1.656 22.974 1.00 75.91 17 A 1 ATOM 147 N N . GLY A 0 18 . -19.906 -1.673 16.692 1.00 73.31 18 A 1 ATOM 148 C CA . GLY A 0 18 . -20.415 -2.089 15.386 1.00 73.31 18 A 1 ATOM 149 C C . GLY A 0 18 . -19.762 -1.343 14.218 1.00 73.31 18 A 1 ATOM 150 O O . GLY A 0 18 . -19.358 -1.973 13.240 1.00 73.31 18 A 1 ATOM 151 N N . THR A 0 19 . -19.609 -0.019 14.317 1.00 71.77 19 A 1 ATOM 152 C CA . THR A 0 19 . -19.018 0.797 13.242 1.00 71.77 19 A 1 ATOM 153 C C . THR A 0 19 . -17.511 0.598 13.127 1.00 71.77 19 A 1 ATOM 154 C CB . THR A 0 19 . -19.324 2.291 13.411 1.00 71.77 19 A 1 ATOM 155 O O . THR A 0 19 . -17.009 0.404 12.020 1.00 71.77 19 A 1 ATOM 156 C CG2 . THR A 0 19 . -20.817 2.594 13.283 1.00 71.77 19 A 1 ATOM 157 O OG1 . THR A 0 19 . -18.898 2.762 14.665 1.00 71.77 19 A 1 ATOM 158 N N . PHE A 0 20 . -16.788 0.566 14.252 1.00 64.15 20 A 1 ATOM 159 C CA . PHE A 0 20 . -15.358 0.261 14.248 1.00 64.15 20 A 1 ATOM 160 C C . PHE A 0 20 . -15.101 -1.168 13.763 1.00 64.15 20 A 1 ATOM 161 C CB . PHE A 0 20 . -14.742 0.524 15.630 1.00 64.15 20 A 1 ATOM 162 O O . PHE A 0 20 . -14.227 -1.368 12.924 1.00 64.15 20 A 1 ATOM 163 C CG . PHE A 0 20 . -14.405 1.985 15.871 1.00 64.15 20 A 1 ATOM 164 C CD1 . PHE A 0 20 . -13.289 2.552 15.227 1.00 64.15 20 A 1 ATOM 165 C CD2 . PHE A 0 20 . -15.185 2.785 16.728 1.00 64.15 20 A 1 ATOM 166 C CE1 . PHE A 0 20 . -12.969 3.907 15.425 1.00 64.15 20 A 1 ATOM 167 C CE2 . PHE A 0 20 . -14.873 4.141 16.917 1.00 64.15 20 A 1 ATOM 168 C CZ . PHE A 0 20 . -13.766 4.704 16.263 1.00 64.15 20 A 1 ATOM 169 N N . GLY A 0 21 . -15.901 -2.147 14.199 1.00 61.33 21 A 1 ATOM 170 C CA . GLY A 0 21 . -15.790 -3.536 13.751 1.00 61.33 21 A 1 ATOM 171 C C . GLY A 0 21 . -15.956 -3.699 12.239 1.00 61.33 21 A 1 ATOM 172 O O . GLY A 0 21 . -15.199 -4.446 11.623 1.00 61.33 21 A 1 ATOM 173 N N . GLN A 0 22 . -16.881 -2.961 11.614 1.00 59.50 22 A 1 ATOM 174 C CA . GLN A 0 22 . -17.002 -2.946 10.152 1.00 59.50 22 A 1 ATOM 175 C C . GLN A 0 22 . -15.828 -2.253 9.466 1.00 59.50 22 A 1 ATOM 176 C CB . GLN A 0 22 . -18.316 -2.293 9.712 1.00 59.50 22 A 1 ATOM 177 O O . GLN A 0 22 . -15.382 -2.727 8.423 1.00 59.50 22 A 1 ATOM 178 C CG . GLN A 0 22 . -19.510 -3.218 9.980 1.00 59.50 22 A 1 ATOM 179 C CD . GLN A 0 22 . -20.716 -2.904 9.105 1.00 59.50 22 A 1 ATOM 180 N NE2 . GLN A 0 22 . -21.679 -3.796 9.042 1.00 59.50 22 A 1 ATOM 181 O OE1 . GLN A 0 22 . -20.826 -1.883 8.450 1.00 59.50 22 A 1 ATOM 182 N N . TYR A 0 23 . -15.295 -1.181 10.057 1.00 58.77 23 A 1 ATOM 183 C CA . TYR A 0 23 . -14.115 -0.512 9.518 1.00 58.77 23 A 1 ATOM 184 C C . TYR A 0 23 . -12.926 -1.476 9.480 1.00 58.77 23 A 1 ATOM 185 C CB . TYR A 0 23 . -13.818 0.770 10.306 1.00 58.77 23 A 1 ATOM 186 O O . TYR A 0 23 . -12.339 -1.655 8.421 1.00 58.77 23 A 1 ATOM 187 C CG . TYR A 0 23 . -13.103 1.823 9.482 1.00 58.77 23 A 1 ATOM 188 C CD1 . TYR A 0 23 . -11.708 1.994 9.581 1.00 58.77 23 A 1 ATOM 189 C CD2 . TYR A 0 23 . -13.850 2.638 8.610 1.00 58.77 23 A 1 ATOM 190 C CE1 . TYR A 0 23 . -11.067 2.991 8.819 1.00 58.77 23 A 1 ATOM 191 C CE2 . TYR A 0 23 . -13.211 3.623 7.834 1.00 58.77 23 A 1 ATOM 192 O OH . TYR A 0 23 . -11.184 4.737 7.186 1.00 58.77 23 A 1 ATOM 193 C CZ . TYR A 0 23 . -11.815 3.799 7.938 1.00 58.77 23 A 1 ATOM 194 N N . TYR A 0 24 . -12.638 -2.184 10.578 1.00 55.83 24 A 1 ATOM 195 C CA . TYR A 0 24 . -11.567 -3.189 10.616 1.00 55.83 24 A 1 ATOM 196 C C . TYR A 0 24 . -11.798 -4.343 9.636 1.00 55.83 24 A 1 ATOM 197 C CB . TYR A 0 24 . -11.378 -3.710 12.047 1.00 55.83 24 A 1 ATOM 198 O O . TYR A 0 24 . -10.856 -4.765 8.971 1.00 55.83 24 A 1 ATOM 199 C CG . TYR A 0 24 . -10.741 -2.689 12.970 1.00 55.83 24 A 1 ATOM 200 C CD1 . TYR A 0 24 . -9.391 -2.335 12.787 1.00 55.83 24 A 1 ATOM 201 C CD2 . TYR A 0 24 . -11.487 -2.088 14.001 1.00 55.83 24 A 1 ATOM 202 C CE1 . TYR A 0 24 . -8.798 -1.356 13.607 1.00 55.83 24 A 1 ATOM 203 C CE2 . TYR A 0 24 . -10.910 -1.089 14.806 1.00 55.83 24 A 1 ATOM 204 O OH . TYR A 0 24 . -9.005 0.233 15.397 1.00 55.83 24 A 1 ATOM 205 C CZ . TYR A 0 24 . -9.565 -0.721 14.609 1.00 55.83 24 A 1 ATOM 206 N N . LYS A 0 25 . -13.048 -4.791 9.461 1.00 57.40 25 A 1 ATOM 207 C CA . LYS A 0 25 . -13.375 -5.858 8.506 1.00 57.40 25 A 1 ATOM 208 C C . LYS A 0 25 . -13.073 -5.470 7.054 1.00 57.40 25 A 1 ATOM 209 C CB . LYS A 0 25 . -14.838 -6.288 8.691 1.00 57.40 25 A 1 ATOM 210 O O . LYS A 0 25 . -12.572 -6.296 6.307 1.00 57.40 25 A 1 ATOM 211 C CG . LYS A 0 25 . -14.966 -7.808 8.579 1.00 57.40 25 A 1 ATOM 212 C CD . LYS A 0 25 . -16.420 -8.237 8.780 1.00 57.40 25 A 1 ATOM 213 C CE . LYS A 0 25 . -16.477 -9.765 8.776 1.00 57.40 25 A 1 ATOM 214 N NZ . LYS A 0 25 . -17.875 -10.254 8.792 1.00 57.40 25 A 1 ATOM 215 N N . ILE A 0 26 . -13.301 -4.208 6.678 1.00 57.03 26 A 1 ATOM 216 C CA . ILE A 0 26 . -12.968 -3.689 5.338 1.00 57.03 26 A 1 ATOM 217 C C . ILE A 0 26 . -11.447 -3.688 5.094 1.00 57.03 26 A 1 ATOM 218 C CB . ILE A 0 26 . -13.600 -2.286 5.148 1.00 57.03 26 A 1 ATOM 219 O O . ILE A 0 26 . -11.012 -3.866 3.957 1.00 57.03 26 A 1 ATOM 220 C CG1 . ILE A 0 26 . -15.144 -2.393 5.097 1.00 57.03 26 A 1 ATOM 221 C CG2 . ILE A 0 26 . -13.097 -1.584 3.871 1.00 57.03 26 A 1 ATOM 222 C CD1 . ILE A 0 26 . -15.866 -1.061 5.345 1.00 57.03 26 A 1 ATOM 223 N N . TRP A 0 27 . -10.632 -3.517 6.142 1.00 51.30 27 A 1 ATOM 224 C CA . TRP A 0 27 . -9.169 -3.569 6.034 1.00 51.30 27 A 1 ATOM 225 C C . TRP A 0 27 . -8.604 -4.996 6.079 1.00 51.30 27 A 1 ATOM 226 C CB . TRP A 0 27 . -8.523 -2.669 7.093 1.00 51.30 27 A 1 ATOM 227 O O . TRP A 0 27 . -7.600 -5.247 5.419 1.00 51.30 27 A 1 ATOM 228 C CG . TRP A 0 27 . -8.784 -1.204 6.907 1.00 51.30 27 A 1 ATOM 229 C CD1 . TRP A 0 27 . -9.672 -0.474 7.609 1.00 51.30 27 A 1 ATOM 230 C CD2 . TRP A 0 27 . -8.131 -0.255 6.011 1.00 51.30 27 A 1 ATOM 231 C CE2 . TRP A 0 27 . -8.740 1.025 6.185 1.00 51.30 27 A 1 ATOM 232 C CE3 . TRP A 0 27 . -7.056 -0.336 5.101 1.00 51.30 27 A 1 ATOM 233 N NE1 . TRP A 0 27 . -9.714 0.815 7.131 1.00 51.30 27 A 1 ATOM 234 C CH2 . TRP A 0 27 . -7.230 2.055 4.605 1.00 51.30 27 A 1 ATOM 235 C CZ2 . TRP A 0 27 . -8.313 2.167 5.493 1.00 51.30 27 A 1 ATOM 236 C CZ3 . TRP A 0 27 . -6.606 0.808 4.411 1.00 51.30 27 A 1 ATOM 237 N N . ASP A 0 28 . -9.246 -5.931 6.784 1.00 54.97 28 A 1 ATOM 238 C CA . ASP A 0 28 . -8.861 -7.355 6.768 1.00 54.97 28 A 1 ATOM 239 C C . ASP A 0 28 . -9.264 -8.055 5.462 1.00 54.97 28 A 1 ATOM 240 C CB . ASP A 0 28 . -9.487 -8.091 7.966 1.00 54.97 28 A 1 ATOM 241 O O . ASP A 0 28 . -8.586 -8.974 5.005 1.00 54.97 28 A 1 ATOM 242 C CG . ASP A 0 28 . -8.684 -7.983 9.268 1.00 54.97 28 A 1 ATOM 243 O OD1 . ASP A 0 28 . -7.483 -7.632 9.218 1.00 54.97 28 A 1 ATOM 244 O OD2 . ASP A 0 28 . -9.283 -8.302 10.322 1.00 54.97 28 A 1 ATOM 245 N N . GLU A 0 29 . -10.343 -7.597 4.826 1.00 51.10 29 A 1 ATOM 246 C CA . GLU A 0 29 . -10.838 -8.119 3.548 1.00 51.10 29 A 1 ATOM 247 C C . GLU A 0 29 . -10.135 -7.479 2.337 1.00 51.10 29 A 1 ATOM 248 C CB . GLU A 0 29 . -12.372 -8.009 3.543 1.00 51.10 29 A 1 ATOM 249 O O . GLU A 0 29 . -10.509 -7.722 1.186 1.00 51.10 29 A 1 ATOM 250 C CG . GLU A 0 29 . -13.097 -9.056 2.684 1.00 51.10 29 A 1 ATOM 251 C CD . GLU A 0 29 . -14.548 -9.276 3.162 1.00 51.10 29 A 1 ATOM 252 O OE1 . GLU A 0 29 . -15.033 -10.426 3.051 1.00 51.10 29 A 1 ATOM 253 O OE2 . GLU A 0 29 . -15.185 -8.314 3.655 1.00 51.10 29 A 1 ATOM 254 N N . TYR A 0 30 . -9.063 -6.706 2.571 1.00 48.06 30 A 1 ATOM 255 C CA . TYR A 0 30 . -8.143 -6.340 1.501 1.00 48.06 30 A 1 ATOM 256 C C . TYR A 0 30 . -7.596 -7.635 0.887 1.00 48.06 30 A 1 ATOM 257 C CB . TYR A 0 30 . -7.002 -5.433 1.985 1.00 48.06 30 A 1 ATOM 258 O O . TYR A 0 30 . -6.975 -8.436 1.590 1.00 48.06 30 A 1 ATOM 259 C CG . TYR A 0 30 . -6.870 -4.164 1.172 1.00 48.06 30 A 1 ATOM 260 C CD1 . TYR A 0 30 . -6.038 -4.111 0.036 1.00 48.06 30 A 1 ATOM 261 C CD2 . TYR A 0 30 . -7.610 -3.032 1.559 1.00 48.06 30 A 1 ATOM 262 C CE1 . TYR A 0 30 . -5.937 -2.915 -0.704 1.00 48.06 30 A 1 ATOM 263 C CE2 . TYR A 0 30 . -7.506 -1.834 0.830 1.00 48.06 30 A 1 ATOM 264 O OH . TYR A 0 30 . -6.565 -0.620 -1.009 1.00 48.06 30 A 1 ATOM 265 C CZ . TYR A 0 30 . -6.667 -1.776 -0.303 1.00 48.06 30 A 1 ATOM 266 N N . PRO A 0 31 . -7.814 -7.880 -0.413 1.00 46.50 31 A 1 ATOM 267 C CA . PRO A 0 31 . -7.496 -9.161 -1.018 1.00 46.50 31 A 1 ATOM 268 C C . PRO A 0 31 . -5.989 -9.435 -0.930 1.00 46.50 31 A 1 ATOM 269 C CB . PRO A 0 31 . -8.040 -9.077 -2.450 1.00 46.50 31 A 1 ATOM 270 O O . PRO A 0 31 . -5.196 -8.924 -1.724 1.00 46.50 31 A 1 ATOM 271 C CG . PRO A 0 31 . -8.132 -7.579 -2.721 1.00 46.50 31 A 1 ATOM 272 C CD . PRO A 0 31 . -8.462 -6.995 -1.362 1.00 46.50 31 A 1 ATOM 273 N N . GLN A 0 32 . -5.592 -10.310 0.002 1.00 49.31 32 A 1 ATOM 274 C CA . GLN A 0 32 . -4.246 -10.896 0.070 1.00 49.31 32 A 1 ATOM 275 C C . GLN A 0 32 . -3.854 -11.587 -1.251 1.00 49.31 32 A 1 ATOM 276 C CB . GLN A 0 32 . -4.165 -11.892 1.243 1.00 49.31 32 A 1 ATOM 277 O O . GLN A 0 32 . -2.667 -11.752 -1.535 1.00 49.31 32 A 1 ATOM 278 C CG . GLN A 0 32 . -3.914 -11.206 2.597 1.00 49.31 32 A 1 ATOM 279 C CD . GLN A 0 32 . -3.847 -12.195 3.762 1.00 49.31 32 A 1 ATOM 280 N NE2 . GLN A 0 32 . -3.290 -11.812 4.889 1.00 49.31 32 A 1 ATOM 281 O OE1 . GLN A 0 32 . -4.284 -13.329 3.690 1.00 49.31 32 A 1 ATOM 282 N N . SER A 0 33 . -4.825 -11.902 -2.116 1.00 42.97 33 A 1 ATOM 283 C CA . SER A 0 33 . -4.604 -12.405 -3.475 1.00 42.97 33 A 1 ATOM 284 C C . SER A 0 33 . -3.920 -11.404 -4.419 1.00 42.97 33 A 1 ATOM 285 C CB . SER A 0 33 . -5.933 -12.876 -4.073 1.00 42.97 33 A 1 ATOM 286 O O . SER A 0 33 . -3.285 -11.829 -5.381 1.00 42.97 33 A 1 ATOM 287 O OG . SER A 0 33 . -6.872 -11.819 -4.119 1.00 42.97 33 A 1 ATOM 288 N N . ILE A 0 34 . -3.951 -10.093 -4.140 1.00 43.96 34 A 1 ATOM 289 C CA . ILE A 0 34 . -3.163 -9.104 -4.905 1.00 43.96 34 A 1 ATOM 290 C C . ILE A 0 34 . -1.674 -9.181 -4.524 1.00 43.96 34 A 1 ATOM 291 C CB . ILE A 0 34 . -3.747 -7.676 -4.744 1.00 43.96 34 A 1 ATOM 292 O O . ILE A 0 34 . -0.805 -8.895 -5.346 1.00 43.96 34 A 1 ATOM 293 C CG1 . ILE A 0 34 . -5.223 -7.645 -5.211 1.00 43.96 34 A 1 ATOM 294 C CG2 . ILE A 0 34 . -2.924 -6.643 -5.543 1.00 43.96 34 A 1 ATOM 295 C CD1 . ILE A 0 34 . -5.894 -6.266 -5.124 1.00 43.96 34 A 1 ATOM 296 N N . LEU A 0 35 . -1.366 -9.611 -3.296 1.00 43.75 35 A 1 ATOM 297 C CA . LEU A 0 35 . -0.003 -9.687 -2.761 1.00 43.75 35 A 1 ATOM 298 C C . LEU A 0 35 . 0.707 -11.014 -3.073 1.00 43.75 35 A 1 ATOM 299 C CB . LEU A 0 35 . -0.059 -9.383 -1.246 1.00 43.75 35 A 1 ATOM 300 O O . LEU A 0 35 . 1.935 -11.033 -3.114 1.00 43.75 35 A 1 ATOM 301 C CG . LEU A 0 35 . 0.602 -8.036 -0.882 1.00 43.75 35 A 1 ATOM 302 C CD1 . LEU A 0 35 . -0.247 -7.251 0.116 1.00 43.75 35 A 1 ATOM 303 C CD2 . LEU A 0 35 . 1.988 -8.256 -0.271 1.00 43.75 35 A 1 ATOM 304 N N . GLN A 0 36 . -0.038 -12.095 -3.326 1.00 42.48 36 A 1 ATOM 305 C CA . GLN A 0 36 . 0.521 -13.416 -3.649 1.00 42.48 36 A 1 ATOM 306 C C . GLN A 0 36 . 0.690 -13.704 -5.145 1.00 42.48 36 A 1 ATOM 307 C CB . GLN A 0 36 . -0.296 -14.518 -2.963 1.00 42.48 36 A 1 ATOM 308 O O . GLN A 0 36 . 1.446 -14.611 -5.492 1.00 42.48 36 A 1 ATOM 309 C CG . GLN A 0 36 . 0.251 -14.805 -1.558 1.00 42.48 36 A 1 ATOM 310 C CD . GLN A 0 36 . -0.458 -15.973 -0.886 1.00 42.48 36 A 1 ATOM 311 N NE2 . GLN A 0 36 . 0.126 -16.556 0.138 1.00 42.48 36 A 1 ATOM 312 O OE1 . GLN A 0 36 . -1.544 -16.384 -1.250 1.00 42.48 36 A 1 ATOM 313 N N . ASN A 0 37 . 0.101 -12.901 -6.037 1.00 40.76 37 A 1 ATOM 314 C CA . ASN A 0 37 . 0.449 -12.930 -7.459 1.00 40.76 37 A 1 ATOM 315 C C . ASN A 0 37 . 1.788 -12.206 -7.690 1.00 40.76 37 A 1 ATOM 316 C CB . ASN A 0 37 . -0.730 -12.431 -8.314 1.00 40.76 37 A 1 ATOM 317 O O . ASN A 0 37 . 1.879 -11.182 -8.364 1.00 40.76 37 A 1 ATOM 318 C CG . ASN A 0 37 . -1.839 -13.464 -8.451 1.00 40.76 37 A 1 ATOM 319 N ND2 . ASN A 0 37 . -3.013 -13.055 -8.867 1.00 40.76 37 A 1 ATOM 320 O OD1 . ASN A 0 37 . -1.680 -14.645 -8.207 1.00 40.76 37 A 1 ATOM 321 N N . GLU A 0 38 . 2.863 -12.788 -7.153 1.00 41.87 38 A 1 ATOM 322 C CA . GLU A 0 38 . 4.250 -12.556 -7.571 1.00 41.87 38 A 1 ATOM 323 C C . GLU A 0 38 . 4.543 -13.149 -8.966 1.00 41.87 38 A 1 ATOM 324 C CB . GLU A 0 38 . 5.246 -13.101 -6.530 1.00 41.87 38 A 1 ATOM 325 O O . GLU A 0 38 . 5.700 -13.321 -9.358 1.00 41.87 38 A 1 ATOM 326 C CG . GLU A 0 38 . 5.190 -12.378 -5.177 1.00 41.87 38 A 1 ATOM 327 C CD . GLU A 0 38 . 6.403 -12.673 -4.278 1.00 41.87 38 A 1 ATOM 328 O OE1 . GLU A 0 38 . 6.515 -11.992 -3.231 1.00 41.87 38 A 1 ATOM 329 O OE2 . GLU A 0 38 . 7.374 -13.318 -4.718 1.00 41.87 38 A 1 ATOM 330 N N . GLU A 0 39 . 3.511 -13.438 -9.760 1.00 39.41 39 A 1 ATOM 331 C CA . GLU A 0 39 . 3.646 -13.680 -11.187 1.00 39.41 39 A 1 ATOM 332 C C . GLU A 0 39 . 4.139 -12.395 -11.844 1.00 39.41 39 A 1 ATOM 333 C CB . GLU A 0 39 . 2.319 -14.133 -11.806 1.00 39.41 39 A 1 ATOM 334 O O . GLU A 0 39 . 3.372 -11.470 -12.091 1.00 39.41 39 A 1 ATOM 335 C CG . GLU A 0 39 . 2.013 -15.599 -11.481 1.00 39.41 39 A 1 ATOM 336 C CD . GLU A 0 39 . 0.789 -16.120 -12.248 1.00 39.41 39 A 1 ATOM 337 O OE1 . GLU A 0 39 . 0.740 -17.351 -12.455 1.00 39.41 39 A 1 ATOM 338 O OE2 . GLU A 0 39 . -0.043 -15.285 -12.673 1.00 39.41 39 A 1 ATOM 339 N N . ARG A 0 40 . 5.461 -12.331 -12.051 1.00 42.24 40 A 1 ATOM 340 C CA . ARG A 0 40 . 6.181 -11.479 -13.009 1.00 42.24 40 A 1 ATOM 341 C C . ARG A 0 40 . 5.363 -10.266 -13.461 1.00 42.24 40 A 1 ATOM 342 C CB . ARG A 0 40 . 6.543 -12.340 -14.236 1.00 42.24 40 A 1 ATOM 343 O O . ARG A 0 40 . 4.516 -10.400 -14.341 1.00 42.24 40 A 1 ATOM 344 C CG . ARG A 0 40 . 7.630 -13.387 -13.963 1.00 42.24 40 A 1 ATOM 345 C CD . ARG A 0 40 . 7.852 -14.244 -15.216 1.00 42.24 40 A 1 ATOM 346 N NE . ARG A 0 40 . 9.043 -15.109 -15.086 1.00 42.24 40 A 1 ATOM 347 N NH1 . ARG A 0 40 . 8.211 -17.003 -16.102 1.00 42.24 40 A 1 ATOM 348 N NH2 . ARG A 0 40 . 10.321 -16.968 -15.390 1.00 42.24 40 A 1 ATOM 349 C CZ . ARG A 0 40 . 9.182 -16.350 -15.525 1.00 42.24 40 A 1 ATOM 350 N N . LEU A 0 41 . 5.687 -9.071 -12.955 1.00 46.50 41 A 1 ATOM 351 C CA . LEU A 0 41 . 5.287 -7.808 -13.590 1.00 46.50 41 A 1 ATOM 352 C C . LEU A 0 41 . 5.775 -7.800 -15.056 1.00 46.50 41 A 1 ATOM 353 C CB . LEU A 0 41 . 5.841 -6.597 -12.804 1.00 46.50 41 A 1 ATOM 354 O O . LEU A 0 41 . 6.852 -7.310 -15.376 1.00 46.50 41 A 1 ATOM 355 C CG . LEU A 0 41 . 4.982 -6.161 -11.597 1.00 46.50 41 A 1 ATOM 356 C CD1 . LEU A 0 41 . 5.768 -6.260 -10.288 1.00 46.50 41 A 1 ATOM 357 C CD2 . LEU A 0 41 . 4.526 -4.707 -11.758 1.00 46.50 41 A 1 ATOM 358 N N . THR A 0 42 . 4.984 -8.389 -15.949 1.00 50.23 42 A 1 ATOM 359 C CA . THR A 0 42 . 5.190 -8.460 -17.402 1.00 50.23 42 A 1 ATOM 360 C C . THR A 0 42 . 4.790 -7.148 -18.063 1.00 50.23 42 A 1 ATOM 361 C CB . THR A 0 42 . 4.354 -9.600 -18.012 1.00 50.23 42 A 1 ATOM 362 O O . THR A 0 42 . 5.224 -6.832 -19.170 1.00 50.23 42 A 1 ATOM 363 C CG2 . THR A 0 42 . 4.956 -10.978 -17.752 1.00 50.23 42 A 1 ATOM 364 O OG1 . THR A 0 42 . 3.048 -9.589 -17.474 1.00 50.23 42 A 1 ATOM 365 N N . LYS A 0 43 . 3.984 -6.345 -17.366 1.00 49.53 43 A 1 ATOM 366 C CA . LYS A 0 43 . 3.566 -5.021 -17.803 1.00 49.53 43 A 1 ATOM 367 C C . LYS A 0 43 . 4.584 -3.979 -17.360 1.00 49.53 43 A 1 ATOM 368 C CB . LYS A 0 43 . 2.140 -4.749 -17.319 1.00 49.53 43 A 1 ATOM 369 O O . LYS A 0 43 . 4.899 -3.835 -16.180 1.00 49.53 43 A 1 ATOM 370 C CG . LYS A 0 43 . 1.149 -5.605 -18.122 1.00 49.53 43 A 1 ATOM 371 C CD . LYS A 0 43 . -0.302 -5.230 -17.813 1.00 49.53 43 A 1 ATOM 372 C CE . LYS A 0 43 . -1.235 -6.155 -18.605 1.00 49.53 43 A 1 ATOM 373 N NZ . LYS A 0 43 . -2.667 -5.884 -18.316 1.00 49.53 43 A 1 ATOM 374 N N . ARG A 0 44 . 5.117 -3.258 -18.345 1.00 51.02 44 A 1 ATOM 375 C CA . ARG A 0 44 . 6.121 -2.214 -18.145 1.00 51.02 44 A 1 ATOM 376 C C . ARG A 0 44 . 5.511 -1.071 -17.308 1.00 51.02 44 A 1 ATOM 377 C CB . ARG A 0 44 . 6.646 -1.756 -19.512 1.00 51.02 44 A 1 ATOM 378 O O . ARG A 0 44 . 4.360 -0.720 -17.537 1.00 51.02 44 A 1 ATOM 379 C CG . ARG A 0 44 . 7.227 -2.900 -20.381 1.00 51.02 44 A 1 ATOM 380 C CD . ARG A 0 44 . 7.911 -2.277 -21.597 1.00 51.02 44 A 1 ATOM 381 N NE . ARG A 0 44 . 8.517 -3.174 -22.590 1.00 51.02 44 A 1 ATOM 382 N NH1 . ARG A 0 44 . 9.286 -1.531 -24.035 1.00 51.02 44 A 1 ATOM 383 N NH2 . ARG A 0 44 . 9.643 -3.657 -24.516 1.00 51.02 44 A 1 ATOM 384 C CZ . ARG A 0 44 . 9.136 -2.784 -23.700 1.00 51.02 44 A 1 ATOM 385 N N . PRO A 0 45 . 6.240 -0.444 -16.371 1.00 51.70 45 A 1 ATOM 386 C CA . PRO A 0 45 . 5.664 0.462 -15.365 1.00 51.70 45 A 1 ATOM 387 C C . PRO A 0 45 . 4.909 1.687 -15.920 1.00 51.70 45 A 1 ATOM 388 C CB . PRO A 0 45 . 6.834 0.861 -14.454 1.00 51.70 45 A 1 ATOM 389 O O . PRO A 0 45 . 4.107 2.287 -15.215 1.00 51.70 45 A 1 ATOM 390 C CG . PRO A 0 45 . 8.091 0.485 -15.241 1.00 51.70 45 A 1 ATOM 391 C CD . PRO A 0 45 . 7.641 -0.689 -16.100 1.00 51.70 45 A 1 ATOM 392 N N . TRP A 0 46 . 5.110 2.042 -17.191 1.00 59.34 46 A 1 ATOM 393 C CA . TRP A 0 46 . 4.367 3.102 -17.884 1.00 59.34 46 A 1 ATOM 394 C C . TRP A 0 46 . 2.992 2.683 -18.421 1.00 59.34 46 A 1 ATOM 395 C CB . TRP A 0 46 . 5.218 3.586 -19.046 1.00 59.34 46 A 1 ATOM 396 O O . TRP A 0 46 . 2.267 3.526 -18.935 1.00 59.34 46 A 1 ATOM 397 C CG . TRP A 0 46 . 5.547 2.519 -20.036 1.00 59.34 46 A 1 ATOM 398 C CD1 . TRP A 0 46 . 4.767 2.126 -21.069 1.00 59.34 46 A 1 ATOM 399 C CD2 . TRP A 0 46 . 6.778 1.758 -20.138 1.00 59.34 46 A 1 ATOM 400 C CE2 . TRP A 0 46 . 6.764 1.117 -21.404 1.00 59.34 46 A 1 ATOM 401 C CE3 . TRP A 0 46 . 7.947 1.651 -19.354 1.00 59.34 46 A 1 ATOM 402 N NE1 . TRP A 0 46 . 5.471 1.246 -21.863 1.00 59.34 46 A 1 ATOM 403 C CH2 . TRP A 0 46 . 9.108 0.564 -21.189 1.00 59.34 46 A 1 ATOM 404 C CZ2 . TRP A 0 46 . 7.932 0.616 -21.966 1.00 59.34 46 A 1 ATOM 405 C CZ3 . TRP A 0 46 . 9.093 1.012 -19.858 1.00 59.34 46 A 1 ATOM 406 N N . THR A 0 47 . 2.636 1.398 -18.361 1.00 53.26 47 A 1 ATOM 407 C CA . THR A 0 47 . 1.285 0.927 -18.699 1.00 53.26 47 A 1 ATOM 408 C C . THR A 0 47 . 0.337 0.985 -17.501 1.00 53.26 47 A 1 ATOM 409 C CB . THR A 0 47 . 1.290 -0.486 -19.303 1.00 53.26 47 A 1 ATOM 410 O O . THR A 0 47 . -0.836 0.653 -17.642 1.00 53.26 47 A 1 ATOM 411 C CG2 . THR A 0 47 . 2.176 -0.597 -20.545 1.00 53.26 47 A 1 ATOM 412 O OG1 . THR A 0 47 . 1.763 -1.438 -18.385 1.00 53.26 47 A 1 ATOM 413 N N . LEU A 0 48 . 0.831 1.359 -16.313 1.00 53.70 48 A 1 ATOM 414 C CA . LEU A 0 48 . -0.022 1.641 -15.162 1.00 53.70 48 A 1 ATOM 415 C C . LEU A 0 48 . -0.724 2.985 -15.365 1.00 53.70 48 A 1 ATOM 416 C CB . LEU A 0 48 . 0.767 1.626 -13.839 1.00 53.70 48 A 1 ATOM 417 O O . LEU A 0 48 . -0.116 3.944 -15.837 1.00 53.70 48 A 1 ATOM 418 C CG . LEU A 0 48 . 0.997 0.216 -13.262 1.00 53.70 48 A 1 ATOM 419 C CD1 . LEU A 0 48 . 2.233 -0.465 -13.850 1.00 53.70 48 A 1 ATOM 420 C CD2 . LEU A 0 48 . 1.181 0.302 -11.748 1.00 53.70 48 A 1 ATOM 421 N N . ARG A 0 49 . -2.003 3.039 -14.973 1.00 57.31 49 A 1 ATOM 422 C CA . ARG A 0 49 . -2.868 4.224 -15.104 1.00 57.31 49 A 1 ATOM 423 C C . ARG A 0 49 . -2.263 5.466 -14.443 1.00 57.31 49 A 1 ATOM 424 C CB . ARG A 0 49 . -4.260 3.894 -14.534 1.00 57.31 49 A 1 ATOM 425 O O . ARG A 0 49 . -2.437 6.556 -14.967 1.00 57.31 49 A 1 ATOM 426 C CG . ARG A 0 49 . -5.392 4.462 -15.399 1.00 57.31 49 A 1 ATOM 427 C CD . ARG A 0 49 . -6.750 4.031 -14.826 1.00 57.31 49 A 1 ATOM 428 N NE . ARG A 0 49 . -7.854 4.268 -15.777 1.00 57.31 49 A 1 ATOM 429 N NH1 . ARG A 0 49 . -9.563 3.526 -14.431 1.00 57.31 49 A 1 ATOM 430 N NH2 . ARG A 0 49 . -10.013 4.202 -16.507 1.00 57.31 49 A 1 ATOM 431 C CZ . ARG A 0 49 . -9.132 3.999 -15.568 1.00 57.31 49 A 1 ATOM 432 N N . ASP A 0 50 . -1.493 5.255 -13.375 1.00 57.32 50 A 1 ATOM 433 C CA . ASP A 0 50 . -0.620 6.249 -12.766 1.00 57.32 50 A 1 ATOM 434 C C . ASP A 0 50 . 0.749 5.625 -12.445 1.00 57.32 50 A 1 ATOM 435 C CB . ASP A 0 50 . -1.270 6.816 -11.498 1.00 57.32 50 A 1 ATOM 436 O O . ASP A 0 50 . 0.843 4.770 -11.561 1.00 57.32 50 A 1 ATOM 437 C CG . ASP A 0 50 . -2.245 7.942 -11.834 1.00 57.32 50 A 1 ATOM 438 O OD1 . ASP A 0 50 . -1.779 8.900 -12.494 1.00 57.32 50 A 1 ATOM 439 O OD2 . ASP A 0 50 . -3.421 7.838 -11.425 1.00 57.32 50 A 1 ATOM 440 N N . PRO A 0 51 . 1.846 6.051 -13.100 1.00 55.14 51 A 1 ATOM 441 C CA . PRO A 0 51 . 3.193 5.572 -12.774 1.00 55.14 51 A 1 ATOM 442 C C . PRO A 0 51 . 3.629 5.959 -11.349 1.00 55.14 51 A 1 ATOM 443 C CB . PRO A 0 51 . 4.101 6.171 -13.854 1.00 55.14 51 A 1 ATOM 444 O O . PRO A 0 51 . 4.563 5.372 -10.806 1.00 55.14 51 A 1 ATOM 445 C CG . PRO A 0 51 . 3.346 7.408 -14.340 1.00 55.14 51 A 1 ATOM 446 C CD . PRO A 0 51 . 1.882 7.017 -14.186 1.00 55.14 51 A 1 ATOM 447 N N . LEU A 0 52 . 2.935 6.919 -10.729 1.00 61.67 52 A 1 ATOM 448 C CA . LEU A 0 52 . 3.110 7.307 -9.331 1.00 61.67 52 A 1 ATOM 449 C C . LEU A 0 52 . 2.423 6.345 -8.353 1.00 61.67 52 A 1 ATOM 450 C CB . LEU A 0 52 . 2.589 8.743 -9.149 1.00 61.67 52 A 1 ATOM 451 O O . LEU A 0 52 . 2.894 6.238 -7.223 1.00 61.67 52 A 1 ATOM 452 C CG . LEU A 0 52 . 3.498 9.808 -9.791 1.00 61.67 52 A 1 ATOM 453 C CD1 . LEU A 0 52 . 2.748 11.132 -9.914 1.00 61.67 52 A 1 ATOM 454 C CD2 . LEU A 0 52 . 4.763 10.049 -8.961 1.00 61.67 52 A 1 ATOM 455 N N . ASN A 0 53 . 1.395 5.596 -8.775 1.00 60.59 53 A 1 ATOM 456 C CA . ASN A 0 53 . 0.731 4.628 -7.896 1.00 60.59 53 A 1 ATOM 457 C C . ASN A 0 53 . 1.671 3.490 -7.500 1.00 60.59 53 A 1 ATOM 458 C CB . ASN A 0 53 . -0.581 4.102 -8.500 1.00 60.59 53 A 1 ATOM 459 O O . ASN A 0 53 . 1.696 3.131 -6.336 1.00 60.59 53 A 1 ATOM 460 C CG . ASN A 0 53 . -1.733 5.077 -8.345 1.00 60.59 53 A 1 ATOM 461 N ND2 . ASN A 0 53 . -2.909 4.711 -8.794 1.00 60.59 53 A 1 ATOM 462 O OD1 . ASN A 0 53 . -1.593 6.181 -7.850 1.00 60.59 53 A 1 ATOM 463 N N . CYS A 0 54 . 2.569 3.026 -8.382 1.00 57.13 54 A 1 ATOM 464 C CA . CYS A 0 54 . 3.594 2.043 -7.979 1.00 57.13 54 A 1 ATOM 465 C C . CYS A 0 54 . 4.461 2.555 -6.799 1.00 57.13 54 A 1 ATOM 466 C CB . CYS A 0 54 . 4.444 1.620 -9.203 1.00 57.13 54 A 1 ATOM 467 O O . CYS A 0 54 . 4.912 1.759 -5.976 1.00 57.13 54 A 1 ATOM 468 S SG . CYS A 0 54 . 6.049 0.810 -8.833 1.00 57.13 54 A 1 ATOM 469 N N . CYS A 0 55 . 4.675 3.871 -6.676 1.00 59.99 55 A 1 ATOM 470 C CA . CYS A 0 55 . 5.454 4.460 -5.583 1.00 59.99 55 A 1 ATOM 471 C C . CYS A 0 55 . 4.603 4.806 -4.354 1.00 59.99 55 A 1 ATOM 472 C CB . CYS A 0 55 . 6.215 5.679 -6.112 1.00 59.99 55 A 1 ATOM 473 O O . CYS A 0 55 . 5.108 4.708 -3.238 1.00 59.99 55 A 1 ATOM 474 S SG . CYS A 0 55 . 7.744 5.331 -7.040 1.00 59.99 55 A 1 ATOM 475 N N . LEU A 0 56 . 3.335 5.178 -4.543 1.00 62.60 56 A 1 ATOM 476 C CA . LEU A 0 56 . 2.378 5.385 -3.451 1.00 62.60 56 A 1 ATOM 477 C C . LEU A 0 56 . 2.006 4.058 -2.772 1.00 62.60 56 A 1 ATOM 478 C CB . LEU A 0 56 . 1.130 6.102 -3.996 1.00 62.60 56 A 1 ATOM 479 O O . LEU A 0 56 . 2.006 3.986 -1.549 1.00 62.60 56 A 1 ATOM 480 C CG . LEU A 0 56 . 1.374 7.555 -4.442 1.00 62.60 56 A 1 ATOM 481 C CD1 . LEU A 0 56 . 0.160 8.099 -5.192 1.00 62.60 56 A 1 ATOM 482 C CD2 . LEU A 0 56 . 1.640 8.485 -3.255 1.00 62.60 56 A 1 ATOM 483 N N . ASP A 0 57 . 1.823 2.997 -3.559 1.00 60.87 57 A 1 ATOM 484 C CA . ASP A 0 57 . 1.492 1.639 -3.106 1.00 60.87 57 A 1 ATOM 485 C C . ASP A 0 57 . 2.728 0.857 -2.631 1.00 60.87 57 A 1 ATOM 486 C CB . ASP A 0 57 . 0.759 0.879 -4.228 1.00 60.87 57 A 1 ATOM 487 O O . ASP A 0 57 . 2.667 -0.344 -2.363 1.00 60.87 57 A 1 ATOM 488 C CG . ASP A 0 57 . -0.549 1.546 -4.669 1.00 60.87 57 A 1 ATOM 489 O OD1 . ASP A 0 57 . -1.166 2.239 -3.831 1.00 60.87 57 A 1 ATOM 490 O OD2 . ASP A 0 57 . -0.910 1.368 -5.858 1.00 60.87 57 A 1 ATOM 491 N N . ASN A 0 58 . 3.885 1.525 -2.549 1.00 56.71 58 A 1 ATOM 492 C CA . ASN A 0 58 . 5.148 0.962 -2.074 1.00 56.71 58 A 1 ATOM 493 C C . ASN A 0 58 . 5.524 -0.368 -2.768 1.00 56.71 58 A 1 ATOM 494 C CB . ASN A 0 58 . 5.081 0.901 -0.535 1.00 56.71 58 A 1 ATOM 495 O O . ASN A 0 58 . 6.154 -1.260 -2.175 1.00 56.71 58 A 1 ATOM 496 C CG . ASN A 0 58 . 6.371 1.273 0.157 1.00 56.71 58 A 1 ATOM 497 N ND2 . ASN A 0 58 . 6.398 1.159 1.464 1.00 56.71 58 A 1 ATOM 498 O OD1 . ASN A 0 58 . 7.363 1.673 -0.430 1.00 56.71 58 A 1 ATOM 499 N N . ALA A 0 59 . 5.111 -0.499 -4.034 1.00 60.73 59 A 1 ATOM 500 C CA . ALA A 0 59 . 5.237 -1.710 -4.820 1.00 60.73 59 A 1 ATOM 501 C C . ALA A 0 59 . 6.714 -2.040 -5.059 1.00 60.73 59 A 1 ATOM 502 C CB . ALA A 0 59 . 4.443 -1.546 -6.123 1.00 60.73 59 A 1 ATOM 503 O O . ALA A 0 59 . 7.585 -1.162 -5.092 1.00 60.73 59 A 1 ATOM 504 N N . LYS A 0 60 . 7.019 -3.328 -5.271 1.00 58.60 60 A 1 ATOM 505 C CA . LYS A 0 60 . 8.401 -3.805 -5.475 1.00 58.60 60 A 1 ATOM 506 C C . LYS A 0 60 . 9.122 -3.063 -6.615 1.00 58.60 60 A 1 ATOM 507 C CB . LYS A 0 60 . 8.422 -5.328 -5.714 1.00 58.60 60 A 1 ATOM 508 O O . LYS A 0 60 . 10.336 -2.908 -6.542 1.00 58.60 60 A 1 ATOM 509 C CG . LYS A 0 60 . 8.032 -6.170 -4.481 1.00 58.60 60 A 1 ATOM 510 C CD . LYS A 0 60 . 8.235 -7.672 -4.762 1.00 58.60 60 A 1 ATOM 511 C CE . LYS A 0 60 . 7.781 -8.565 -3.594 1.00 58.60 60 A 1 ATOM 512 N NZ . LYS A 0 60 . 8.028 -10.006 -3.867 1.00 58.60 60 A 1 ATOM 513 N N . CYS A 0 61 . 8.384 -2.551 -7.608 1.00 55.63 61 A 1 ATOM 514 C CA . CYS A 0 61 . 8.910 -1.734 -8.707 1.00 55.63 61 A 1 ATOM 515 C C . CYS A 0 61 . 9.483 -0.367 -8.277 1.00 55.63 61 A 1 ATOM 516 C CB . CYS A 0 61 . 7.830 -1.583 -9.804 1.00 55.63 61 A 1 ATOM 517 O O . CYS A 0 61 . 10.373 0.140 -8.956 1.00 55.63 61 A 1 ATOM 518 S SG . CYS A 0 61 . 6.107 -1.170 -9.330 1.00 55.63 61 A 1 ATOM 519 N N . CYS A 0 62 . 9.029 0.209 -7.156 1.00 56.15 62 A 1 ATOM 520 C CA . CYS A 0 62 . 9.518 1.488 -6.621 1.00 56.15 62 A 1 ATOM 521 C C . CYS A 0 62 . 10.495 1.336 -5.445 1.00 56.15 62 A 1 ATOM 522 C CB . CYS A 0 62 . 8.335 2.394 -6.251 1.00 56.15 62 A 1 ATOM 523 O O . CYS A 0 62 . 11.155 2.307 -5.064 1.00 56.15 62 A 1 ATOM 524 S SG . CYS A 0 62 . 7.695 3.367 -7.646 1.00 56.15 62 A 1 ATOM 525 N N . ARG A 0 63 . 10.657 0.131 -4.881 1.00 54.49 63 A 1 ATOM 526 C CA . ARG A 0 63 . 11.699 -0.120 -3.879 1.00 54.49 63 A 1 ATOM 527 C C . ARG A 0 63 . 13.066 -0.083 -4.559 1.00 54.49 63 A 1 ATOM 528 C CB . ARG A 0 63 . 11.458 -1.441 -3.128 1.00 54.49 63 A 1 ATOM 529 O O . ARG A 0 63 . 13.485 -1.049 -5.193 1.00 54.49 63 A 1 ATOM 530 C CG . ARG A 0 63 . 10.238 -1.357 -2.198 1.00 54.49 63 A 1 ATOM 531 C CD . ARG A 0 63 . 10.125 -2.620 -1.335 1.00 54.49 63 A 1 ATOM 532 N NE . ARG A 0 63 . 8.854 -2.641 -0.589 1.00 54.49 63 A 1 ATOM 533 N NH1 . ARG A 0 63 . 9.186 -4.594 0.585 1.00 54.49 63 A 1 ATOM 534 N NH2 . ARG A 0 63 . 7.281 -3.457 0.825 1.00 54.49 63 A 1 ATOM 535 C CZ . ARG A 0 63 . 8.452 -3.560 0.271 1.00 54.49 63 A 1 ATOM 536 N N . ARG A 0 64 . 13.790 1.032 -4.398 1.00 53.06 64 A 1 ATOM 537 C CA . ARG A 0 64 . 15.233 1.102 -4.684 1.00 53.06 64 A 1 ATOM 538 C C . ARG A 0 64 . 15.909 -0.086 -3.995 1.00 53.06 64 A 1 ATOM 539 C CB . ARG A 0 64 . 15.831 2.434 -4.175 1.00 53.06 64 A 1 ATOM 540 O O . ARG A 0 64 . 15.948 -0.136 -2.765 1.00 53.06 64 A 1 ATOM 541 C CG . ARG A 0 64 . 16.046 3.468 -5.290 1.00 53.06 64 A 1 ATOM 542 C CD . ARG A 0 64 . 16.642 4.760 -4.708 1.00 53.06 64 A 1 ATOM 543 N NE . ARG A 0 64 . 17.059 5.706 -5.764 1.00 53.06 64 A 1 ATOM 544 N NH1 . ARG A 0 64 . 17.177 7.604 -4.467 1.00 53.06 64 A 1 ATOM 545 N NH2 . ARG A 0 64 . 17.738 7.706 -6.620 1.00 53.06 64 A 1 ATOM 546 C CZ . ARG A 0 64 . 17.319 6.995 -5.612 1.00 53.06 64 A 1 ATOM 547 N N . LYS A 0 65 . 16.440 -1.035 -4.773 1.00 52.42 65 A 1 ATOM 548 C CA . LYS A 0 65 . 17.331 -2.077 -4.249 1.00 52.42 65 A 1 ATOM 549 C C . LYS A 0 65 . 18.491 -1.367 -3.542 1.00 52.42 65 A 1 ATOM 550 C CB . LYS A 0 65 . 17.842 -2.994 -5.383 1.00 52.42 65 A 1 ATOM 551 O O . LYS A 0 65 . 19.297 -0.714 -4.196 1.00 52.42 65 A 1 ATOM 552 C CG . LYS A 0 65 . 16.835 -4.076 -5.821 1.00 52.42 65 A 1 ATOM 553 C CD . LYS A 0 65 . 17.470 -5.012 -6.867 1.00 52.42 65 A 1 ATOM 554 C CE . LYS A 0 65 . 16.556 -6.196 -7.225 1.00 52.42 65 A 1 ATOM 555 N NZ . LYS A 0 65 . 17.213 -7.120 -8.193 1.00 52.42 65 A 1 ATOM 556 N N . ARG A 0 66 . 18.573 -1.489 -2.212 1.00 45.33 66 A 1 ATOM 557 C CA . ARG A 0 66 . 19.686 -0.986 -1.377 1.00 45.33 66 A 1 ATOM 558 C C . ARG A 0 66 . 20.995 -1.778 -1.563 1.00 45.33 66 A 1 ATOM 559 C CB . ARG A 0 66 . 19.265 -0.912 0.109 1.00 45.33 66 A 1 ATOM 560 O O . ARG A 0 66 . 21.916 -1.613 -0.780 1.00 45.33 66 A 1 ATOM 561 C CG . ARG A 0 66 . 18.418 0.325 0.448 1.00 45.33 66 A 1 ATOM 562 C CD . ARG A 0 66 . 18.198 0.395 1.968 1.00 45.33 66 A 1 ATOM 563 N NE . ARG A 0 66 . 17.333 1.528 2.361 1.00 45.33 66 A 1 ATOM 564 N NH1 . ARG A 0 66 . 17.015 0.898 4.551 1.00 45.33 66 A 1 ATOM 565 N NH2 . ARG A 0 66 . 16.035 2.746 3.790 1.00 45.33 66 A 1 ATOM 566 C CZ . ARG A 0 66 . 16.801 1.717 3.559 1.00 45.33 66 A 1 ATOM 567 N N . TYR A 0 67 . 21.097 -2.585 -2.616 1.00 44.72 67 A 1 ATOM 568 C CA . TYR A 0 67 . 22.268 -3.391 -2.942 1.00 44.72 67 A 1 ATOM 569 C C . TYR A 0 67 . 22.728 -3.043 -4.359 1.00 44.72 67 A 1 ATOM 570 C CB . TYR A 0 67 . 21.933 -4.876 -2.747 1.00 44.72 67 A 1 ATOM 571 O O . TYR A 0 67 . 22.362 -3.704 -5.326 1.00 44.72 67 A 1 ATOM 572 C CG . TYR A 0 67 . 21.691 -5.255 -1.297 1.00 44.72 67 A 1 ATOM 573 C CD1 . TYR A 0 67 . 22.786 -5.571 -0.469 1.00 44.72 67 A 1 ATOM 574 C CD2 . TYR A 0 67 . 20.383 -5.285 -0.772 1.00 44.72 67 A 1 ATOM 575 C CE1 . TYR A 0 67 . 22.580 -5.922 0.878 1.00 44.72 67 A 1 ATOM 576 C CE2 . TYR A 0 67 . 20.174 -5.630 0.578 1.00 44.72 67 A 1 ATOM 577 O OH . TYR A 0 67 . 21.058 -6.293 2.700 1.00 44.72 67 A 1 ATOM 578 C CZ . TYR A 0 67 . 21.272 -5.952 1.404 1.00 44.72 67 A 1 ATOM 579 N N . PHE A 0 68 . 23.474 -1.944 -4.473 1.00 44.75 68 A 1 ATOM 580 C CA . PHE A 0 68 . 24.349 -1.656 -5.610 1.00 44.75 68 A 1 ATOM 581 C C . PHE A 0 68 . 25.791 -1.796 -5.109 1.00 44.75 68 A 1 ATOM 582 C CB . PHE A 0 68 . 24.031 -0.282 -6.241 1.00 44.75 68 A 1 ATOM 583 O O . PHE A 0 68 . 26.515 -0.815 -4.945 1.00 44.75 68 A 1 ATOM 584 C CG . PHE A 0 68 . 23.163 -0.335 -7.486 1.00 44.75 68 A 1 ATOM 585 C CD1 . PHE A 0 68 . 23.758 -0.560 -8.744 1.00 44.75 68 A 1 ATOM 586 C CD2 . PHE A 0 68 . 21.773 -0.134 -7.400 1.00 44.75 68 A 1 ATOM 587 C CE1 . PHE A 0 68 . 22.970 -0.576 -9.908 1.00 44.75 68 A 1 ATOM 588 C CE2 . PHE A 0 68 . 20.985 -0.147 -8.566 1.00 44.75 68 A 1 ATOM 589 C CZ . PHE A 0 68 . 21.584 -0.366 -9.820 1.00 44.75 68 A 1 ATOM 590 N N . GLU A 0 69 . 26.197 -3.031 -4.812 1.00 40.59 69 A 1 ATOM 591 C CA . GLU A 0 69 . 27.612 -3.371 -4.921 1.00 40.59 69 A 1 ATOM 592 C C . GLU A 0 69 . 27.951 -3.402 -6.410 1.00 40.59 69 A 1 ATOM 593 C CB . GLU A 0 69 . 27.960 -4.679 -4.205 1.00 40.59 69 A 1 ATOM 594 O O . GLU A 0 69 . 27.270 -4.019 -7.228 1.00 40.59 69 A 1 ATOM 595 C CG . GLU A 0 69 . 28.301 -4.383 -2.737 1.00 40.59 69 A 1 ATOM 596 C CD . GLU A 0 69 . 28.647 -5.637 -1.927 1.00 40.59 69 A 1 ATOM 597 O OE1 . GLU A 0 69 . 29.221 -5.449 -0.833 1.00 40.59 69 A 1 ATOM 598 O OE2 . GLU A 0 69 . 28.303 -6.747 -2.387 1.00 40.59 69 A 1 ATOM 599 N N . ARG A 0 70 . 28.947 -2.597 -6.762 1.00 36.62 70 A 1 ATOM 600 C CA . ARG A 0 70 . 29.346 -2.275 -8.125 1.00 36.62 70 A 1 ATOM 601 C C . ARG A 0 70 . 29.867 -3.527 -8.831 1.00 36.62 70 A 1 ATOM 602 C CB . ARG A 0 70 . 30.459 -1.212 -8.071 1.00 36.62 70 A 1 ATOM 603 O O . ARG A 0 70 . 30.974 -3.967 -8.547 1.00 36.62 70 A 1 ATOM 604 C CG . ARG A 0 70 . 30.055 0.115 -7.414 1.00 36.62 70 A 1 ATOM 605 C CD . ARG A 0 70 . 31.296 0.988 -7.176 1.00 36.62 70 A 1 ATOM 606 N NE . ARG A 0 70 . 31.101 1.871 -6.008 1.00 36.62 70 A 1 ATOM 607 N NH1 . ARG A 0 70 . 33.281 1.925 -5.268 1.00 36.62 70 A 1 ATOM 608 N NH2 . ARG A 0 70 . 31.683 2.917 -4.073 1.00 36.62 70 A 1 ATOM 609 C CZ . ARG A 0 70 . 32.021 2.232 -5.129 1.00 36.62 70 A 1 ATOM 610 N N . LYS A 0 71 . 29.126 -4.000 -9.827 1.00 39.99 71 A 1 ATOM 611 C CA . LYS A 0 71 . 29.691 -4.505 -11.081 1.00 39.99 71 A 1 ATOM 612 C C . LYS A 0 71 . 28.961 -3.790 -12.211 1.00 39.99 71 A 1 ATOM 613 C CB . LYS A 0 71 . 29.606 -6.036 -11.174 1.00 39.99 71 A 1 ATOM 614 O O . LYS A 0 71 . 27.780 -4.022 -12.447 1.00 39.99 71 A 1 ATOM 615 C CG . LYS A 0 71 . 30.762 -6.698 -10.407 1.00 39.99 71 A 1 ATOM 616 C CD . LYS A 0 71 . 30.755 -8.213 -10.623 1.00 39.99 71 A 1 ATOM 617 C CE . LYS A 0 71 . 31.977 -8.845 -9.948 1.00 39.99 71 A 1 ATOM 618 N NZ . LYS A 0 71 . 31.990 -10.310 -10.173 1.00 39.99 71 A 1 ATOM 619 N N . LEU A 0 72 . 29.632 -2.788 -12.778 1.00 44.51 72 A 1 ATOM 620 C CA . LEU A 0 72 . 29.253 -2.183 -14.051 1.00 44.51 72 A 1 ATOM 621 C C . LEU A 0 72 . 29.708 -3.169 -15.125 1.00 44.51 72 A 1 ATOM 622 C CB . LEU A 0 72 . 29.928 -0.797 -14.210 1.00 44.51 72 A 1 ATOM 623 O O . LEU A 0 72 . 30.795 -3.012 -15.668 1.00 44.51 72 A 1 ATOM 624 C CG . LEU A 0 72 . 29.067 0.395 -13.753 1.00 44.51 72 A 1 ATOM 625 C CD1 . LEU A 0 72 . 29.794 1.238 -12.702 1.00 44.51 72 A 1 ATOM 626 C CD2 . LEU A 0 72 . 28.731 1.312 -14.936 1.00 44.51 72 A 1 ATOM 627 N N . ASP A 0 73 . 28.909 -4.206 -15.345 1.00 44.62 73 A 1 ATOM 628 C CA . ASP A 0 73 . 29.087 -5.077 -16.497 1.00 44.62 73 A 1 ATOM 629 C C . ASP A 0 73 . 28.402 -4.408 -17.702 1.00 44.62 73 A 1 ATOM 630 C CB . ASP A 0 73 . 28.647 -6.518 -16.178 1.00 44.62 73 A 1 ATOM 631 O O . ASP A 0 73 . 27.347 -3.772 -17.593 1.00 44.62 73 A 1 ATOM 632 C CG . ASP A 0 73 . 29.539 -7.195 -15.113 1.00 44.62 73 A 1 ATOM 633 O OD1 . ASP A 0 73 . 30.735 -6.840 -14.994 1.00 44.62 73 A 1 ATOM 634 O OD2 . ASP A 0 73 . 29.026 -8.053 -14.354 1.00 44.62 73 A 1 ATOM 635 N N . GLU A 0 74 . 29.121 -4.425 -18.817 1.00 40.10 74 A 1 ATOM 636 C CA . GLU A 0 74 . 28.877 -3.693 -20.054 1.00 40.10 74 A 1 ATOM 637 C C . GLU A 0 74 . 27.646 -4.227 -20.801 1.00 40.10 74 A 1 ATOM 638 C CB . GLU A 0 74 . 30.145 -3.791 -20.927 1.00 40.10 74 A 1 ATOM 639 O O . GLU A 0 74 . 27.757 -4.954 -21.783 1.00 40.10 74 A 1 ATOM 640 C CG . GLU A 0 74 . 31.391 -3.156 -20.289 1.00 40.10 74 A 1 ATOM 641 C CD . GLU A 0 74 . 32.641 -3.286 -21.177 1.00 40.10 74 A 1 ATOM 642 O OE1 . GLU A 0 74 . 33.474 -2.350 -21.123 1.00 40.10 74 A 1 ATOM 643 O OE2 . GLU A 0 74 . 32.770 -4.308 -21.885 1.00 40.10 74 A 1 ATOM 644 N N . ASP A 0 75 . 26.448 -3.844 -20.367 1.00 40.52 75 A 1 ATOM 645 C CA . ASP A 0 75 . 25.227 -4.199 -21.092 1.00 40.52 75 A 1 ATOM 646 C C . ASP A 0 75 . 24.978 -3.210 -22.247 1.00 40.52 75 A 1 ATOM 647 C CB . ASP A 0 75 . 24.034 -4.317 -20.134 1.00 40.52 75 A 1 ATOM 648 O O . ASP A 0 75 . 24.507 -2.090 -22.035 1.00 40.52 75 A 1 ATOM 649 C CG . ASP A 0 75 . 24.111 -5.506 -19.163 1.00 40.52 75 A 1 ATOM 650 O OD1 . ASP A 0 75 . 24.861 -6.468 -19.429 1.00 40.52 75 A 1 ATOM 651 O OD2 . ASP A 0 75 . 23.341 -5.453 -18.173 1.00 40.52 75 A 1 ATOM 652 N N . GLU A 0 76 . 25.362 -3.653 -23.451 1.00 45.63 76 A 1 ATOM 653 C CA . GLU A 0 76 . 24.866 -3.521 -24.848 1.00 45.63 76 A 1 ATOM 654 C C . GLU A 0 76 . 23.789 -2.473 -25.261 1.00 45.63 76 A 1 ATOM 655 C CB . GLU A 0 76 . 24.450 -4.945 -25.283 1.00 45.63 76 A 1 ATOM 656 O O . GLU A 0 76 . 23.484 -2.324 -26.442 1.00 45.63 76 A 1 ATOM 657 C CG . GLU A 0 76 . 24.886 -5.310 -26.713 1.00 45.63 76 A 1 ATOM 658 C CD . GLU A 0 76 . 24.648 -6.792 -27.065 1.00 45.63 76 A 1 ATOM 659 O OE1 . GLU A 0 76 . 24.965 -7.158 -28.219 1.00 45.63 76 A 1 ATOM 660 O OE2 . GLU A 0 76 . 24.118 -7.539 -26.210 1.00 45.63 76 A 1 ATOM 661 N N . PHE A 0 77 . 23.233 -1.671 -24.354 1.00 36.93 77 A 1 ATOM 662 C CA . PHE A 0 77 . 22.270 -0.596 -24.616 1.00 36.93 77 A 1 ATOM 663 C C . PHE A 0 77 . 22.844 0.788 -24.257 1.00 36.93 77 A 1 ATOM 664 C CB . PHE A 0 77 . 20.919 -0.918 -23.951 1.00 36.93 77 A 1 ATOM 665 O O . PHE A 0 77 . 22.369 1.479 -23.356 1.00 36.93 77 A 1 ATOM 666 C CG . PHE A 0 77 . 19.976 -1.706 -24.842 1.00 36.93 77 A 1 ATOM 667 C CD1 . PHE A 0 77 . 19.064 -1.024 -25.673 1.00 36.93 77 A 1 ATOM 668 C CD2 . PHE A 0 77 . 20.019 -3.111 -24.862 1.00 36.93 77 A 1 ATOM 669 C CE1 . PHE A 0 77 . 18.193 -1.744 -26.511 1.00 36.93 77 A 1 ATOM 670 C CE2 . PHE A 0 77 . 19.149 -3.830 -25.700 1.00 36.93 77 A 1 ATOM 671 C CZ . PHE A 0 77 . 18.235 -3.149 -26.523 1.00 36.93 77 A 1 ATOM 672 N N . GLY A 0 78 . 23.869 1.208 -25.010 1.00 33.86 78 A 1 ATOM 673 C CA . GLY A 0 78 . 24.137 2.603 -25.404 1.00 33.86 78 A 1 ATOM 674 C C . GLY A 0 78 . 23.805 3.713 -24.396 1.00 33.86 78 A 1 ATOM 675 O O . GLY A 0 78 . 23.030 4.627 -24.690 1.00 33.86 78 A 1 ATOM 676 N N . MET A 0 79 . 24.406 3.664 -23.206 1.00 35.34 79 A 1 ATOM 677 C CA . MET A 0 79 . 24.281 4.688 -22.165 1.00 35.34 79 A 1 ATOM 678 C C . MET A 0 79 . 25.034 5.986 -22.540 1.00 35.34 79 A 1 ATOM 679 C CB . MET A 0 79 . 24.720 4.098 -20.799 1.00 35.34 79 A 1 ATOM 680 O O . MET A 0 79 . 26.085 6.296 -21.992 1.00 35.34 79 A 1 ATOM 681 C CG . MET A 0 79 . 23.582 4.038 -19.776 1.00 35.34 79 A 1 ATOM 682 S SD . MET A 0 79 . 24.155 3.755 -18.071 1.00 35.34 79 A 1 ATOM 683 C CE . MET A 0 79 . 24.644 2.005 -18.199 1.00 35.34 79 A 1 ATOM 684 N N . THR A 0 80 . 24.462 6.810 -23.423 1.00 37.63 80 A 1 ATOM 685 C CA . THR A 0 80 . 24.880 8.217 -23.644 1.00 37.63 80 A 1 ATOM 686 C C . THR A 0 80 . 23.708 9.203 -23.560 1.00 37.63 80 A 1 ATOM 687 C CB . THR A 0 80 . 25.707 8.415 -24.927 1.00 37.63 80 A 1 ATOM 688 O O . THR A 0 80 . 23.656 10.216 -24.250 1.00 37.63 80 A 1 ATOM 689 C CG2 . THR A 0 80 . 27.107 7.817 -24.813 1.00 37.63 80 A 1 ATOM 690 O OG1 . THR A 0 80 . 25.051 7.806 -26.009 1.00 37.63 80 A 1 ATOM 691 N N . ARG A 0 81 . 22.743 8.961 -22.660 1.00 39.90 81 A 1 ATOM 692 C CA . ARG A 0 81 . 21.626 9.896 -22.389 1.00 39.90 81 A 1 ATOM 693 C C . ARG A 0 81 . 21.444 10.169 -20.892 1.00 39.90 81 A 1 ATOM 694 C CB . ARG A 0 81 . 20.364 9.407 -23.126 1.00 39.90 81 A 1 ATOM 695 O O . ARG A 0 81 . 20.333 10.110 -20.369 1.00 39.90 81 A 1 ATOM 696 C CG . ARG A 0 81 . 19.479 10.577 -23.580 1.00 39.90 81 A 1 ATOM 697 C CD . ARG A 0 81 . 18.279 10.046 -24.374 1.00 39.90 81 A 1 ATOM 698 N NE . ARG A 0 81 . 17.553 11.129 -25.069 1.00 39.90 81 A 1 ATOM 699 N NH1 . ARG A 0 81 . 15.982 9.805 -26.097 1.00 39.90 81 A 1 ATOM 700 N NH2 . ARG A 0 81 . 16.032 11.991 -26.532 1.00 39.90 81 A 1 ATOM 701 C CZ . ARG A 0 81 . 16.528 10.972 -25.890 1.00 39.90 81 A 1 ATOM 702 N N . ARG A 0 82 . 22.563 10.400 -20.195 1.00 39.94 82 A 1 ATOM 703 C CA . ARG A 0 82 . 22.677 10.285 -18.730 1.00 39.94 82 A 1 ATOM 704 C C . ARG A 0 82 . 21.993 11.359 -17.876 1.00 39.94 82 A 1 ATOM 705 C CB . ARG A 0 82 . 24.149 10.053 -18.309 1.00 39.94 82 A 1 ATOM 706 O O . ARG A 0 82 . 21.783 11.069 -16.710 1.00 39.94 82 A 1 ATOM 707 C CG . ARG A 0 82 . 24.391 8.577 -17.941 1.00 39.94 82 A 1 ATOM 708 C CD . ARG A 0 82 . 25.824 8.315 -17.458 1.00 39.94 82 A 1 ATOM 709 N NE . ARG A 0 82 . 26.043 6.879 -17.177 1.00 39.94 82 A 1 ATOM 710 N NH1 . ARG A 0 82 . 28.204 7.030 -16.403 1.00 39.94 82 A 1 ATOM 711 N NH2 . ARG A 0 82 . 27.224 5.031 -16.579 1.00 39.94 82 A 1 ATOM 712 C CZ . ARG A 0 82 . 27.153 6.324 -16.719 1.00 39.94 82 A 1 ATOM 713 N N . GLU A 0 83 . 21.552 12.508 -18.390 1.00 43.27 83 A 1 ATOM 714 C CA . GLU A 0 83 . 20.970 13.540 -17.493 1.00 43.27 83 A 1 ATOM 715 C C . GLU A 0 83 . 19.696 14.246 -17.983 1.00 43.27 83 A 1 ATOM 716 C CB . GLU A 0 83 . 22.072 14.540 -17.109 1.00 43.27 83 A 1 ATOM 717 O O . GLU A 0 83 . 18.891 14.694 -17.168 1.00 43.27 83 A 1 ATOM 718 C CG . GLU A 0 83 . 22.783 14.063 -15.828 1.00 43.27 83 A 1 ATOM 719 C CD . GLU A 0 83 . 23.998 14.905 -15.440 1.00 43.27 83 A 1 ATOM 720 O OE1 . GLU A 0 83 . 24.396 14.794 -14.261 1.00 43.27 83 A 1 ATOM 721 O OE2 . GLU A 0 83 . 24.518 15.616 -16.328 1.00 43.27 83 A 1 ATOM 722 N N . TYR A 0 84 . 19.416 14.283 -19.288 1.00 39.51 84 A 1 ATOM 723 C CA . TYR A 0 84 . 18.344 15.149 -19.809 1.00 39.51 84 A 1 ATOM 724 C C . TYR A 0 84 . 17.009 14.438 -20.094 1.00 39.51 84 A 1 ATOM 725 C CB . TYR A 0 84 . 18.895 15.929 -21.007 1.00 39.51 84 A 1 ATOM 726 O O . TYR A 0 84 . 15.955 15.072 -20.120 1.00 39.51 84 A 1 ATOM 727 C CG . TYR A 0 84 . 19.988 16.901 -20.594 1.00 39.51 84 A 1 ATOM 728 C CD1 . TYR A 0 84 . 19.632 18.164 -20.080 1.00 39.51 84 A 1 ATOM 729 C CD2 . TYR A 0 84 . 21.349 16.534 -20.670 1.00 39.51 84 A 1 ATOM 730 C CE1 . TYR A 0 84 . 20.630 19.057 -19.647 1.00 39.51 84 A 1 ATOM 731 C CE2 . TYR A 0 84 . 22.347 17.420 -20.220 1.00 39.51 84 A 1 ATOM 732 O OH . TYR A 0 84 . 22.935 19.554 -19.272 1.00 39.51 84 A 1 ATOM 733 C CZ . TYR A 0 84 . 21.989 18.686 -19.710 1.00 39.51 84 A 1 ATOM 734 N N . ALA A 0 85 . 16.998 13.110 -20.253 1.00 41.25 85 A 1 ATOM 735 C CA . ALA A 0 85 . 15.783 12.379 -20.646 1.00 41.25 85 A 1 ATOM 736 C C . ALA A 0 85 . 14.796 12.118 -19.492 1.00 41.25 85 A 1 ATOM 737 C CB . ALA A 0 85 . 16.204 11.080 -21.336 1.00 41.25 85 A 1 ATOM 738 O O . ALA A 0 85 . 13.614 11.862 -19.734 1.00 41.25 85 A 1 ATOM 739 N N . TRP A 0 86 . 15.267 12.177 -18.243 1.00 37.85 86 A 1 ATOM 740 C CA . TRP A 0 86 . 14.414 12.005 -17.064 1.00 37.85 86 A 1 ATOM 741 C C . TRP A 0 86 . 13.695 13.296 -16.667 1.00 37.85 86 A 1 ATOM 742 C CB . TRP A 0 86 . 15.227 11.400 -15.917 1.00 37.85 86 A 1 ATOM 743 O O . TRP A 0 86 . 12.546 13.230 -16.235 1.00 37.85 86 A 1 ATOM 744 C CG . TRP A 0 86 . 15.251 9.903 -15.940 1.00 37.85 86 A 1 ATOM 745 C CD1 . TRP A 0 86 . 16.065 9.122 -16.687 1.00 37.85 86 A 1 ATOM 746 C CD2 . TRP A 0 86 . 14.416 8.987 -15.168 1.00 37.85 86 A 1 ATOM 747 C CE2 . TRP A 0 86 . 14.783 7.650 -15.503 1.00 37.85 86 A 1 ATOM 748 C CE3 . TRP A 0 86 . 13.398 9.155 -14.204 1.00 37.85 86 A 1 ATOM 749 N NE1 . TRP A 0 86 . 15.790 7.791 -16.435 1.00 37.85 86 A 1 ATOM 750 C CH2 . TRP A 0 86 . 13.169 6.734 -13.951 1.00 37.85 86 A 1 ATOM 751 C CZ2 . TRP A 0 86 . 14.175 6.533 -14.912 1.00 37.85 86 A 1 ATOM 752 C CZ3 . TRP A 0 86 . 12.783 8.041 -13.601 1.00 37.85 86 A 1 ATOM 753 N N . LYS A 0 87 . 14.306 14.469 -16.899 1.00 37.59 87 A 1 ATOM 754 C CA . LYS A 0 87 . 13.642 15.760 -16.668 1.00 37.59 87 A 1 ATOM 755 C C . LYS A 0 87 . 12.439 15.940 -17.599 1.00 37.59 87 A 1 ATOM 756 C CB . LYS A 0 87 . 14.651 16.927 -16.745 1.00 37.59 87 A 1 ATOM 757 O O . LYS A 0 87 . 11.352 16.226 -17.113 1.00 37.59 87 A 1 ATOM 758 C CG . LYS A 0 87 . 14.980 17.470 -15.342 1.00 37.59 87 A 1 ATOM 759 C CD . LYS A 0 87 . 16.012 18.608 -15.390 1.00 37.59 87 A 1 ATOM 760 C CE . LYS A 0 87 . 16.225 19.218 -13.994 1.00 37.59 87 A 1 ATOM 761 N NZ . LYS A 0 87 . 17.315 20.232 -13.994 1.00 37.59 87 A 1 ATOM 762 N N . ASN A 0 88 . 12.576 15.666 -18.898 1.00 41.39 88 A 1 ATOM 763 C CA . ASN A 0 88 . 11.511 15.975 -19.864 1.00 41.39 88 A 1 ATOM 764 C C . ASN A 0 88 . 10.212 15.170 -19.671 1.00 41.39 88 A 1 ATOM 765 C CB . ASN A 0 88 . 12.069 15.863 -21.295 1.00 41.39 88 A 1 ATOM 766 O O . ASN A 0 88 . 9.133 15.723 -19.861 1.00 41.39 88 A 1 ATOM 767 C CG . ASN A 0 88 . 12.961 17.040 -21.658 1.00 41.39 88 A 1 ATOM 768 N ND2 . ASN A 0 88 . 13.463 17.089 -22.869 1.00 41.39 88 A 1 ATOM 769 O OD1 . ASN A 0 88 . 13.221 17.926 -20.865 1.00 41.39 88 A 1 ATOM 770 N N . ARG A 0 89 . 10.273 13.910 -19.219 1.00 39.05 89 A 1 ATOM 771 C CA . ARG A 0 89 . 9.056 13.090 -19.045 1.00 39.05 89 A 1 ATOM 772 C C . ARG A 0 89 . 8.209 13.481 -17.834 1.00 39.05 89 A 1 ATOM 773 C CB . ARG A 0 89 . 9.407 11.594 -19.037 1.00 39.05 89 A 1 ATOM 774 O O . ARG A 0 89 . 6.989 13.365 -17.887 1.00 39.05 89 A 1 ATOM 775 C CG . ARG A 0 89 . 9.501 11.072 -20.478 1.00 39.05 89 A 1 ATOM 776 C CD . ARG A 0 89 . 9.642 9.547 -20.542 1.00 39.05 89 A 1 ATOM 777 N NE . ARG A 0 89 . 11.033 9.095 -20.348 1.00 39.05 89 A 1 ATOM 778 N NH1 . ARG A 0 89 . 10.638 6.864 -20.727 1.00 39.05 89 A 1 ATOM 779 N NH2 . ARG A 0 89 . 12.727 7.574 -20.394 1.00 39.05 89 A 1 ATOM 780 C CZ . ARG A 0 89 . 11.458 7.851 -20.489 1.00 39.05 89 A 1 ATOM 781 N N . VAL A 0 90 . 8.827 13.980 -16.762 1.00 39.05 90 A 1 ATOM 782 C CA . VAL A 0 90 . 8.094 14.434 -15.566 1.00 39.05 90 A 1 ATOM 783 C C . VAL A 0 90 . 7.346 15.743 -15.844 1.00 39.05 90 A 1 ATOM 784 C CB . VAL A 0 90 . 9.043 14.553 -14.356 1.00 39.05 90 A 1 ATOM 785 O O . VAL A 0 90 . 6.216 15.909 -15.385 1.00 39.05 90 A 1 ATOM 786 C CG1 . VAL A 0 90 . 8.319 15.049 -13.097 1.00 39.05 90 A 1 ATOM 787 C CG2 . VAL A 0 90 . 9.670 13.191 -14.020 1.00 39.05 90 A 1 ATOM 788 N N . TYR A 0 91 . 7.929 16.645 -16.643 1.00 36.25 91 A 1 ATOM 789 C CA . TYR A 0 91 . 7.251 17.872 -17.082 1.00 36.25 91 A 1 ATOM 790 C C . TYR A 0 91 . 6.120 17.590 -18.080 1.00 36.25 91 A 1 ATOM 791 C CB . TYR A 0 91 . 8.270 18.871 -17.651 1.00 36.25 91 A 1 ATOM 792 O O . TYR A 0 91 . 5.068 18.217 -17.994 1.00 36.25 91 A 1 ATOM 793 C CG . TYR A 0 91 . 9.149 19.509 -16.589 1.00 36.25 91 A 1 ATOM 794 C CD1 . TYR A 0 91 . 8.619 20.490 -15.728 1.00 36.25 91 A 1 ATOM 795 C CD2 . TYR A 0 91 . 10.499 19.141 -16.467 1.00 36.25 91 A 1 ATOM 796 C CE1 . TYR A 0 91 . 9.428 21.070 -14.730 1.00 36.25 91 A 1 ATOM 797 C CE2 . TYR A 0 91 . 11.300 19.678 -15.445 1.00 36.25 91 A 1 ATOM 798 O OH . TYR A 0 91 . 11.561 21.192 -13.617 1.00 36.25 91 A 1 ATOM 799 C CZ . TYR A 0 91 . 10.768 20.648 -14.576 1.00 36.25 91 A 1 ATOM 800 N N . GLU A 0 92 . 6.278 16.606 -18.969 1.00 42.01 92 A 1 ATOM 801 C CA . GLU A 0 92 . 5.236 16.248 -19.938 1.00 42.01 92 A 1 ATOM 802 C C . GLU A 0 92 . 3.991 15.637 -19.268 1.00 42.01 92 A 1 ATOM 803 C CB . GLU A 0 92 . 5.844 15.307 -20.988 1.00 42.01 92 A 1 ATOM 804 O O . GLU A 0 92 . 2.862 15.959 -19.635 1.00 42.01 92 A 1 ATOM 805 C CG . GLU A 0 92 . 5.090 15.401 -22.319 1.00 42.01 92 A 1 ATOM 806 C CD . GLU A 0 92 . 5.616 14.433 -23.387 1.00 42.01 92 A 1 ATOM 807 O OE1 . GLU A 0 92 . 4.903 14.325 -24.414 1.00 42.01 92 A 1 ATOM 808 O OE2 . GLU A 0 92 . 6.644 13.755 -23.146 1.00 42.01 92 A 1 ATOM 809 N N . ILE A 0 93 . 4.182 14.822 -18.223 1.00 47.19 93 A 1 ATOM 810 C CA . ILE A 0 93 . 3.082 14.254 -17.425 1.00 47.19 93 A 1 ATOM 811 C C . ILE A 0 93 . 2.395 15.343 -16.587 1.00 47.19 93 A 1 ATOM 812 C CB . ILE A 0 93 . 3.602 13.077 -16.566 1.00 47.19 93 A 1 ATOM 813 O O . ILE A 0 93 . 1.166 15.393 -16.538 1.00 47.19 93 A 1 ATOM 814 C CG1 . ILE A 0 93 . 4.057 11.913 -17.480 1.00 47.19 93 A 1 ATOM 815 C CG2 . ILE A 0 93 . 2.522 12.574 -15.587 1.00 47.19 93 A 1 ATOM 816 C CD1 . ILE A 0 93 . 4.876 10.837 -16.755 1.00 47.19 93 A 1 ATOM 817 N N . ARG A 0 94 . 3.163 16.267 -15.986 1.00 41.70 94 A 1 ATOM 818 C CA . ARG A 0 94 . 2.612 17.405 -15.227 1.00 41.70 94 A 1 ATOM 819 C C . ARG A 0 94 . 1.768 18.336 -16.106 1.00 41.70 94 A 1 ATOM 820 C CB . ARG A 0 94 . 3.759 18.156 -14.529 1.00 41.70 94 A 1 ATOM 821 O O . ARG A 0 94 . 0.768 18.853 -15.627 1.00 41.70 94 A 1 ATOM 822 C CG . ARG A 0 94 . 3.240 19.232 -13.560 1.00 41.70 94 A 1 ATOM 823 C CD . ARG A 0 94 . 4.372 20.021 -12.892 1.00 41.70 94 A 1 ATOM 824 N NE . ARG A 0 94 . 5.136 19.210 -11.921 1.00 41.70 94 A 1 ATOM 825 N NH1 . ARG A 0 94 . 6.111 20.957 -10.792 1.00 41.70 94 A 1 ATOM 826 N NH2 . ARG A 0 94 . 6.504 18.864 -10.131 1.00 41.70 94 A 1 ATOM 827 C CZ . ARG A 0 94 . 5.912 19.679 -10.958 1.00 41.70 94 A 1 ATOM 828 N N . ASN A 0 95 . 2.128 18.498 -17.379 1.00 45.58 95 A 1 ATOM 829 C CA . ASN A 0 95 . 1.398 19.339 -18.333 1.00 45.58 95 A 1 ATOM 830 C C . ASN A 0 95 . 0.132 18.677 -18.907 1.00 45.58 95 A 1 ATOM 831 C CB . ASN A 0 95 . 2.366 19.767 -19.449 1.00 45.58 95 A 1 ATOM 832 O O . ASN A 0 95 . -0.720 19.375 -19.449 1.00 45.58 95 A 1 ATOM 833 C CG . ASN A 0 95 . 3.413 20.769 -18.992 1.00 45.58 95 A 1 ATOM 834 N ND2 . ASN A 0 95 . 4.388 21.049 -19.825 1.00 45.58 95 A 1 ATOM 835 O OD1 . ASN A 0 95 . 3.376 21.328 -17.908 1.00 45.58 95 A 1 ATOM 836 N N . ARG A 0 96 . -0.013 17.348 -18.793 1.00 50.74 96 A 1 ATOM 837 C CA . ARG A 0 96 . -1.236 16.621 -19.187 1.00 50.74 96 A 1 ATOM 838 C C . ARG A 0 96 . -2.234 16.451 -18.045 1.00 50.74 96 A 1 ATOM 839 C CB . ARG A 0 96 . -0.874 15.253 -19.779 1.00 50.74 96 A 1 ATOM 840 O O . ARG A 0 96 . -3.402 16.165 -18.295 1.00 50.74 96 A 1 ATOM 841 C CG . ARG A 0 96 . -0.210 15.376 -21.156 1.00 50.74 96 A 1 ATOM 842 C CD . ARG A 0 96 . 0.015 13.978 -21.739 1.00 50.74 96 A 1 ATOM 843 N NE . ARG A 0 96 . 0.883 14.016 -22.932 1.00 50.74 96 A 1 ATOM 844 N NH1 . ARG A 0 96 . 0.308 11.976 -23.809 1.00 50.74 96 A 1 ATOM 845 N NH2 . ARG A 0 96 . 1.956 13.160 -24.750 1.00 50.74 96 A 1 ATOM 846 C CZ . ARG A 0 96 . 1.040 13.059 -23.828 1.00 50.74 96 A 1 ATOM 847 N N . MET A 0 97 . -1.792 16.604 -16.799 1.00 45.60 97 A 1 ATOM 848 C CA . MET A 0 97 . -2.683 16.555 -15.647 1.00 45.60 97 A 1 ATOM 849 C C . MET A 0 97 . -3.484 17.851 -15.541 1.00 45.60 97 A 1 ATOM 850 C CB . MET A 0 97 . -1.904 16.254 -14.361 1.00 45.60 97 A 1 ATOM 851 O O . MET A 0 97 . -2.931 18.947 -15.525 1.00 45.60 97 A 1 ATOM 852 C CG . MET A 0 97 . -1.639 14.751 -14.235 1.00 45.60 97 A 1 ATOM 853 S SD . MET A 0 97 . -0.769 14.280 -12.717 1.00 45.60 97 A 1 ATOM 854 C CE . MET A 0 97 . -0.992 12.477 -12.790 1.00 45.60 97 A 1 ATOM 855 N N . ASN A 0 98 . -4.807 17.711 -15.436 1.00 49.70 98 A 1 ATOM 856 C CA . ASN A 0 98 . -5.700 18.834 -15.183 1.00 49.70 98 A 1 ATOM 857 C C . ASN A 0 98 . -5.253 19.543 -13.883 1.00 49.70 98 A 1 ATOM 858 C CB . ASN A 0 98 . -7.144 18.296 -15.124 1.00 49.70 98 A 1 ATOM 859 O O . ASN A 0 98 . -5.163 18.878 -12.846 1.00 49.70 98 A 1 ATOM 860 C CG . ASN A 0 98 . -8.209 19.370 -14.989 1.00 49.70 98 A 1 ATOM 861 N ND2 . ASN A 0 98 . -9.436 19.061 -15.330 1.00 49.70 98 A 1 ATOM 862 O OD1 . ASN A 0 98 . -7.967 20.478 -14.545 1.00 49.70 98 A 1 ATOM 863 N N . PRO A 0 99 . -4.986 20.862 -13.888 1.00 55.07 99 A 1 ATOM 864 C CA . PRO A 0 99 . -4.561 21.591 -12.690 1.00 55.07 99 A 1 ATOM 865 C C . PRO A 0 99 . -5.546 21.454 -11.516 1.00 55.07 99 A 1 ATOM 866 C CB . PRO A 0 99 . -4.377 23.046 -13.145 1.00 55.07 99 A 1 ATOM 867 O O . PRO A 0 99 . -5.139 21.530 -10.356 1.00 55.07 99 A 1 ATOM 868 C CG . PRO A 0 99 . -5.160 23.150 -14.454 1.00 55.07 99 A 1 ATOM 869 C CD . PRO A 0 99 . -5.056 21.749 -15.036 1.00 55.07 99 A 1 ATOM 870 N N . LEU A 0 100 . -6.823 21.162 -11.792 1.00 56.11 100 A 1 ATOM 871 C CA . LEU A 0 100 . -7.829 20.848 -10.773 1.00 56.11 100 A 1 ATOM 872 C C . LEU A 0 100 . -7.548 19.529 -10.035 1.00 56.11 100 A 1 ATOM 873 C CB . LEU A 0 100 . -9.217 20.800 -11.437 1.00 56.11 100 A 1 ATOM 874 O O . LEU A 0 100 . -7.783 19.446 -8.831 1.00 56.11 100 A 1 ATOM 875 C CG . LEU A 0 100 . -9.685 22.138 -12.040 1.00 56.11 100 A 1 ATOM 876 C CD1 . LEU A 0 100 . -10.984 21.926 -12.815 1.00 56.11 100 A 1 ATOM 877 C CD2 . LEU A 0 100 . -9.934 23.187 -10.954 1.00 56.11 100 A 1 ATOM 878 N N . LEU A 0 101 . -7.006 18.517 -10.723 1.00 55.28 101 A 1 ATOM 879 C CA . LEU A 0 101 . -6.613 17.246 -10.105 1.00 55.28 101 A 1 ATOM 880 C C . LEU A 0 101 . -5.416 17.452 -9.176 1.00 55.28 101 A 1 ATOM 881 C CB . LEU A 0 101 . -6.300 16.189 -11.183 1.00 55.28 101 A 1 ATOM 882 O O . LEU A 0 101 . -5.435 16.978 -8.045 1.00 55.28 101 A 1 ATOM 883 C CG . LEU A 0 101 . -7.536 15.674 -11.941 1.00 55.28 101 A 1 ATOM 884 C CD1 . LEU A 0 101 . -7.104 14.874 -13.171 1.00 55.28 101 A 1 ATOM 885 C CD2 . LEU A 0 101 . -8.393 14.761 -11.060 1.00 55.28 101 A 1 ATOM 886 N N . ILE A 0 102 . -4.423 18.237 -9.608 1.00 54.65 102 A 1 ATOM 887 C CA . ILE A 0 102 . -3.246 18.573 -8.791 1.00 54.65 102 A 1 ATOM 888 C C . ILE A 0 102 . -3.681 19.275 -7.499 1.00 54.65 102 A 1 ATOM 889 C CB . ILE A 0 102 . -2.245 19.428 -9.606 1.00 54.65 102 A 1 ATOM 890 O O . ILE A 0 102 . -3.242 18.887 -6.417 1.00 54.65 102 A 1 ATOM 891 C CG1 . ILE A 0 102 . -1.762 18.645 -10.852 1.00 54.65 102 A 1 ATOM 892 C CG2 . ILE A 0 102 . -1.050 19.850 -8.727 1.00 54.65 102 A 1 ATOM 893 C CD1 . ILE A 0 102 . -0.879 19.456 -11.810 1.00 54.65 102 A 1 ATOM 894 N N . LYS A 0 103 . -4.595 20.252 -7.600 1.00 56.35 103 A 1 ATOM 895 C CA . LYS A 0 103 . -5.112 21.000 -6.446 1.00 56.35 103 A 1 ATOM 896 C C . LYS A 0 103 . -5.873 20.099 -5.467 1.00 56.35 103 A 1 ATOM 897 C CB . LYS A 0 103 . -5.957 22.182 -6.951 1.00 56.35 103 A 1 ATOM 898 O O . LYS A 0 103 . -5.704 20.252 -4.260 1.00 56.35 103 A 1 ATOM 899 C CG . LYS A 0 103 . -6.066 23.303 -5.905 1.00 56.35 103 A 1 ATOM 900 C CD . LYS A 0 103 . -6.832 24.510 -6.469 1.00 56.35 103 A 1 ATOM 901 C CE . LYS A 0 103 . -6.847 25.656 -5.447 1.00 56.35 103 A 1 ATOM 902 N NZ . LYS A 0 103 . -7.622 26.829 -5.931 1.00 56.35 103 A 1 ATOM 903 N N . LYS A 0 104 . -6.653 19.134 -5.971 1.00 56.48 104 A 1 ATOM 904 C CA . LYS A 0 104 . -7.392 18.164 -5.146 1.00 56.48 104 A 1 ATOM 905 C C . LYS A 0 104 . -6.446 17.252 -4.356 1.00 56.48 104 A 1 ATOM 906 C CB . LYS A 0 104 . -8.374 17.385 -6.036 1.00 56.48 104 A 1 ATOM 907 O O . LYS A 0 104 . -6.579 17.157 -3.141 1.00 56.48 104 A 1 ATOM 908 C CG . LYS A 0 104 . -9.395 16.621 -5.186 1.00 56.48 104 A 1 ATOM 909 C CD . LYS A 0 104 . -10.442 15.908 -6.048 1.00 56.48 104 A 1 ATOM 910 C CE . LYS A 0 104 . -11.388 15.172 -5.095 1.00 56.48 104 A 1 ATOM 911 N NZ . LYS A 0 104 . -12.409 14.369 -5.806 1.00 56.48 104 A 1 ATOM 912 N N . PHE A 0 105 . -5.419 16.704 -5.010 1.00 51.54 105 A 1 ATOM 913 C CA . PHE A 0 105 . -4.411 15.865 -4.351 1.00 51.54 105 A 1 ATOM 914 C C . PHE A 0 105 . -3.578 16.621 -3.311 1.00 51.54 105 A 1 ATOM 915 C CB . PHE A 0 105 . -3.480 15.245 -5.404 1.00 51.54 105 A 1 ATOM 916 O O . PHE A 0 105 . -3.249 16.062 -2.267 1.00 51.54 105 A 1 ATOM 917 C CG . PHE A 0 105 . -4.069 14.044 -6.114 1.00 51.54 105 A 1 ATOM 918 C CD1 . PHE A 0 105 . -4.275 12.849 -5.400 1.00 51.54 105 A 1 ATOM 919 C CD2 . PHE A 0 105 . -4.389 14.099 -7.482 1.00 51.54 105 A 1 ATOM 920 C CE1 . PHE A 0 105 . -4.814 11.725 -6.048 1.00 51.54 105 A 1 ATOM 921 C CE2 . PHE A 0 105 . -4.957 12.985 -8.124 1.00 51.54 105 A 1 ATOM 922 C CZ . PHE A 0 105 . -5.165 11.796 -7.407 1.00 51.54 105 A 1 ATOM 923 N N . THR A 0 106 . -3.226 17.887 -3.563 1.00 54.41 106 A 1 ATOM 924 C CA . THR A 0 106 . -2.479 18.689 -2.580 1.00 54.41 106 A 1 ATOM 925 C C . THR A 0 106 . -3.329 19.076 -1.375 1.00 54.41 106 A 1 ATOM 926 C CB . THR A 0 106 . -1.869 19.953 -3.201 1.00 54.41 106 A 1 ATOM 927 O O . THR A 0 106 . -2.809 19.126 -0.266 1.00 54.41 106 A 1 ATOM 928 C CG2 . THR A 0 106 . -0.729 19.604 -4.158 1.00 54.41 106 A 1 ATOM 929 O OG1 . THR A 0 106 . -2.813 20.707 -3.930 1.00 54.41 106 A 1 ATOM 930 N N . HIS A 0 107 . -4.626 19.327 -1.575 1.00 48.62 107 A 1 ATOM 931 C CA . HIS A 0 107 . -5.518 19.791 -0.514 1.00 48.62 107 A 1 ATOM 932 C C . HIS A 0 107 . -6.018 18.648 0.381 1.00 48.62 107 A 1 ATOM 933 C CB . HIS A 0 107 . -6.674 20.570 -1.149 1.00 48.62 107 A 1 ATOM 934 O O . HIS A 0 107 . -6.166 18.845 1.584 1.00 48.62 107 A 1 ATOM 935 C CG . HIS A 0 107 . -7.238 21.636 -0.254 1.00 48.62 107 A 1 ATOM 936 C CD2 . HIS A 0 107 . -7.377 22.956 -0.583 1.00 48.62 107 A 1 ATOM 937 N ND1 . HIS A 0 107 . -7.628 21.500 1.059 1.00 48.62 107 A 1 ATOM 938 C CE1 . HIS A 0 107 . -8.000 22.714 1.503 1.00 48.62 107 A 1 ATOM 939 N NE2 . HIS A 0 107 . -7.872 23.633 0.529 1.00 48.62 107 A 1 ATOM 940 N N . GLU A 0 108 . -6.220 17.447 -0.172 1.00 49.97 108 A 1 ATOM 941 C CA . GLU A 0 108 . -6.543 16.249 0.618 1.00 49.97 108 A 1 ATOM 942 C C . GLU A 0 108 . -5.366 15.829 1.513 1.00 49.97 108 A 1 ATOM 943 C CB . GLU A 0 108 . -6.987 15.107 -0.317 1.00 49.97 108 A 1 ATOM 944 O O . GLU A 0 108 . -5.585 15.385 2.633 1.00 49.97 108 A 1 ATOM 945 C CG . GLU A 0 108 . -8.432 15.315 -0.820 1.00 49.97 108 A 1 ATOM 946 C CD . GLU A 0 108 . -8.898 14.297 -1.882 1.00 49.97 108 A 1 ATOM 947 O OE1 . GLU A 0 108 . -10.064 14.422 -2.338 1.00 49.97 108 A 1 ATOM 948 O OE2 . GLU A 0 108 . -8.084 13.454 -2.319 1.00 49.97 108 A 1 ATOM 949 N N . ARG A 0 109 . -4.116 16.059 1.079 1.00 46.27 109 A 1 ATOM 950 C CA . ARG A 0 109 . -2.909 15.726 1.859 1.00 46.27 109 A 1 ATOM 951 C C . ARG A 0 109 . -2.581 16.706 2.985 1.00 46.27 109 A 1 ATOM 952 C CB . ARG A 0 109 . -1.704 15.600 0.917 1.00 46.27 109 A 1 ATOM 953 O O . ARG A 0 109 . -1.927 16.308 3.944 1.00 46.27 109 A 1 ATOM 954 C CG . ARG A 0 109 . -1.029 14.235 1.056 1.00 46.27 109 A 1 ATOM 955 C CD . ARG A 0 109 . 0.204 14.202 0.149 1.00 46.27 109 A 1 ATOM 956 N NE . ARG A 0 109 . 0.545 12.825 -0.238 1.00 46.27 109 A 1 ATOM 957 N NH1 . ARG A 0 109 . 2.197 13.353 -1.733 1.00 46.27 109 A 1 ATOM 958 N NH2 . ARG A 0 109 . 1.550 11.226 -1.489 1.00 46.27 109 A 1 ATOM 959 C CZ . ARG A 0 109 . 1.427 12.474 -1.150 1.00 46.27 109 A 1 ATOM 960 N N . MET A 0 110 . -2.985 17.972 2.857 1.00 44.13 110 A 1 ATOM 961 C CA . MET A 0 110 . -2.785 18.980 3.909 1.00 44.13 110 A 1 ATOM 962 C C . MET A 0 110 . -3.834 18.899 5.026 1.00 44.13 110 A 1 ATOM 963 C CB . MET A 0 110 . -2.735 20.397 3.317 1.00 44.13 110 A 1 ATOM 964 O O . MET A 0 110 . -3.607 19.466 6.084 1.00 44.13 110 A 1 ATOM 965 C CG . MET A 0 110 . -1.453 20.663 2.521 1.00 44.13 110 A 1 ATOM 966 S SD . MET A 0 110 . -1.204 22.424 2.157 1.00 44.13 110 A 1 ATOM 967 C CE . MET A 0 110 . 0.025 22.327 0.837 1.00 44.13 110 A 1 ATOM 968 N N . ASN A 0 111 . -4.940 18.175 4.821 1.00 48.62 111 A 1 ATOM 969 C CA . ASN A 0 111 . -6.007 18.012 5.817 1.00 48.62 111 A 1 ATOM 970 C C . ASN A 0 111 . -5.932 16.675 6.589 1.00 48.62 111 A 1 ATOM 971 C CB . ASN A 0 111 . -7.365 18.214 5.117 1.00 48.62 111 A 1 ATOM 972 O O . ASN A 0 111 . -6.844 16.361 7.349 1.00 48.62 111 A 1 ATOM 973 C CG . ASN A 0 111 . -7.690 19.659 4.775 1.00 48.62 111 A 1 ATOM 974 N ND2 . ASN A 0 111 . -8.802 19.884 4.115 1.00 48.62 111 A 1 ATOM 975 O OD1 . ASN A 0 111 . -7.003 20.611 5.092 1.00 48.62 111 A 1 ATOM 976 N N . THR A 0 112 . -4.881 15.874 6.379 1.00 47.46 112 A 1 ATOM 977 C CA . THR A 0 112 . -4.672 14.558 7.023 1.00 47.46 112 A 1 ATOM 978 C C . THR A 0 112 . -3.453 14.502 7.958 1.00 47.46 112 A 1 ATOM 979 C CB . THR A 0 112 . -4.634 13.418 5.984 1.00 47.46 112 A 1 ATOM 980 O O . THR A 0 112 . -3.027 13.410 8.327 1.00 47.46 112 A 1 ATOM 981 C CG2 . THR A 0 112 . -6.027 13.087 5.454 1.00 47.46 112 A 1 ATOM 982 O OG1 . THR A 0 112 . -3.809 13.759 4.886 1.00 47.46 112 A 1 ATOM 983 N N . TYR A 0 113 . -2.895 15.653 8.339 1.00 44.11 113 A 1 ATOM 984 C CA . TYR A 0 113 . -1.879 15.815 9.390 1.00 44.11 113 A 1 ATOM 985 C C . TYR A 0 113 . -2.361 16.848 10.405 1.00 44.11 113 A 1 ATOM 986 C CB . TYR A 0 113 . -0.537 16.251 8.783 1.00 44.11 113 A 1 ATOM 987 O O . TYR A 0 113 . -2.003 16.691 11.592 1.00 44.11 113 A 1 ATOM 988 C CG . TYR A 0 113 . 0.294 15.114 8.234 1.00 44.11 113 A 1 ATOM 989 C CD1 . TYR A 0 113 . 1.071 14.343 9.118 1.00 44.11 113 A 1 ATOM 990 C CD2 . TYR A 0 113 . 0.293 14.827 6.856 1.00 44.11 113 A 1 ATOM 991 C CE1 . TYR A 0 113 . 1.858 13.283 8.630 1.00 44.11 113 A 1 ATOM 992 C CE2 . TYR A 0 113 . 1.080 13.768 6.361 1.00 44.11 113 A 1 ATOM 993 O OH . TYR A 0 113 . 2.618 11.974 6.772 1.00 44.11 113 A 1 ATOM 994 C CZ . TYR A 0 113 . 1.860 12.997 7.248 1.00 44.11 113 A 1 ATOM 995 O OXT . TYR A 0 113 . -3.068 17.771 9.946 1.00 44.11 113 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 53.04 # loop_ _atom_type.symbol C N O S #