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 ASN 0 3 GLU 0 4 TYR 0 5 LEU 0 6 LYS 0 7 ASN 0 8 GLU 0 9 LEU 0 10 ILE 0 11 PHE 0 12 GLN 0 13 PHE 0 14 TYR 0 15 THR 0 16 PHE 0 17 TYR 0 18 VAL 0 19 MET 0 20 GLN 0 21 MET 0 22 GLN 0 23 SER 0 24 ARG 0 25 SER 0 26 SER 0 27 SER 0 28 LEU 0 29 GLN 0 30 SER 0 31 GLU 0 32 ASN 0 33 LEU 0 34 SER 0 35 GLY 0 36 THR 0 37 ARG 0 38 ASN 0 39 GLN 0 40 GLN 0 41 CYS 0 42 ASN 0 43 HIS 0 44 TYR 0 45 ARG 0 46 HIS 0 47 HIS 0 48 LYS 0 49 HIS 0 50 ARG 0 51 GLY 0 52 HIS 0 53 PHE 0 54 VAL 0 55 ARG 0 56 LEU 0 57 PRO 0 58 TYR 0 59 TYR 0 60 ILE 0 61 LEU 0 62 LEU 0 63 VAL 0 64 ALA 0 65 LEU 0 66 PHE 0 67 LEU 0 68 SER 0 69 LEU 0 70 TYR 0 71 PHE 0 72 LEU 0 73 ALA 0 74 ILE 0 75 SER 0 76 LEU 0 77 ILE 0 78 MET 0 79 ASP 0 80 ASP 0 81 ASN 0 82 LEU 0 83 PHE 0 84 SER 0 85 LEU 0 86 ILE 0 87 TYR 0 88 GLU 0 89 MET 0 90 LYS 0 91 LEU # 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 . 22.620 4.921 -3.302 1.00 56.85 1 A 1 ATOM 2 C CA . MET A 0 1 . 21.509 5.714 -2.723 1.00 56.85 1 A 1 ATOM 3 C C . MET A 0 1 . 20.190 4.934 -2.602 1.00 56.85 1 A 1 ATOM 4 C CB . MET A 0 1 . 21.342 7.049 -3.466 1.00 56.85 1 A 1 ATOM 5 O O . MET A 0 1 . 19.402 5.265 -1.731 1.00 56.85 1 A 1 ATOM 6 C CG . MET A 0 1 . 20.833 8.146 -2.524 1.00 56.85 1 A 1 ATOM 7 S SD . MET A 0 1 . 21.070 9.823 -3.167 1.00 56.85 1 A 1 ATOM 8 C CE . MET A 0 1 . 19.624 9.989 -4.249 1.00 56.85 1 A 1 ATOM 9 N N . ASN A 0 2 . 19.959 3.874 -3.393 1.00 75.03 2 A 1 ATOM 10 C CA . ASN A 0 2 . 18.689 3.124 -3.380 1.00 75.03 2 A 1 ATOM 11 C C . ASN A 0 2 . 18.477 2.165 -2.198 1.00 75.03 2 A 1 ATOM 12 C CB . ASN A 0 2 . 18.562 2.354 -4.713 1.00 75.03 2 A 1 ATOM 13 O O . ASN A 0 2 . 17.336 1.887 -1.848 1.00 75.03 2 A 1 ATOM 14 C CG . ASN A 0 2 . 18.034 3.221 -5.840 1.00 75.03 2 A 1 ATOM 15 N ND2 . ASN A 0 2 . 18.156 2.792 -7.073 1.00 75.03 2 A 1 ATOM 16 O OD1 . ASN A 0 2 . 17.525 4.302 -5.628 1.00 75.03 2 A 1 ATOM 17 N N . GLU A 0 3 . 19.538 1.646 -1.579 1.00 78.92 3 A 1 ATOM 18 C CA . GLU A 0 3 . 19.382 0.599 -0.561 1.00 78.92 3 A 1 ATOM 19 C C . GLU A 0 3 . 18.843 1.148 0.767 1.00 78.92 3 A 1 ATOM 20 C CB . GLU A 0 3 . 20.723 -0.120 -0.392 1.00 78.92 3 A 1 ATOM 21 O O . GLU A 0 3 . 17.942 0.563 1.359 1.00 78.92 3 A 1 ATOM 22 C CG . GLU A 0 3 . 20.514 -1.600 -0.056 1.00 78.92 3 A 1 ATOM 23 C CD . GLU A 0 3 . 21.836 -2.371 0.035 1.00 78.92 3 A 1 ATOM 24 O OE1 . GLU A 0 3 . 21.747 -3.608 0.174 1.00 78.92 3 A 1 ATOM 25 O OE2 . GLU A 0 3 . 22.901 -1.718 -0.060 1.00 78.92 3 A 1 ATOM 26 N N . TYR A 0 4 . 19.311 2.331 1.179 1.00 80.76 4 A 1 ATOM 27 C CA . TYR A 0 4 . 18.824 3.005 2.386 1.00 80.76 4 A 1 ATOM 28 C C . TYR A 0 4 . 17.337 3.368 2.276 1.00 80.76 4 A 1 ATOM 29 C CB . TYR A 0 4 . 19.682 4.251 2.654 1.00 80.76 4 A 1 ATOM 30 O O . TYR A 0 4 . 16.555 3.056 3.166 1.00 80.76 4 A 1 ATOM 31 C CG . TYR A 0 4 . 19.389 4.886 3.997 1.00 80.76 4 A 1 ATOM 32 C CD1 . TYR A 0 4 . 18.376 5.859 4.125 1.00 80.76 4 A 1 ATOM 33 C CD2 . TYR A 0 4 . 20.096 4.456 5.136 1.00 80.76 4 A 1 ATOM 34 C CE1 . TYR A 0 4 . 18.042 6.367 5.396 1.00 80.76 4 A 1 ATOM 35 C CE2 . TYR A 0 4 . 19.782 4.983 6.402 1.00 80.76 4 A 1 ATOM 36 O OH . TYR A 0 4 . 18.395 6.357 7.778 1.00 80.76 4 A 1 ATOM 37 C CZ . TYR A 0 4 . 18.738 5.921 6.539 1.00 80.76 4 A 1 ATOM 38 N N . LEU A 0 5 . 16.928 3.952 1.143 1.00 79.61 5 A 1 ATOM 39 C CA . LEU A 0 5 . 15.532 4.311 0.867 1.00 79.61 5 A 1 ATOM 40 C C . LEU A 0 5 . 14.615 3.084 0.842 1.00 79.61 5 A 1 ATOM 41 C CB . LEU A 0 5 . 15.483 5.080 -0.471 1.00 79.61 5 A 1 ATOM 42 O O . LEU A 0 5 . 13.513 3.124 1.384 1.00 79.61 5 A 1 ATOM 43 C CG . LEU A 0 5 . 15.162 6.573 -0.277 1.00 79.61 5 A 1 ATOM 44 C CD1 . LEU A 0 5 . 15.806 7.403 -1.385 1.00 79.61 5 A 1 ATOM 45 C CD2 . LEU A 0 5 . 13.651 6.808 -0.297 1.00 79.61 5 A 1 ATOM 46 N N . LYS A 0 6 . 15.081 1.975 0.255 1.00 82.04 6 A 1 ATOM 47 C CA . LYS A 0 6 . 14.344 0.707 0.254 1.00 82.04 6 A 1 ATOM 48 C C . LYS A 0 6 . 14.182 0.155 1.673 1.00 82.04 6 A 1 ATOM 49 C CB . LYS A 0 6 . 15.061 -0.277 -0.679 1.00 82.04 6 A 1 ATOM 50 O O . LYS A 0 6 . 13.086 -0.275 2.023 1.00 82.04 6 A 1 ATOM 51 C CG . LYS A 0 6 . 14.298 -1.600 -0.822 1.00 82.04 6 A 1 ATOM 52 C CD . LYS A 0 6 . 15.053 -2.554 -1.752 1.00 82.04 6 A 1 ATOM 53 C CE . LYS A 0 6 . 14.350 -3.915 -1.780 1.00 82.04 6 A 1 ATOM 54 N NZ . LYS A 0 6 . 15.118 -4.903 -2.577 1.00 82.04 6 A 1 ATOM 55 N N . ASN A 0 7 . 15.240 0.187 2.481 1.00 85.34 7 A 1 ATOM 56 C CA . ASN A 0 7 . 15.206 -0.301 3.860 1.00 85.34 7 A 1 ATOM 57 C C . ASN A 0 7 . 14.299 0.558 4.752 1.00 85.34 7 A 1 ATOM 58 C CB . ASN A 0 7 . 16.643 -0.387 4.403 1.00 85.34 7 A 1 ATOM 59 O O . ASN A 0 7 . 13.518 -0.002 5.517 1.00 85.34 7 A 1 ATOM 60 C CG . ASN A 0 7 . 17.458 -1.494 3.754 1.00 85.34 7 A 1 ATOM 61 N ND2 . ASN A 0 7 . 18.760 -1.470 3.923 1.00 85.34 7 A 1 ATOM 62 O OD1 . ASN A 0 7 . 16.948 -2.396 3.109 1.00 85.34 7 A 1 ATOM 63 N N . GLU A 0 8 . 14.328 1.885 4.598 1.00 84.64 8 A 1 ATOM 64 C CA . GLU A 0 8 . 13.389 2.803 5.262 1.00 84.64 8 A 1 ATOM 65 C C . GLU A 0 8 . 11.937 2.496 4.887 1.00 84.64 8 A 1 ATOM 66 C CB . GLU A 0 8 . 13.726 4.256 4.881 1.00 84.64 8 A 1 ATOM 67 O O . GLU A 0 8 . 11.080 2.360 5.760 1.00 84.64 8 A 1 ATOM 68 C CG . GLU A 0 8 . 14.751 4.888 5.832 1.00 84.64 8 A 1 ATOM 69 C CD . GLU A 0 8 . 14.210 5.102 7.256 1.00 84.64 8 A 1 ATOM 70 O OE1 . GLU A 0 8 . 15.060 5.232 8.163 1.00 84.64 8 A 1 ATOM 71 O OE2 . GLU A 0 8 . 12.968 5.162 7.424 1.00 84.64 8 A 1 ATOM 72 N N . LEU A 0 9 . 11.654 2.294 3.596 1.00 84.01 9 A 1 ATOM 73 C CA . LEU A 0 9 . 10.304 1.972 3.138 1.00 84.01 9 A 1 ATOM 74 C C . LEU A 0 9 . 9.821 0.637 3.728 1.00 84.01 9 A 1 ATOM 75 C CB . LEU A 0 9 . 10.289 1.972 1.601 1.00 84.01 9 A 1 ATOM 76 O O . LEU A 0 9 . 8.710 0.553 4.246 1.00 84.01 9 A 1 ATOM 77 C CG . LEU A 0 9 . 8.895 2.274 1.013 1.00 84.01 9 A 1 ATOM 78 C CD1 . LEU A 0 9 . 8.913 3.609 0.264 1.00 84.01 9 A 1 ATOM 79 C CD2 . LEU A 0 9 . 8.473 1.184 0.029 1.00 84.01 9 A 1 ATOM 80 N N . ILE A 0 10 . 10.672 -0.396 3.717 1.00 87.18 10 A 1 ATOM 81 C CA . ILE A 0 10 . 10.367 -1.700 4.328 1.00 87.18 10 A 1 ATOM 82 C C . ILE A 0 10 . 10.115 -1.549 5.833 1.00 87.18 10 A 1 ATOM 83 C CB . ILE A 0 10 . 11.497 -2.716 4.036 1.00 87.18 10 A 1 ATOM 84 O O . ILE A 0 10 . 9.160 -2.131 6.352 1.00 87.18 10 A 1 ATOM 85 C CG1 . ILE A 0 10 . 11.522 -3.072 2.531 1.00 87.18 10 A 1 ATOM 86 C CG2 . ILE A 0 10 . 11.321 -4.008 4.861 1.00 87.18 10 A 1 ATOM 87 C CD1 . ILE A 0 10 . 12.806 -3.788 2.088 1.00 87.18 10 A 1 ATOM 88 N N . PHE A 0 11 . 10.927 -0.753 6.532 1.00 86.19 11 A 1 ATOM 89 C CA . PHE A 0 11 . 10.773 -0.513 7.965 1.00 86.19 11 A 1 ATOM 90 C C . PHE A 0 11 . 9.461 0.218 8.291 1.00 86.19 11 A 1 ATOM 91 C CB . PHE A 0 11 . 11.994 0.256 8.481 1.00 86.19 11 A 1 ATOM 92 O O . PHE A 0 11 . 8.754 -0.172 9.227 1.00 86.19 11 A 1 ATOM 93 C CG . PHE A 0 11 . 11.987 0.416 9.985 1.00 86.19 11 A 1 ATOM 94 C CD1 . PHE A 0 11 . 11.561 1.624 10.567 1.00 86.19 11 A 1 ATOM 95 C CD2 . PHE A 0 11 . 12.371 -0.661 10.805 1.00 86.19 11 A 1 ATOM 96 C CE1 . PHE A 0 11 . 11.513 1.750 11.966 1.00 86.19 11 A 1 ATOM 97 C CE2 . PHE A 0 11 . 12.328 -0.532 12.204 1.00 86.19 11 A 1 ATOM 98 C CZ . PHE A 0 11 . 11.895 0.673 12.785 1.00 86.19 11 A 1 ATOM 99 N N . GLN A 0 12 . 9.075 1.215 7.488 1.00 86.12 12 A 1 ATOM 100 C CA . GLN A 0 12 . 7.784 1.896 7.622 1.00 86.12 12 A 1 ATOM 101 C C . GLN A 0 12 . 6.607 0.945 7.372 1.00 86.12 12 A 1 ATOM 102 C CB . GLN A 0 12 . 7.711 3.095 6.668 1.00 86.12 12 A 1 ATOM 103 O O . GLN A 0 12 . 5.662 0.919 8.166 1.00 86.12 12 A 1 ATOM 104 C CG . GLN A 0 12 . 8.604 4.254 7.135 1.00 86.12 12 A 1 ATOM 105 C CD . GLN A 0 12 . 8.424 5.518 6.304 1.00 86.12 12 A 1 ATOM 106 N NE2 . GLN A 0 12 . 9.159 6.561 6.615 1.00 86.12 12 A 1 ATOM 107 O OE1 . GLN A 0 12 . 7.620 5.610 5.388 1.00 86.12 12 A 1 ATOM 108 N N . PHE A 0 13 . 6.681 0.110 6.330 1.00 85.70 13 A 1 ATOM 109 C CA . PHE A 0 13 . 5.662 -0.906 6.048 1.00 85.70 13 A 1 ATOM 110 C C . PHE A 0 13 . 5.531 -1.927 7.184 1.00 85.70 13 A 1 ATOM 111 C CB . PHE A 0 13 . 5.967 -1.609 4.714 1.00 85.70 13 A 1 ATOM 112 O O . PHE A 0 13 . 4.413 -2.247 7.596 1.00 85.70 13 A 1 ATOM 113 C CG . PHE A 0 13 . 5.254 -0.986 3.530 1.00 85.70 13 A 1 ATOM 114 C CD1 . PHE A 0 13 . 3.884 -1.240 3.337 1.00 85.70 13 A 1 ATOM 115 C CD2 . PHE A 0 13 . 5.934 -0.148 2.628 1.00 85.70 13 A 1 ATOM 116 C CE1 . PHE A 0 13 . 3.200 -0.656 2.256 1.00 85.70 13 A 1 ATOM 117 C CE2 . PHE A 0 13 . 5.248 0.450 1.559 1.00 85.70 13 A 1 ATOM 118 C CZ . PHE A 0 13 . 3.882 0.193 1.369 1.00 85.70 13 A 1 ATOM 119 N N . TYR A 0 14 . 6.651 -2.408 7.727 1.00 84.82 14 A 1 ATOM 120 C CA . TYR A 0 14 . 6.652 -3.346 8.848 1.00 84.82 14 A 1 ATOM 121 C C . TYR A 0 14 . 6.060 -2.716 10.115 1.00 84.82 14 A 1 ATOM 122 C CB . TYR A 0 14 . 8.078 -3.850 9.095 1.00 84.82 14 A 1 ATOM 123 O O . TYR A 0 14 . 5.198 -3.315 10.758 1.00 84.82 14 A 1 ATOM 124 C CG . TYR A 0 14 . 8.157 -4.870 10.213 1.00 84.82 14 A 1 ATOM 125 C CD1 . TYR A 0 14 . 8.608 -4.489 11.492 1.00 84.82 14 A 1 ATOM 126 C CD2 . TYR A 0 14 . 7.744 -6.195 9.977 1.00 84.82 14 A 1 ATOM 127 C CE1 . TYR A 0 14 . 8.658 -5.436 12.533 1.00 84.82 14 A 1 ATOM 128 C CE2 . TYR A 0 14 . 7.786 -7.143 11.017 1.00 84.82 14 A 1 ATOM 129 O OH . TYR A 0 14 . 8.288 -7.687 13.292 1.00 84.82 14 A 1 ATOM 130 C CZ . TYR A 0 14 . 8.246 -6.766 12.295 1.00 84.82 14 A 1 ATOM 131 N N . THR A 0 15 . 6.452 -1.482 10.439 1.00 84.41 15 A 1 ATOM 132 C CA . THR A 0 15 . 5.938 -0.755 11.610 1.00 84.41 15 A 1 ATOM 133 C C . THR A 0 15 . 4.429 -0.536 11.505 1.00 84.41 15 A 1 ATOM 134 C CB . THR A 0 15 . 6.665 0.585 11.786 1.00 84.41 15 A 1 ATOM 135 O O . THR A 0 15 . 3.693 -0.827 12.449 1.00 84.41 15 A 1 ATOM 136 C CG2 . THR A 0 15 . 6.231 1.316 13.058 1.00 84.41 15 A 1 ATOM 137 O OG1 . THR A 0 15 . 8.048 0.352 11.904 1.00 84.41 15 A 1 ATOM 138 N N . PHE A 0 16 . 3.943 -0.113 10.334 1.00 83.44 16 A 1 ATOM 139 C CA . PHE A 0 16 . 2.511 0.049 10.085 1.00 83.44 16 A 1 ATOM 140 C C . PHE A 0 16 . 1.746 -1.280 10.208 1.00 83.44 16 A 1 ATOM 141 C CB . PHE A 0 16 . 2.318 0.679 8.702 1.00 83.44 16 A 1 ATOM 142 O O . PHE A 0 16 . 0.682 -1.329 10.829 1.00 83.44 16 A 1 ATOM 143 C CG . PHE A 0 16 . 0.867 0.975 8.379 1.00 83.44 16 A 1 ATOM 144 C CD1 . PHE A 0 16 . 0.133 0.118 7.538 1.00 83.44 16 A 1 ATOM 145 C CD2 . PHE A 0 16 . 0.244 2.105 8.941 1.00 83.44 16 A 1 ATOM 146 C CE1 . PHE A 0 16 . -1.216 0.396 7.251 1.00 83.44 16 A 1 ATOM 147 C CE2 . PHE A 0 16 . -1.105 2.382 8.656 1.00 83.44 16 A 1 ATOM 148 C CZ . PHE A 0 16 . -1.834 1.530 7.808 1.00 83.44 16 A 1 ATOM 149 N N . TYR A 0 17 . 2.304 -2.376 9.681 1.00 81.06 17 A 1 ATOM 150 C CA . TYR A 0 17 . 1.716 -3.713 9.800 1.00 81.06 17 A 1 ATOM 151 C C . TYR A 0 17 . 1.621 -4.181 11.262 1.00 81.06 17 A 1 ATOM 152 C CB . TYR A 0 17 . 2.533 -4.692 8.949 1.00 81.06 17 A 1 ATOM 153 O O . TYR A 0 17 . 0.571 -4.668 11.689 1.00 81.06 17 A 1 ATOM 154 C CG . TYR A 0 17 . 2.002 -6.110 8.963 1.00 81.06 17 A 1 ATOM 155 C CD1 . TYR A 0 17 . 2.594 -7.080 9.796 1.00 81.06 17 A 1 ATOM 156 C CD2 . TYR A 0 17 . 0.919 -6.459 8.133 1.00 81.06 17 A 1 ATOM 157 C CE1 . TYR A 0 17 . 2.125 -8.407 9.777 1.00 81.06 17 A 1 ATOM 158 C CE2 . TYR A 0 17 . 0.447 -7.784 8.112 1.00 81.06 17 A 1 ATOM 159 O OH . TYR A 0 17 . 0.643 -10.053 8.851 1.00 81.06 17 A 1 ATOM 160 C CZ . TYR A 0 17 . 1.062 -8.763 8.919 1.00 81.06 17 A 1 ATOM 161 N N . VAL A 0 18 . 2.677 -3.979 12.058 1.00 79.19 18 A 1 ATOM 162 C CA . VAL A 0 18 . 2.691 -4.319 13.491 1.00 79.19 18 A 1 ATOM 163 C C . VAL A 0 18 . 1.678 -3.478 14.275 1.00 79.19 18 A 1 ATOM 164 C CB . VAL A 0 18 . 4.112 -4.190 14.078 1.00 79.19 18 A 1 ATOM 165 O O . VAL A 0 18 . 0.918 -4.041 15.067 1.00 79.19 18 A 1 ATOM 166 C CG1 . VAL A 0 18 . 4.136 -4.379 15.602 1.00 79.19 18 A 1 ATOM 167 C CG2 . VAL A 0 18 . 5.045 -5.257 13.486 1.00 79.19 18 A 1 ATOM 168 N N . MET A 0 19 . 1.592 -2.163 14.029 1.00 75.96 19 A 1 ATOM 169 C CA . MET A 0 19 . 0.587 -1.299 14.673 1.00 75.96 19 A 1 ATOM 170 C C . MET A 0 19 . -0.844 -1.734 14.330 1.00 75.96 19 A 1 ATOM 171 C CB . MET A 0 19 . 0.782 0.171 14.266 1.00 75.96 19 A 1 ATOM 172 O O . MET A 0 19 . -1.719 -1.752 15.201 1.00 75.96 19 A 1 ATOM 173 C CG . MET A 0 19 . 2.022 0.810 14.896 1.00 75.96 19 A 1 ATOM 174 S SD . MET A 0 19 . 2.205 2.572 14.504 1.00 75.96 19 A 1 ATOM 175 C CE . MET A 0 19 . 1.400 3.318 15.948 1.00 75.96 19 A 1 ATOM 176 N N . GLN A 0 20 . -1.092 -2.144 13.083 1.00 77.49 20 A 1 ATOM 177 C CA . GLN A 0 20 . -2.406 -2.632 12.668 1.00 77.49 20 A 1 ATOM 178 C C . GLN A 0 20 . -2.767 -3.959 13.362 1.00 77.49 20 A 1 ATOM 179 C CB . GLN A 0 20 . -2.438 -2.749 11.137 1.00 77.49 20 A 1 ATOM 180 O O . GLN A 0 20 . -3.910 -4.140 13.792 1.00 77.49 20 A 1 ATOM 181 C CG . GLN A 0 20 . -3.882 -2.794 10.623 1.00 77.49 20 A 1 ATOM 182 C CD . GLN A 0 20 . -3.949 -3.146 9.145 1.00 77.49 20 A 1 ATOM 183 N NE2 . GLN A 0 20 . -3.850 -2.187 8.250 1.00 77.49 20 A 1 ATOM 184 O OE1 . GLN A 0 20 . -4.109 -4.295 8.771 1.00 77.49 20 A 1 ATOM 185 N N . MET A 0 21 . -1.796 -4.863 13.539 1.00 74.29 21 A 1 ATOM 186 C CA . MET A 0 21 . -1.992 -6.125 14.263 1.00 74.29 21 A 1 ATOM 187 C C . MET A 0 21 . -2.227 -5.919 15.765 1.00 74.29 21 A 1 ATOM 188 C CB . MET A 0 21 . -0.798 -7.062 14.028 1.00 74.29 21 A 1 ATOM 189 O O . MET A 0 21 . -3.120 -6.556 16.325 1.00 74.29 21 A 1 ATOM 190 C CG . MET A 0 21 . -0.807 -7.677 12.625 1.00 74.29 21 A 1 ATOM 191 S SD . MET A 0 21 . -2.237 -8.753 12.306 1.00 74.29 21 A 1 ATOM 192 C CE . MET A 0 21 . -1.741 -9.426 10.707 1.00 74.29 21 A 1 ATOM 193 N N . GLN A 0 22 . -1.499 -5.003 16.412 1.00 70.25 22 A 1 ATOM 194 C CA . GLN A 0 22 . -1.714 -4.666 17.828 1.00 70.25 22 A 1 ATOM 195 C C . GLN A 0 22 . -3.083 -4.019 18.074 1.00 70.25 22 A 1 ATOM 196 C CB . GLN A 0 22 . -0.612 -3.720 18.319 1.00 70.25 22 A 1 ATOM 197 O O . GLN A 0 22 . -3.737 -4.294 19.078 1.00 70.25 22 A 1 ATOM 198 C CG . GLN A 0 22 . 0.727 -4.438 18.537 1.00 70.25 22 A 1 ATOM 199 C CD . GLN A 0 22 . 1.803 -3.507 19.086 1.00 70.25 22 A 1 ATOM 200 N NE2 . GLN A 0 22 . 3.003 -4.000 19.306 1.00 70.25 22 A 1 ATOM 201 O OE1 . GLN A 0 22 . 1.603 -2.332 19.332 1.00 70.25 22 A 1 ATOM 202 N N . SER A 0 23 . -3.551 -3.195 17.135 1.00 62.36 23 A 1 ATOM 203 C CA . SER A 0 23 . -4.884 -2.583 17.216 1.00 62.36 23 A 1 ATOM 204 C C . SER A 0 23 . -6.007 -3.624 17.103 1.00 62.36 23 A 1 ATOM 205 C CB . SER A 0 23 . -5.052 -1.529 16.120 1.00 62.36 23 A 1 ATOM 206 O O . SER A 0 23 . -7.072 -3.465 17.694 1.00 62.36 23 A 1 ATOM 207 O OG . SER A 0 23 . -4.001 -0.583 16.155 1.00 62.36 23 A 1 ATOM 208 N N . ARG A 0 24 . -5.769 -4.715 16.360 1.00 56.12 24 A 1 ATOM 209 C CA . ARG A 0 24 . -6.692 -5.857 16.251 1.00 56.12 24 A 1 ATOM 210 C C . ARG A 0 24 . -6.675 -6.772 17.476 1.00 56.12 24 A 1 ATOM 211 C CB . ARG A 0 24 . -6.357 -6.672 14.991 1.00 56.12 24 A 1 ATOM 212 O O . ARG A 0 24 . -7.716 -7.321 17.832 1.00 56.12 24 A 1 ATOM 213 C CG . ARG A 0 24 . -7.269 -6.310 13.817 1.00 56.12 24 A 1 ATOM 214 C CD . ARG A 0 24 . -6.920 -7.184 12.607 1.00 56.12 24 A 1 ATOM 215 N NE . ARG A 0 24 . -8.060 -7.304 11.680 1.00 56.12 24 A 1 ATOM 216 N NH1 . ARG A 0 24 . -7.059 -8.744 10.202 1.00 56.12 24 A 1 ATOM 217 N NH2 . ARG A 0 24 . -9.199 -8.175 9.911 1.00 56.12 24 A 1 ATOM 218 C CZ . ARG A 0 24 . -8.100 -8.069 10.606 1.00 56.12 24 A 1 ATOM 219 N N . SER A 0 25 . -5.520 -6.980 18.106 1.00 57.64 25 A 1 ATOM 220 C CA . SER A 0 25 . -5.440 -7.823 19.305 1.00 57.64 25 A 1 ATOM 221 C C . SER A 0 25 . -6.053 -7.139 20.529 1.00 57.64 25 A 1 ATOM 222 C CB . SER A 0 25 . -4.003 -8.272 19.574 1.00 57.64 25 A 1 ATOM 223 O O . SER A 0 25 . -6.732 -7.805 21.311 1.00 57.64 25 A 1 ATOM 224 O OG . SER A 0 25 . -3.147 -7.168 19.762 1.00 57.64 25 A 1 ATOM 225 N N . SER A 0 26 . -5.910 -5.816 20.665 1.00 55.03 26 A 1 ATOM 226 C CA . SER A 0 26 . -6.531 -5.068 21.766 1.00 55.03 26 A 1 ATOM 227 C C . SER A 0 26 . -8.059 -5.019 21.666 1.00 55.03 26 A 1 ATOM 228 C CB . SER A 0 26 . -5.936 -3.662 21.861 1.00 55.03 26 A 1 ATOM 229 O O . SER A 0 26 . -8.730 -5.140 22.692 1.00 55.03 26 A 1 ATOM 230 O OG . SER A 0 26 . -6.208 -2.921 20.690 1.00 55.03 26 A 1 ATOM 231 N N . SER A 0 27 . -8.633 -4.949 20.455 1.00 54.50 27 A 1 ATOM 232 C CA . SER A 0 27 . -10.092 -5.024 20.282 1.00 54.50 27 A 1 ATOM 233 C C . SER A 0 27 . -10.670 -6.384 20.687 1.00 54.50 27 A 1 ATOM 234 C CB . SER A 0 27 . -10.514 -4.660 18.852 1.00 54.50 27 A 1 ATOM 235 O O . SER A 0 27 . -11.769 -6.440 21.223 1.00 54.50 27 A 1 ATOM 236 O OG . SER A 0 27 . -10.057 -5.584 17.881 1.00 54.50 27 A 1 ATOM 237 N N . LEU A 0 28 . -9.929 -7.479 20.481 1.00 51.52 28 A 1 ATOM 238 C CA . LEU A 0 28 . -10.353 -8.812 20.933 1.00 51.52 28 A 1 ATOM 239 C C . LEU A 0 28 . -10.208 -8.986 22.456 1.00 51.52 28 A 1 ATOM 240 C CB . LEU A 0 28 . -9.555 -9.884 20.169 1.00 51.52 28 A 1 ATOM 241 O O . LEU A 0 28 . -10.954 -9.747 23.068 1.00 51.52 28 A 1 ATOM 242 C CG . LEU A 0 28 . -9.984 -10.055 18.699 1.00 51.52 28 A 1 ATOM 243 C CD1 . LEU A 0 28 . -8.952 -10.907 17.958 1.00 51.52 28 A 1 ATOM 244 C CD2 . LEU A 0 28 . -11.344 -10.747 18.573 1.00 51.52 28 A 1 ATOM 245 N N . GLN A 0 29 . -9.273 -8.275 23.094 1.00 50.13 29 A 1 ATOM 246 C CA . GLN A 0 29 . -9.125 -8.299 24.552 1.00 50.13 29 A 1 ATOM 247 C C . GLN A 0 29 . -10.192 -7.471 25.282 1.00 50.13 29 A 1 ATOM 248 C CB . GLN A 0 29 . -7.701 -7.872 24.951 1.00 50.13 29 A 1 ATOM 249 O O . GLN A 0 29 . -10.631 -7.883 26.357 1.00 50.13 29 A 1 ATOM 250 C CG . GLN A 0 29 . -6.881 -9.091 25.401 1.00 50.13 29 A 1 ATOM 251 C CD . GLN A 0 29 . -5.439 -8.748 25.763 1.00 50.13 29 A 1 ATOM 252 N NE2 . GLN A 0 29 . -4.675 -9.703 26.249 1.00 50.13 29 A 1 ATOM 253 O OE1 . GLN A 0 29 . -4.958 -7.639 25.617 1.00 50.13 29 A 1 ATOM 254 N N . SER A 0 30 . -10.655 -6.349 24.719 1.00 48.96 30 A 1 ATOM 255 C CA . SER A 0 30 . -11.728 -5.550 25.332 1.00 48.96 30 A 1 ATOM 256 C C . SER A 0 30 . -13.103 -6.227 25.253 1.00 48.96 30 A 1 ATOM 257 C CB . SER A 0 30 . -11.768 -4.144 24.731 1.00 48.96 30 A 1 ATOM 258 O O . SER A 0 30 . -13.929 -6.045 26.154 1.00 48.96 30 A 1 ATOM 259 O OG . SER A 0 30 . -12.062 -4.188 23.352 1.00 48.96 30 A 1 ATOM 260 N N . GLU A 0 31 . -13.327 -7.078 24.248 1.00 49.11 31 A 1 ATOM 261 C CA . GLU A 0 31 . -14.539 -7.901 24.136 1.00 49.11 31 A 1 ATOM 262 C C . GLU A 0 31 . -14.635 -8.955 25.259 1.00 49.11 31 A 1 ATOM 263 C CB . GLU A 0 31 . -14.605 -8.528 22.725 1.00 49.11 31 A 1 ATOM 264 O O . GLU A 0 31 . -15.725 -9.244 25.753 1.00 49.11 31 A 1 ATOM 265 C CG . GLU A 0 31 . -15.957 -8.238 22.050 1.00 49.11 31 A 1 ATOM 266 C CD . GLU A 0 31 . -16.045 -8.690 20.578 1.00 49.11 31 A 1 ATOM 267 O OE1 . GLU A 0 31 . -17.159 -8.576 20.016 1.00 49.11 31 A 1 ATOM 268 O OE2 . GLU A 0 31 . -15.018 -9.125 20.006 1.00 49.11 31 A 1 ATOM 269 N N . ASN A 0 32 . -13.499 -9.456 25.762 1.00 51.22 32 A 1 ATOM 270 C CA . ASN A 0 32 . -13.475 -10.461 26.832 1.00 51.22 32 A 1 ATOM 271 C C . ASN A 0 32 . -13.744 -9.902 28.243 1.00 51.22 32 A 1 ATOM 272 C CB . ASN A 0 32 . -12.142 -11.229 26.767 1.00 51.22 32 A 1 ATOM 273 O O . ASN A 0 32 . -14.071 -10.676 29.141 1.00 51.22 32 A 1 ATOM 274 C CG . ASN A 0 32 . -12.107 -12.247 25.641 1.00 51.22 32 A 1 ATOM 275 N ND2 . ASN A 0 32 . -10.939 -12.569 25.138 1.00 51.22 32 A 1 ATOM 276 O OD1 . ASN A 0 32 . -13.104 -12.802 25.220 1.00 51.22 32 A 1 ATOM 277 N N . LEU A 0 33 . -13.638 -8.586 28.470 1.00 49.71 33 A 1 ATOM 278 C CA . LEU A 0 33 . -13.759 -8.004 29.819 1.00 49.71 33 A 1 ATOM 279 C C . LEU A 0 33 . -15.142 -7.425 30.155 1.00 49.71 33 A 1 ATOM 280 C CB . LEU A 0 33 . -12.620 -6.994 30.052 1.00 49.71 33 A 1 ATOM 281 O O . LEU A 0 33 . -15.373 -7.051 31.302 1.00 49.71 33 A 1 ATOM 282 C CG . LEU A 0 33 . -11.239 -7.652 30.249 1.00 49.71 33 A 1 ATOM 283 C CD1 . LEU A 0 33 . -10.160 -6.570 30.264 1.00 49.71 33 A 1 ATOM 284 C CD2 . LEU A 0 33 . -11.139 -8.431 31.566 1.00 49.71 33 A 1 ATOM 285 N N . SER A 0 34 . -16.083 -7.368 29.208 1.00 49.76 34 A 1 ATOM 286 C CA . SER A 0 34 . -17.389 -6.713 29.423 1.00 49.76 34 A 1 ATOM 287 C C . SER A 0 34 . -18.620 -7.627 29.278 1.00 49.76 34 A 1 ATOM 288 C CB . SER A 0 34 . -17.471 -5.436 28.573 1.00 49.76 34 A 1 ATOM 289 O O . SER A 0 34 . -19.750 -7.175 29.458 1.00 49.76 34 A 1 ATOM 290 O OG . SER A 0 34 . -17.139 -5.675 27.218 1.00 49.76 34 A 1 ATOM 291 N N . GLY A 0 35 . -18.438 -8.928 29.020 1.00 47.19 35 A 1 ATOM 292 C CA . GLY A 0 35 . -19.519 -9.803 28.539 1.00 47.19 35 A 1 ATOM 293 C C . GLY A 0 35 . -20.215 -10.755 29.526 1.00 47.19 35 A 1 ATOM 294 O O . GLY A 0 35 . -21.124 -11.466 29.095 1.00 47.19 35 A 1 ATOM 295 N N . THR A 0 36 . -19.848 -10.832 30.811 1.00 50.83 36 A 1 ATOM 296 C CA . THR A 0 36 . -20.353 -11.905 31.707 1.00 50.83 36 A 1 ATOM 297 C C . THR A 0 36 . -21.588 -11.579 32.544 1.00 50.83 36 A 1 ATOM 298 C CB . THR A 0 36 . -19.248 -12.504 32.597 1.00 50.83 36 A 1 ATOM 299 O O . THR A 0 36 . -22.027 -12.451 33.289 1.00 50.83 36 A 1 ATOM 300 C CG2 . THR A 0 36 . -18.469 -13.581 31.848 1.00 50.83 36 A 1 ATOM 301 O OG1 . THR A 0 36 . -18.342 -11.502 32.995 1.00 50.83 36 A 1 ATOM 302 N N . ARG A 0 37 . -22.205 -10.389 32.443 1.00 49.90 37 A 1 ATOM 303 C CA . ARG A 0 37 . -23.337 -10.058 33.341 1.00 49.90 37 A 1 ATOM 304 C C . ARG A 0 37 . -24.719 -9.858 32.719 1.00 49.90 37 A 1 ATOM 305 C CB . ARG A 0 37 . -22.924 -8.978 34.358 1.00 49.90 37 A 1 ATOM 306 O O . ARG A 0 37 . -25.685 -9.920 33.463 1.00 49.90 37 A 1 ATOM 307 C CG . ARG A 0 37 . -23.373 -9.394 35.769 1.00 49.90 37 A 1 ATOM 308 C CD . ARG A 0 37 . -22.883 -8.422 36.844 1.00 49.90 37 A 1 ATOM 309 N NE . ARG A 0 37 . -23.490 -8.746 38.149 1.00 49.90 37 A 1 ATOM 310 N NH1 . ARG A 0 37 . -22.143 -7.438 39.469 1.00 49.90 37 A 1 ATOM 311 N NH2 . ARG A 0 37 . -23.812 -8.595 40.396 1.00 49.90 37 A 1 ATOM 312 C CZ . ARG A 0 37 . -23.146 -8.261 39.327 1.00 49.90 37 A 1 ATOM 313 N N . ASN A 0 38 . -24.859 -9.727 31.397 1.00 48.40 38 A 1 ATOM 314 C CA . ASN A 0 38 . -26.162 -9.421 30.774 1.00 48.40 38 A 1 ATOM 315 C C . ASN A 0 38 . -26.574 -10.378 29.635 1.00 48.40 38 A 1 ATOM 316 C CB . ASN A 0 38 . -26.199 -7.926 30.389 1.00 48.40 38 A 1 ATOM 317 O O . ASN A 0 38 . -27.252 -9.970 28.695 1.00 48.40 38 A 1 ATOM 318 C CG . ASN A 0 38 . -26.359 -6.994 31.580 1.00 48.40 38 A 1 ATOM 319 N ND2 . ASN A 0 38 . -26.011 -5.739 31.427 1.00 48.40 38 A 1 ATOM 320 O OD1 . ASN A 0 38 . -26.814 -7.348 32.649 1.00 48.40 38 A 1 ATOM 321 N N . GLN A 0 39 . -26.209 -11.662 29.709 1.00 50.23 39 A 1 ATOM 322 C CA . GLN A 0 39 . -26.548 -12.651 28.669 1.00 50.23 39 A 1 ATOM 323 C C . GLN A 0 39 . -27.994 -13.195 28.707 1.00 50.23 39 A 1 ATOM 324 C CB . GLN A 0 39 . -25.513 -13.792 28.643 1.00 50.23 39 A 1 ATOM 325 O O . GLN A 0 39 . -28.324 -14.041 27.886 1.00 50.23 39 A 1 ATOM 326 C CG . GLN A 0 39 . -24.165 -13.329 28.067 1.00 50.23 39 A 1 ATOM 327 C CD . GLN A 0 39 . -23.171 -14.469 27.861 1.00 50.23 39 A 1 ATOM 328 N NE2 . GLN A 0 39 . -21.919 -14.152 27.618 1.00 50.23 39 A 1 ATOM 329 O OE1 . GLN A 0 39 . -23.483 -15.645 27.916 1.00 50.23 39 A 1 ATOM 330 N N . GLN A 0 40 . -28.892 -12.729 29.587 1.00 49.79 40 A 1 ATOM 331 C CA . GLN A 0 40 . -30.226 -13.351 29.708 1.00 49.79 40 A 1 ATOM 332 C C . GLN A 0 40 . -31.417 -12.633 29.054 1.00 49.79 40 A 1 ATOM 333 C CB . GLN A 0 40 . -30.500 -13.769 31.163 1.00 49.79 40 A 1 ATOM 334 O O . GLN A 0 40 . -32.464 -13.262 28.950 1.00 49.79 40 A 1 ATOM 335 C CG . GLN A 0 40 . -29.930 -15.176 31.422 1.00 49.79 40 A 1 ATOM 336 C CD . GLN A 0 40 . -30.342 -15.737 32.776 1.00 49.79 40 A 1 ATOM 337 N NE2 . GLN A 0 40 . -30.588 -17.026 32.879 1.00 49.79 40 A 1 ATOM 338 O OE1 . GLN A 0 40 . -30.445 -15.039 33.767 1.00 49.79 40 A 1 ATOM 339 N N . CYS A 0 41 . -31.316 -11.392 28.554 1.00 50.40 41 A 1 ATOM 340 C CA . CYS A 0 41 . -32.538 -10.667 28.138 1.00 50.40 41 A 1 ATOM 341 C C . CYS A 0 41 . -32.752 -10.431 26.631 1.00 50.40 41 A 1 ATOM 342 C CB . CYS A 0 41 . -32.702 -9.394 28.981 1.00 50.40 41 A 1 ATOM 343 O O . CYS A 0 41 . -33.841 -10.028 26.243 1.00 50.40 41 A 1 ATOM 344 S SG . CYS A 0 41 . -34.384 -9.380 29.673 1.00 50.40 41 A 1 ATOM 345 N N . ASN A 0 42 . -31.792 -10.726 25.748 1.00 46.91 42 A 1 ATOM 346 C CA . ASN A 0 42 . -31.917 -10.383 24.318 1.00 46.91 42 A 1 ATOM 347 C C . ASN A 0 42 . -31.953 -11.608 23.387 1.00 46.91 42 A 1 ATOM 348 C CB . ASN A 0 42 . -30.879 -9.307 23.951 1.00 46.91 42 A 1 ATOM 349 O O . ASN A 0 42 . -31.306 -11.629 22.344 1.00 46.91 42 A 1 ATOM 350 C CG . ASN A 0 42 . -31.221 -7.939 24.521 1.00 46.91 42 A 1 ATOM 351 N ND2 . ASN A 0 42 . -30.244 -7.079 24.680 1.00 46.91 42 A 1 ATOM 352 O OD1 . ASN A 0 42 . -32.353 -7.599 24.805 1.00 46.91 42 A 1 ATOM 353 N N . HIS A 0 43 . -32.743 -12.628 23.740 1.00 50.85 43 A 1 ATOM 354 C CA . HIS A 0 43 . -32.953 -13.819 22.901 1.00 50.85 43 A 1 ATOM 355 C C . HIS A 0 43 . -34.031 -13.671 21.807 1.00 50.85 43 A 1 ATOM 356 C CB . HIS A 0 43 . -33.140 -15.073 23.777 1.00 50.85 43 A 1 ATOM 357 O O . HIS A 0 43 . -34.304 -14.628 21.087 1.00 50.85 43 A 1 ATOM 358 C CG . HIS A 0 43 . -31.878 -15.896 23.854 1.00 50.85 43 A 1 ATOM 359 C CD2 . HIS A 0 43 . -31.193 -16.255 24.983 1.00 50.85 43 A 1 ATOM 360 N ND1 . HIS A 0 43 . -31.186 -16.411 22.779 1.00 50.85 43 A 1 ATOM 361 C CE1 . HIS A 0 43 . -30.105 -17.055 23.249 1.00 50.85 43 A 1 ATOM 362 N NE2 . HIS A 0 43 . -30.073 -16.991 24.586 1.00 50.85 43 A 1 ATOM 363 N N . TYR A 0 44 . -34.600 -12.479 21.599 1.00 47.87 44 A 1 ATOM 364 C CA . TYR A 0 44 . -35.653 -12.258 20.598 1.00 47.87 44 A 1 ATOM 365 C C . TYR A 0 44 . -35.285 -11.195 19.559 1.00 47.87 44 A 1 ATOM 366 C CB . TYR A 0 44 . -36.995 -11.982 21.288 1.00 47.87 44 A 1 ATOM 367 O O . TYR A 0 44 . -35.905 -10.138 19.488 1.00 47.87 44 A 1 ATOM 368 C CG . TYR A 0 44 . -37.590 -13.201 21.959 1.00 47.87 44 A 1 ATOM 369 C CD1 . TYR A 0 44 . -38.313 -14.139 21.194 1.00 47.87 44 A 1 ATOM 370 C CD2 . TYR A 0 44 . -37.430 -13.394 23.344 1.00 47.87 44 A 1 ATOM 371 C CE1 . TYR A 0 44 . -38.885 -15.263 21.817 1.00 47.87 44 A 1 ATOM 372 C CE2 . TYR A 0 44 . -38.000 -14.519 23.969 1.00 47.87 44 A 1 ATOM 373 O OH . TYR A 0 44 . -39.303 -16.531 23.801 1.00 47.87 44 A 1 ATOM 374 C CZ . TYR A 0 44 . -38.734 -15.452 23.205 1.00 47.87 44 A 1 ATOM 375 N N . ARG A 0 45 . -34.312 -11.491 18.688 1.00 43.18 45 A 1 ATOM 376 C CA . ARG A 0 45 . -34.365 -10.990 17.300 1.00 43.18 45 A 1 ATOM 377 C C . ARG A 0 45 . -33.550 -11.853 16.336 1.00 43.18 45 A 1 ATOM 378 C CB . ARG A 0 45 . -34.066 -9.472 17.207 1.00 43.18 45 A 1 ATOM 379 O O . ARG A 0 45 . -32.513 -11.469 15.809 1.00 43.18 45 A 1 ATOM 380 C CG . ARG A 0 45 . -35.131 -8.794 16.322 1.00 43.18 45 A 1 ATOM 381 C CD . ARG A 0 45 . -34.983 -7.269 16.329 1.00 43.18 45 A 1 ATOM 382 N NE . ARG A 0 45 . -36.000 -6.617 15.478 1.00 43.18 45 A 1 ATOM 383 N NH1 . ARG A 0 45 . -35.500 -4.448 16.038 1.00 43.18 45 A 1 ATOM 384 N NH2 . ARG A 0 45 . -37.127 -4.856 14.567 1.00 43.18 45 A 1 ATOM 385 C CZ . ARG A 0 45 . -36.204 -5.316 15.365 1.00 43.18 45 A 1 ATOM 386 N N . HIS A 0 46 . -34.073 -13.046 16.074 1.00 42.07 46 A 1 ATOM 387 C CA . HIS A 0 46 . -33.827 -13.743 14.817 1.00 42.07 46 A 1 ATOM 388 C C . HIS A 0 46 . -34.414 -12.917 13.665 1.00 42.07 46 A 1 ATOM 389 C CB . HIS A 0 46 . -34.529 -15.113 14.860 1.00 42.07 46 A 1 ATOM 390 O O . HIS A 0 46 . -35.603 -12.655 13.693 1.00 42.07 46 A 1 ATOM 391 C CG . HIS A 0 46 . -33.681 -16.215 15.431 1.00 42.07 46 A 1 ATOM 392 C CD2 . HIS A 0 46 . -33.637 -16.647 16.730 1.00 42.07 46 A 1 ATOM 393 N ND1 . HIS A 0 46 . -32.816 -17.006 14.708 1.00 42.07 46 A 1 ATOM 394 C CE1 . HIS A 0 46 . -32.260 -17.892 15.550 1.00 42.07 46 A 1 ATOM 395 N NE2 . HIS A 0 46 . -32.727 -17.706 16.788 1.00 42.07 46 A 1 ATOM 396 N N . HIS A 0 47 . -33.594 -12.527 12.683 1.00 50.45 47 A 1 ATOM 397 C CA . HIS A 0 47 . -33.849 -12.576 11.228 1.00 50.45 47 A 1 ATOM 398 C C . HIS A 0 47 . -32.549 -12.148 10.519 1.00 50.45 47 A 1 ATOM 399 C CB . HIS A 0 47 . -35.054 -11.725 10.770 1.00 50.45 47 A 1 ATOM 400 O O . HIS A 0 47 . -32.186 -10.982 10.475 1.00 50.45 47 A 1 ATOM 401 C CG . HIS A 0 47 . -36.400 -12.391 10.991 1.00 50.45 47 A 1 ATOM 402 C CD2 . HIS A 0 47 . -37.452 -11.883 11.708 1.00 50.45 47 A 1 ATOM 403 N ND1 . HIS A 0 47 . -36.764 -13.668 10.613 1.00 50.45 47 A 1 ATOM 404 C CE1 . HIS A 0 47 . -37.988 -13.923 11.112 1.00 50.45 47 A 1 ATOM 405 N NE2 . HIS A 0 47 . -38.447 -12.862 11.781 1.00 50.45 47 A 1 ATOM 406 N N . LYS A 0 48 . -31.708 -13.122 10.148 1.00 47.44 48 A 1 ATOM 407 C CA . LYS A 0 48 . -31.481 -13.510 8.744 1.00 47.44 48 A 1 ATOM 408 C C . LYS A 0 48 . -31.165 -12.325 7.814 1.00 47.44 48 A 1 ATOM 409 C CB . LYS A 0 48 . -32.657 -14.344 8.178 1.00 47.44 48 A 1 ATOM 410 O O . LYS A 0 48 . -32.021 -11.900 7.061 1.00 47.44 48 A 1 ATOM 411 C CG . LYS A 0 48 . -32.690 -15.818 8.609 1.00 47.44 48 A 1 ATOM 412 C CD . LYS A 0 48 . -33.849 -16.539 7.892 1.00 47.44 48 A 1 ATOM 413 C CE . LYS A 0 48 . -33.884 -18.041 8.210 1.00 47.44 48 A 1 ATOM 414 N NZ . LYS A 0 48 . -35.033 -18.722 7.552 1.00 47.44 48 A 1 ATOM 415 N N . HIS A 0 49 . -29.895 -11.938 7.741 1.00 49.03 49 A 1 ATOM 416 C CA . HIS A 0 49 . -29.204 -11.873 6.453 1.00 49.03 49 A 1 ATOM 417 C C . HIS A 0 49 . -27.767 -12.331 6.656 1.00 49.03 49 A 1 ATOM 418 C CB . HIS A 0 49 . -29.327 -10.515 5.743 1.00 49.03 49 A 1 ATOM 419 O O . HIS A 0 49 . -26.893 -11.612 7.126 1.00 49.03 49 A 1 ATOM 420 C CG . HIS A 0 49 . -30.437 -10.538 4.717 1.00 49.03 49 A 1 ATOM 421 C CD2 . HIS A 0 49 . -31.685 -9.993 4.856 1.00 49.03 49 A 1 ATOM 422 N ND1 . HIS A 0 49 . -30.420 -11.197 3.502 1.00 49.03 49 A 1 ATOM 423 C CE1 . HIS A 0 49 . -31.629 -11.050 2.932 1.00 49.03 49 A 1 ATOM 424 N NE2 . HIS A 0 49 . -32.431 -10.330 3.724 1.00 49.03 49 A 1 ATOM 425 N N . ARG A 0 50 . -27.557 -13.592 6.287 1.00 45.87 50 A 1 ATOM 426 C CA . ARG A 0 50 . -26.290 -14.320 6.201 1.00 45.87 50 A 1 ATOM 427 C C . ARG A 0 50 . -25.396 -13.779 5.074 1.00 45.87 50 A 1 ATOM 428 C CB . ARG A 0 50 . -26.637 -15.818 6.039 1.00 45.87 50 A 1 ATOM 429 O O . ARG A 0 50 . -24.706 -14.533 4.404 1.00 45.87 50 A 1 ATOM 430 C CG . ARG A 0 50 . -26.064 -16.700 7.151 1.00 45.87 50 A 1 ATOM 431 C CD . ARG A 0 50 . -26.461 -18.148 6.844 1.00 45.87 50 A 1 ATOM 432 N NE . ARG A 0 50 . -26.100 -19.073 7.931 1.00 45.87 50 A 1 ATOM 433 N NH1 . ARG A 0 50 . -26.600 -21.021 6.813 1.00 45.87 50 A 1 ATOM 434 N NH2 . ARG A 0 50 . -25.855 -21.115 8.910 1.00 45.87 50 A 1 ATOM 435 C CZ . ARG A 0 50 . -26.188 -20.392 7.880 1.00 45.87 50 A 1 ATOM 436 N N . GLY A 0 51 . -25.405 -12.468 4.860 1.00 48.86 51 A 1 ATOM 437 C CA . GLY A 0 51 . -24.423 -11.781 4.049 1.00 48.86 51 A 1 ATOM 438 C C . GLY A 0 51 . -23.199 -11.502 4.903 1.00 48.86 51 A 1 ATOM 439 O O . GLY A 0 51 . -22.865 -10.342 5.110 1.00 48.86 51 A 1 ATOM 440 N N . HIS A 0 52 . -22.487 -12.547 5.336 1.00 51.24 52 A 1 ATOM 441 C CA . HIS A 0 52 . -21.034 -12.430 5.461 1.00 51.24 52 A 1 ATOM 442 C C . HIS A 0 52 . -20.474 -12.276 4.037 1.00 51.24 52 A 1 ATOM 443 C CB . HIS A 0 52 . -20.410 -13.616 6.226 1.00 51.24 52 A 1 ATOM 444 O O . HIS A 0 52 . -19.663 -13.066 3.567 1.00 51.24 52 A 1 ATOM 445 C CG . HIS A 0 52 . -20.401 -13.479 7.728 1.00 51.24 52 A 1 ATOM 446 C CD2 . HIS A 0 52 . -21.150 -14.200 8.616 1.00 51.24 52 A 1 ATOM 447 N ND1 . HIS A 0 52 . -19.537 -12.703 8.471 1.00 51.24 52 A 1 ATOM 448 C CE1 . HIS A 0 52 . -19.772 -12.943 9.773 1.00 51.24 52 A 1 ATOM 449 N NE2 . HIS A 0 52 . -20.756 -13.846 9.907 1.00 51.24 52 A 1 ATOM 450 N N . PHE A 0 53 . -20.881 -11.211 3.338 1.00 50.34 53 A 1 ATOM 451 C CA . PHE A 0 53 . -19.900 -10.460 2.599 1.00 50.34 53 A 1 ATOM 452 C C . PHE A 0 53 . -18.911 -10.102 3.686 1.00 50.34 53 A 1 ATOM 453 C CB . PHE A 0 53 . -20.526 -9.221 1.946 1.00 50.34 53 A 1 ATOM 454 O O . PHE A 0 53 . -19.179 -9.248 4.532 1.00 50.34 53 A 1 ATOM 455 C CG . PHE A 0 53 . -21.399 -9.563 0.758 1.00 50.34 53 A 1 ATOM 456 C CD1 . PHE A 0 53 . -20.809 -9.783 -0.501 1.00 50.34 53 A 1 ATOM 457 C CD2 . PHE A 0 53 . -22.791 -9.699 0.914 1.00 50.34 53 A 1 ATOM 458 C CE1 . PHE A 0 53 . -21.608 -10.138 -1.601 1.00 50.34 53 A 1 ATOM 459 C CE2 . PHE A 0 53 . -23.590 -10.057 -0.187 1.00 50.34 53 A 1 ATOM 460 C CZ . PHE A 0 53 . -22.998 -10.278 -1.444 1.00 50.34 53 A 1 ATOM 461 N N . VAL A 0 54 . -17.818 -10.864 3.745 1.00 54.31 54 A 1 ATOM 462 C CA . VAL A 0 54 . -16.549 -10.337 4.208 1.00 54.31 54 A 1 ATOM 463 C C . VAL A 0 54 . -16.534 -8.960 3.577 1.00 54.31 54 A 1 ATOM 464 C CB . VAL A 0 54 . -15.391 -11.213 3.685 1.00 54.31 54 A 1 ATOM 465 O O . VAL A 0 54 . -16.437 -8.859 2.354 1.00 54.31 54 A 1 ATOM 466 C CG1 . VAL A 0 54 . -14.029 -10.658 4.113 1.00 54.31 54 A 1 ATOM 467 C CG2 . VAL A 0 54 . -15.516 -12.649 4.211 1.00 54.31 54 A 1 ATOM 468 N N . ARG A 0 55 . -16.848 -7.922 4.365 1.00 58.85 55 A 1 ATOM 469 C CA . ARG A 0 55 . -16.682 -6.541 3.946 1.00 58.85 55 A 1 ATOM 470 C C . ARG A 0 55 . -15.191 -6.504 3.757 1.00 58.85 55 A 1 ATOM 471 C CB . ARG A 0 55 . -17.177 -5.543 5.016 1.00 58.85 55 A 1 ATOM 472 O O . ARG A 0 55 . -14.467 -6.295 4.729 1.00 58.85 55 A 1 ATOM 473 C CG . ARG A 0 55 . -18.531 -4.913 4.667 1.00 58.85 55 A 1 ATOM 474 C CD . ARG A 0 55 . -18.992 -3.988 5.803 1.00 58.85 55 A 1 ATOM 475 N NE . ARG A 0 55 . -20.271 -3.322 5.489 1.00 58.85 55 A 1 ATOM 476 N NH1 . ARG A 0 55 . -20.738 -2.539 7.601 1.00 58.85 55 A 1 ATOM 477 N NH2 . ARG A 0 55 . -22.146 -2.103 5.929 1.00 58.85 55 A 1 ATOM 478 C CZ . ARG A 0 55 . -21.042 -2.662 6.338 1.00 58.85 55 A 1 ATOM 479 N N . LEU A 0 56 . -14.747 -6.876 2.552 1.00 61.17 56 A 1 ATOM 480 C CA . LEU A 0 56 . -13.386 -6.700 2.134 1.00 61.17 56 A 1 ATOM 481 C C . LEU A 0 56 . -13.194 -5.236 2.452 1.00 61.17 56 A 1 ATOM 482 C CB . LEU A 0 56 . -13.169 -6.980 0.639 1.00 61.17 56 A 1 ATOM 483 O O . LEU A 0 56 . -13.986 -4.414 1.968 1.00 61.17 56 A 1 ATOM 484 C CG . LEU A 0 56 . -12.062 -8.028 0.431 1.00 61.17 56 A 1 ATOM 485 C CD1 . LEU A 0 56 . -12.668 -9.430 0.392 1.00 61.17 56 A 1 ATOM 486 C CD2 . LEU A 0 56 . -11.299 -7.764 -0.862 1.00 61.17 56 A 1 ATOM 487 N N . PRO A 0 57 . -12.310 -4.932 3.402 1.00 74.28 57 A 1 ATOM 488 C CA . PRO A 0 57 . -12.213 -3.582 3.860 1.00 74.28 57 A 1 ATOM 489 C C . PRO A 0 57 . -12.000 -2.733 2.624 1.00 74.28 57 A 1 ATOM 490 C CB . PRO A 0 57 . -11.023 -3.567 4.779 1.00 74.28 57 A 1 ATOM 491 O O . PRO A 0 57 . -11.123 -3.037 1.818 1.00 74.28 57 A 1 ATOM 492 C CG . PRO A 0 57 . -10.659 -5.012 5.098 1.00 74.28 57 A 1 ATOM 493 C CD . PRO A 0 57 . -11.398 -5.837 4.071 1.00 74.28 57 A 1 ATOM 494 N N . TYR A 0 58 . -12.843 -1.727 2.432 1.00 77.27 58 A 1 ATOM 495 C CA . TYR A 0 58 . -12.761 -0.868 1.259 1.00 77.27 58 A 1 ATOM 496 C C . TYR A 0 58 . -11.330 -0.324 1.072 1.00 77.27 58 A 1 ATOM 497 C CB . TYR A 0 58 . -13.798 0.238 1.450 1.00 77.27 58 A 1 ATOM 498 O O . TYR A 0 58 . -10.882 -0.124 -0.050 1.00 77.27 58 A 1 ATOM 499 C CG . TYR A 0 58 . -13.796 1.269 0.353 1.00 77.27 58 A 1 ATOM 500 C CD1 . TYR A 0 58 . -13.103 2.480 0.542 1.00 77.27 58 A 1 ATOM 501 C CD2 . TYR A 0 58 . -14.471 1.013 -0.855 1.00 77.27 58 A 1 ATOM 502 C CE1 . TYR A 0 58 . -13.091 3.447 -0.478 1.00 77.27 58 A 1 ATOM 503 C CE2 . TYR A 0 58 . -14.463 1.982 -1.875 1.00 77.27 58 A 1 ATOM 504 O OH . TYR A 0 58 . -13.783 4.130 -2.673 1.00 77.27 58 A 1 ATOM 505 C CZ . TYR A 0 58 . -13.776 3.199 -1.687 1.00 77.27 58 A 1 ATOM 506 N N . TYR A 0 59 . -10.566 -0.216 2.169 1.00 79.65 59 A 1 ATOM 507 C CA . TYR A 0 59 . -9.140 0.091 2.146 1.00 79.65 59 A 1 ATOM 508 C C . TYR A 0 59 . -8.284 -0.903 1.341 1.00 79.65 59 A 1 ATOM 509 C CB . TYR A 0 59 . -8.604 0.268 3.580 1.00 79.65 59 A 1 ATOM 510 O O . TYR A 0 59 . -7.370 -0.454 0.669 1.00 79.65 59 A 1 ATOM 511 C CG . TYR A 0 59 . -8.431 -0.979 4.442 1.00 79.65 59 A 1 ATOM 512 C CD1 . TYR A 0 59 . -9.229 -1.169 5.587 1.00 79.65 59 A 1 ATOM 513 C CD2 . TYR A 0 59 . -7.381 -1.885 4.181 1.00 79.65 59 A 1 ATOM 514 C CE1 . TYR A 0 59 . -9.016 -2.286 6.425 1.00 79.65 59 A 1 ATOM 515 C CE2 . TYR A 0 59 . -7.211 -3.034 4.977 1.00 79.65 59 A 1 ATOM 516 O OH . TYR A 0 59 . -7.929 -4.398 6.810 1.00 79.65 59 A 1 ATOM 517 C CZ . TYR A 0 59 . -8.050 -3.257 6.081 1.00 79.65 59 A 1 ATOM 518 N N . ILE A 0 60 . -8.543 -2.218 1.357 1.00 84.57 60 A 1 ATOM 519 C CA . ILE A 0 60 . -7.762 -3.194 0.570 1.00 84.57 60 A 1 ATOM 520 C C . ILE A 0 60 . -7.991 -2.947 -0.917 1.00 84.57 60 A 1 ATOM 521 C CB . ILE A 0 60 . -8.104 -4.665 0.921 1.00 84.57 60 A 1 ATOM 522 O O . ILE A 0 60 . -7.035 -2.908 -1.686 1.00 84.57 60 A 1 ATOM 523 C CG1 . ILE A 0 60 . -7.794 -4.947 2.403 1.00 84.57 60 A 1 ATOM 524 C CG2 . ILE A 0 60 . -7.327 -5.640 0.010 1.00 84.57 60 A 1 ATOM 525 C CD1 . ILE A 0 60 . -7.937 -6.411 2.841 1.00 84.57 60 A 1 ATOM 526 N N . LEU A 0 61 . -9.252 -2.744 -1.308 1.00 86.30 61 A 1 ATOM 527 C CA . LEU A 0 61 . -9.604 -2.425 -2.688 1.00 86.30 61 A 1 ATOM 528 C C . LEU A 0 61 . -8.957 -1.103 -3.120 1.00 86.30 61 A 1 ATOM 529 C CB . LEU A 0 61 . -11.137 -2.371 -2.807 1.00 86.30 61 A 1 ATOM 530 O O . LEU A 0 61 . -8.394 -1.024 -4.206 1.00 86.30 61 A 1 ATOM 531 C CG . LEU A 0 61 . -11.628 -2.215 -4.259 1.00 86.30 61 A 1 ATOM 532 C CD1 . LEU A 0 61 . -11.442 -3.508 -5.056 1.00 86.30 61 A 1 ATOM 533 C CD2 . LEU A 0 61 . -13.113 -1.855 -4.257 1.00 86.30 61 A 1 ATOM 534 N N . LEU A 0 62 . -8.987 -0.093 -2.248 1.00 89.54 62 A 1 ATOM 535 C CA . LEU A 0 62 . -8.377 1.210 -2.497 1.00 89.54 62 A 1 ATOM 536 C C . LEU A 0 62 . -6.850 1.117 -2.631 1.00 89.54 62 A 1 ATOM 537 C CB . LEU A 0 62 . -8.786 2.159 -1.358 1.00 89.54 62 A 1 ATOM 538 O O . LEU A 0 62 . -6.286 1.712 -3.543 1.00 89.54 62 A 1 ATOM 539 C CG . LEU A 0 62 . -8.419 3.630 -1.617 1.00 89.54 62 A 1 ATOM 540 C CD1 . LEU A 0 62 . -9.305 4.243 -2.704 1.00 89.54 62 A 1 ATOM 541 C CD2 . LEU A 0 62 . -8.608 4.432 -0.330 1.00 89.54 62 A 1 ATOM 542 N N . VAL A 0 63 . -6.182 0.350 -1.766 1.00 90.86 63 A 1 ATOM 543 C CA . VAL A 0 63 . -4.730 0.116 -1.838 1.00 90.86 63 A 1 ATOM 544 C C . VAL A 0 63 . -4.371 -0.642 -3.115 1.00 90.86 63 A 1 ATOM 545 C CB . VAL A 0 63 . -4.229 -0.630 -0.584 1.00 90.86 63 A 1 ATOM 546 O O . VAL A 0 63 . -3.430 -0.256 -3.802 1.00 90.86 63 A 1 ATOM 547 C CG1 . VAL A 0 63 . -2.784 -1.129 -0.721 1.00 90.86 63 A 1 ATOM 548 C CG2 . VAL A 0 63 . -4.262 0.288 0.647 1.00 90.86 63 A 1 ATOM 549 N N . ALA A 0 64 . -5.132 -1.678 -3.475 1.00 91.85 64 A 1 ATOM 550 C CA . ALA A 0 64 . -4.925 -2.417 -4.718 1.00 91.85 64 A 1 ATOM 551 C C . ALA A 0 64 . -5.114 -1.524 -5.956 1.00 91.85 64 A 1 ATOM 552 C CB . ALA A 0 64 . -5.874 -3.620 -4.735 1.00 91.85 64 A 1 ATOM 553 O O . ALA A 0 64 . -4.314 -1.599 -6.887 1.00 91.85 64 A 1 ATOM 554 N N . LEU A 0 65 . -6.123 -0.646 -5.942 1.00 93.56 65 A 1 ATOM 555 C CA . LEU A 0 65 . -6.359 0.344 -6.995 1.00 93.56 65 A 1 ATOM 556 C C . LEU A 0 65 . -5.219 1.368 -7.080 1.00 93.56 65 A 1 ATOM 557 C CB . LEU A 0 65 . -7.704 1.040 -6.719 1.00 93.56 65 A 1 ATOM 558 O O . LEU A 0 65 . -4.774 1.723 -8.167 1.00 93.56 65 A 1 ATOM 559 C CG . LEU A 0 65 . -8.117 2.044 -7.812 1.00 93.56 65 A 1 ATOM 560 C CD1 . LEU A 0 65 . -8.631 1.324 -9.059 1.00 93.56 65 A 1 ATOM 561 C CD2 . LEU A 0 65 . -9.222 2.961 -7.288 1.00 93.56 65 A 1 ATOM 562 N N . PHE A 0 66 . -4.726 1.849 -5.940 1.00 92.90 66 A 1 ATOM 563 C CA . PHE A 0 66 . -3.618 2.798 -5.919 1.00 92.90 66 A 1 ATOM 564 C C . PHE A 0 66 . -2.335 2.165 -6.468 1.00 92.90 66 A 1 ATOM 565 C CB . PHE A 0 66 . -3.422 3.322 -4.495 1.00 92.90 66 A 1 ATOM 566 O O . PHE A 0 66 . -1.640 2.775 -7.277 1.00 92.90 66 A 1 ATOM 567 C CG . PHE A 0 66 . -2.463 4.490 -4.441 1.00 92.90 66 A 1 ATOM 568 C CD1 . PHE A 0 66 . -1.102 4.287 -4.147 1.00 92.90 66 A 1 ATOM 569 C CD2 . PHE A 0 66 . -2.931 5.785 -4.733 1.00 92.90 66 A 1 ATOM 570 C CE1 . PHE A 0 66 . -0.214 5.378 -4.137 1.00 92.90 66 A 1 ATOM 571 C CE2 . PHE A 0 66 . -2.044 6.875 -4.722 1.00 92.90 66 A 1 ATOM 572 C CZ . PHE A 0 66 . -0.686 6.671 -4.423 1.00 92.90 66 A 1 ATOM 573 N N . LEU A 0 67 . -2.049 0.919 -6.083 1.00 93.96 67 A 1 ATOM 574 C CA . LEU A 0 67 . -0.908 0.167 -6.598 1.00 93.96 67 A 1 ATOM 575 C C . LEU A 0 67 . -1.030 -0.093 -8.101 1.00 93.96 67 A 1 ATOM 576 C CB . LEU A 0 67 . -0.768 -1.155 -5.826 1.00 93.96 67 A 1 ATOM 577 O O . LEU A 0 67 . -0.047 0.086 -8.814 1.00 93.96 67 A 1 ATOM 578 C CG . LEU A 0 67 . -0.233 -0.987 -4.393 1.00 93.96 67 A 1 ATOM 579 C CD1 . LEU A 0 67 . -0.382 -2.308 -3.638 1.00 93.96 67 A 1 ATOM 580 C CD2 . LEU A 0 67 . 1.246 -0.592 -4.377 1.00 93.96 67 A 1 ATOM 581 N N . SER A 0 68 . -2.209 -0.473 -8.601 1.00 93.41 68 A 1 ATOM 582 C CA . SER A 0 68 . -2.392 -0.705 -10.038 1.00 93.41 68 A 1 ATOM 583 C C . SER A 0 68 . -2.190 0.572 -10.854 1.00 93.41 68 A 1 ATOM 584 C CB . SER A 0 68 . -3.751 -1.343 -10.337 1.00 93.41 68 A 1 ATOM 585 O O . SER A 0 68 . -1.494 0.532 -11.865 1.00 93.41 68 A 1 ATOM 586 O OG . SER A 0 68 . -4.826 -0.483 -10.031 1.00 93.41 68 A 1 ATOM 587 N N . LEU A 0 69 . -2.711 1.712 -10.388 1.00 91.57 69 A 1 ATOM 588 C CA . LEU A 0 69 . -2.480 3.016 -11.016 1.00 91.57 69 A 1 ATOM 589 C C . LEU A 0 69 . -1.011 3.442 -10.948 1.00 91.57 69 A 1 ATOM 590 C CB . LEU A 0 69 . -3.369 4.074 -10.343 1.00 91.57 69 A 1 ATOM 591 O O . LEU A 0 69 . -0.484 3.954 -11.932 1.00 91.57 69 A 1 ATOM 592 C CG . LEU A 0 69 . -4.859 3.964 -10.703 1.00 91.57 69 A 1 ATOM 593 C CD1 . LEU A 0 69 . -5.664 4.912 -9.813 1.00 91.57 69 A 1 ATOM 594 C CD2 . LEU A 0 69 . -5.126 4.340 -12.164 1.00 91.57 69 A 1 ATOM 595 N N . TYR A 0 70 . -0.337 3.203 -9.822 1.00 91.37 70 A 1 ATOM 596 C CA . TYR A 0 70 . 1.091 3.478 -9.676 1.00 91.37 70 A 1 ATOM 597 C C . TYR A 0 70 . 1.924 2.662 -10.674 1.00 91.37 70 A 1 ATOM 598 C CB . TYR A 0 70 . 1.515 3.207 -8.227 1.00 91.37 70 A 1 ATOM 599 O O . TYR A 0 70 . 2.720 3.233 -11.416 1.00 91.37 70 A 1 ATOM 600 C CG . TYR A 0 70 . 2.991 3.432 -7.979 1.00 91.37 70 A 1 ATOM 601 C CD1 . TYR A 0 70 . 3.883 2.341 -7.979 1.00 91.37 70 A 1 ATOM 602 C CD2 . TYR A 0 70 . 3.473 4.740 -7.782 1.00 91.37 70 A 1 ATOM 603 C CE1 . TYR A 0 70 . 5.258 2.560 -7.771 1.00 91.37 70 A 1 ATOM 604 C CE2 . TYR A 0 70 . 4.847 4.963 -7.578 1.00 91.37 70 A 1 ATOM 605 O OH . TYR A 0 70 . 7.069 4.077 -7.374 1.00 91.37 70 A 1 ATOM 606 C CZ . TYR A 0 70 . 5.742 3.870 -7.572 1.00 91.37 70 A 1 ATOM 607 N N . PHE A 0 71 . 1.702 1.346 -10.761 1.00 89.03 71 A 1 ATOM 608 C CA . PHE A 0 71 . 2.393 0.495 -11.736 1.00 89.03 71 A 1 ATOM 609 C C . PHE A 0 71 . 2.065 0.872 -13.182 1.00 89.03 71 A 1 ATOM 610 C CB . PHE A 0 71 . 2.062 -0.983 -11.485 1.00 89.03 71 A 1 ATOM 611 O O . PHE A 0 71 . 2.960 0.853 -14.027 1.00 89.03 71 A 1 ATOM 612 C CG . PHE A 0 71 . 2.914 -1.616 -10.404 1.00 89.03 71 A 1 ATOM 613 C CD1 . PHE A 0 71 . 4.284 -1.833 -10.644 1.00 89.03 71 A 1 ATOM 614 C CD2 . PHE A 0 71 . 2.356 -2.002 -9.172 1.00 89.03 71 A 1 ATOM 615 C CE1 . PHE A 0 71 . 5.092 -2.412 -9.651 1.00 89.03 71 A 1 ATOM 616 C CE2 . PHE A 0 71 . 3.165 -2.568 -8.173 1.00 89.03 71 A 1 ATOM 617 C CZ . PHE A 0 71 . 4.535 -2.773 -8.412 1.00 89.03 71 A 1 ATOM 618 N N . LEU A 0 72 . 0.817 1.248 -13.469 1.00 89.38 72 A 1 ATOM 619 C CA . LEU A 0 72 . 0.411 1.711 -14.793 1.00 89.38 72 A 1 ATOM 620 C C . LEU A 0 72 . 1.140 3.001 -15.180 1.00 89.38 72 A 1 ATOM 621 C CB . LEU A 0 72 . -1.115 1.897 -14.808 1.00 89.38 72 A 1 ATOM 622 O O . LEU A 0 72 . 1.706 3.068 -16.264 1.00 89.38 72 A 1 ATOM 623 C CG . LEU A 0 72 . -1.678 2.333 -16.172 1.00 89.38 72 A 1 ATOM 624 C CD1 . LEU A 0 72 . -1.494 1.250 -17.236 1.00 89.38 72 A 1 ATOM 625 C CD2 . LEU A 0 72 . -3.171 2.631 -16.029 1.00 89.38 72 A 1 ATOM 626 N N . ALA A 0 73 . 1.176 3.996 -14.291 1.00 85.49 73 A 1 ATOM 627 C CA . ALA A 0 73 . 1.871 5.256 -14.536 1.00 85.49 73 A 1 ATOM 628 C C . ALA A 0 73 . 3.376 5.041 -14.752 1.00 85.49 73 A 1 ATOM 629 C CB . ALA A 0 73 . 1.604 6.198 -13.357 1.00 85.49 73 A 1 ATOM 630 O O . ALA A 0 73 . 3.948 5.607 -15.677 1.00 85.49 73 A 1 ATOM 631 N N . ILE A 0 74 . 4.011 4.187 -13.943 1.00 83.99 74 A 1 ATOM 632 C CA . ILE A 0 74 . 5.425 3.831 -14.122 1.00 83.99 74 A 1 ATOM 633 C C . ILE A 0 74 . 5.654 3.122 -15.458 1.00 83.99 74 A 1 ATOM 634 C CB . ILE A 0 74 . 5.925 2.979 -12.934 1.00 83.99 74 A 1 ATOM 635 O O . ILE A 0 74 . 6.614 3.451 -16.146 1.00 83.99 74 A 1 ATOM 636 C CG1 . ILE A 0 74 . 5.949 3.777 -11.609 1.00 83.99 74 A 1 ATOM 637 C CG2 . ILE A 0 74 . 7.315 2.370 -13.205 1.00 83.99 74 A 1 ATOM 638 C CD1 . ILE A 0 74 . 6.940 4.947 -11.543 1.00 83.99 74 A 1 ATOM 639 N N . SER A 0 75 . 4.783 2.185 -15.839 1.00 80.98 75 A 1 ATOM 640 C CA . SER A 0 75 . 4.889 1.485 -17.127 1.00 80.98 75 A 1 ATOM 641 C C . SER A 0 75 . 4.754 2.461 -18.291 1.00 80.98 75 A 1 ATOM 642 C CB . SER A 0 75 . 3.836 0.382 -17.263 1.00 80.98 75 A 1 ATOM 643 O O . SER A 0 75 . 5.560 2.418 -19.206 1.00 80.98 75 A 1 ATOM 644 O OG . SER A 0 75 . 3.918 -0.521 -16.173 1.00 80.98 75 A 1 ATOM 645 N N . LEU A 0 76 . 3.810 3.401 -18.208 1.00 79.98 76 A 1 ATOM 646 C CA . LEU A 0 76 . 3.582 4.407 -19.243 1.00 79.98 76 A 1 ATOM 647 C C . LEU A 0 76 . 4.756 5.389 -19.357 1.00 79.98 76 A 1 ATOM 648 C CB . LEU A 0 76 . 2.239 5.093 -18.941 1.00 79.98 76 A 1 ATOM 649 O O . LEU A 0 76 . 5.206 5.670 -20.456 1.00 79.98 76 A 1 ATOM 650 C CG . LEU A 0 76 . 1.565 5.688 -20.194 1.00 79.98 76 A 1 ATOM 651 C CD1 . LEU A 0 76 . 0.091 5.270 -20.229 1.00 79.98 76 A 1 ATOM 652 C CD2 . LEU A 0 76 . 1.617 7.213 -20.192 1.00 79.98 76 A 1 ATOM 653 N N . ILE A 0 77 . 5.329 5.832 -18.232 1.00 79.11 77 A 1 ATOM 654 C CA . ILE A 0 77 . 6.546 6.663 -18.226 1.00 79.11 77 A 1 ATOM 655 C C . ILE A 0 77 . 7.749 5.888 -18.779 1.00 79.11 77 A 1 ATOM 656 C CB . ILE A 0 77 . 6.837 7.179 -16.797 1.00 79.11 77 A 1 ATOM 657 O O . ILE A 0 77 . 8.585 6.456 -19.479 1.00 79.11 77 A 1 ATOM 658 C CG1 . ILE A 0 77 . 5.765 8.202 -16.359 1.00 79.11 77 A 1 ATOM 659 C CG2 . ILE A 0 77 . 8.236 7.826 -16.691 1.00 79.11 77 A 1 ATOM 660 C CD1 . ILE A 0 77 . 5.754 8.467 -14.846 1.00 79.11 77 A 1 ATOM 661 N N . MET A 0 78 . 7.882 4.603 -18.443 1.00 74.54 78 A 1 ATOM 662 C CA . MET A 0 78 . 8.951 3.760 -18.980 1.00 74.54 78 A 1 ATOM 663 C C . MET A 0 78 . 8.775 3.550 -20.485 1.00 74.54 78 A 1 ATOM 664 C CB . MET A 0 78 . 9.011 2.414 -18.247 1.00 74.54 78 A 1 ATOM 665 O O . MET A 0 78 . 9.766 3.653 -21.199 1.00 74.54 78 A 1 ATOM 666 C CG . MET A 0 78 . 9.495 2.510 -16.791 1.00 74.54 78 A 1 ATOM 667 S SD . MET A 0 78 . 11.274 2.259 -16.496 1.00 74.54 78 A 1 ATOM 668 C CE . MET A 0 78 . 11.924 3.930 -16.742 1.00 74.54 78 A 1 ATOM 669 N N . ASP A 0 79 . 7.548 3.329 -20.961 1.00 70.15 79 A 1 ATOM 670 C CA . ASP A 0 79 . 7.223 3.198 -22.383 1.00 70.15 79 A 1 ATOM 671 C C . ASP A 0 79 . 7.435 4.516 -23.136 1.00 70.15 79 A 1 ATOM 672 C CB . ASP A 0 79 . 5.778 2.698 -22.571 1.00 70.15 79 A 1 ATOM 673 O O . ASP A 0 79 . 8.018 4.489 -24.214 1.00 70.15 79 A 1 ATOM 674 C CG . ASP A 0 79 . 5.593 1.189 -22.350 1.00 70.15 79 A 1 ATOM 675 O OD1 . ASP A 0 79 . 6.592 0.437 -22.453 1.00 70.15 79 A 1 ATOM 676 O OD2 . ASP A 0 79 . 4.429 0.776 -22.137 1.00 70.15 79 A 1 ATOM 677 N N . ASP A 0 80 . 7.061 5.666 -22.568 1.00 65.24 80 A 1 ATOM 678 C CA . ASP A 0 80 . 7.318 6.990 -23.152 1.00 65.24 80 A 1 ATOM 679 C C . ASP A 0 80 . 8.821 7.293 -23.212 1.00 65.24 80 A 1 ATOM 680 C CB . ASP A 0 80 . 6.617 8.093 -22.338 1.00 65.24 80 A 1 ATOM 681 O O . ASP A 0 80 . 9.319 7.784 -24.225 1.00 65.24 80 A 1 ATOM 682 C CG . ASP A 0 80 . 5.097 8.177 -22.532 1.00 65.24 80 A 1 ATOM 683 O OD1 . ASP A 0 80 . 4.600 7.741 -23.596 1.00 65.24 80 A 1 ATOM 684 O OD2 . ASP A 0 80 . 4.448 8.766 -21.635 1.00 65.24 80 A 1 ATOM 685 N N . ASN A 0 81 . 9.577 6.951 -22.164 1.00 61.54 81 A 1 ATOM 686 C CA . ASN A 0 81 . 11.037 7.056 -22.177 1.00 61.54 81 A 1 ATOM 687 C C . ASN A 0 81 . 11.659 6.093 -23.195 1.00 61.54 81 A 1 ATOM 688 C CB . ASN A 0 81 . 11.595 6.783 -20.772 1.00 61.54 81 A 1 ATOM 689 O O . ASN A 0 81 . 12.631 6.457 -23.856 1.00 61.54 81 A 1 ATOM 690 C CG . ASN A 0 81 . 11.418 7.944 -19.813 1.00 61.54 81 A 1 ATOM 691 N ND2 . ASN A 0 81 . 11.437 7.676 -18.529 1.00 61.54 81 A 1 ATOM 692 O OD1 . ASN A 0 81 . 11.322 9.104 -20.166 1.00 61.54 81 A 1 ATOM 693 N N . LEU A 0 82 . 11.106 4.887 -23.354 1.00 56.84 82 A 1 ATOM 694 C CA . LEU A 0 82 . 11.542 3.936 -24.374 1.00 56.84 82 A 1 ATOM 695 C C . LEU A 0 82 . 11.229 4.474 -25.776 1.00 56.84 82 A 1 ATOM 696 C CB . LEU A 0 82 . 10.878 2.568 -24.134 1.00 56.84 82 A 1 ATOM 697 O O . LEU A 0 82 . 12.079 4.398 -26.657 1.00 56.84 82 A 1 ATOM 698 C CG . LEU A 0 82 . 11.707 1.400 -24.702 1.00 56.84 82 A 1 ATOM 699 C CD1 . LEU A 0 82 . 12.387 0.625 -23.568 1.00 56.84 82 A 1 ATOM 700 C CD2 . LEU A 0 82 . 10.831 0.423 -25.482 1.00 56.84 82 A 1 ATOM 701 N N . PHE A 0 83 . 10.055 5.078 -25.977 1.00 56.77 83 A 1 ATOM 702 C CA . PHE A 0 83 . 9.660 5.714 -27.232 1.00 56.77 83 A 1 ATOM 703 C C . PHE A 0 83 . 10.541 6.917 -27.557 1.00 56.77 83 A 1 ATOM 704 C CB . PHE A 0 83 . 8.178 6.129 -27.197 1.00 56.77 83 A 1 ATOM 705 O O . PHE A 0 83 . 10.997 7.037 -28.692 1.00 56.77 83 A 1 ATOM 706 C CG . PHE A 0 83 . 7.352 5.415 -28.242 1.00 56.77 83 A 1 ATOM 707 C CD1 . PHE A 0 83 . 7.312 5.906 -29.560 1.00 56.77 83 A 1 ATOM 708 C CD2 . PHE A 0 83 . 6.647 4.247 -27.906 1.00 56.77 83 A 1 ATOM 709 C CE1 . PHE A 0 83 . 6.564 5.232 -30.542 1.00 56.77 83 A 1 ATOM 710 C CE2 . PHE A 0 83 . 5.897 3.573 -28.886 1.00 56.77 83 A 1 ATOM 711 C CZ . PHE A 0 83 . 5.855 4.065 -30.204 1.00 56.77 83 A 1 ATOM 712 N N . SER A 0 84 . 10.828 7.768 -26.570 1.00 59.10 84 A 1 ATOM 713 C CA . SER A 0 84 . 11.751 8.896 -26.709 1.00 59.10 84 A 1 ATOM 714 C C . SER A 0 84 . 13.159 8.417 -27.055 1.00 59.10 84 A 1 ATOM 715 C CB . SER A 0 84 . 11.791 9.712 -25.414 1.00 59.10 84 A 1 ATOM 716 O O . SER A 0 84 . 13.793 8.995 -27.931 1.00 59.10 84 A 1 ATOM 717 O OG . SER A 0 84 . 12.587 10.871 -25.588 1.00 59.10 84 A 1 ATOM 718 N N . LEU A 0 85 . 13.639 7.350 -26.409 1.00 58.05 85 A 1 ATOM 719 C CA . LEU A 0 85 . 14.964 6.784 -26.663 1.00 58.05 85 A 1 ATOM 720 C C . LEU A 0 85 . 15.046 6.107 -28.040 1.00 58.05 85 A 1 ATOM 721 C CB . LEU A 0 85 . 15.312 5.845 -25.496 1.00 58.05 85 A 1 ATOM 722 O O . LEU A 0 85 . 16.059 6.231 -28.721 1.00 58.05 85 A 1 ATOM 723 C CG . LEU A 0 85 . 16.778 5.369 -25.500 1.00 58.05 85 A 1 ATOM 724 C CD1 . LEU A 0 85 . 17.371 5.470 -24.093 1.00 58.05 85 A 1 ATOM 725 C CD2 . LEU A 0 85 . 16.894 3.914 -25.959 1.00 58.05 85 A 1 ATOM 726 N N . ILE A 0 86 . 13.974 5.447 -28.489 1.00 61.55 86 A 1 ATOM 727 C CA . ILE A 0 86 . 13.874 4.889 -29.845 1.00 61.55 86 A 1 ATOM 728 C C . ILE A 0 86 . 13.805 6.006 -30.896 1.00 61.55 86 A 1 ATOM 729 C CB . ILE A 0 86 . 12.674 3.916 -29.944 1.00 61.55 86 A 1 ATOM 730 O O . ILE A 0 86 . 14.410 5.862 -31.956 1.00 61.55 86 A 1 ATOM 731 C CG1 . ILE A 0 86 . 12.962 2.626 -29.139 1.00 61.55 86 A 1 ATOM 732 C CG2 . ILE A 0 86 . 12.358 3.537 -31.407 1.00 61.55 86 A 1 ATOM 733 C CD1 . ILE A 0 86 . 11.712 1.777 -28.864 1.00 61.55 86 A 1 ATOM 734 N N . TYR A 0 87 . 13.097 7.110 -30.630 1.00 62.38 87 A 1 ATOM 735 C CA . TYR A 0 87 . 13.051 8.262 -31.538 1.00 62.38 87 A 1 ATOM 736 C C . TYR A 0 87 . 14.411 8.960 -31.652 1.00 62.38 87 A 1 ATOM 737 C CB . TYR A 0 87 . 11.951 9.254 -31.122 1.00 62.38 87 A 1 ATOM 738 O O . TYR A 0 87 . 14.814 9.286 -32.764 1.00 62.38 87 A 1 ATOM 739 C CG . TYR A 0 87 . 10.796 9.313 -32.103 1.00 62.38 87 A 1 ATOM 740 C CD1 . TYR A 0 87 . 10.882 10.162 -33.223 1.00 62.38 87 A 1 ATOM 741 C CD2 . TYR A 0 87 . 9.648 8.523 -31.903 1.00 62.38 87 A 1 ATOM 742 C CE1 . TYR A 0 87 . 9.813 10.240 -34.136 1.00 62.38 87 A 1 ATOM 743 C CE2 . TYR A 0 87 . 8.578 8.592 -32.818 1.00 62.38 87 A 1 ATOM 744 O OH . TYR A 0 87 . 7.625 9.529 -34.812 1.00 62.38 87 A 1 ATOM 745 C CZ . TYR A 0 87 . 8.657 9.455 -33.931 1.00 62.38 87 A 1 ATOM 746 N N . GLU A 0 88 . 15.132 9.127 -30.539 1.00 67.60 88 A 1 ATOM 747 C CA . GLU A 0 88 . 16.512 9.637 -30.521 1.00 67.60 88 A 1 ATOM 748 C C . GLU A 0 88 . 17.478 8.707 -31.265 1.00 67.60 88 A 1 ATOM 749 C CB . GLU A 0 88 . 16.976 9.821 -29.065 1.00 67.60 88 A 1 ATOM 750 O O . GLU A 0 88 . 18.267 9.177 -32.070 1.00 67.60 88 A 1 ATOM 751 C CG . GLU A 0 88 . 16.784 11.253 -28.528 1.00 67.60 88 A 1 ATOM 752 C CD . GLU A 0 88 . 18.049 12.131 -28.617 1.00 67.60 88 A 1 ATOM 753 O OE1 . GLU A 0 88 . 17.893 13.344 -28.886 1.00 67.60 88 A 1 ATOM 754 O OE2 . GLU A 0 88 . 19.151 11.612 -28.324 1.00 67.60 88 A 1 ATOM 755 N N . MET A 0 89 . 17.390 7.383 -31.078 1.00 65.99 89 A 1 ATOM 756 C CA . MET A 0 89 . 18.266 6.436 -31.790 1.00 65.99 89 A 1 ATOM 757 C C . MET A 0 89 . 17.994 6.333 -33.296 1.00 65.99 89 A 1 ATOM 758 C CB . MET A 0 89 . 18.160 5.028 -31.175 1.00 65.99 89 A 1 ATOM 759 O O . MET A 0 89 . 18.807 5.755 -34.019 1.00 65.99 89 A 1 ATOM 760 C CG . MET A 0 89 . 19.351 4.709 -30.270 1.00 65.99 89 A 1 ATOM 761 S SD . MET A 0 89 . 19.425 2.981 -29.709 1.00 65.99 89 A 1 ATOM 762 C CE . MET A 0 89 . 20.062 2.171 -31.202 1.00 65.99 89 A 1 ATOM 763 N N . LYS A 0 90 . 16.830 6.791 -33.765 1.00 59.38 90 A 1 ATOM 764 C CA . LYS A 0 90 . 16.440 6.708 -35.177 1.00 59.38 90 A 1 ATOM 765 C C . LYS A 0 90 . 16.766 7.984 -35.962 1.00 59.38 90 A 1 ATOM 766 C CB . LYS A 0 90 . 14.959 6.311 -35.256 1.00 59.38 90 A 1 ATOM 767 O O . LYS A 0 90 . 16.653 7.947 -37.189 1.00 59.38 90 A 1 ATOM 768 C CG . LYS A 0 90 . 14.616 5.589 -36.565 1.00 59.38 90 A 1 ATOM 769 C CD . LYS A 0 90 . 13.143 5.180 -36.557 1.00 59.38 90 A 1 ATOM 770 C CE . LYS A 0 90 . 12.830 4.369 -37.814 1.00 59.38 90 A 1 ATOM 771 N NZ . LYS A 0 90 . 11.393 4.017 -37.861 1.00 59.38 90 A 1 ATOM 772 N N . LEU A 0 91 . 17.122 9.076 -35.281 1.00 53.04 91 A 1 ATOM 773 C CA . LEU A 0 91 . 17.610 10.319 -35.887 1.00 53.04 91 A 1 ATOM 774 C C . LEU A 0 91 . 19.140 10.286 -36.011 1.00 53.04 91 A 1 ATOM 775 C CB . LEU A 0 91 . 17.114 11.516 -35.047 1.00 53.04 91 A 1 ATOM 776 O O . LEU A 0 91 . 19.638 10.777 -37.048 1.00 53.04 91 A 1 ATOM 777 C CG . LEU A 0 91 . 17.013 12.799 -35.888 1.00 53.04 91 A 1 ATOM 778 C CD1 . LEU A 0 91 . 15.566 13.011 -36.344 1.00 53.04 91 A 1 ATOM 779 C CD2 . LEU A 0 91 . 17.453 14.021 -35.088 1.00 53.04 91 A 1 ATOM 780 O OXT . LEU A 0 91 . 19.770 9.759 -35.074 1.00 53.04 91 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 68.10 # loop_ _atom_type.symbol C N O S #