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 ALA 0 3 ILE 0 4 ALA 0 5 PHE 0 6 PHE 0 7 ARG 0 8 GLY 0 9 VAL 0 10 SER 0 11 LYS 0 12 PHE 0 13 GLY 0 14 LEU 0 15 VAL 0 16 ALA 0 17 ALA 0 18 PHE 0 19 GLY 0 20 TYR 0 21 PHE 0 22 SER 0 23 VAL 0 24 VAL 0 25 GLU 0 26 GLY 0 27 VAL 0 28 TRP 0 29 SER 0 30 THR 0 31 ALA 0 32 ASP 0 33 LYS 0 34 GLY 0 35 SER 0 36 ASN 0 37 ASN 0 38 ALA 0 39 THR 0 40 LYS 0 41 VAL 0 42 ARG 0 43 GLU 0 44 VAL 0 45 VAL 0 46 PRO 0 47 HIS 0 48 VAL 0 49 PHE 0 50 SER 0 51 PHE 0 52 LEU 0 53 GLN 0 54 LYS 0 55 PHE 0 56 PRO 0 57 ASP 0 58 GLU 0 59 MET 0 60 ARG 0 61 GLU 0 62 THR 0 63 TRP 0 64 ASN 0 65 GLU 0 66 ASN 0 67 VAL 0 68 LYS 0 69 ASN 0 70 LEU 0 71 PHE 0 72 THR 0 73 TRP 0 74 THR 0 75 ARG 0 76 SER 0 77 ASN 0 78 GLN 0 79 CYS 0 80 SER 0 81 ASN 0 82 CYS 0 83 ASN 0 84 MET 0 85 LYS 0 86 GLN 0 87 CYS 0 88 PHE 0 89 ASN 0 90 SER 0 91 PHE 0 92 GLY 0 93 LEU 0 94 PHE 0 95 GLY 0 96 LYS 0 97 LYS 0 98 SER # 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 . -13.734 17.069 -15.052 1.00 50.23 1 A 1 ATOM 2 C CA . MET A 0 1 . -12.791 17.041 -13.906 1.00 50.23 1 A 1 ATOM 3 C C . MET A 0 1 . -13.171 16.058 -12.783 1.00 50.23 1 A 1 ATOM 4 C CB . MET A 0 1 . -12.544 18.451 -13.352 1.00 50.23 1 A 1 ATOM 5 O O . MET A 0 1 . -12.302 15.733 -11.990 1.00 50.23 1 A 1 ATOM 6 C CG . MET A 0 1 . -11.843 19.347 -14.382 1.00 50.23 1 A 1 ATOM 7 S SD . MET A 0 1 . -11.279 20.905 -13.665 1.00 50.23 1 A 1 ATOM 8 C CE . MET A 0 1 . -10.848 21.842 -15.158 1.00 50.23 1 A 1 ATOM 9 N N . ALA A 0 2 . -14.393 15.503 -12.724 1.00 51.64 2 A 1 ATOM 10 C CA . ALA A 0 2 . -14.788 14.547 -11.673 1.00 51.64 2 A 1 ATOM 11 C C . ALA A 0 2 . -14.077 13.175 -11.747 1.00 51.64 2 A 1 ATOM 12 C CB . ALA A 0 2 . -16.311 14.381 -11.748 1.00 51.64 2 A 1 ATOM 13 O O . ALA A 0 2 . -13.739 12.593 -10.721 1.00 51.64 2 A 1 ATOM 14 N N . ILE A 0 3 . -13.778 12.680 -12.956 1.00 54.01 3 A 1 ATOM 15 C CA . ILE A 0 3 . -13.154 11.356 -13.156 1.00 54.01 3 A 1 ATOM 16 C C . ILE A 0 3 . -11.752 11.279 -12.520 1.00 54.01 3 A 1 ATOM 17 C CB . ILE A 0 3 . -13.126 11.001 -14.667 1.00 54.01 3 A 1 ATOM 18 O O . ILE A 0 3 . -11.363 10.231 -12.008 1.00 54.01 3 A 1 ATOM 19 C CG1 . ILE A 0 3 . -14.556 11.015 -15.264 1.00 54.01 3 A 1 ATOM 20 C CG2 . ILE A 0 3 . -12.470 9.625 -14.898 1.00 54.01 3 A 1 ATOM 21 C CD1 . ILE A 0 3 . -14.622 10.767 -16.777 1.00 54.01 3 A 1 ATOM 22 N N . ALA A 0 4 . -10.998 12.385 -12.507 1.00 56.04 4 A 1 ATOM 23 C CA . ALA A 0 4 . -9.678 12.438 -11.875 1.00 56.04 4 A 1 ATOM 24 C C . ALA A 0 4 . -9.771 12.328 -10.345 1.00 56.04 4 A 1 ATOM 25 C CB . ALA A 0 4 . -8.974 13.728 -12.308 1.00 56.04 4 A 1 ATOM 26 O O . ALA A 0 4 . -8.977 11.616 -9.735 1.00 56.04 4 A 1 ATOM 27 N N . PHE A 0 5 . -10.781 12.961 -9.738 1.00 54.42 5 A 1 ATOM 28 C CA . PHE A 0 5 . -11.010 12.879 -8.297 1.00 54.42 5 A 1 ATOM 29 C C . PHE A 0 5 . -11.420 11.461 -7.881 1.00 54.42 5 A 1 ATOM 30 C CB . PHE A 0 5 . -12.043 13.932 -7.874 1.00 54.42 5 A 1 ATOM 31 O O . PHE A 0 5 . -10.839 10.910 -6.952 1.00 54.42 5 A 1 ATOM 32 C CG . PHE A 0 5 . -11.878 14.367 -6.432 1.00 54.42 5 A 1 ATOM 33 C CD1 . PHE A 0 5 . -12.563 13.703 -5.397 1.00 54.42 5 A 1 ATOM 34 C CD2 . PHE A 0 5 . -11.012 15.435 -6.125 1.00 54.42 5 A 1 ATOM 35 C CE1 . PHE A 0 5 . -12.387 14.112 -4.062 1.00 54.42 5 A 1 ATOM 36 C CE2 . PHE A 0 5 . -10.838 15.843 -4.791 1.00 54.42 5 A 1 ATOM 37 C CZ . PHE A 0 5 . -11.527 15.182 -3.760 1.00 54.42 5 A 1 ATOM 38 N N . PHE A 0 6 . -12.320 10.814 -8.633 1.00 50.48 6 A 1 ATOM 39 C CA . PHE A 0 6 . -12.694 9.413 -8.390 1.00 50.48 6 A 1 ATOM 40 C C . PHE A 0 6 . -11.507 8.448 -8.521 1.00 50.48 6 A 1 ATOM 41 C CB . PHE A 0 6 . -13.843 9.004 -9.323 1.00 50.48 6 A 1 ATOM 42 O O . PHE A 0 6 . -11.353 7.563 -7.682 1.00 50.48 6 A 1 ATOM 43 C CG . PHE A 0 6 . -15.209 9.323 -8.753 1.00 50.48 6 A 1 ATOM 44 C CD1 . PHE A 0 6 . -15.766 8.477 -7.775 1.00 50.48 6 A 1 ATOM 45 C CD2 . PHE A 0 6 . -15.924 10.459 -9.178 1.00 50.48 6 A 1 ATOM 46 C CE1 . PHE A 0 6 . -17.028 8.765 -7.227 1.00 50.48 6 A 1 ATOM 47 C CE2 . PHE A 0 6 . -17.184 10.750 -8.625 1.00 50.48 6 A 1 ATOM 48 C CZ . PHE A 0 6 . -17.736 9.902 -7.650 1.00 50.48 6 A 1 ATOM 49 N N . ARG A 0 7 . -10.623 8.651 -9.511 1.00 55.38 7 A 1 ATOM 50 C CA . ARG A 0 7 . -9.371 7.879 -9.639 1.00 55.38 7 A 1 ATOM 51 C C . ARG A 0 7 . -8.389 8.124 -8.489 1.00 55.38 7 A 1 ATOM 52 C CB . ARG A 0 7 . -8.693 8.190 -10.982 1.00 55.38 7 A 1 ATOM 53 O O . ARG A 0 7 . -7.608 7.234 -8.159 1.00 55.38 7 A 1 ATOM 54 C CG . ARG A 0 7 . -9.328 7.414 -12.141 1.00 55.38 7 A 1 ATOM 55 C CD . ARG A 0 7 . -8.567 7.691 -13.444 1.00 55.38 7 A 1 ATOM 56 N NE . ARG A 0 7 . -8.901 6.692 -14.479 1.00 55.38 7 A 1 ATOM 57 N NH1 . ARG A 0 7 . -9.594 8.099 -16.165 1.00 55.38 7 A 1 ATOM 58 N NH2 . ARG A 0 7 . -9.574 5.898 -16.503 1.00 55.38 7 A 1 ATOM 59 C CZ . ARG A 0 7 . -9.355 6.903 -15.704 1.00 55.38 7 A 1 ATOM 60 N N . GLY A 0 8 . -8.406 9.316 -7.893 1.00 56.52 8 A 1 ATOM 61 C CA . GLY A 0 8 . -7.642 9.623 -6.685 1.00 56.52 8 A 1 ATOM 62 C C . GLY A 0 8 . -8.209 8.893 -5.468 1.00 56.52 8 A 1 ATOM 63 O O . GLY A 0 8 . -7.496 8.130 -4.818 1.00 56.52 8 A 1 ATOM 64 N N . VAL A 0 9 . -9.508 9.065 -5.203 1.00 57.46 9 A 1 ATOM 65 C CA . VAL A 0 9 . -10.198 8.459 -4.053 1.00 57.46 9 A 1 ATOM 66 C C . VAL A 0 9 . -10.124 6.934 -4.092 1.00 57.46 9 A 1 ATOM 67 C CB . VAL A 0 9 . -11.663 8.933 -3.958 1.00 57.46 9 A 1 ATOM 68 O O . VAL A 0 9 . -9.918 6.329 -3.048 1.00 57.46 9 A 1 ATOM 69 C CG1 . VAL A 0 9 . -12.413 8.272 -2.793 1.00 57.46 9 A 1 ATOM 70 C CG2 . VAL A 0 9 . -11.740 10.447 -3.721 1.00 57.46 9 A 1 ATOM 71 N N . SER A 0 10 . -10.196 6.295 -5.265 1.00 59.84 10 A 1 ATOM 72 C CA . SER A 0 10 . -10.061 4.834 -5.353 1.00 59.84 10 A 1 ATOM 73 C C . SER A 0 10 . -8.693 4.336 -4.871 1.00 59.84 10 A 1 ATOM 74 C CB . SER A 0 10 . -10.351 4.348 -6.778 1.00 59.84 10 A 1 ATOM 75 O O . SER A 0 10 . -8.618 3.300 -4.215 1.00 59.84 10 A 1 ATOM 76 O OG . SER A 0 10 . -9.389 4.818 -7.706 1.00 59.84 10 A 1 ATOM 77 N N . LYS A 0 11 . -7.609 5.083 -5.141 1.00 57.71 11 A 1 ATOM 78 C CA . LYS A 0 11 . -6.264 4.743 -4.646 1.00 57.71 11 A 1 ATOM 79 C C . LYS A 0 11 . -6.159 4.953 -3.137 1.00 57.71 11 A 1 ATOM 80 C CB . LYS A 0 11 . -5.182 5.551 -5.380 1.00 57.71 11 A 1 ATOM 81 O O . LYS A 0 11 . -5.662 4.074 -2.440 1.00 57.71 11 A 1 ATOM 82 C CG . LYS A 0 11 . -5.027 5.145 -6.853 1.00 57.71 11 A 1 ATOM 83 C CD . LYS A 0 11 . -3.886 5.943 -7.498 1.00 57.71 11 A 1 ATOM 84 C CE . LYS A 0 11 . -3.678 5.521 -8.957 1.00 57.71 11 A 1 ATOM 85 N NZ . LYS A 0 11 . -2.480 6.177 -9.543 1.00 57.71 11 A 1 ATOM 86 N N . PHE A 0 12 . -6.673 6.074 -2.625 1.00 62.62 12 A 1 ATOM 87 C CA . PHE A 0 12 . -6.690 6.333 -1.182 1.00 62.62 12 A 1 ATOM 88 C C . PHE A 0 12 . -7.577 5.343 -0.421 1.00 62.62 12 A 1 ATOM 89 C CB . PHE A 0 12 . -7.121 7.776 -0.899 1.00 62.62 12 A 1 ATOM 90 O O . PHE A 0 12 . -7.201 4.927 0.667 1.00 62.62 12 A 1 ATOM 91 C CG . PHE A 0 12 . -6.057 8.800 -1.237 1.00 62.62 12 A 1 ATOM 92 C CD1 . PHE A 0 12 . -4.906 8.906 -0.433 1.00 62.62 12 A 1 ATOM 93 C CD2 . PHE A 0 12 . -6.212 9.654 -2.342 1.00 62.62 12 A 1 ATOM 94 C CE1 . PHE A 0 12 . -3.910 9.847 -0.746 1.00 62.62 12 A 1 ATOM 95 C CE2 . PHE A 0 12 . -5.209 10.583 -2.668 1.00 62.62 12 A 1 ATOM 96 C CZ . PHE A 0 12 . -4.057 10.680 -1.868 1.00 62.62 12 A 1 ATOM 97 N N . GLY A 0 13 . -8.701 4.914 -0.998 1.00 66.53 13 A 1 ATOM 98 C CA . GLY A 0 13 . -9.586 3.907 -0.415 1.00 66.53 13 A 1 ATOM 99 C C . GLY A 0 13 . -8.898 2.554 -0.254 1.00 66.53 13 A 1 ATOM 100 O O . GLY A 0 13 . -8.994 1.949 0.807 1.00 66.53 13 A 1 ATOM 101 N N . LEU A 0 14 . -8.129 2.120 -1.257 1.00 67.83 14 A 1 ATOM 102 C CA . LEU A 0 14 . -7.307 0.908 -1.172 1.00 67.83 14 A 1 ATOM 103 C C . LEU A 0 14 . -6.228 1.012 -0.084 1.00 67.83 14 A 1 ATOM 104 C CB . LEU A 0 14 . -6.700 0.627 -2.561 1.00 67.83 14 A 1 ATOM 105 O O . LEU A 0 14 . -6.069 0.087 0.710 1.00 67.83 14 A 1 ATOM 106 C CG . LEU A 0 14 . -7.508 -0.428 -3.341 1.00 67.83 14 A 1 ATOM 107 C CD1 . LEU A 0 14 . -7.488 -0.138 -4.840 1.00 67.83 14 A 1 ATOM 108 C CD2 . LEU A 0 14 . -6.924 -1.823 -3.109 1.00 67.83 14 A 1 ATOM 109 N N . VAL A 0 15 . -5.526 2.146 0.002 1.00 71.95 15 A 1 ATOM 110 C CA . VAL A 0 15 . -4.501 2.372 1.039 1.00 71.95 15 A 1 ATOM 111 C C . VAL A 0 15 . -5.124 2.448 2.437 1.00 71.95 15 A 1 ATOM 112 C CB . VAL A 0 15 . -3.670 3.632 0.726 1.00 71.95 15 A 1 ATOM 113 O O . VAL A 0 15 . -4.594 1.856 3.374 1.00 71.95 15 A 1 ATOM 114 C CG1 . VAL A 0 15 . -2.656 3.958 1.830 1.00 71.95 15 A 1 ATOM 115 C CG2 . VAL A 0 15 . -2.871 3.452 -0.573 1.00 71.95 15 A 1 ATOM 116 N N . ALA A 0 16 . -6.267 3.121 2.587 1.00 68.82 16 A 1 ATOM 117 C CA . ALA A 0 16 . -6.996 3.210 3.850 1.00 68.82 16 A 1 ATOM 118 C C . ALA A 0 16 . -7.547 1.846 4.288 1.00 68.82 16 A 1 ATOM 119 C CB . ALA A 0 16 . -8.116 4.248 3.706 1.00 68.82 16 A 1 ATOM 120 O O . ALA A 0 16 . -7.443 1.502 5.463 1.00 68.82 16 A 1 ATOM 121 N N . ALA A 0 17 . -8.067 1.045 3.352 1.00 68.81 17 A 1 ATOM 122 C CA . ALA A 0 17 . -8.511 -0.319 3.622 1.00 68.81 17 A 1 ATOM 123 C C . ALA A 0 17 . -7.346 -1.209 4.080 1.00 68.81 17 A 1 ATOM 124 C CB . ALA A 0 17 . -9.190 -0.879 2.366 1.00 68.81 17 A 1 ATOM 125 O O . ALA A 0 17 . -7.482 -1.933 5.064 1.00 68.81 17 A 1 ATOM 126 N N . PHE A 0 18 . -6.182 -1.106 3.429 1.00 72.25 18 A 1 ATOM 127 C CA . PHE A 0 18 . -4.982 -1.838 3.839 1.00 72.25 18 A 1 ATOM 128 C C . PHE A 0 18 . -4.478 -1.395 5.221 1.00 72.25 18 A 1 ATOM 129 C CB . PHE A 0 18 . -3.897 -1.669 2.769 1.00 72.25 18 A 1 ATOM 130 O O . PHE A 0 18 . -4.166 -2.228 6.072 1.00 72.25 18 A 1 ATOM 131 C CG . PHE A 0 18 . -2.717 -2.593 2.988 1.00 72.25 18 A 1 ATOM 132 C CD1 . PHE A 0 18 . -1.589 -2.157 3.709 1.00 72.25 18 A 1 ATOM 133 C CD2 . PHE A 0 18 . -2.772 -3.913 2.503 1.00 72.25 18 A 1 ATOM 134 C CE1 . PHE A 0 18 . -0.518 -3.039 3.938 1.00 72.25 18 A 1 ATOM 135 C CE2 . PHE A 0 18 . -1.700 -4.793 2.731 1.00 72.25 18 A 1 ATOM 136 C CZ . PHE A 0 18 . -0.572 -4.356 3.447 1.00 72.25 18 A 1 ATOM 137 N N . GLY A 0 19 . -4.462 -0.084 5.481 1.00 68.58 19 A 1 ATOM 138 C CA . GLY A 0 19 . -4.135 0.473 6.792 1.00 68.58 19 A 1 ATOM 139 C C . GLY A 0 19 . -5.074 -0.044 7.884 1.00 68.58 19 A 1 ATOM 140 O O . GLY A 0 19 . -4.604 -0.532 8.910 1.00 68.58 19 A 1 ATOM 141 N N . TYR A 0 20 . -6.385 -0.027 7.638 1.00 63.67 20 A 1 ATOM 142 C CA . TYR A 0 20 . -7.387 -0.556 8.563 1.00 63.67 20 A 1 ATOM 143 C C . TYR A 0 20 . -7.189 -2.052 8.827 1.00 63.67 20 A 1 ATOM 144 C CB . TYR A 0 20 . -8.789 -0.273 8.012 1.00 63.67 20 A 1 ATOM 145 O O . TYR A 0 20 . -7.171 -2.469 9.984 1.00 63.67 20 A 1 ATOM 146 C CG . TYR A 0 20 . -9.893 -0.623 8.988 1.00 63.67 20 A 1 ATOM 147 C CD1 . TYR A 0 20 . -10.572 -1.853 8.885 1.00 63.67 20 A 1 ATOM 148 C CD2 . TYR A 0 20 . -10.222 0.281 10.016 1.00 63.67 20 A 1 ATOM 149 C CE1 . TYR A 0 20 . -11.590 -2.171 9.804 1.00 63.67 20 A 1 ATOM 150 C CE2 . TYR A 0 20 . -11.233 -0.039 10.943 1.00 63.67 20 A 1 ATOM 151 O OH . TYR A 0 20 . -12.894 -1.585 11.726 1.00 63.67 20 A 1 ATOM 152 C CZ . TYR A 0 20 . -11.918 -1.269 10.837 1.00 63.67 20 A 1 ATOM 153 N N . PHE A 0 21 . -6.947 -2.844 7.779 1.00 64.38 21 A 1 ATOM 154 C CA . PHE A 0 21 . -6.667 -4.272 7.915 1.00 64.38 21 A 1 ATOM 155 C C . PHE A 0 21 . -5.424 -4.524 8.784 1.00 64.38 21 A 1 ATOM 156 C CB . PHE A 0 21 . -6.537 -4.895 6.519 1.00 64.38 21 A 1 ATOM 157 O O . PHE A 0 21 . -5.466 -5.348 9.691 1.00 64.38 21 A 1 ATOM 158 C CG . PHE A 0 21 . -6.562 -6.408 6.545 1.00 64.38 21 A 1 ATOM 159 C CD1 . PHE A 0 21 . -5.366 -7.147 6.478 1.00 64.38 21 A 1 ATOM 160 C CD2 . PHE A 0 21 . -7.792 -7.079 6.685 1.00 64.38 21 A 1 ATOM 161 C CE1 . PHE A 0 21 . -5.401 -8.550 6.559 1.00 64.38 21 A 1 ATOM 162 C CE2 . PHE A 0 21 . -7.825 -8.480 6.775 1.00 64.38 21 A 1 ATOM 163 C CZ . PHE A 0 21 . -6.629 -9.215 6.719 1.00 64.38 21 A 1 ATOM 164 N N . SER A 0 22 . -4.353 -3.740 8.606 1.00 67.54 22 A 1 ATOM 165 C CA . SER A 0 22 . -3.139 -3.858 9.430 1.00 67.54 22 A 1 ATOM 166 C C . SER A 0 22 . -3.365 -3.536 10.917 1.00 67.54 22 A 1 ATOM 167 C CB . SER A 0 22 . -2.011 -2.998 8.845 1.00 67.54 22 A 1 ATOM 168 O O . SER A 0 22 . -2.696 -4.103 11.784 1.00 67.54 22 A 1 ATOM 169 O OG . SER A 0 22 . -2.138 -1.617 9.139 1.00 67.54 22 A 1 ATOM 170 N N . VAL A 0 23 . -4.321 -2.653 11.229 1.00 60.59 23 A 1 ATOM 171 C CA . VAL A 0 23 . -4.703 -2.321 12.610 1.00 60.59 23 A 1 ATOM 172 C C . VAL A 0 23 . -5.579 -3.418 13.214 1.00 60.59 23 A 1 ATOM 173 C CB . VAL A 0 23 . -5.395 -0.945 12.677 1.00 60.59 23 A 1 ATOM 174 O O . VAL A 0 23 . -5.335 -3.814 14.352 1.00 60.59 23 A 1 ATOM 175 C CG1 . VAL A 0 23 . -5.932 -0.626 14.079 1.00 60.59 23 A 1 ATOM 176 C CG2 . VAL A 0 23 . -4.411 0.174 12.308 1.00 60.59 23 A 1 ATOM 177 N N . VAL A 0 24 . -6.558 -3.937 12.462 1.00 60.97 24 A 1 ATOM 178 C CA . VAL A 0 24 . -7.458 -5.015 12.915 1.00 60.97 24 A 1 ATOM 179 C C . VAL A 0 24 . -6.697 -6.313 13.165 1.00 60.97 24 A 1 ATOM 180 C CB . VAL A 0 24 . -8.598 -5.248 11.905 1.00 60.97 24 A 1 ATOM 181 O O . VAL A 0 24 . -6.886 -6.936 14.206 1.00 60.97 24 A 1 ATOM 182 C CG1 . VAL A 0 24 . -9.444 -6.485 12.239 1.00 60.97 24 A 1 ATOM 183 C CG2 . VAL A 0 24 . -9.548 -4.045 11.895 1.00 60.97 24 A 1 ATOM 184 N N . GLU A 0 25 . -5.773 -6.673 12.274 1.00 58.46 25 A 1 ATOM 185 C CA . GLU A 0 25 . -4.881 -7.824 12.466 1.00 58.46 25 A 1 ATOM 186 C C . GLU A 0 25 . -3.893 -7.614 13.628 1.00 58.46 25 A 1 ATOM 187 C CB . GLU A 0 25 . -4.140 -8.112 11.151 1.00 58.46 25 A 1 ATOM 188 O O . GLU A 0 25 . -3.186 -8.531 14.052 1.00 58.46 25 A 1 ATOM 189 C CG . GLU A 0 25 . -5.053 -8.685 10.053 1.00 58.46 25 A 1 ATOM 190 C CD . GLU A 0 25 . -5.698 -10.031 10.424 1.00 58.46 25 A 1 ATOM 191 O OE1 . GLU A 0 25 . -6.775 -10.332 9.866 1.00 58.46 25 A 1 ATOM 192 O OE2 . GLU A 0 25 . -5.116 -10.752 11.267 1.00 58.46 25 A 1 ATOM 193 N N . GLY A 0 26 . -3.840 -6.407 14.197 1.00 56.59 26 A 1 ATOM 194 C CA . GLY A 0 26 . -2.976 -6.104 15.325 1.00 56.59 26 A 1 ATOM 195 C C . GLY A 0 26 . -1.497 -6.149 14.955 1.00 56.59 26 A 1 ATOM 196 O O . GLY A 0 26 . -0.670 -6.365 15.838 1.00 56.59 26 A 1 ATOM 197 N N . VAL A 0 27 . -1.150 -5.905 13.684 1.00 60.02 27 A 1 ATOM 198 C CA . VAL A 0 27 . 0.251 -5.819 13.226 1.00 60.02 27 A 1 ATOM 199 C C . VAL A 0 27 . 1.003 -4.721 13.989 1.00 60.02 27 A 1 ATOM 200 C CB . VAL A 0 27 . 0.319 -5.580 11.701 1.00 60.02 27 A 1 ATOM 201 O O . VAL A 0 27 . 2.198 -4.843 14.235 1.00 60.02 27 A 1 ATOM 202 C CG1 . VAL A 0 27 . 1.757 -5.453 11.182 1.00 60.02 27 A 1 ATOM 203 C CG2 . VAL A 0 27 . -0.346 -6.731 10.931 1.00 60.02 27 A 1 ATOM 204 N N . TRP A 0 28 . 0.284 -3.684 14.431 1.00 57.81 28 A 1 ATOM 205 C CA . TRP A 0 28 . 0.793 -2.584 15.258 1.00 57.81 28 A 1 ATOM 206 C C . TRP A 0 28 . 0.459 -2.726 16.752 1.00 57.81 28 A 1 ATOM 207 C CB . TRP A 0 28 . 0.253 -1.261 14.704 1.00 57.81 28 A 1 ATOM 208 O O . TRP A 0 28 . 0.647 -1.783 17.520 1.00 57.81 28 A 1 ATOM 209 C CG . TRP A 0 28 . 0.553 -1.004 13.262 1.00 57.81 28 A 1 ATOM 210 C CD1 . TRP A 0 28 . -0.162 -1.468 12.212 1.00 57.81 28 A 1 ATOM 211 C CD2 . TRP A 0 28 . 1.632 -0.204 12.692 1.00 57.81 28 A 1 ATOM 212 C CE2 . TRP A 0 28 . 1.504 -0.230 11.271 1.00 57.81 28 A 1 ATOM 213 C CE3 . TRP A 0 28 . 2.692 0.556 13.235 1.00 57.81 28 A 1 ATOM 214 N NE1 . TRP A 0 28 . 0.391 -1.011 11.034 1.00 57.81 28 A 1 ATOM 215 C CH2 . TRP A 0 28 . 3.432 1.211 11.001 1.00 57.81 28 A 1 ATOM 216 C CZ2 . TRP A 0 28 . 2.386 0.464 10.430 1.00 57.81 28 A 1 ATOM 217 C CZ3 . TRP A 0 28 . 3.582 1.257 12.399 1.00 57.81 28 A 1 ATOM 218 N N . SER A 0 29 . -0.092 -3.866 17.180 1.00 54.85 29 A 1 ATOM 219 C CA . SER A 0 29 . -0.339 -4.124 18.601 1.00 54.85 29 A 1 ATOM 220 C C . SER A 0 29 . 0.986 -4.323 19.345 1.00 54.85 29 A 1 ATOM 221 C CB . SER A 0 29 . -1.264 -5.332 18.785 1.00 54.85 29 A 1 ATOM 222 O O . SER A 0 29 . 2.020 -4.586 18.732 1.00 54.85 29 A 1 ATOM 223 O OG . SER A 0 29 . -1.921 -5.256 20.041 1.00 54.85 29 A 1 ATOM 224 N N . THR A 0 30 . 0.956 -4.196 20.675 1.00 54.06 30 A 1 ATOM 225 C CA . THR A 0 30 . 2.103 -4.434 21.567 1.00 54.06 30 A 1 ATOM 226 C C . THR A 0 30 . 2.862 -5.696 21.149 1.00 54.06 30 A 1 ATOM 227 C CB . THR A 0 30 . 1.606 -4.584 23.013 1.00 54.06 30 A 1 ATOM 228 O O . THR A 0 30 . 2.227 -6.698 20.817 1.00 54.06 30 A 1 ATOM 229 C CG2 . THR A 0 30 . 2.727 -4.677 24.046 1.00 54.06 30 A 1 ATOM 230 O OG1 . THR A 0 30 . 0.818 -3.467 23.362 1.00 54.06 30 A 1 ATOM 231 N N . ALA A 0 31 . 4.200 -5.643 21.165 1.00 57.34 31 A 1 ATOM 232 C CA . ALA A 0 31 . 5.099 -6.669 20.617 1.00 57.34 31 A 1 ATOM 233 C C . ALA A 0 31 . 4.713 -8.116 20.991 1.00 57.34 31 A 1 ATOM 234 C CB . ALA A 0 31 . 6.520 -6.340 21.097 1.00 57.34 31 A 1 ATOM 235 O O . ALA A 0 31 . 4.813 -9.016 20.155 1.00 57.34 31 A 1 ATOM 236 N N . ASP A 0 32 . 4.182 -8.315 22.200 1.00 54.63 32 A 1 ATOM 237 C CA . ASP A 0 32 . 3.717 -9.614 22.696 1.00 54.63 32 A 1 ATOM 238 C C . ASP A 0 32 . 2.532 -10.193 21.903 1.00 54.63 32 A 1 ATOM 239 C CB . ASP A 0 32 . 3.321 -9.468 24.173 1.00 54.63 32 A 1 ATOM 240 O O . ASP A 0 32 . 2.449 -11.400 21.695 1.00 54.63 32 A 1 ATOM 241 C CG . ASP A 0 32 . 4.479 -8.996 25.055 1.00 54.63 32 A 1 ATOM 242 O OD1 . ASP A 0 32 . 5.629 -9.388 24.767 1.00 54.63 32 A 1 ATOM 243 O OD2 . ASP A 0 32 . 4.192 -8.188 25.963 1.00 54.63 32 A 1 ATOM 244 N N . LYS A 0 33 . 1.614 -9.344 21.423 1.00 54.07 33 A 1 ATOM 245 C CA . LYS A 0 33 . 0.471 -9.744 20.578 1.00 54.07 33 A 1 ATOM 246 C C . LYS A 0 33 . 0.823 -9.733 19.094 1.00 54.07 33 A 1 ATOM 247 C CB . LYS A 0 33 . -0.732 -8.830 20.848 1.00 54.07 33 A 1 ATOM 248 O O . LYS A 0 33 . 0.318 -10.566 18.341 1.00 54.07 33 A 1 ATOM 249 C CG . LYS A 0 33 . -1.314 -9.060 22.248 1.00 54.07 33 A 1 ATOM 250 C CD . LYS A 0 33 . -2.519 -8.146 22.488 1.00 54.07 33 A 1 ATOM 251 C CE . LYS A 0 33 . -3.075 -8.404 23.891 1.00 54.07 33 A 1 ATOM 252 N NZ . LYS A 0 33 . -4.113 -7.409 24.254 1.00 54.07 33 A 1 ATOM 253 N N . GLY A 0 34 . 1.697 -8.812 18.686 1.00 55.81 34 A 1 ATOM 254 C CA . GLY A 0 34 . 2.115 -8.656 17.296 1.00 55.81 34 A 1 ATOM 255 C C . GLY A 0 34 . 2.821 -9.896 16.749 1.00 55.81 34 A 1 ATOM 256 O O . GLY A 0 34 . 2.538 -10.296 15.626 1.00 55.81 34 A 1 ATOM 257 N N . SER A 0 35 . 3.679 -10.558 17.535 1.00 56.40 35 A 1 ATOM 258 C CA . SER A 0 35 . 4.394 -11.761 17.076 1.00 56.40 35 A 1 ATOM 259 C C . SER A 0 35 . 3.454 -12.945 16.822 1.00 56.40 35 A 1 ATOM 260 C CB . SER A 0 35 . 5.490 -12.147 18.074 1.00 56.40 35 A 1 ATOM 261 O O . SER A 0 35 . 3.541 -13.587 15.776 1.00 56.40 35 A 1 ATOM 262 O OG . SER A 0 35 . 4.922 -12.546 19.305 1.00 56.40 35 A 1 ATOM 263 N N . ASN A 0 36 . 2.509 -13.196 17.732 1.00 56.97 36 A 1 ATOM 264 C CA . ASN A 0 36 . 1.570 -14.308 17.600 1.00 56.97 36 A 1 ATOM 265 C C . ASN A 0 36 . 0.583 -14.083 16.442 1.00 56.97 36 A 1 ATOM 266 C CB . ASN A 0 36 . 0.861 -14.512 18.948 1.00 56.97 36 A 1 ATOM 267 O O . ASN A 0 36 . 0.270 -15.005 15.688 1.00 56.97 36 A 1 ATOM 268 C CG . ASN A 0 36 . 0.236 -15.892 19.050 1.00 56.97 36 A 1 ATOM 269 N ND2 . ASN A 0 36 . -0.918 -16.012 19.662 1.00 56.97 36 A 1 ATOM 270 O OD1 . ASN A 0 36 . 0.781 -16.888 18.614 1.00 56.97 36 A 1 ATOM 271 N N . ASN A 0 37 . 0.140 -12.837 16.248 1.00 54.60 37 A 1 ATOM 272 C CA . ASN A 0 37 . -0.716 -12.485 15.118 1.00 54.60 37 A 1 ATOM 273 C C . ASN A 0 37 . 0.053 -12.429 13.794 1.00 54.60 37 A 1 ATOM 274 C CB . ASN A 0 37 . -1.426 -11.158 15.396 1.00 54.60 37 A 1 ATOM 275 O O . ASN A 0 37 . -0.489 -12.831 12.771 1.00 54.60 37 A 1 ATOM 276 C CG . ASN A 0 37 . -2.585 -11.276 16.367 1.00 54.60 37 A 1 ATOM 277 N ND2 . ASN A 0 37 . -3.373 -10.233 16.446 1.00 54.60 37 A 1 ATOM 278 O OD1 . ASN A 0 37 . -2.830 -12.284 17.019 1.00 54.60 37 A 1 ATOM 279 N N . ALA A 0 38 . 1.320 -12.007 13.787 1.00 56.51 38 A 1 ATOM 280 C CA . ALA A 0 38 . 2.146 -12.032 12.582 1.00 56.51 38 A 1 ATOM 281 C C . ALA A 0 38 . 2.271 -13.454 12.021 1.00 56.51 38 A 1 ATOM 282 C CB . ALA A 0 38 . 3.523 -11.433 12.886 1.00 56.51 38 A 1 ATOM 283 O O . ALA A 0 38 . 2.260 -13.627 10.803 1.00 56.51 38 A 1 ATOM 284 N N . THR A 0 39 . 2.326 -14.473 12.884 1.00 60.20 39 A 1 ATOM 285 C CA . THR A 0 39 . 2.281 -15.877 12.453 1.00 60.20 39 A 1 ATOM 286 C C . THR A 0 39 . 0.942 -16.219 11.799 1.00 60.20 39 A 1 ATOM 287 C CB . THR A 0 39 . 2.563 -16.841 13.613 1.00 60.20 39 A 1 ATOM 288 O O . THR A 0 39 . 0.941 -16.791 10.713 1.00 60.20 39 A 1 ATOM 289 C CG2 . THR A 0 39 . 2.959 -18.226 13.104 1.00 60.20 39 A 1 ATOM 290 O OG1 . THR A 0 39 . 3.656 -16.369 14.364 1.00 60.20 39 A 1 ATOM 291 N N . LYS A 0 40 . -0.192 -15.783 12.369 1.00 60.32 40 A 1 ATOM 292 C CA . LYS A 0 40 . -1.512 -15.958 11.732 1.00 60.32 40 A 1 ATOM 293 C C . LYS A 0 40 . -1.601 -15.265 10.374 1.00 60.32 40 A 1 ATOM 294 C CB . LYS A 0 40 . -2.641 -15.451 12.636 1.00 60.32 40 A 1 ATOM 295 O O . LYS A 0 40 . -2.068 -15.865 9.415 1.00 60.32 40 A 1 ATOM 296 C CG . LYS A 0 40 . -2.939 -16.419 13.782 1.00 60.32 40 A 1 ATOM 297 C CD . LYS A 0 40 . -4.146 -15.904 14.568 1.00 60.32 40 A 1 ATOM 298 C CE . LYS A 0 40 . -4.577 -16.951 15.593 1.00 60.32 40 A 1 ATOM 299 N NZ . LYS A 0 40 . -5.818 -16.524 16.278 1.00 60.32 40 A 1 ATOM 300 N N . VAL A 0 41 . -1.103 -14.035 10.248 1.00 58.41 41 A 1 ATOM 301 C CA . VAL A 0 41 . -1.085 -13.322 8.959 1.00 58.41 41 A 1 ATOM 302 C C . VAL A 0 41 . -0.174 -14.033 7.952 1.00 58.41 41 A 1 ATOM 303 C CB . VAL A 0 41 . -0.683 -11.847 9.145 1.00 58.41 41 A 1 ATOM 304 O O . VAL A 0 41 . -0.510 -14.109 6.771 1.00 58.41 41 A 1 ATOM 305 C CG1 . VAL A 0 41 . -0.591 -11.101 7.806 1.00 58.41 41 A 1 ATOM 306 C CG2 . VAL A 0 41 . -1.707 -11.095 10.006 1.00 58.41 41 A 1 ATOM 307 N N . ARG A 0 42 . 0.952 -14.610 8.398 1.00 56.86 42 A 1 ATOM 308 C CA . ARG A 0 42 . 1.813 -15.448 7.545 1.00 56.86 42 A 1 ATOM 309 C C . ARG A 0 42 . 1.096 -16.702 7.048 1.00 56.86 42 A 1 ATOM 310 C CB . ARG A 0 42 . 3.099 -15.847 8.282 1.00 56.86 42 A 1 ATOM 311 O O . ARG A 0 42 . 1.286 -17.055 5.889 1.00 56.86 42 A 1 ATOM 312 C CG . ARG A 0 42 . 4.145 -14.730 8.293 1.00 56.86 42 A 1 ATOM 313 C CD . ARG A 0 42 . 5.371 -15.212 9.074 1.00 56.86 42 A 1 ATOM 314 N NE . ARG A 0 42 . 6.468 -14.230 9.022 1.00 56.86 42 A 1 ATOM 315 N NH1 . ARG A 0 42 . 8.166 -15.655 9.625 1.00 56.86 42 A 1 ATOM 316 N NH2 . ARG A 0 42 . 8.618 -13.510 9.204 1.00 56.86 42 A 1 ATOM 317 C CZ . ARG A 0 42 . 7.740 -14.470 9.282 1.00 56.86 42 A 1 ATOM 318 N N . GLU A 0 43 . 0.286 -17.344 7.886 1.00 62.66 43 A 1 ATOM 319 C CA . GLU A 0 43 . -0.515 -18.512 7.493 1.00 62.66 43 A 1 ATOM 320 C C . GLU A 0 43 . -1.644 -18.147 6.527 1.00 62.66 43 A 1 ATOM 321 C CB . GLU A 0 43 . -1.117 -19.196 8.727 1.00 62.66 43 A 1 ATOM 322 O O . GLU A 0 43 . -1.891 -18.876 5.569 1.00 62.66 43 A 1 ATOM 323 C CG . GLU A 0 43 . -0.074 -19.979 9.532 1.00 62.66 43 A 1 ATOM 324 C CD . GLU A 0 43 . -0.688 -20.728 10.726 1.00 62.66 43 A 1 ATOM 325 O OE1 . GLU A 0 43 . 0.029 -21.594 11.273 1.00 62.66 43 A 1 ATOM 326 O OE2 . GLU A 0 43 . -1.841 -20.418 11.109 1.00 62.66 43 A 1 ATOM 327 N N . VAL A 0 44 . -2.307 -17.008 6.741 1.00 62.17 44 A 1 ATOM 328 C CA . VAL A 0 44 . -3.413 -16.563 5.881 1.00 62.17 44 A 1 ATOM 329 C C . VAL A 0 44 . -2.896 -16.041 4.539 1.00 62.17 44 A 1 ATOM 330 C CB . VAL A 0 44 . -4.290 -15.528 6.616 1.00 62.17 44 A 1 ATOM 331 O O . VAL A 0 44 . -3.594 -16.146 3.530 1.00 62.17 44 A 1 ATOM 332 C CG1 . VAL A 0 44 . -5.453 -15.009 5.757 1.00 62.17 44 A 1 ATOM 333 C CG2 . VAL A 0 44 . -4.947 -16.143 7.861 1.00 62.17 44 A 1 ATOM 334 N N . VAL A 0 45 . -1.674 -15.494 4.487 1.00 59.42 45 A 1 ATOM 335 C CA . VAL A 0 45 . -1.162 -14.843 3.274 1.00 59.42 45 A 1 ATOM 336 C C . VAL A 0 45 . 0.281 -15.226 2.901 1.00 59.42 45 A 1 ATOM 337 C CB . VAL A 0 45 . -1.402 -13.316 3.306 1.00 59.42 45 A 1 ATOM 338 O O . VAL A 0 45 . 1.119 -14.346 2.664 1.00 59.42 45 A 1 ATOM 339 C CG1 . VAL A 0 45 . -1.712 -12.893 1.871 1.00 59.42 45 A 1 ATOM 340 C CG2 . VAL A 0 45 . -2.594 -12.827 4.140 1.00 59.42 45 A 1 ATOM 341 N N . PRO A 0 46 . 0.600 -16.527 2.735 1.00 60.76 46 A 1 ATOM 342 C CA . PRO A 0 46 . 1.919 -16.954 2.259 1.00 60.76 46 A 1 ATOM 343 C C . PRO A 0 46 . 2.243 -16.351 0.881 1.00 60.76 46 A 1 ATOM 344 C CB . PRO A 0 46 . 1.856 -18.487 2.226 1.00 60.76 46 A 1 ATOM 345 O O . PRO A 0 46 . 3.381 -15.971 0.602 1.00 60.76 46 A 1 ATOM 346 C CG . PRO A 0 46 . 0.366 -18.806 2.093 1.00 60.76 46 A 1 ATOM 347 C CD . PRO A 0 46 . -0.289 -17.672 2.872 1.00 60.76 46 A 1 ATOM 348 N N . HIS A 0 47 . 1.216 -16.162 0.047 1.00 61.36 47 A 1 ATOM 349 C CA . HIS A 0 47 . 1.344 -15.580 -1.287 1.00 61.36 47 A 1 ATOM 350 C C . HIS A 0 47 . 1.837 -14.129 -1.287 1.00 61.36 47 A 1 ATOM 351 C CB . HIS A 0 47 . -0.007 -15.684 -2.004 1.00 61.36 47 A 1 ATOM 352 O O . HIS A 0 47 . 2.539 -13.737 -2.220 1.00 61.36 47 A 1 ATOM 353 C CG . HIS A 0 47 . -0.419 -17.111 -2.252 1.00 61.36 47 A 1 ATOM 354 C CD2 . HIS A 0 47 . -1.420 -17.802 -1.624 1.00 61.36 47 A 1 ATOM 355 N ND1 . HIS A 0 47 . 0.179 -17.976 -3.140 1.00 61.36 47 A 1 ATOM 356 C CE1 . HIS A 0 47 . -0.446 -19.161 -3.051 1.00 61.36 47 A 1 ATOM 357 N NE2 . HIS A 0 47 . -1.424 -19.101 -2.138 1.00 61.36 47 A 1 ATOM 358 N N . VAL A 0 48 . 1.529 -13.333 -0.253 1.00 61.55 48 A 1 ATOM 359 C CA . VAL A 0 48 . 2.008 -11.943 -0.183 1.00 61.55 48 A 1 ATOM 360 C C . VAL A 0 48 . 3.507 -11.907 0.072 1.00 61.55 48 A 1 ATOM 361 C CB . VAL A 0 48 . 1.215 -11.101 0.834 1.00 61.55 48 A 1 ATOM 362 O O . VAL A 0 48 . 4.198 -11.128 -0.574 1.00 61.55 48 A 1 ATOM 363 C CG1 . VAL A 0 48 . 1.906 -9.792 1.237 1.00 61.55 48 A 1 ATOM 364 C CG2 . VAL A 0 48 . -0.111 -10.684 0.187 1.00 61.55 48 A 1 ATOM 365 N N . PHE A 0 49 . 4.049 -12.788 0.917 1.00 62.72 49 A 1 ATOM 366 C CA . PHE A 0 49 . 5.500 -12.857 1.115 1.00 62.72 49 A 1 ATOM 367 C C . PHE A 0 49 . 6.235 -13.264 -0.164 1.00 62.72 49 A 1 ATOM 368 C CB . PHE A 0 49 . 5.838 -13.793 2.281 1.00 62.72 49 A 1 ATOM 369 O O . PHE A 0 49 . 7.229 -12.633 -0.524 1.00 62.72 49 A 1 ATOM 370 C CG . PHE A 0 49 . 6.050 -13.040 3.576 1.00 62.72 49 A 1 ATOM 371 C CD1 . PHE A 0 49 . 7.316 -12.496 3.862 1.00 62.72 49 A 1 ATOM 372 C CD2 . PHE A 0 49 . 4.982 -12.837 4.469 1.00 62.72 49 A 1 ATOM 373 C CE1 . PHE A 0 49 . 7.518 -11.756 5.040 1.00 62.72 49 A 1 ATOM 374 C CE2 . PHE A 0 49 . 5.183 -12.094 5.647 1.00 62.72 49 A 1 ATOM 375 C CZ . PHE A 0 49 . 6.449 -11.552 5.931 1.00 62.72 49 A 1 ATOM 376 N N . SER A 0 50 . 5.722 -14.257 -0.897 1.00 66.79 50 A 1 ATOM 377 C CA . SER A 0 50 . 6.302 -14.644 -2.190 1.00 66.79 50 A 1 ATOM 378 C C . SER A 0 50 . 6.231 -13.516 -3.222 1.00 66.79 50 A 1 ATOM 379 C CB . SER A 0 50 . 5.582 -15.866 -2.760 1.00 66.79 50 A 1 ATOM 380 O O . SER A 0 50 . 7.149 -13.356 -4.023 1.00 66.79 50 A 1 ATOM 381 O OG . SER A 0 50 . 5.523 -16.917 -1.821 1.00 66.79 50 A 1 ATOM 382 N N . PHE A 0 51 . 5.158 -12.723 -3.203 1.00 64.55 51 A 1 ATOM 383 C CA . PHE A 0 51 . 5.011 -11.559 -4.071 1.00 64.55 51 A 1 ATOM 384 C C . PHE A 0 51 . 5.982 -10.433 -3.696 1.00 64.55 51 A 1 ATOM 385 C CB . PHE A 0 51 . 3.554 -11.091 -4.026 1.00 64.55 51 A 1 ATOM 386 O O . PHE A 0 51 . 6.632 -9.879 -4.577 1.00 64.55 51 A 1 ATOM 387 C CG . PHE A 0 51 . 3.303 -9.865 -4.874 1.00 64.55 51 A 1 ATOM 388 C CD1 . PHE A 0 51 . 3.220 -8.598 -4.269 1.00 64.55 51 A 1 ATOM 389 C CD2 . PHE A 0 51 . 3.184 -9.987 -6.270 1.00 64.55 51 A 1 ATOM 390 C CE1 . PHE A 0 51 . 2.998 -7.459 -5.058 1.00 64.55 51 A 1 ATOM 391 C CE2 . PHE A 0 51 . 2.981 -8.843 -7.061 1.00 64.55 51 A 1 ATOM 392 C CZ . PHE A 0 51 . 2.888 -7.578 -6.455 1.00 64.55 51 A 1 ATOM 393 N N . LEU A 0 52 . 6.146 -10.145 -2.401 1.00 65.01 52 A 1 ATOM 394 C CA . LEU A 0 52 . 7.108 -9.156 -1.906 1.00 65.01 52 A 1 ATOM 395 C C . LEU A 0 52 . 8.553 -9.543 -2.238 1.00 65.01 52 A 1 ATOM 396 C CB . LEU A 0 52 . 6.946 -8.993 -0.384 1.00 65.01 52 A 1 ATOM 397 O O . LEU A 0 52 . 9.368 -8.675 -2.529 1.00 65.01 52 A 1 ATOM 398 C CG . LEU A 0 52 . 5.661 -8.275 0.064 1.00 65.01 52 A 1 ATOM 399 C CD1 . LEU A 0 52 . 5.566 -8.326 1.591 1.00 65.01 52 A 1 ATOM 400 C CD2 . LEU A 0 52 . 5.623 -6.811 -0.377 1.00 65.01 52 A 1 ATOM 401 N N . GLN A 0 53 . 8.877 -10.838 -2.234 1.00 69.22 53 A 1 ATOM 402 C CA . GLN A 0 53 . 10.213 -11.308 -2.601 1.00 69.22 53 A 1 ATOM 403 C C . GLN A 0 53 . 10.472 -11.240 -4.113 1.00 69.22 53 A 1 ATOM 404 C CB . GLN A 0 53 . 10.393 -12.729 -2.060 1.00 69.22 53 A 1 ATOM 405 O O . GLN A 0 53 . 11.607 -11.044 -4.532 1.00 69.22 53 A 1 ATOM 406 C CG . GLN A 0 53 . 11.874 -13.127 -2.009 1.00 69.22 53 A 1 ATOM 407 C CD . GLN A 0 53 . 12.086 -14.483 -1.349 1.00 69.22 53 A 1 ATOM 408 N NE2 . GLN A 0 53 . 13.286 -14.775 -0.899 1.00 69.22 53 A 1 ATOM 409 O OE1 . GLN A 0 53 . 11.194 -15.306 -1.226 1.00 69.22 53 A 1 ATOM 410 N N . LYS A 0 54 . 9.423 -11.379 -4.933 1.00 71.28 54 A 1 ATOM 411 C CA . LYS A 0 54 . 9.479 -11.212 -6.396 1.00 71.28 54 A 1 ATOM 412 C C . LYS A 0 54 . 9.255 -9.767 -6.845 1.00 71.28 54 A 1 ATOM 413 C CB . LYS A 0 54 . 8.469 -12.154 -7.066 1.00 71.28 54 A 1 ATOM 414 O O . LYS A 0 54 . 9.094 -9.529 -8.040 1.00 71.28 54 A 1 ATOM 415 C CG . LYS A 0 54 . 8.889 -13.621 -6.949 1.00 71.28 54 A 1 ATOM 416 C CD . LYS A 0 54 . 7.894 -14.497 -7.715 1.00 71.28 54 A 1 ATOM 417 C CE . LYS A 0 54 . 8.338 -15.958 -7.639 1.00 71.28 54 A 1 ATOM 418 N NZ . LYS A 0 54 . 7.456 -16.834 -8.447 1.00 71.28 54 A 1 ATOM 419 N N . PHE A 0 55 . 9.188 -8.821 -5.912 1.00 70.57 55 A 1 ATOM 420 C CA . PHE A 0 55 . 8.894 -7.435 -6.233 1.00 70.57 55 A 1 ATOM 421 C C . PHE A 0 55 . 10.058 -6.850 -7.049 1.00 70.57 55 A 1 ATOM 422 C CB . PHE A 0 55 . 8.608 -6.658 -4.946 1.00 70.57 55 A 1 ATOM 423 O O . PHE A 0 55 . 11.183 -6.843 -6.548 1.00 70.57 55 A 1 ATOM 424 C CG . PHE A 0 55 . 7.626 -5.528 -5.137 1.00 70.57 55 A 1 ATOM 425 C CD1 . PHE A 0 55 . 8.066 -4.195 -5.214 1.00 70.57 55 A 1 ATOM 426 C CD2 . PHE A 0 55 . 6.251 -5.823 -5.215 1.00 70.57 55 A 1 ATOM 427 C CE1 . PHE A 0 55 . 7.125 -3.157 -5.329 1.00 70.57 55 A 1 ATOM 428 C CE2 . PHE A 0 55 . 5.319 -4.783 -5.370 1.00 70.57 55 A 1 ATOM 429 C CZ . PHE A 0 55 . 5.755 -3.450 -5.419 1.00 70.57 55 A 1 ATOM 430 N N . PRO A 0 56 . 9.829 -6.398 -8.297 1.00 76.90 56 A 1 ATOM 431 C CA . PRO A 0 56 . 10.900 -5.887 -9.147 1.00 76.90 56 A 1 ATOM 432 C C . PRO A 0 56 . 11.603 -4.695 -8.492 1.00 76.90 56 A 1 ATOM 433 C CB . PRO A 0 56 . 10.233 -5.489 -10.469 1.00 76.90 56 A 1 ATOM 434 O O . PRO A 0 56 . 10.937 -3.845 -7.895 1.00 76.90 56 A 1 ATOM 435 C CG . PRO A 0 56 . 8.944 -6.308 -10.493 1.00 76.90 56 A 1 ATOM 436 C CD . PRO A 0 56 . 8.569 -6.420 -9.021 1.00 76.90 56 A 1 ATOM 437 N N . ASP A 0 57 . 12.926 -4.591 -8.640 1.00 77.90 57 A 1 ATOM 438 C CA . ASP A 0 57 . 13.700 -3.487 -8.055 1.00 77.90 57 A 1 ATOM 439 C C . ASP A 0 57 . 13.186 -2.111 -8.518 1.00 77.90 57 A 1 ATOM 440 C CB . ASP A 0 57 . 15.191 -3.658 -8.384 1.00 77.90 57 A 1 ATOM 441 O O . ASP A 0 57 . 13.034 -1.203 -7.701 1.00 77.90 57 A 1 ATOM 442 C CG . ASP A 0 57 . 15.859 -4.750 -7.540 1.00 77.90 57 A 1 ATOM 443 O OD1 . ASP A 0 57 . 15.681 -4.713 -6.296 1.00 77.90 57 A 1 ATOM 444 O OD2 . ASP A 0 57 . 16.562 -5.593 -8.134 1.00 77.90 57 A 1 ATOM 445 N N . GLU A 0 58 . 12.782 -1.990 -9.787 1.00 77.26 58 A 1 ATOM 446 C CA . GLU A 0 58 . 12.163 -0.777 -10.349 1.00 77.26 58 A 1 ATOM 447 C C . GLU A 0 58 . 10.873 -0.376 -9.614 1.00 77.26 58 A 1 ATOM 448 C CB . GLU A 0 58 . 11.795 -1.030 -11.819 1.00 77.26 58 A 1 ATOM 449 O O . GLU A 0 58 . 10.619 0.801 -9.335 1.00 77.26 58 A 1 ATOM 450 C CG . GLU A 0 58 . 12.994 -1.326 -12.732 1.00 77.26 58 A 1 ATOM 451 C CD . GLU A 0 58 . 12.573 -1.585 -14.190 1.00 77.26 58 A 1 ATOM 452 O OE1 . GLU A 0 58 . 13.484 -1.805 -15.017 1.00 77.26 58 A 1 ATOM 453 O OE2 . GLU A 0 58 . 11.350 -1.604 -14.467 1.00 77.26 58 A 1 ATOM 454 N N . MET A 0 59 . 10.047 -1.363 -9.253 1.00 77.11 59 A 1 ATOM 455 C CA . MET A 0 59 . 8.812 -1.128 -8.504 1.00 77.11 59 A 1 ATOM 456 C C . MET A 0 59 . 9.115 -0.725 -7.064 1.00 77.11 59 A 1 ATOM 457 C CB . MET A 0 59 . 7.915 -2.374 -8.530 1.00 77.11 59 A 1 ATOM 458 O O . MET A 0 59 . 8.369 0.065 -6.485 1.00 77.11 59 A 1 ATOM 459 C CG . MET A 0 59 . 7.298 -2.622 -9.905 1.00 77.11 59 A 1 ATOM 460 S SD . MET A 0 59 . 5.973 -1.453 -10.319 1.00 77.11 59 A 1 ATOM 461 C CE . MET A 0 59 . 5.629 -2.005 -12.008 1.00 77.11 59 A 1 ATOM 462 N N . ARG A 0 60 . 10.210 -1.228 -6.481 1.00 76.84 60 A 1 ATOM 463 C CA . ARG A 0 60 . 10.658 -0.845 -5.138 1.00 76.84 60 A 1 ATOM 464 C C . ARG A 0 60 . 11.118 0.610 -5.099 1.00 76.84 60 A 1 ATOM 465 C CB . ARG A 0 60 . 11.764 -1.804 -4.681 1.00 76.84 60 A 1 ATOM 466 O O . ARG A 0 60 . 10.732 1.333 -4.183 1.00 76.84 60 A 1 ATOM 467 C CG . ARG A 0 60 . 12.117 -1.593 -3.202 1.00 76.84 60 A 1 ATOM 468 C CD . ARG A 0 60 . 13.242 -2.533 -2.761 1.00 76.84 60 A 1 ATOM 469 N NE . ARG A 0 60 . 14.535 -2.167 -3.369 1.00 76.84 60 A 1 ATOM 470 N NH1 . ARG A 0 60 . 15.785 -3.844 -2.426 1.00 76.84 60 A 1 ATOM 471 N NH2 . ARG A 0 60 . 16.738 -2.430 -3.864 1.00 76.84 60 A 1 ATOM 472 C CZ . ARG A 0 60 . 15.678 -2.811 -3.214 1.00 76.84 60 A 1 ATOM 473 N N . GLU A 0 61 . 11.905 1.049 -6.078 1.00 82.31 61 A 1 ATOM 474 C CA . GLU A 0 61 . 12.320 2.453 -6.191 1.00 82.31 61 A 1 ATOM 475 C C . GLU A 0 61 . 11.114 3.366 -6.403 1.00 82.31 61 A 1 ATOM 476 C CB . GLU A 0 61 . 13.333 2.633 -7.325 1.00 82.31 61 A 1 ATOM 477 O O . GLU A 0 61 . 10.904 4.297 -5.625 1.00 82.31 61 A 1 ATOM 478 C CG . GLU A 0 61 . 14.673 1.985 -6.957 1.00 82.31 61 A 1 ATOM 479 C CD . GLU A 0 61 . 15.789 2.287 -7.965 1.00 82.31 61 A 1 ATOM 480 O OE1 . GLU A 0 61 . 16.943 1.956 -7.610 1.00 82.31 61 A 1 ATOM 481 O OE2 . GLU A 0 61 . 15.493 2.850 -9.041 1.00 82.31 61 A 1 ATOM 482 N N . THR A 0 62 . 10.246 3.015 -7.355 1.00 80.56 62 A 1 ATOM 483 C CA . THR A 0 62 . 8.997 3.742 -7.613 1.00 80.56 62 A 1 ATOM 484 C C . THR A 0 62 . 8.132 3.826 -6.354 1.00 80.56 62 A 1 ATOM 485 C CB . THR A 0 62 . 8.202 3.055 -8.734 1.00 80.56 62 A 1 ATOM 486 O O . THR A 0 62 . 7.592 4.883 -6.026 1.00 80.56 62 A 1 ATOM 487 C CG2 . THR A 0 62 . 6.919 3.811 -9.086 1.00 80.56 62 A 1 ATOM 488 O OG1 . THR A 0 62 . 8.952 2.980 -9.918 1.00 80.56 62 A 1 ATOM 489 N N . TRP A 0 63 . 7.990 2.728 -5.607 1.00 77.90 63 A 1 ATOM 490 C CA . TRP A 0 63 . 7.262 2.713 -4.338 1.00 77.90 63 A 1 ATOM 491 C C . TRP A 0 63 . 7.888 3.665 -3.314 1.00 77.90 63 A 1 ATOM 492 C CB . TRP A 0 63 . 7.206 1.284 -3.793 1.00 77.90 63 A 1 ATOM 493 O O . TRP A 0 63 . 7.181 4.497 -2.745 1.00 77.90 63 A 1 ATOM 494 C CG . TRP A 0 63 . 6.595 1.185 -2.434 1.00 77.90 63 A 1 ATOM 495 C CD1 . TRP A 0 63 . 7.276 1.077 -1.270 1.00 77.90 63 A 1 ATOM 496 C CD2 . TRP A 0 63 . 5.185 1.257 -2.072 1.00 77.90 63 A 1 ATOM 497 C CE2 . TRP A 0 63 . 5.081 1.170 -0.652 1.00 77.90 63 A 1 ATOM 498 C CE3 . TRP A 0 63 . 3.985 1.397 -2.803 1.00 77.90 63 A 1 ATOM 499 N NE1 . TRP A 0 63 . 6.384 1.050 -0.217 1.00 77.90 63 A 1 ATOM 500 C CH2 . TRP A 0 63 . 2.669 1.349 -0.744 1.00 77.90 63 A 1 ATOM 501 C CZ2 . TRP A 0 63 . 3.846 1.214 0.012 1.00 77.90 63 A 1 ATOM 502 C CZ3 . TRP A 0 63 . 2.739 1.441 -2.147 1.00 77.90 63 A 1 ATOM 503 N N . ASN A 0 64 . 9.206 3.596 -3.116 1.00 84.31 64 A 1 ATOM 504 C CA . ASN A 0 64 . 9.925 4.458 -2.179 1.00 84.31 64 A 1 ATOM 505 C C . ASN A 0 64 . 9.774 5.943 -2.530 1.00 84.31 64 A 1 ATOM 506 C CB . ASN A 0 64 . 11.408 4.054 -2.165 1.00 84.31 64 A 1 ATOM 507 O O . ASN A 0 64 . 9.525 6.763 -1.643 1.00 84.31 64 A 1 ATOM 508 C CG . ASN A 0 64 . 11.669 2.735 -1.465 1.00 84.31 64 A 1 ATOM 509 N ND2 . ASN A 0 64 . 12.794 2.119 -1.739 1.00 84.31 64 A 1 ATOM 510 O OD1 . ASN A 0 64 . 10.910 2.267 -0.629 1.00 84.31 64 A 1 ATOM 511 N N . GLU A 0 65 . 9.872 6.297 -3.811 1.00 84.24 65 A 1 ATOM 512 C CA . GLU A 0 65 . 9.652 7.665 -4.280 1.00 84.24 65 A 1 ATOM 513 C C . GLU A 0 65 . 8.223 8.134 -4.023 1.00 84.24 65 A 1 ATOM 514 C CB . GLU A 0 65 . 9.935 7.770 -5.776 1.00 84.24 65 A 1 ATOM 515 O O . GLU A 0 65 . 8.018 9.234 -3.510 1.00 84.24 65 A 1 ATOM 516 C CG . GLU A 0 65 . 11.433 7.708 -6.086 1.00 84.24 65 A 1 ATOM 517 C CD . GLU A 0 65 . 11.721 8.012 -7.560 1.00 84.24 65 A 1 ATOM 518 O OE1 . GLU A 0 65 . 12.911 8.257 -7.846 1.00 84.24 65 A 1 ATOM 519 O OE2 . GLU A 0 65 . 10.751 8.093 -8.350 1.00 84.24 65 A 1 ATOM 520 N N . ASN A 0 66 . 7.225 7.297 -4.309 1.00 82.16 66 A 1 ATOM 521 C CA . ASN A 0 66 . 5.828 7.622 -4.034 1.00 82.16 66 A 1 ATOM 522 C C . ASN A 0 66 . 5.581 7.845 -2.538 1.00 82.16 66 A 1 ATOM 523 C CB . ASN A 0 66 . 4.919 6.517 -4.584 1.00 82.16 66 A 1 ATOM 524 O O . ASN A 0 66 . 4.929 8.819 -2.163 1.00 82.16 66 A 1 ATOM 525 C CG . ASN A 0 66 . 4.670 6.689 -6.066 1.00 82.16 66 A 1 ATOM 526 N ND2 . ASN A 0 66 . 5.157 5.804 -6.893 1.00 82.16 66 A 1 ATOM 527 O OD1 . ASN A 0 66 . 4.020 7.624 -6.498 1.00 82.16 66 A 1 ATOM 528 N N . VAL A 0 67 . 6.133 6.985 -1.679 1.00 85.82 67 A 1 ATOM 529 C CA . VAL A 0 67 . 6.041 7.131 -0.221 1.00 85.82 67 A 1 ATOM 530 C C . VAL A 0 67 . 6.710 8.432 0.230 1.00 85.82 67 A 1 ATOM 531 C CB . VAL A 0 67 . 6.644 5.896 0.477 1.00 85.82 67 A 1 ATOM 532 O O . VAL A 0 67 . 6.110 9.213 0.972 1.00 85.82 67 A 1 ATOM 533 C CG1 . VAL A 0 67 . 6.740 6.084 1.993 1.00 85.82 67 A 1 ATOM 534 C CG2 . VAL A 0 67 . 5.765 4.659 0.249 1.00 85.82 67 A 1 ATOM 535 N N . LYS A 0 68 . 7.917 8.726 -0.267 1.00 82.52 68 A 1 ATOM 536 C CA . LYS A 0 68 . 8.631 9.978 0.022 1.00 82.52 68 A 1 ATOM 537 C C . LYS A 0 68 . 7.831 11.199 -0.427 1.00 82.52 68 A 1 ATOM 538 C CB . LYS A 0 68 . 10.008 9.924 -0.652 1.00 82.52 68 A 1 ATOM 539 O O . LYS A 0 68 . 7.716 12.159 0.333 1.00 82.52 68 A 1 ATOM 540 C CG . LYS A 0 68 . 10.866 11.162 -0.354 1.00 82.52 68 A 1 ATOM 541 C CD . LYS A 0 68 . 12.220 11.029 -1.058 1.00 82.52 68 A 1 ATOM 542 C CE . LYS A 0 68 . 13.080 12.273 -0.822 1.00 82.52 68 A 1 ATOM 543 N NZ . LYS A 0 68 . 14.356 12.181 -1.576 1.00 82.52 68 A 1 ATOM 544 N N . ASN A 0 69 . 7.248 11.160 -1.621 1.00 81.37 69 A 1 ATOM 545 C CA . ASN A 0 69 . 6.433 12.241 -2.164 1.00 81.37 69 A 1 ATOM 546 C C . ASN A 0 69 . 5.153 12.437 -1.354 1.00 81.37 69 A 1 ATOM 547 C CB . ASN A 0 69 . 6.131 11.953 -3.644 1.00 81.37 69 A 1 ATOM 548 O O . ASN A 0 69 . 4.807 13.572 -1.051 1.00 81.37 69 A 1 ATOM 549 C CG . ASN A 0 69 . 7.343 12.164 -4.536 1.00 81.37 69 A 1 ATOM 550 N ND2 . ASN A 0 69 . 7.320 11.635 -5.736 1.00 81.37 69 A 1 ATOM 551 O OD1 . ASN A 0 69 . 8.302 12.828 -4.175 1.00 81.37 69 A 1 ATOM 552 N N . LEU A 0 70 . 4.489 11.358 -0.931 1.00 79.02 70 A 1 ATOM 553 C CA . LEU A 0 70 . 3.297 11.426 -0.087 1.00 79.02 70 A 1 ATOM 554 C C . LEU A 0 70 . 3.598 12.082 1.263 1.00 79.02 70 A 1 ATOM 555 C CB . LEU A 0 70 . 2.741 10.006 0.108 1.00 79.02 70 A 1 ATOM 556 O O . LEU A 0 70 . 2.870 12.980 1.686 1.00 79.02 70 A 1 ATOM 557 C CG . LEU A 0 70 . 1.481 9.950 0.991 1.00 79.02 70 A 1 ATOM 558 C CD1 . LEU A 0 70 . 0.295 10.668 0.342 1.00 79.02 70 A 1 ATOM 559 C CD2 . LEU A 0 70 . 1.097 8.495 1.242 1.00 79.02 70 A 1 ATOM 560 N N . PHE A 0 71 . 4.676 11.670 1.934 1.00 80.14 71 A 1 ATOM 561 C CA . PHE A 0 71 . 5.078 12.282 3.201 1.00 80.14 71 A 1 ATOM 562 C C . PHE A 0 71 . 5.575 13.717 3.017 1.00 80.14 71 A 1 ATOM 563 C CB . PHE A 0 71 . 6.127 11.416 3.903 1.00 80.14 71 A 1 ATOM 564 O O . PHE A 0 71 . 5.286 14.565 3.856 1.00 80.14 71 A 1 ATOM 565 C CG . PHE A 0 71 . 5.534 10.206 4.596 1.00 80.14 71 A 1 ATOM 566 C CD1 . PHE A 0 71 . 4.653 10.384 5.680 1.00 80.14 71 A 1 ATOM 567 C CD2 . PHE A 0 71 . 5.866 8.905 4.179 1.00 80.14 71 A 1 ATOM 568 C CE1 . PHE A 0 71 . 4.091 9.270 6.327 1.00 80.14 71 A 1 ATOM 569 C CE2 . PHE A 0 71 . 5.310 7.791 4.832 1.00 80.14 71 A 1 ATOM 570 C CZ . PHE A 0 71 . 4.417 7.972 5.900 1.00 80.14 71 A 1 ATOM 571 N N . THR A 0 72 . 6.250 14.020 1.908 1.00 79.08 72 A 1 ATOM 572 C CA . THR A 0 72 . 6.681 15.387 1.575 1.00 79.08 72 A 1 ATOM 573 C C . THR A 0 72 . 5.483 16.294 1.305 1.00 79.08 72 A 1 ATOM 574 C CB . THR A 0 72 . 7.642 15.394 0.379 1.00 79.08 72 A 1 ATOM 575 O O . THR A 0 72 . 5.416 17.386 1.857 1.00 79.08 72 A 1 ATOM 576 C CG2 . THR A 0 72 . 8.153 16.794 0.048 1.00 79.08 72 A 1 ATOM 577 O OG1 . THR A 0 72 . 8.767 14.605 0.687 1.00 79.08 72 A 1 ATOM 578 N N . TRP A 0 73 . 4.499 15.819 0.540 1.00 76.97 73 A 1 ATOM 579 C CA . TRP A 0 73 . 3.233 16.506 0.275 1.00 76.97 73 A 1 ATOM 580 C C . TRP A 0 73 . 2.413 16.700 1.552 1.00 76.97 73 A 1 ATOM 581 C CB . TRP A 0 73 . 2.439 15.683 -0.745 1.00 76.97 73 A 1 ATOM 582 O O . TRP A 0 73 . 1.862 17.770 1.806 1.00 76.97 73 A 1 ATOM 583 C CG . TRP A 0 73 . 1.083 16.220 -1.075 1.00 76.97 73 A 1 ATOM 584 C CD1 . TRP A 0 73 . 0.822 17.170 -2.000 1.00 76.97 73 A 1 ATOM 585 C CD2 . TRP A 0 73 . -0.205 15.873 -0.479 1.00 76.97 73 A 1 ATOM 586 C CE2 . TRP A 0 73 . -1.220 16.628 -1.141 1.00 76.97 73 A 1 ATOM 587 C CE3 . TRP A 0 73 . -0.618 15.015 0.564 1.00 76.97 73 A 1 ATOM 588 N NE1 . TRP A 0 73 . -0.537 17.406 -2.053 1.00 76.97 73 A 1 ATOM 589 C CH2 . TRP A 0 73 . -2.947 15.703 0.281 1.00 76.97 73 A 1 ATOM 590 C CZ2 . TRP A 0 73 . -2.572 16.553 -0.774 1.00 76.97 73 A 1 ATOM 591 C CZ3 . TRP A 0 73 . -1.972 14.934 0.942 1.00 76.97 73 A 1 ATOM 592 N N . THR A 0 74 . 2.373 15.675 2.405 1.00 75.27 74 A 1 ATOM 593 C CA . THR A 0 74 . 1.726 15.762 3.717 1.00 75.27 74 A 1 ATOM 594 C C . THR A 0 74 . 2.433 16.797 4.583 1.00 75.27 74 A 1 ATOM 595 C CB . THR A 0 74 . 1.701 14.403 4.424 1.00 75.27 74 A 1 ATOM 596 O O . THR A 0 74 . 1.767 17.619 5.196 1.00 75.27 74 A 1 ATOM 597 C CG2 . THR A 0 74 . 0.972 14.460 5.765 1.00 75.27 74 A 1 ATOM 598 O OG1 . THR A 0 74 . 1.022 13.465 3.625 1.00 75.27 74 A 1 ATOM 599 N N . ARG A 0 75 . 3.770 16.824 4.589 1.00 69.92 75 A 1 ATOM 600 C CA . ARG A 0 75 . 4.568 17.827 5.304 1.00 69.92 75 A 1 ATOM 601 C C . ARG A 0 75 . 4.387 19.236 4.736 1.00 69.92 75 A 1 ATOM 602 C CB . ARG A 0 75 . 6.043 17.400 5.290 1.00 69.92 75 A 1 ATOM 603 O O . ARG A 0 75 . 4.365 20.179 5.512 1.00 69.92 75 A 1 ATOM 604 C CG . ARG A 0 75 . 6.928 18.343 6.114 1.00 69.92 75 A 1 ATOM 605 C CD . ARG A 0 75 . 8.389 17.893 6.055 1.00 69.92 75 A 1 ATOM 606 N NE . ARG A 0 75 . 9.265 18.841 6.770 1.00 69.92 75 A 1 ATOM 607 N NH1 . ARG A 0 75 . 9.216 17.846 8.842 1.00 69.92 75 A 1 ATOM 608 N NH2 . ARG A 0 75 . 10.381 19.726 8.545 1.00 69.92 75 A 1 ATOM 609 C CZ . ARG A 0 75 . 9.615 18.797 8.044 1.00 69.92 75 A 1 ATOM 610 N N . SER A 0 76 . 4.248 19.402 3.420 1.00 67.99 76 A 1 ATOM 611 C CA . SER A 0 76 . 4.003 20.720 2.819 1.00 67.99 76 A 1 ATOM 612 C C . SER A 0 76 . 2.587 21.231 3.092 1.00 67.99 76 A 1 ATOM 613 C CB . SER A 0 76 . 4.300 20.712 1.315 1.00 67.99 76 A 1 ATOM 614 O O . SER A 0 76 . 2.396 22.434 3.226 1.00 67.99 76 A 1 ATOM 615 O OG . SER A 0 76 . 3.457 19.834 0.598 1.00 67.99 76 A 1 ATOM 616 N N . ASN A 0 77 . 1.602 20.331 3.200 1.00 59.09 77 A 1 ATOM 617 C CA . ASN A 0 77 . 0.221 20.672 3.564 1.00 59.09 77 A 1 ATOM 618 C C . ASN A 0 77 . -0.020 20.743 5.069 1.00 59.09 77 A 1 ATOM 619 C CB . ASN A 0 77 . -0.736 19.653 2.948 1.00 59.09 77 A 1 ATOM 620 O O . ASN A 0 77 . -0.994 21.360 5.502 1.00 59.09 77 A 1 ATOM 621 C CG . ASN A 0 77 . -0.911 19.872 1.468 1.00 59.09 77 A 1 ATOM 622 N ND2 . ASN A 0 77 . -1.117 18.815 0.741 1.00 59.09 77 A 1 ATOM 623 O OD1 . ASN A 0 77 . -0.885 20.968 0.941 1.00 59.09 77 A 1 ATOM 624 N N . GLN A 0 78 . 0.858 20.148 5.878 1.00 56.95 78 A 1 ATOM 625 C CA . GLN A 0 78 . 1.014 20.520 7.274 1.00 56.95 78 A 1 ATOM 626 C C . GLN A 0 78 . 1.530 21.952 7.271 1.00 56.95 78 A 1 ATOM 627 C CB . GLN A 0 78 . 1.962 19.562 8.014 1.00 56.95 78 A 1 ATOM 628 O O . GLN A 0 78 . 2.730 22.203 7.321 1.00 56.95 78 A 1 ATOM 629 C CG . GLN A 0 78 . 1.299 18.221 8.355 1.00 56.95 78 A 1 ATOM 630 C CD . GLN A 0 78 . 2.275 17.207 8.945 1.00 56.95 78 A 1 ATOM 631 N NE2 . GLN A 0 78 . 1.870 15.964 9.081 1.00 56.95 78 A 1 ATOM 632 O OE1 . GLN A 0 78 . 3.405 17.490 9.310 1.00 56.95 78 A 1 ATOM 633 N N . CYS A 0 79 . 0.594 22.897 7.158 1.00 52.31 79 A 1 ATOM 634 C CA . CYS A 0 79 . 0.797 24.285 7.504 1.00 52.31 79 A 1 ATOM 635 C C . CYS A 0 79 . 1.758 24.343 8.693 1.00 52.31 79 A 1 ATOM 636 C CB . CYS A 0 79 . -0.504 24.859 8.042 1.00 52.31 79 A 1 ATOM 637 O O . CYS A 0 79 . 1.370 24.009 9.816 1.00 52.31 79 A 1 ATOM 638 S SG . CYS A 0 79 . -1.821 25.552 7.046 1.00 52.31 79 A 1 ATOM 639 N N . SER A 0 80 . 2.981 24.809 8.459 1.00 53.75 80 A 1 ATOM 640 C CA . SER A 0 80 . 3.976 24.951 9.519 1.00 53.75 80 A 1 ATOM 641 C C . SER A 0 80 . 3.472 25.828 10.677 1.00 53.75 80 A 1 ATOM 642 C CB . SER A 0 80 . 5.264 25.519 8.921 1.00 53.75 80 A 1 ATOM 643 O O . SER A 0 80 . 4.043 25.760 11.756 1.00 53.75 80 A 1 ATOM 644 O OG . SER A 0 80 . 6.295 25.522 9.882 1.00 53.75 80 A 1 ATOM 645 N N . ASN A 0 81 . 2.392 26.601 10.475 1.00 50.19 81 A 1 ATOM 646 C CA . ASN A 0 81 . 1.782 27.489 11.466 1.00 50.19 81 A 1 ATOM 647 C C . ASN A 0 81 . 0.250 27.367 11.624 1.00 50.19 81 A 1 ATOM 648 C CB . ASN A 0 81 . 2.189 28.933 11.109 1.00 50.19 81 A 1 ATOM 649 O O . ASN A 0 81 . -0.334 28.169 12.354 1.00 50.19 81 A 1 ATOM 650 C CG . ASN A 0 81 . 3.589 29.302 11.563 1.00 50.19 81 A 1 ATOM 651 N ND2 . ASN A 0 81 . 4.048 30.479 11.218 1.00 50.19 81 A 1 ATOM 652 O OD1 . ASN A 0 81 . 4.286 28.577 12.244 1.00 50.19 81 A 1 ATOM 653 N N . CYS A 0 82 . -0.448 26.413 10.993 1.00 51.62 82 A 1 ATOM 654 C CA . CYS A 0 82 . -1.903 26.318 11.200 1.00 51.62 82 A 1 ATOM 655 C C . CYS A 0 82 . -2.143 25.510 12.466 1.00 51.62 82 A 1 ATOM 656 C CB . CYS A 0 82 . -2.710 25.798 9.994 1.00 51.62 82 A 1 ATOM 657 O O . CYS A 0 82 . -2.185 24.286 12.417 1.00 51.62 82 A 1 ATOM 658 S SG . CYS A 0 82 . -2.579 26.808 8.481 1.00 51.62 82 A 1 ATOM 659 N N . ASN A 0 83 . -2.247 26.225 13.590 1.00 52.26 83 A 1 ATOM 660 C CA . ASN A 0 83 . -2.900 25.848 14.842 1.00 52.26 83 A 1 ATOM 661 C C . ASN A 0 83 . -3.693 24.535 14.749 1.00 52.26 83 A 1 ATOM 662 C CB . ASN A 0 83 . -3.830 27.017 15.236 1.00 52.26 83 A 1 ATOM 663 O O . ASN A 0 83 . -4.918 24.545 14.641 1.00 52.26 83 A 1 ATOM 664 C CG . ASN A 0 83 . -3.083 28.216 15.777 1.00 52.26 83 A 1 ATOM 665 N ND2 . ASN A 0 83 . -3.545 29.411 15.499 1.00 52.26 83 A 1 ATOM 666 O OD1 . ASN A 0 83 . -2.105 28.076 16.488 1.00 52.26 83 A 1 ATOM 667 N N . MET A 0 84 . -3.010 23.388 14.830 1.00 52.90 84 A 1 ATOM 668 C CA . MET A 0 84 . -3.652 22.076 14.694 1.00 52.90 84 A 1 ATOM 669 C C . MET A 0 84 . -4.682 21.855 15.812 1.00 52.90 84 A 1 ATOM 670 C CB . MET A 0 84 . -2.560 20.997 14.630 1.00 52.90 84 A 1 ATOM 671 O O . MET A 0 84 . -5.664 21.141 15.627 1.00 52.90 84 A 1 ATOM 672 C CG . MET A 0 84 . -3.092 19.635 14.169 1.00 52.90 84 A 1 ATOM 673 S SD . MET A 0 84 . -1.871 18.609 13.302 1.00 52.90 84 A 1 ATOM 674 C CE . MET A 0 84 . -0.693 18.236 14.628 1.00 52.90 84 A 1 ATOM 675 N N . LYS A 0 85 . -4.533 22.587 16.928 1.00 52.62 85 A 1 ATOM 676 C CA . LYS A 0 85 . -5.551 22.730 17.975 1.00 52.62 85 A 1 ATOM 677 C C . LYS A 0 85 . -6.891 23.258 17.445 1.00 52.62 85 A 1 ATOM 678 C CB . LYS A 0 85 . -5.037 23.645 19.102 1.00 52.62 85 A 1 ATOM 679 O O . LYS A 0 85 . -7.925 22.790 17.897 1.00 52.62 85 A 1 ATOM 680 C CG . LYS A 0 85 . -3.864 23.032 19.885 1.00 52.62 85 A 1 ATOM 681 C CD . LYS A 0 85 . -3.575 23.830 21.167 1.00 52.62 85 A 1 ATOM 682 C CE . LYS A 0 85 . -2.430 23.181 21.956 1.00 52.62 85 A 1 ATOM 683 N NZ . LYS A 0 85 . -2.234 23.820 23.283 1.00 52.62 85 A 1 ATOM 684 N N . GLN A 0 86 . -6.899 24.196 16.500 1.00 56.83 86 A 1 ATOM 685 C CA . GLN A 0 86 . -8.120 24.811 15.971 1.00 56.83 86 A 1 ATOM 686 C C . GLN A 0 86 . -8.852 23.875 14.993 1.00 56.83 86 A 1 ATOM 687 C CB . GLN A 0 86 . -7.766 26.182 15.368 1.00 56.83 86 A 1 ATOM 688 O O . GLN A 0 86 . -10.069 23.734 15.098 1.00 56.83 86 A 1 ATOM 689 C CG . GLN A 0 86 . -8.900 27.211 15.515 1.00 56.83 86 A 1 ATOM 690 C CD . GLN A 0 86 . -8.466 28.624 15.121 1.00 56.83 86 A 1 ATOM 691 N NE2 . GLN A 0 86 . -9.250 29.633 15.432 1.00 56.83 86 A 1 ATOM 692 O OE1 . GLN A 0 86 . -7.408 28.854 14.557 1.00 56.83 86 A 1 ATOM 693 N N . CYS A 0 87 . -8.124 23.143 14.138 1.00 51.37 87 A 1 ATOM 694 C CA . CYS A 0 87 . -8.726 22.106 13.286 1.00 51.37 87 A 1 ATOM 695 C C . CYS A 0 87 . -9.268 20.918 14.096 1.00 51.37 87 A 1 ATOM 696 C CB . CYS A 0 87 . -7.723 21.619 12.231 1.00 51.37 87 A 1 ATOM 697 O O . CYS A 0 87 . -10.368 20.447 13.823 1.00 51.37 87 A 1 ATOM 698 S SG . CYS A 0 87 . -7.726 22.760 10.823 1.00 51.37 87 A 1 ATOM 699 N N . PHE A 0 88 . -8.542 20.450 15.118 1.00 52.44 88 A 1 ATOM 700 C CA . PHE A 0 88 . -9.022 19.335 15.943 1.00 52.44 88 A 1 ATOM 701 C C . PHE A 0 88 . -10.177 19.722 16.870 1.00 52.44 88 A 1 ATOM 702 C CB . PHE A 0 88 . -7.867 18.699 16.724 1.00 52.44 88 A 1 ATOM 703 O O . PHE A 0 88 . -11.045 18.889 17.125 1.00 52.44 88 A 1 ATOM 704 C CG . PHE A 0 88 . -7.319 17.472 16.029 1.00 52.44 88 A 1 ATOM 705 C CD1 . PHE A 0 88 . -7.876 16.211 16.315 1.00 52.44 88 A 1 ATOM 706 C CD2 . PHE A 0 88 . -6.298 17.586 15.068 1.00 52.44 88 A 1 ATOM 707 C CE1 . PHE A 0 88 . -7.400 15.064 15.657 1.00 52.44 88 A 1 ATOM 708 C CE2 . PHE A 0 88 . -5.821 16.438 14.410 1.00 52.44 88 A 1 ATOM 709 C CZ . PHE A 0 88 . -6.371 15.178 14.706 1.00 52.44 88 A 1 ATOM 710 N N . ASN A 0 89 . -10.239 20.977 17.331 1.00 55.85 89 A 1 ATOM 711 C CA . ASN A 0 89 . -11.382 21.454 18.110 1.00 55.85 89 A 1 ATOM 712 C C . ASN A 0 89 . -12.668 21.471 17.262 1.00 55.85 89 A 1 ATOM 713 C CB . ASN A 0 89 . -11.036 22.822 18.723 1.00 55.85 89 A 1 ATOM 714 O O . ASN A 0 89 . -13.726 21.086 17.748 1.00 55.85 89 A 1 ATOM 715 C CG . ASN A 0 89 . -11.926 23.205 19.891 1.00 55.85 89 A 1 ATOM 716 N ND2 . ASN A 0 89 . -11.689 24.349 20.486 1.00 55.85 89 A 1 ATOM 717 O OD1 . ASN A 0 89 . -12.797 22.485 20.332 1.00 55.85 89 A 1 ATOM 718 N N . SER A 0 90 . -12.571 21.790 15.963 1.00 60.48 90 A 1 ATOM 719 C CA . SER A 0 90 . -13.725 21.708 15.052 1.00 60.48 90 A 1 ATOM 720 C C . SER A 0 90 . -14.268 20.287 14.886 1.00 60.48 90 A 1 ATOM 721 C CB . SER A 0 90 . -13.365 22.243 13.667 1.00 60.48 90 A 1 ATOM 722 O O . SER A 0 90 . -15.448 20.129 14.588 1.00 60.48 90 A 1 ATOM 723 O OG . SER A 0 90 . -14.520 22.272 12.851 1.00 60.48 90 A 1 ATOM 724 N N . PHE A 0 91 . -13.439 19.257 15.067 1.00 57.06 91 A 1 ATOM 725 C CA . PHE A 0 91 . -13.886 17.867 14.975 1.00 57.06 91 A 1 ATOM 726 C C . PHE A 0 91 . -14.540 17.350 16.265 1.00 57.06 91 A 1 ATOM 727 C CB . PHE A 0 91 . -12.743 16.976 14.458 1.00 57.06 91 A 1 ATOM 728 O O . PHE A 0 91 . -14.951 16.195 16.307 1.00 57.06 91 A 1 ATOM 729 C CG . PHE A 0 91 . -12.936 16.600 13.002 1.00 57.06 91 A 1 ATOM 730 C CD1 . PHE A 0 91 . -13.721 15.479 12.671 1.00 57.06 91 A 1 ATOM 731 C CD2 . PHE A 0 91 . -12.391 17.399 11.980 1.00 57.06 91 A 1 ATOM 732 C CE1 . PHE A 0 91 . -13.947 15.148 11.323 1.00 57.06 91 A 1 ATOM 733 C CE2 . PHE A 0 91 . -12.618 17.067 10.631 1.00 57.06 91 A 1 ATOM 734 C CZ . PHE A 0 91 . -13.394 15.941 10.303 1.00 57.06 91 A 1 ATOM 735 N N . GLY A 0 92 . -14.640 18.170 17.322 1.00 51.68 92 A 1 ATOM 736 C CA . GLY A 0 92 . -15.359 17.825 18.555 1.00 51.68 92 A 1 ATOM 737 C C . GLY A 0 92 . -14.787 16.630 19.331 1.00 51.68 92 A 1 ATOM 738 O O . GLY A 0 92 . -15.375 16.203 20.321 1.00 51.68 92 A 1 ATOM 739 N N . LEU A 0 93 . -13.635 16.088 18.918 1.00 53.16 93 A 1 ATOM 740 C CA . LEU A 0 93 . -13.075 14.845 19.465 1.00 53.16 93 A 1 ATOM 741 C C . LEU A 0 93 . -12.397 15.009 20.828 1.00 53.16 93 A 1 ATOM 742 C CB . LEU A 0 93 . -12.119 14.216 18.435 1.00 53.16 93 A 1 ATOM 743 O O . LEU A 0 93 . -12.129 14.019 21.501 1.00 53.16 93 A 1 ATOM 744 C CG . LEU A 0 93 . -12.835 13.420 17.330 1.00 53.16 93 A 1 ATOM 745 C CD1 . LEU A 0 93 . -11.812 12.992 16.278 1.00 53.16 93 A 1 ATOM 746 C CD2 . LEU A 0 93 . -13.515 12.157 17.870 1.00 53.16 93 A 1 ATOM 747 N N . PHE A 0 94 . -12.163 16.245 21.266 1.00 51.20 94 A 1 ATOM 748 C CA . PHE A 0 94 . -11.701 16.549 22.618 1.00 51.20 94 A 1 ATOM 749 C C . PHE A 0 94 . -12.758 17.355 23.370 1.00 51.20 94 A 1 ATOM 750 C CB . PHE A 0 94 . -10.303 17.176 22.588 1.00 51.20 94 A 1 ATOM 751 O O . PHE A 0 94 . -12.481 18.411 23.938 1.00 51.20 94 A 1 ATOM 752 C CG . PHE A 0 94 . -9.220 16.193 22.186 1.00 51.20 94 A 1 ATOM 753 C CD1 . PHE A 0 94 . -8.695 15.299 23.140 1.00 51.20 94 A 1 ATOM 754 C CD2 . PHE A 0 94 . -8.747 16.157 20.861 1.00 51.20 94 A 1 ATOM 755 C CE1 . PHE A 0 94 . -7.694 14.382 22.773 1.00 51.20 94 A 1 ATOM 756 C CE2 . PHE A 0 94 . -7.745 15.241 20.495 1.00 51.20 94 A 1 ATOM 757 C CZ . PHE A 0 94 . -7.217 14.355 21.451 1.00 51.20 94 A 1 ATOM 758 N N . GLY A 0 95 . -13.990 16.841 23.385 1.00 50.98 95 A 1 ATOM 759 C CA . GLY A 0 95 . -14.928 17.165 24.450 1.00 50.98 95 A 1 ATOM 760 C C . GLY A 0 95 . -14.248 16.873 25.785 1.00 50.98 95 A 1 ATOM 761 O O . GLY A 0 95 . -13.933 15.722 26.088 1.00 50.98 95 A 1 ATOM 762 N N . LYS A 0 96 . -13.948 17.938 26.539 1.00 50.06 96 A 1 ATOM 763 C CA . LYS A 0 96 . -13.434 17.878 27.909 1.00 50.06 96 A 1 ATOM 764 C C . LYS A 0 96 . -14.247 16.844 28.691 1.00 50.06 96 A 1 ATOM 765 C CB . LYS A 0 96 . -13.600 19.249 28.596 1.00 50.06 96 A 1 ATOM 766 O O . LYS A 0 96 . -15.417 17.084 28.981 1.00 50.06 96 A 1 ATOM 767 C CG . LYS A 0 96 . -12.411 20.211 28.467 1.00 50.06 96 A 1 ATOM 768 C CD . LYS A 0 96 . -12.701 21.452 29.328 1.00 50.06 96 A 1 ATOM 769 C CE . LYS A 0 96 . -11.471 22.348 29.498 1.00 50.06 96 A 1 ATOM 770 N NZ . LYS A 0 96 . -11.782 23.513 30.366 1.00 50.06 96 A 1 ATOM 771 N N . LYS A 0 97 . -13.622 15.733 29.081 1.00 51.35 97 A 1 ATOM 772 C CA . LYS A 0 97 . -14.060 15.048 30.294 1.00 51.35 97 A 1 ATOM 773 C C . LYS A 0 97 . -13.677 15.964 31.452 1.00 51.35 97 A 1 ATOM 774 C CB . LYS A 0 97 . -13.457 13.643 30.425 1.00 51.35 97 A 1 ATOM 775 O O . LYS A 0 97 . -12.491 16.217 31.665 1.00 51.35 97 A 1 ATOM 776 C CG . LYS A 0 97 . -14.349 12.601 29.733 1.00 51.35 97 A 1 ATOM 777 C CD . LYS A 0 97 . -13.835 11.182 30.000 1.00 51.35 97 A 1 ATOM 778 C CE . LYS A 0 97 . -14.808 10.149 29.422 1.00 51.35 97 A 1 ATOM 779 N NZ . LYS A 0 97 . -14.359 8.764 29.709 1.00 51.35 97 A 1 ATOM 780 N N . SER A 0 98 . -14.703 16.555 32.062 1.00 54.30 98 A 1 ATOM 781 C CA . SER A 0 98 . -14.632 17.093 33.419 1.00 54.30 98 A 1 ATOM 782 C C . SER A 0 98 . -14.172 16.022 34.399 1.00 54.30 98 A 1 ATOM 783 C CB . SER A 0 98 . -16.010 17.592 33.846 1.00 54.30 98 A 1 ATOM 784 O O . SER A 0 98 . -14.349 14.821 34.087 1.00 54.30 98 A 1 ATOM 785 O OG . SER A 0 98 . -15.882 18.114 35.144 1.00 54.30 98 A 1 ATOM 786 O OXT . SER A 0 98 . -13.724 16.481 35.467 1.00 54.30 98 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 63.40 # loop_ _atom_type.symbol C N O S #