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 LEU 0 3 ASN 0 4 LYS 0 5 GLN 0 6 TYR 0 7 TYR 0 8 MET 0 9 SER 0 10 ILE 0 11 THR 0 12 VAL 0 13 MET 0 14 PHE 0 15 ILE 0 16 TYR 0 17 ILE 0 18 LEU 0 19 ILE 0 20 SER 0 21 SER 0 22 ILE 0 23 TYR 0 24 ILE 0 25 GLY 0 26 ASN 0 27 SER 0 28 GLY 0 29 ALA 0 30 LEU 0 31 LYS 0 32 CYS 0 33 TYR 0 34 VAL 0 35 CYS 0 36 GLN 0 37 ASN 0 38 CYS 0 39 SER 0 40 ASN 0 41 VAL 0 42 THR 0 43 GLY 0 44 LYS 0 45 ALA 0 46 ASN 0 47 PHE 0 48 THR 0 49 ILE 0 50 GLY 0 51 ASP 0 52 ASN 0 53 CYS 0 54 LYS 0 55 PHE 0 56 CYS 0 57 GLN 0 58 LYS 0 59 ILE 0 60 VAL 0 61 ARG 0 62 LEU 0 63 LYS 0 64 ASN 0 65 GLY 0 66 PHE 0 67 LEU 0 68 ASN 0 69 SER 0 70 THR 0 71 THR 0 72 ARG 0 73 SER 0 74 CYS 0 75 LEU 0 76 THR 0 77 ASP 0 78 THR 0 79 CYS 0 80 VAL 0 81 ASN 0 82 SER 0 83 ASN 0 84 LYS 0 85 SER 0 86 GLU 0 87 SER 0 88 PRO 0 89 TRP 0 90 LEU 0 91 ASN 0 92 ILE 0 93 THR 0 94 THR 0 95 CYS 0 96 CYS 0 97 THR 0 98 LYS 0 99 PRO 0 100 ASP 0 101 LEU 0 102 CYS 0 103 ASN 0 104 GLN 0 105 SER 0 106 VAL 0 107 ARG 0 108 THR 0 109 THR 0 110 SER 0 111 LYS 0 112 MET 0 113 ASN 0 114 ILE 0 115 GLN 0 116 PHE 0 117 ILE 0 118 TRP 0 119 ILE 0 120 LEU 0 121 PHE 0 122 SER 0 123 ILE 0 124 TRP 0 125 ILE 0 126 TRP 0 127 TYR 0 128 ASN 0 129 CYS # 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 . -35.706 -7.449 38.279 1.00 59.29 1 A 1 ATOM 2 C CA . MET A 0 1 . -34.382 -7.719 37.669 1.00 59.29 1 A 1 ATOM 3 C C . MET A 0 1 . -34.484 -8.112 36.196 1.00 59.29 1 A 1 ATOM 4 C CB . MET A 0 1 . -33.573 -8.719 38.500 1.00 59.29 1 A 1 ATOM 5 O O . MET A 0 1 . -33.776 -7.502 35.407 1.00 59.29 1 A 1 ATOM 6 C CG . MET A 0 1 . -33.074 -8.028 39.776 1.00 59.29 1 A 1 ATOM 7 S SD . MET A 0 1 . -32.163 -9.128 40.875 1.00 59.29 1 A 1 ATOM 8 C CE . MET A 0 1 . -31.392 -7.926 41.994 1.00 59.29 1 A 1 ATOM 9 N N . LEU A 0 2 . -35.413 -8.998 35.805 1.00 66.42 2 A 1 ATOM 10 C CA . LEU A 0 2 . -35.619 -9.429 34.406 1.00 66.42 2 A 1 ATOM 11 C C . LEU A 0 2 . -35.734 -8.272 33.388 1.00 66.42 2 A 1 ATOM 12 C CB . LEU A 0 2 . -36.875 -10.324 34.353 1.00 66.42 2 A 1 ATOM 13 O O . LEU A 0 2 . -35.058 -8.295 32.365 1.00 66.42 2 A 1 ATOM 14 C CG . LEU A 0 2 . -36.715 -11.689 35.058 1.00 66.42 2 A 1 ATOM 15 C CD1 . LEU A 0 2 . -38.087 -12.313 35.311 1.00 66.42 2 A 1 ATOM 16 C CD2 . LEU A 0 2 . -35.865 -12.652 34.232 1.00 66.42 2 A 1 ATOM 17 N N . ASN A 0 3 . -36.486 -7.205 33.702 1.00 74.80 3 A 1 ATOM 18 C CA . ASN A 0 3 . -36.571 -6.027 32.822 1.00 74.80 3 A 1 ATOM 19 C C . ASN A 0 3 . -35.208 -5.345 32.608 1.00 74.80 3 A 1 ATOM 20 C CB . ASN A 0 3 . -37.619 -5.026 33.363 1.00 74.80 3 A 1 ATOM 21 O O . ASN A 0 3 . -34.862 -5.026 31.478 1.00 74.80 3 A 1 ATOM 22 C CG . ASN A 0 3 . -39.043 -5.363 32.949 1.00 74.80 3 A 1 ATOM 23 N ND2 . ASN A 0 3 . -40.027 -4.655 33.451 1.00 74.80 3 A 1 ATOM 24 O OD1 . ASN A 0 3 . -39.295 -6.269 32.184 1.00 74.80 3 A 1 ATOM 25 N N . LYS A 0 4 . -34.402 -5.158 33.665 1.00 76.71 4 A 1 ATOM 26 C CA . LYS A 0 4 . -33.071 -4.531 33.558 1.00 76.71 4 A 1 ATOM 27 C C . LYS A 0 4 . -32.140 -5.358 32.664 1.00 76.71 4 A 1 ATOM 28 C CB . LYS A 0 4 . -32.468 -4.310 34.960 1.00 76.71 4 A 1 ATOM 29 O O . LYS A 0 4 . -31.446 -4.788 31.829 1.00 76.71 4 A 1 ATOM 30 C CG . LYS A 0 4 . -31.131 -3.545 34.919 1.00 76.71 4 A 1 ATOM 31 C CD . LYS A 0 4 . -30.497 -3.418 36.313 1.00 76.71 4 A 1 ATOM 32 C CE . LYS A 0 4 . -29.119 -2.745 36.206 1.00 76.71 4 A 1 ATOM 33 N NZ . LYS A 0 4 . -28.351 -2.820 37.477 1.00 76.71 4 A 1 ATOM 34 N N . GLN A 0 5 . -32.160 -6.683 32.817 1.00 73.01 5 A 1 ATOM 35 C CA . GLN A 0 5 . -31.346 -7.602 32.014 1.00 73.01 5 A 1 ATOM 36 C C . GLN A 0 5 . -31.747 -7.578 30.532 1.00 73.01 5 A 1 ATOM 37 C CB . GLN A 0 5 . -31.462 -9.020 32.592 1.00 73.01 5 A 1 ATOM 38 O O . GLN A 0 5 . -30.877 -7.504 29.666 1.00 73.01 5 A 1 ATOM 39 C CG . GLN A 0 5 . -30.681 -9.165 33.910 1.00 73.01 5 A 1 ATOM 40 C CD . GLN A 0 5 . -30.830 -10.548 34.536 1.00 73.01 5 A 1 ATOM 41 N NE2 . GLN A 0 5 . -29.852 -11.003 35.290 1.00 73.01 5 A 1 ATOM 42 O OE1 . GLN A 0 5 . -31.851 -11.207 34.392 1.00 73.01 5 A 1 ATOM 43 N N . TYR A 0 6 . -33.050 -7.548 30.237 1.00 82.24 6 A 1 ATOM 44 C CA . TYR A 0 6 . -33.557 -7.438 28.867 1.00 82.24 6 A 1 ATOM 45 C C . TYR A 0 6 . -33.094 -6.144 28.177 1.00 82.24 6 A 1 ATOM 46 C CB . TYR A 0 6 . -35.084 -7.549 28.904 1.00 82.24 6 A 1 ATOM 47 O O . TYR A 0 6 . -32.543 -6.193 27.078 1.00 82.24 6 A 1 ATOM 48 C CG . TYR A 0 6 . -35.741 -7.465 27.543 1.00 82.24 6 A 1 ATOM 49 C CD1 . TYR A 0 6 . -36.409 -6.287 27.153 1.00 82.24 6 A 1 ATOM 50 C CD2 . TYR A 0 6 . -35.694 -8.572 26.674 1.00 82.24 6 A 1 ATOM 51 C CE1 . TYR A 0 6 . -37.061 -6.228 25.906 1.00 82.24 6 A 1 ATOM 52 C CE2 . TYR A 0 6 . -36.332 -8.511 25.422 1.00 82.24 6 A 1 ATOM 53 O OH . TYR A 0 6 . -37.613 -7.282 23.817 1.00 82.24 6 A 1 ATOM 54 C CZ . TYR A 0 6 . -37.029 -7.346 25.042 1.00 82.24 6 A 1 ATOM 55 N N . TYR A 0 7 . -33.221 -4.990 28.846 1.00 82.23 7 A 1 ATOM 56 C CA . TYR A 0 7 . -32.753 -3.715 28.289 1.00 82.23 7 A 1 ATOM 57 C C . TYR A 0 7 . -31.236 -3.686 28.085 1.00 82.23 7 A 1 ATOM 58 C CB . TYR A 0 7 . -33.191 -2.545 29.180 1.00 82.23 7 A 1 ATOM 59 O O . TYR A 0 7 . -30.769 -3.175 27.071 1.00 82.23 7 A 1 ATOM 60 C CG . TYR A 0 7 . -34.688 -2.307 29.186 1.00 82.23 7 A 1 ATOM 61 C CD1 . TYR A 0 7 . -35.347 -1.966 27.989 1.00 82.23 7 A 1 ATOM 62 C CD2 . TYR A 0 7 . -35.425 -2.418 30.379 1.00 82.23 7 A 1 ATOM 63 C CE1 . TYR A 0 7 . -36.743 -1.789 27.979 1.00 82.23 7 A 1 ATOM 64 C CE2 . TYR A 0 7 . -36.824 -2.272 30.370 1.00 82.23 7 A 1 ATOM 65 O OH . TYR A 0 7 . -38.834 -1.810 29.141 1.00 82.23 7 A 1 ATOM 66 C CZ . TYR A 0 7 . -37.486 -1.962 29.164 1.00 82.23 7 A 1 ATOM 67 N N . MET A 0 8 . -30.467 -4.260 29.013 1.00 79.80 8 A 1 ATOM 68 C CA . MET A 0 8 . -29.010 -4.326 28.905 1.00 79.80 8 A 1 ATOM 69 C C . MET A 0 8 . -28.549 -5.191 27.724 1.00 79.80 8 A 1 ATOM 70 C CB . MET A 0 8 . -28.449 -4.847 30.229 1.00 79.80 8 A 1 ATOM 71 O O . MET A 0 8 . -27.624 -4.819 27.009 1.00 79.80 8 A 1 ATOM 72 C CG . MET A 0 8 . -26.932 -4.725 30.261 1.00 79.80 8 A 1 ATOM 73 S SD . MET A 0 8 . -26.241 -5.180 31.861 1.00 79.80 8 A 1 ATOM 74 C CE . MET A 0 8 . -24.576 -4.587 31.532 1.00 79.80 8 A 1 ATOM 75 N N . SER A 0 9 . -29.210 -6.325 27.482 1.00 80.35 9 A 1 ATOM 76 C CA . SER A 0 9 . -28.896 -7.186 26.337 1.00 80.35 9 A 1 ATOM 77 C C . SER A 0 9 . -29.193 -6.489 25.002 1.00 80.35 9 A 1 ATOM 78 C CB . SER A 0 9 . -29.679 -8.493 26.465 1.00 80.35 9 A 1 ATOM 79 O O . SER A 0 9 . -28.357 -6.499 24.096 1.00 80.35 9 A 1 ATOM 80 O OG . SER A 0 9 . -29.332 -9.379 25.423 1.00 80.35 9 A 1 ATOM 81 N N . ILE A 0 10 . -30.337 -5.799 24.900 1.00 85.03 10 A 1 ATOM 82 C CA . ILE A 0 10 . -30.720 -5.056 23.689 1.00 85.03 10 A 1 ATOM 83 C C . ILE A 0 10 . -29.746 -3.918 23.393 1.00 85.03 10 A 1 ATOM 84 C CB . ILE A 0 10 . -32.167 -4.534 23.807 1.00 85.03 10 A 1 ATOM 85 O O . ILE A 0 10 . -29.350 -3.743 22.240 1.00 85.03 10 A 1 ATOM 86 C CG1 . ILE A 0 10 . -33.114 -5.744 23.729 1.00 85.03 10 A 1 ATOM 87 C CG2 . ILE A 0 10 . -32.512 -3.521 22.692 1.00 85.03 10 A 1 ATOM 88 C CD1 . ILE A 0 10 . -34.569 -5.396 24.014 1.00 85.03 10 A 1 ATOM 89 N N . THR A 0 11 . -29.335 -3.146 24.403 1.00 84.83 11 A 1 ATOM 90 C CA . THR A 0 11 . -28.399 -2.033 24.184 1.00 84.83 11 A 1 ATOM 91 C C . THR A 0 11 . -27.033 -2.530 23.721 1.00 84.83 11 A 1 ATOM 92 C CB . THR A 0 11 . -28.244 -1.142 25.421 1.00 84.83 11 A 1 ATOM 93 O O . THR A 0 11 . -26.463 -1.940 22.806 1.00 84.83 11 A 1 ATOM 94 C CG2 . THR A 0 11 . -29.525 -0.375 25.748 1.00 84.83 11 A 1 ATOM 95 O OG1 . THR A 0 11 . -27.890 -1.894 26.552 1.00 84.83 11 A 1 ATOM 96 N N . VAL A 0 12 . -26.536 -3.648 24.263 1.00 83.88 12 A 1 ATOM 97 C CA . VAL A 0 12 . -25.281 -4.272 23.807 1.00 83.88 12 A 1 ATOM 98 C C . VAL A 0 12 . -25.396 -4.769 22.364 1.00 83.88 12 A 1 ATOM 99 C CB . VAL A 0 12 . -24.856 -5.407 24.759 1.00 83.88 12 A 1 ATOM 100 O O . VAL A 0 12 . -24.506 -4.498 21.558 1.00 83.88 12 A 1 ATOM 101 C CG1 . VAL A 0 12 . -23.653 -6.201 24.230 1.00 83.88 12 A 1 ATOM 102 C CG2 . VAL A 0 12 . -24.448 -4.838 26.125 1.00 83.88 12 A 1 ATOM 103 N N . MET A 0 13 . -26.497 -5.436 22.005 1.00 82.14 13 A 1 ATOM 104 C CA . MET A 0 13 . -26.746 -5.881 20.627 1.00 82.14 13 A 1 ATOM 105 C C . MET A 0 13 . -26.813 -4.699 19.651 1.00 82.14 13 A 1 ATOM 106 C CB . MET A 0 13 . -28.053 -6.686 20.566 1.00 82.14 13 A 1 ATOM 107 O O . MET A 0 13 . -26.232 -4.755 18.568 1.00 82.14 13 A 1 ATOM 108 C CG . MET A 0 13 . -27.970 -8.067 21.228 1.00 82.14 13 A 1 ATOM 109 S SD . MET A 0 13 . -27.430 -9.423 20.143 1.00 82.14 13 A 1 ATOM 110 C CE . MET A 0 13 . -25.631 -9.390 20.357 1.00 82.14 13 A 1 ATOM 111 N N . PHE A 0 14 . -27.461 -3.600 20.043 1.00 86.82 14 A 1 ATOM 112 C CA . PHE A 0 14 . -27.547 -2.396 19.221 1.00 86.82 14 A 1 ATOM 113 C C . PHE A 0 14 . -26.178 -1.729 19.033 1.00 86.82 14 A 1 ATOM 114 C CB . PHE A 0 14 . -28.568 -1.436 19.838 1.00 86.82 14 A 1 ATOM 115 O O . PHE A 0 14 . -25.800 -1.414 17.906 1.00 86.82 14 A 1 ATOM 116 C CG . PHE A 0 14 . -28.956 -0.305 18.910 1.00 86.82 14 A 1 ATOM 117 C CD1 . PHE A 0 14 . -28.468 0.998 19.120 1.00 86.82 14 A 1 ATOM 118 C CD2 . PHE A 0 14 . -29.824 -0.561 17.832 1.00 86.82 14 A 1 ATOM 119 C CE1 . PHE A 0 14 . -28.868 2.042 18.267 1.00 86.82 14 A 1 ATOM 120 C CE2 . PHE A 0 14 . -30.202 0.479 16.965 1.00 86.82 14 A 1 ATOM 121 C CZ . PHE A 0 14 . -29.723 1.781 17.183 1.00 86.82 14 A 1 ATOM 122 N N . ILE A 0 15 . -25.390 -1.589 20.107 1.00 85.63 15 A 1 ATOM 123 C CA . ILE A 0 15 . -24.010 -1.081 20.037 1.00 85.63 15 A 1 ATOM 124 C C . ILE A 0 15 . -23.160 -1.968 19.119 1.00 85.63 15 A 1 ATOM 125 C CB . ILE A 0 15 . -23.404 -0.968 21.457 1.00 85.63 15 A 1 ATOM 126 O O . ILE A 0 15 . -22.408 -1.450 18.296 1.00 85.63 15 A 1 ATOM 127 C CG1 . ILE A 0 15 . -24.079 0.183 22.237 1.00 85.63 15 A 1 ATOM 128 C CG2 . ILE A 0 15 . -21.882 -0.730 21.407 1.00 85.63 15 A 1 ATOM 129 C CD1 . ILE A 0 15 . -23.795 0.154 23.746 1.00 85.63 15 A 1 ATOM 130 N N . TYR A 0 16 . -23.308 -3.292 19.200 1.00 82.47 16 A 1 ATOM 131 C CA . TYR A 0 16 . -22.593 -4.223 18.329 1.00 82.47 16 A 1 ATOM 132 C C . TYR A 0 16 . -22.947 -4.029 16.849 1.00 82.47 16 A 1 ATOM 133 C CB . TYR A 0 16 . -22.880 -5.660 18.772 1.00 82.47 16 A 1 ATOM 134 O O . TYR A 0 16 . -22.047 -3.958 16.010 1.00 82.47 16 A 1 ATOM 135 C CG . TYR A 0 16 . -22.145 -6.682 17.935 1.00 82.47 16 A 1 ATOM 136 C CD1 . TYR A 0 16 . -22.775 -7.292 16.831 1.00 82.47 16 A 1 ATOM 137 C CD2 . TYR A 0 16 . -20.812 -6.995 18.249 1.00 82.47 16 A 1 ATOM 138 C CE1 . TYR A 0 16 . -22.062 -8.209 16.033 1.00 82.47 16 A 1 ATOM 139 C CE2 . TYR A 0 16 . -20.109 -7.927 17.470 1.00 82.47 16 A 1 ATOM 140 O OH . TYR A 0 16 . -20.022 -9.403 15.591 1.00 82.47 16 A 1 ATOM 141 C CZ . TYR A 0 16 . -20.724 -8.522 16.349 1.00 82.47 16 A 1 ATOM 142 N N . ILE A 0 17 . -24.235 -3.894 16.517 1.00 85.45 17 A 1 ATOM 143 C CA . ILE A 0 17 . -24.694 -3.630 15.143 1.00 85.45 17 A 1 ATOM 144 C C . ILE A 0 17 . -24.136 -2.291 14.638 1.00 85.45 17 A 1 ATOM 145 C CB . ILE A 0 17 . -26.239 -3.689 15.074 1.00 85.45 17 A 1 ATOM 146 O O . ILE A 0 17 . -23.613 -2.227 13.523 1.00 85.45 17 A 1 ATOM 147 C CG1 . ILE A 0 17 . -26.729 -5.140 15.293 1.00 85.45 17 A 1 ATOM 148 C CG2 . ILE A 0 17 . -26.756 -3.169 13.717 1.00 85.45 17 A 1 ATOM 149 C CD1 . ILE A 0 17 . -28.225 -5.243 15.617 1.00 85.45 17 A 1 ATOM 150 N N . LEU A 0 18 . -24.168 -1.242 15.469 1.00 85.70 18 A 1 ATOM 151 C CA . LEU A 0 18 . -23.600 0.066 15.129 1.00 85.70 18 A 1 ATOM 152 C C . LEU A 0 18 . -22.088 -0.016 14.877 1.00 85.70 18 A 1 ATOM 153 C CB . LEU A 0 18 . -23.904 1.087 16.238 1.00 85.70 18 A 1 ATOM 154 O O . LEU A 0 18 . -21.621 0.470 13.850 1.00 85.70 18 A 1 ATOM 155 C CG . LEU A 0 18 . -25.371 1.534 16.365 1.00 85.70 18 A 1 ATOM 156 C CD1 . LEU A 0 18 . -25.457 2.529 17.524 1.00 85.70 18 A 1 ATOM 157 C CD2 . LEU A 0 18 . -25.894 2.215 15.100 1.00 85.70 18 A 1 ATOM 158 N N . ILE A 0 19 . -21.326 -0.684 15.749 1.00 83.02 19 A 1 ATOM 159 C CA . ILE A 0 19 . -19.878 -0.879 15.569 1.00 83.02 19 A 1 ATOM 160 C C . ILE A 0 19 . -19.597 -1.688 14.297 1.00 83.02 19 A 1 ATOM 161 C CB . ILE A 0 19 . -19.261 -1.536 16.828 1.00 83.02 19 A 1 ATOM 162 O O . ILE A 0 19 . -18.691 -1.353 13.537 1.00 83.02 19 A 1 ATOM 163 C CG1 . ILE A 0 19 . -19.284 -0.545 18.015 1.00 83.02 19 A 1 ATOM 164 C CG2 . ILE A 0 19 . -17.812 -1.994 16.570 1.00 83.02 19 A 1 ATOM 165 C CD1 . ILE A 0 19 . -18.957 -1.194 19.368 1.00 83.02 19 A 1 ATOM 166 N N . SER A 0 20 . -20.400 -2.717 14.023 1.00 79.38 20 A 1 ATOM 167 C CA . SER A 0 20 . -20.269 -3.553 12.825 1.00 79.38 20 A 1 ATOM 168 C C . SER A 0 20 . -20.487 -2.758 11.533 1.00 79.38 20 A 1 ATOM 169 C CB . SER A 0 20 . -21.246 -4.727 12.880 1.00 79.38 20 A 1 ATOM 170 O O . SER A 0 20 . -19.780 -2.981 10.551 1.00 79.38 20 A 1 ATOM 171 O OG . SER A 0 20 . -21.026 -5.486 14.049 1.00 79.38 20 A 1 ATOM 172 N N . SER A 0 21 . -21.410 -1.788 11.539 1.00 79.20 21 A 1 ATOM 173 C CA . SER A 0 21 . -21.702 -0.941 10.372 1.00 79.20 21 A 1 ATOM 174 C C . SER A 0 21 . -20.535 -0.032 9.953 1.00 79.20 21 A 1 ATOM 175 C CB . SER A 0 21 . -22.978 -0.129 10.620 1.00 79.20 21 A 1 ATOM 176 O O . SER A 0 21 . -20.421 0.323 8.783 1.00 79.20 21 A 1 ATOM 177 O OG . SER A 0 21 . -22.777 0.951 11.511 1.00 79.20 21 A 1 ATOM 178 N N . ILE A 0 22 . -19.604 0.276 10.866 1.00 77.32 22 A 1 ATOM 179 C CA . ILE A 0 22 . -18.416 1.100 10.573 1.00 77.32 22 A 1 ATOM 180 C C . ILE A 0 22 . -17.439 0.357 9.642 1.00 77.32 22 A 1 ATOM 181 C CB . ILE A 0 22 . -17.734 1.550 11.892 1.00 77.32 22 A 1 ATOM 182 O O . ILE A 0 22 . -16.657 0.981 8.928 1.00 77.32 22 A 1 ATOM 183 C CG1 . ILE A 0 22 . -18.730 2.317 12.797 1.00 77.32 22 A 1 ATOM 184 C CG2 . ILE A 0 22 . -16.499 2.435 11.625 1.00 77.32 22 A 1 ATOM 185 C CD1 . ILE A 0 22 . -18.215 2.595 14.215 1.00 77.32 22 A 1 ATOM 186 N N . TYR A 0 23 . -17.495 -0.978 9.601 1.00 70.38 23 A 1 ATOM 187 C CA . TYR A 0 23 . -16.604 -1.799 8.776 1.00 70.38 23 A 1 ATOM 188 C C . TYR A 0 23 . -17.100 -2.016 7.340 1.00 70.38 23 A 1 ATOM 189 C CB . TYR A 0 23 . -16.312 -3.127 9.483 1.00 70.38 23 A 1 ATOM 190 O O . TYR A 0 23 . -16.500 -2.811 6.610 1.00 70.38 23 A 1 ATOM 191 C CG . TYR A 0 23 . -15.618 -2.968 10.818 1.00 70.38 23 A 1 ATOM 192 C CD1 . TYR A 0 23 . -14.230 -2.737 10.875 1.00 70.38 23 A 1 ATOM 193 C CD2 . TYR A 0 23 . -16.368 -3.036 12.004 1.00 70.38 23 A 1 ATOM 194 C CE1 . TYR A 0 23 . -13.589 -2.589 12.121 1.00 70.38 23 A 1 ATOM 195 C CE2 . TYR A 0 23 . -15.733 -2.896 13.250 1.00 70.38 23 A 1 ATOM 196 O OH . TYR A 0 23 . -13.735 -2.549 14.520 1.00 70.38 23 A 1 ATOM 197 C CZ . TYR A 0 23 . -14.344 -2.675 13.312 1.00 70.38 23 A 1 ATOM 198 N N . ILE A 0 24 . -18.167 -1.331 6.907 1.00 69.82 24 A 1 ATOM 199 C CA . ILE A 0 24 . -18.588 -1.345 5.502 1.00 69.82 24 A 1 ATOM 200 C C . ILE A 0 24 . -17.467 -0.701 4.681 1.00 69.82 24 A 1 ATOM 201 C CB . ILE A 0 24 . -19.952 -0.649 5.297 1.00 69.82 24 A 1 ATOM 202 O O . ILE A 0 24 . -17.277 0.512 4.679 1.00 69.82 24 A 1 ATOM 203 C CG1 . ILE A 0 24 . -21.065 -1.358 6.105 1.00 69.82 24 A 1 ATOM 204 C CG2 . ILE A 0 24 . -20.324 -0.659 3.799 1.00 69.82 24 A 1 ATOM 205 C CD1 . ILE A 0 24 . -22.346 -0.524 6.236 1.00 69.82 24 A 1 ATOM 206 N N . GLY A 0 25 . -16.667 -1.536 4.020 1.00 66.21 25 A 1 ATOM 207 C CA . GLY A 0 25 . -15.553 -1.064 3.211 1.00 66.21 25 A 1 ATOM 208 C C . GLY A 0 25 . -16.046 -0.221 2.037 1.00 66.21 25 A 1 ATOM 209 O O . GLY A 0 25 . -17.009 -0.591 1.369 1.00 66.21 25 A 1 ATOM 210 N N . ASN A 0 26 . -15.346 0.875 1.744 1.00 66.87 26 A 1 ATOM 211 C CA . ASN A 0 26 . -15.628 1.688 0.565 1.00 66.87 26 A 1 ATOM 212 C C . ASN A 0 26 . -15.537 0.822 -0.704 1.00 66.87 26 A 1 ATOM 213 C CB . ASN A 0 26 . -14.663 2.890 0.497 1.00 66.87 26 A 1 ATOM 214 O O . ASN A 0 26 . -14.517 0.178 -0.964 1.00 66.87 26 A 1 ATOM 215 C CG . ASN A 0 26 . -14.927 3.951 1.554 1.00 66.87 26 A 1 ATOM 216 N ND2 . ASN A 0 26 . -14.363 5.124 1.402 1.00 66.87 26 A 1 ATOM 217 O OD1 . ASN A 0 26 . -15.625 3.747 2.527 1.00 66.87 26 A 1 ATOM 218 N N . SER A 0 27 . -16.599 0.825 -1.511 1.00 70.35 27 A 1 ATOM 219 C CA . SER A 0 27 . -16.648 0.172 -2.827 1.00 70.35 27 A 1 ATOM 220 C C . SER A 0 27 . -16.108 1.064 -3.953 1.00 70.35 27 A 1 ATOM 221 C CB . SER A 0 27 . -18.075 -0.302 -3.120 1.00 70.35 27 A 1 ATOM 222 O O . SER A 0 27 . -16.440 0.858 -5.118 1.00 70.35 27 A 1 ATOM 223 O OG . SER A 0 27 . -18.941 0.809 -3.225 1.00 70.35 27 A 1 ATOM 224 N N . GLY A 0 28 . -15.317 2.083 -3.614 1.00 79.15 28 A 1 ATOM 225 C CA . GLY A 0 28 . -14.727 2.998 -4.584 1.00 79.15 28 A 1 ATOM 226 C C . GLY A 0 28 . -13.631 2.347 -5.429 1.00 79.15 28 A 1 ATOM 227 O O . GLY A 0 28 . -13.083 1.297 -5.086 1.00 79.15 28 A 1 ATOM 228 N N . ALA A 0 29 . -13.302 3.011 -6.535 1.00 84.66 29 A 1 ATOM 229 C CA . ALA A 0 29 . -12.102 2.738 -7.312 1.00 84.66 29 A 1 ATOM 230 C C . ALA A 0 29 . -10.855 2.884 -6.421 1.00 84.66 29 A 1 ATOM 231 C CB . ALA A 0 29 . -12.090 3.733 -8.476 1.00 84.66 29 A 1 ATOM 232 O O . ALA A 0 29 . -10.691 3.915 -5.768 1.00 84.66 29 A 1 ATOM 233 N N . LEU A 0 30 . -9.988 1.865 -6.404 1.00 92.40 30 A 1 ATOM 234 C CA . LEU A 0 30 . -8.801 1.842 -5.548 1.00 92.40 30 A 1 ATOM 235 C C . LEU A 0 30 . -7.868 3.002 -5.895 1.00 92.40 30 A 1 ATOM 236 C CB . LEU A 0 30 . -8.082 0.492 -5.700 1.00 92.40 30 A 1 ATOM 237 O O . LEU A 0 30 . -7.479 3.171 -7.056 1.00 92.40 30 A 1 ATOM 238 C CG . LEU A 0 30 . -6.713 0.362 -5.009 1.00 92.40 30 A 1 ATOM 239 C CD1 . LEU A 0 30 . -6.859 0.416 -3.492 1.00 92.40 30 A 1 ATOM 240 C CD2 . LEU A 0 30 . -6.042 -0.943 -5.442 1.00 92.40 30 A 1 ATOM 241 N N . LYS A 0 31 . -7.463 3.740 -4.862 1.00 93.15 31 A 1 ATOM 242 C CA . LYS A 0 31 . -6.481 4.821 -4.969 1.00 93.15 31 A 1 ATOM 243 C C . LYS A 0 31 . -5.092 4.353 -4.572 1.00 93.15 31 A 1 ATOM 244 C CB . LYS A 0 31 . -6.912 6.036 -4.145 1.00 93.15 31 A 1 ATOM 245 O O . LYS A 0 31 . -4.936 3.656 -3.571 1.00 93.15 31 A 1 ATOM 246 C CG . LYS A 0 31 . -8.355 6.434 -4.468 1.00 93.15 31 A 1 ATOM 247 C CD . LYS A 0 31 . -8.638 7.868 -4.027 1.00 93.15 31 A 1 ATOM 248 C CE . LYS A 0 31 . -10.017 8.248 -4.559 1.00 93.15 31 A 1 ATOM 249 N NZ . LYS A 0 31 . -10.116 9.706 -4.756 1.00 93.15 31 A 1 ATOM 250 N N . CYS A 0 32 . -4.063 4.786 -5.291 1.00 95.36 32 A 1 ATOM 251 C CA . CYS A 0 32 . -2.671 4.427 -5.012 1.00 95.36 32 A 1 ATOM 252 C C . CYS A 0 32 . -1.759 5.649 -5.055 1.00 95.36 32 A 1 ATOM 253 C CB . CYS A 0 32 . -2.197 3.391 -6.037 1.00 95.36 32 A 1 ATOM 254 O O . CYS A 0 32 . -1.927 6.527 -5.896 1.00 95.36 32 A 1 ATOM 255 S SG . CYS A 0 32 . -3.182 1.878 -6.114 1.00 95.36 32 A 1 ATOM 256 N N . TYR A 0 33 . -0.722 5.674 -4.217 1.00 94.45 33 A 1 ATOM 257 C CA . TYR A 0 33 . 0.366 6.629 -4.415 1.00 94.45 33 A 1 ATOM 258 C C . TYR A 0 33 . 1.150 6.272 -5.680 1.00 94.45 33 A 1 ATOM 259 C CB . TYR A 0 33 . 1.287 6.645 -3.194 1.00 94.45 33 A 1 ATOM 260 O O . TYR A 0 33 . 1.481 5.102 -5.890 1.00 94.45 33 A 1 ATOM 261 C CG . TYR A 0 33 . 0.657 7.239 -1.956 1.00 94.45 33 A 1 ATOM 262 C CD1 . TYR A 0 33 . 0.347 8.612 -1.935 1.00 94.45 33 A 1 ATOM 263 C CD2 . TYR A 0 33 . 0.374 6.438 -0.833 1.00 94.45 33 A 1 ATOM 264 C CE1 . TYR A 0 33 . -0.233 9.194 -0.794 1.00 94.45 33 A 1 ATOM 265 C CE2 . TYR A 0 33 . -0.187 7.031 0.312 1.00 94.45 33 A 1 ATOM 266 O OH . TYR A 0 33 . -1.035 8.943 1.458 1.00 94.45 33 A 1 ATOM 267 C CZ . TYR A 0 33 . -0.493 8.402 0.338 1.00 94.45 33 A 1 ATOM 268 N N . VAL A 0 34 . 1.488 7.277 -6.485 1.00 94.51 34 A 1 ATOM 269 C CA . VAL A 0 34 . 2.309 7.142 -7.690 1.00 94.51 34 A 1 ATOM 270 C C . VAL A 0 34 . 3.489 8.099 -7.591 1.00 94.51 34 A 1 ATOM 271 C CB . VAL A 0 34 . 1.487 7.380 -8.969 1.00 94.51 34 A 1 ATOM 272 O O . VAL A 0 34 . 3.318 9.310 -7.475 1.00 94.51 34 A 1 ATOM 273 C CG1 . VAL A 0 34 . 2.353 7.168 -10.219 1.00 94.51 34 A 1 ATOM 274 C CG2 . VAL A 0 34 . 0.297 6.415 -9.050 1.00 94.51 34 A 1 ATOM 275 N N . CYS A 0 35 . 4.701 7.549 -7.580 1.00 93.16 35 A 1 ATOM 276 C CA . CYS A 0 35 . 5.930 8.334 -7.543 1.00 93.16 35 A 1 ATOM 277 C C . CYS A 0 35 . 7.153 7.490 -7.901 1.00 93.16 35 A 1 ATOM 278 C CB . CYS A 0 35 . 6.105 8.997 -6.166 1.00 93.16 35 A 1 ATOM 279 O O . CYS A 0 35 . 7.217 6.292 -7.611 1.00 93.16 35 A 1 ATOM 280 S SG . CYS A 0 35 . 5.958 7.955 -4.686 1.00 93.16 35 A 1 ATOM 281 N N . GLN A 0 36 . 8.156 8.143 -8.484 1.00 90.67 36 A 1 ATOM 282 C CA . GLN A 0 36 . 9.444 7.546 -8.821 1.00 90.67 36 A 1 ATOM 283 C C . GLN A 0 36 . 10.516 8.049 -7.850 1.00 90.67 36 A 1 ATOM 284 C CB . GLN A 0 36 . 9.757 7.857 -10.289 1.00 90.67 36 A 1 ATOM 285 O O . GLN A 0 36 . 10.620 9.245 -7.602 1.00 90.67 36 A 1 ATOM 286 C CG . GLN A 0 36 . 10.972 7.082 -10.822 1.00 90.67 36 A 1 ATOM 287 C CD . GLN A 0 36 . 11.144 7.244 -12.332 1.00 90.67 36 A 1 ATOM 288 N NE2 . GLN A 0 36 . 12.131 6.616 -12.930 1.00 90.67 36 A 1 ATOM 289 O OE1 . GLN A 0 36 . 10.399 7.925 -13.010 1.00 90.67 36 A 1 ATOM 290 N N . ASN A 0 37 . 11.308 7.129 -7.289 1.00 87.43 37 A 1 ATOM 291 C CA . ASN A 0 37 . 12.382 7.428 -6.329 1.00 87.43 37 A 1 ATOM 292 C C . ASN A 0 37 . 11.950 8.274 -5.105 1.00 87.43 37 A 1 ATOM 293 C CB . ASN A 0 37 . 13.610 7.977 -7.078 1.00 87.43 37 A 1 ATOM 294 O O . ASN A 0 37 . 12.706 9.089 -4.588 1.00 87.43 37 A 1 ATOM 295 C CG . ASN A 0 37 . 14.235 6.974 -8.031 1.00 87.43 37 A 1 ATOM 296 N ND2 . ASN A 0 37 . 14.864 7.450 -9.079 1.00 87.43 37 A 1 ATOM 297 O OD1 . ASN A 0 37 . 14.191 5.761 -7.837 1.00 87.43 37 A 1 ATOM 298 N N . CYS A 0 38 . 10.748 8.023 -4.593 1.00 85.54 38 A 1 ATOM 299 C CA . CYS A 0 38 . 10.178 8.634 -3.396 1.00 85.54 38 A 1 ATOM 300 C C . CYS A 0 38 . 10.446 7.763 -2.157 1.00 85.54 38 A 1 ATOM 301 C CB . CYS A 0 38 . 8.679 8.836 -3.656 1.00 85.54 38 A 1 ATOM 302 O O . CYS A 0 38 . 9.682 6.848 -1.840 1.00 85.54 38 A 1 ATOM 303 S SG . CYS A 0 38 . 7.841 7.352 -4.296 1.00 85.54 38 A 1 ATOM 304 N N . SER A 0 39 . 11.527 8.036 -1.426 1.00 72.89 39 A 1 ATOM 305 C CA . SER A 0 39 . 11.887 7.293 -0.206 1.00 72.89 39 A 1 ATOM 306 C C . SER A 0 39 . 10.813 7.392 0.883 1.00 72.89 39 A 1 ATOM 307 C CB . SER A 0 39 . 13.258 7.752 0.315 1.00 72.89 39 A 1 ATOM 308 O O . SER A 0 39 . 10.518 6.391 1.538 1.00 72.89 39 A 1 ATOM 309 O OG . SER A 0 39 . 13.443 9.137 0.093 1.00 72.89 39 A 1 ATOM 310 N N . ASN A 0 40 . 10.146 8.542 1.020 1.00 68.46 40 A 1 ATOM 311 C CA . ASN A 0 40 . 9.069 8.719 1.988 1.00 68.46 40 A 1 ATOM 312 C C . ASN A 0 40 . 7.884 9.509 1.410 1.00 68.46 40 A 1 ATOM 313 C CB . ASN A 0 40 . 9.659 9.361 3.253 1.00 68.46 40 A 1 ATOM 314 O O . ASN A 0 40 . 8.066 10.571 0.827 1.00 68.46 40 A 1 ATOM 315 C CG . ASN A 0 40 . 8.726 9.227 4.436 1.00 68.46 40 A 1 ATOM 316 N ND2 . ASN A 0 40 . 9.110 9.739 5.574 1.00 68.46 40 A 1 ATOM 317 O OD1 . ASN A 0 40 . 7.641 8.669 4.335 1.00 68.46 40 A 1 ATOM 318 N N . VAL A 0 41 . 6.672 8.990 1.601 1.00 60.27 41 A 1 ATOM 319 C CA . VAL A 0 41 . 5.405 9.642 1.215 1.00 60.27 41 A 1 ATOM 320 C C . VAL A 0 41 . 4.882 10.596 2.287 1.00 60.27 41 A 1 ATOM 321 C CB . VAL A 0 41 . 4.312 8.618 0.843 1.00 60.27 41 A 1 ATOM 322 O O . VAL A 0 41 . 3.963 11.352 2.011 1.00 60.27 41 A 1 ATOM 323 C CG1 . VAL A 0 41 . 4.491 8.145 -0.602 1.00 60.27 41 A 1 ATOM 324 C CG2 . VAL A 0 41 . 4.314 7.402 1.779 1.00 60.27 41 A 1 ATOM 325 N N . THR A 0 42 . 5.456 10.598 3.496 1.00 62.68 42 A 1 ATOM 326 C CA . THR A 0 42 . 5.103 11.597 4.519 1.00 62.68 42 A 1 ATOM 327 C C . THR A 0 42 . 5.893 12.903 4.386 1.00 62.68 42 A 1 ATOM 328 C CB . THR A 0 42 . 5.227 11.044 5.948 1.00 62.68 42 A 1 ATOM 329 O O . THR A 0 42 . 5.558 13.879 5.047 1.00 62.68 42 A 1 ATOM 330 C CG2 . THR A 0 42 . 4.436 9.754 6.160 1.00 62.68 42 A 1 ATOM 331 O OG1 . THR A 0 42 . 6.562 10.774 6.301 1.00 62.68 42 A 1 ATOM 332 N N . GLY A 0 43 . 6.947 12.937 3.560 1.00 63.97 43 A 1 ATOM 333 C CA . GLY A 0 43 . 7.769 14.132 3.332 1.00 63.97 43 A 1 ATOM 334 C C . GLY A 0 43 . 7.330 14.960 2.118 1.00 63.97 43 A 1 ATOM 335 O O . GLY A 0 43 . 6.341 14.646 1.464 1.00 63.97 43 A 1 ATOM 336 N N . LYS A 0 44 . 8.133 15.975 1.760 1.00 60.86 44 A 1 ATOM 337 C CA . LYS A 0 44 . 8.015 16.797 0.530 1.00 60.86 44 A 1 ATOM 338 C C . LYS A 0 44 . 8.307 16.015 -0.770 1.00 60.86 44 A 1 ATOM 339 C CB . LYS A 0 44 . 8.924 18.047 0.629 1.00 60.86 44 A 1 ATOM 340 O O . LYS A 0 44 . 8.925 16.540 -1.692 1.00 60.86 44 A 1 ATOM 341 C CG . LYS A 0 44 . 8.374 19.190 1.489 1.00 60.86 44 A 1 ATOM 342 C CD . LYS A 0 44 . 9.324 20.398 1.385 1.00 60.86 44 A 1 ATOM 343 C CE . LYS A 0 44 . 8.745 21.626 2.096 1.00 60.86 44 A 1 ATOM 344 N NZ . LYS A 0 44 . 9.643 22.805 1.978 1.00 60.86 44 A 1 ATOM 345 N N . ALA A 0 45 . 7.942 14.740 -0.846 1.00 66.45 45 A 1 ATOM 346 C CA . ALA A 0 45 . 8.095 13.986 -2.079 1.00 66.45 45 A 1 ATOM 347 C C . ALA A 0 45 . 7.001 14.394 -3.070 1.00 66.45 45 A 1 ATOM 348 C CB . ALA A 0 45 . 8.087 12.485 -1.778 1.00 66.45 45 A 1 ATOM 349 O O . ALA A 0 45 . 5.827 14.456 -2.713 1.00 66.45 45 A 1 ATOM 350 N N . ASN A 0 46 . 7.385 14.609 -4.326 1.00 81.08 46 A 1 ATOM 351 C CA . ASN A 0 46 . 6.435 14.757 -5.419 1.00 81.08 46 A 1 ATOM 352 C C . ASN A 0 46 . 5.789 13.391 -5.676 1.00 81.08 46 A 1 ATOM 353 C CB . ASN A 0 46 . 7.157 15.316 -6.658 1.00 81.08 46 A 1 ATOM 354 O O . ASN A 0 46 . 6.400 12.502 -6.274 1.00 81.08 46 A 1 ATOM 355 C CG . ASN A 0 46 . 7.612 16.756 -6.488 1.00 81.08 46 A 1 ATOM 356 N ND2 . ASN A 0 46 . 8.521 17.214 -7.315 1.00 81.08 46 A 1 ATOM 357 O OD1 . ASN A 0 46 . 7.169 17.488 -5.622 1.00 81.08 46 A 1 ATOM 358 N N . PHE A 0 47 . 4.571 13.208 -5.179 1.00 88.72 47 A 1 ATOM 359 C CA . PHE A 0 47 . 3.729 12.068 -5.504 1.00 88.72 47 A 1 ATOM 360 C C . PHE A 0 47 . 2.390 12.554 -6.038 1.00 88.72 47 A 1 ATOM 361 C CB . PHE A 0 47 . 3.578 11.123 -4.299 1.00 88.72 47 A 1 ATOM 362 O O . PHE A 0 47 . 1.911 13.631 -5.688 1.00 88.72 47 A 1 ATOM 363 C CG . PHE A 0 47 . 2.823 11.700 -3.115 1.00 88.72 47 A 1 ATOM 364 C CD1 . PHE A 0 47 . 3.524 12.233 -2.018 1.00 88.72 47 A 1 ATOM 365 C CD2 . PHE A 0 47 . 1.414 11.724 -3.116 1.00 88.72 47 A 1 ATOM 366 C CE1 . PHE A 0 47 . 2.825 12.780 -0.928 1.00 88.72 47 A 1 ATOM 367 C CE2 . PHE A 0 47 . 0.715 12.286 -2.034 1.00 88.72 47 A 1 ATOM 368 C CZ . PHE A 0 47 . 1.420 12.806 -0.935 1.00 88.72 47 A 1 ATOM 369 N N . THR A 0 48 . 1.776 11.727 -6.870 1.00 92.81 48 A 1 ATOM 370 C CA . THR A 0 48 . 0.390 11.889 -7.297 1.00 92.81 48 A 1 ATOM 371 C C . THR A 0 48 . -0.449 10.746 -6.741 1.00 92.81 48 A 1 ATOM 372 C CB . THR A 0 48 . 0.282 12.008 -8.824 1.00 92.81 48 A 1 ATOM 373 O O . THR A 0 48 . 0.074 9.731 -6.265 1.00 92.81 48 A 1 ATOM 374 C CG2 . THR A 0 48 . 1.032 13.232 -9.351 1.00 92.81 48 A 1 ATOM 375 O OG1 . THR A 0 48 . 0.833 10.882 -9.459 1.00 92.81 48 A 1 ATOM 376 N N . ILE A 0 49 . -1.765 10.929 -6.749 1.00 92.95 49 A 1 ATOM 377 C CA . ILE A 0 49 . -2.722 9.883 -6.398 1.00 92.95 49 A 1 ATOM 378 C C . ILE A 0 49 . -3.291 9.359 -7.712 1.00 92.95 49 A 1 ATOM 379 C CB . ILE A 0 49 . -3.790 10.415 -5.419 1.00 92.95 49 A 1 ATOM 380 O O . ILE A 0 49 . -3.916 10.108 -8.457 1.00 92.95 49 A 1 ATOM 381 C CG1 . ILE A 0 49 . -3.107 10.871 -4.105 1.00 92.95 49 A 1 ATOM 382 C CG2 . ILE A 0 49 . -4.839 9.320 -5.152 1.00 92.95 49 A 1 ATOM 383 C CD1 . ILE A 0 49 . -4.056 11.513 -3.085 1.00 92.95 49 A 1 ATOM 384 N N . GLY A 0 50 . -3.013 8.094 -8.015 1.00 92.72 50 A 1 ATOM 385 C CA . GLY A 0 50 . -3.662 7.381 -9.107 1.00 92.72 50 A 1 ATOM 386 C C . GLY A 0 50 . -5.007 6.845 -8.638 1.00 92.72 50 A 1 ATOM 387 O O . GLY A 0 50 . -5.076 6.255 -7.560 1.00 92.72 50 A 1 ATOM 388 N N . ASP A 0 51 . -6.040 7.042 -9.449 1.00 91.34 51 A 1 ATOM 389 C CA . ASP A 0 51 . -7.383 6.499 -9.250 1.00 91.34 51 A 1 ATOM 390 C C . ASP A 0 51 . -7.643 5.348 -10.245 1.00 91.34 51 A 1 ATOM 391 C CB . ASP A 0 51 . -8.425 7.629 -9.395 1.00 91.34 51 A 1 ATOM 392 O O . ASP A 0 51 . -6.919 5.184 -11.229 1.00 91.34 51 A 1 ATOM 393 C CG . ASP A 0 51 . -8.444 8.649 -8.241 1.00 91.34 51 A 1 ATOM 394 O OD1 . ASP A 0 51 . -8.236 8.261 -7.070 1.00 91.34 51 A 1 ATOM 395 O OD2 . ASP A 0 51 . -8.790 9.823 -8.482 1.00 91.34 51 A 1 ATOM 396 N N . ASN A 0 52 . -8.691 4.553 -10.003 1.00 90.43 52 A 1 ATOM 397 C CA . ASN A 0 52 . -9.078 3.406 -10.845 1.00 90.43 52 A 1 ATOM 398 C C . ASN A 0 52 . -7.989 2.333 -10.997 1.00 90.43 52 A 1 ATOM 399 C CB . ASN A 0 52 . -9.681 3.902 -12.170 1.00 90.43 52 A 1 ATOM 400 O O . ASN A 0 52 . -7.884 1.651 -12.017 1.00 90.43 52 A 1 ATOM 401 C CG . ASN A 0 52 . -10.544 2.844 -12.833 1.00 90.43 52 A 1 ATOM 402 N ND2 . ASN A 0 52 . -10.496 2.735 -14.139 1.00 90.43 52 A 1 ATOM 403 O OD1 . ASN A 0 52 . -11.300 2.133 -12.191 1.00 90.43 52 A 1 ATOM 404 N N . CYS A 0 53 . -7.181 2.161 -9.956 1.00 92.66 53 A 1 ATOM 405 C CA . CYS A 0 53 . -6.190 1.103 -9.909 1.00 92.66 53 A 1 ATOM 406 C C . CYS A 0 53 . -6.877 -0.240 -9.625 1.00 92.66 53 A 1 ATOM 407 C CB . CYS A 0 53 . -5.140 1.458 -8.853 1.00 92.66 53 A 1 ATOM 408 O O . CYS A 0 53 . -7.894 -0.313 -8.940 1.00 92.66 53 A 1 ATOM 409 S SG . CYS A 0 53 . -4.576 3.182 -8.918 1.00 92.66 53 A 1 ATOM 410 N N . LYS A 0 54 . -6.291 -1.338 -10.094 1.00 93.69 54 A 1 ATOM 411 C CA . LYS A 0 54 . -6.634 -2.689 -9.630 1.00 93.69 54 A 1 ATOM 412 C C . LYS A 0 54 . -5.707 -3.127 -8.498 1.00 93.69 54 A 1 ATOM 413 C CB . LYS A 0 54 . -6.608 -3.634 -10.832 1.00 93.69 54 A 1 ATOM 414 O O . LYS A 0 54 . -6.139 -3.798 -7.565 1.00 93.69 54 A 1 ATOM 415 C CG . LYS A 0 54 . -7.241 -4.991 -10.506 1.00 93.69 54 A 1 ATOM 416 C CD . LYS A 0 54 . -7.233 -5.853 -11.771 1.00 93.69 54 A 1 ATOM 417 C CE . LYS A 0 54 . -7.767 -7.259 -11.498 1.00 93.69 54 A 1 ATOM 418 N NZ . LYS A 0 54 . -7.806 -8.036 -12.762 1.00 93.69 54 A 1 ATOM 419 N N . PHE A 0 55 . -4.444 -2.703 -8.558 1.00 95.15 55 A 1 ATOM 420 C CA . PHE A 0 55 . -3.428 -2.952 -7.542 1.00 95.15 55 A 1 ATOM 421 C C . PHE A 0 55 . -2.575 -1.703 -7.315 1.00 95.15 55 A 1 ATOM 422 C CB . PHE A 0 55 . -2.526 -4.122 -7.965 1.00 95.15 55 A 1 ATOM 423 O O . PHE A 0 55 . -2.204 -1.007 -8.260 1.00 95.15 55 A 1 ATOM 424 C CG . PHE A 0 55 . -3.246 -5.419 -8.276 1.00 95.15 55 A 1 ATOM 425 C CD1 . PHE A 0 55 . -3.395 -6.413 -7.295 1.00 95.15 55 A 1 ATOM 426 C CD2 . PHE A 0 55 . -3.752 -5.642 -9.564 1.00 95.15 55 A 1 ATOM 427 C CE1 . PHE A 0 55 . -4.068 -7.612 -7.598 1.00 95.15 55 A 1 ATOM 428 C CE2 . PHE A 0 55 . -4.378 -6.859 -9.885 1.00 95.15 55 A 1 ATOM 429 C CZ . PHE A 0 55 . -4.557 -7.839 -8.896 1.00 95.15 55 A 1 ATOM 430 N N . CYS A 0 56 . -2.181 -1.469 -6.067 1.00 95.44 56 A 1 ATOM 431 C CA . CYS A 0 56 . -1.083 -0.571 -5.749 1.00 95.44 56 A 1 ATOM 432 C C . CYS A 0 56 . 0.207 -1.374 -5.617 1.00 95.44 56 A 1 ATOM 433 C CB . CYS A 0 56 . -1.353 0.210 -4.465 1.00 95.44 56 A 1 ATOM 434 O O . CYS A 0 56 . 0.265 -2.356 -4.872 1.00 95.44 56 A 1 ATOM 435 S SG . CYS A 0 56 . -2.955 1.017 -4.307 1.00 95.44 56 A 1 ATOM 436 N N . GLN A 0 57 . 1.256 -0.923 -6.295 1.00 95.81 57 A 1 ATOM 437 C CA . GLN A 0 57 . 2.593 -1.491 -6.200 1.00 95.81 57 A 1 ATOM 438 C C . GLN A 0 57 . 3.511 -0.559 -5.407 1.00 95.81 57 A 1 ATOM 439 C CB . GLN A 0 57 . 3.123 -1.774 -7.608 1.00 95.81 57 A 1 ATOM 440 O O . GLN A 0 57 . 3.422 0.669 -5.508 1.00 95.81 57 A 1 ATOM 441 C CG . GLN A 0 57 . 4.435 -2.569 -7.607 1.00 95.81 57 A 1 ATOM 442 C CD . GLN A 0 57 . 4.932 -2.810 -9.026 1.00 95.81 57 A 1 ATOM 443 N NE2 . GLN A 0 57 . 4.951 -4.034 -9.501 1.00 95.81 57 A 1 ATOM 444 O OE1 . GLN A 0 57 . 5.308 -1.891 -9.728 1.00 95.81 57 A 1 ATOM 445 N N . LYS A 0 58 . 4.417 -1.154 -4.633 1.00 93.95 58 A 1 ATOM 446 C CA . LYS A 0 58 . 5.569 -0.500 -4.013 1.00 93.95 58 A 1 ATOM 447 C C . LYS A 0 58 . 6.812 -1.348 -4.241 1.00 93.95 58 A 1 ATOM 448 C CB . LYS A 0 58 . 5.280 -0.276 -2.526 1.00 93.95 58 A 1 ATOM 449 O O . LYS A 0 58 . 6.857 -2.501 -3.815 1.00 93.95 58 A 1 ATOM 450 C CG . LYS A 0 58 . 6.468 0.270 -1.724 1.00 93.95 58 A 1 ATOM 451 C CD . LYS A 0 58 . 6.068 0.346 -0.248 1.00 93.95 58 A 1 ATOM 452 C CE . LYS A 0 58 . 7.194 0.931 0.602 1.00 93.95 58 A 1 ATOM 453 N NZ . LYS A 0 58 . 6.750 1.072 2.009 1.00 93.95 58 A 1 ATOM 454 N N . ILE A 0 59 . 7.818 -0.754 -4.868 1.00 93.90 59 A 1 ATOM 455 C CA . ILE A 0 59 . 9.135 -1.342 -5.102 1.00 93.90 59 A 1 ATOM 456 C C . ILE A 0 59 . 10.136 -0.614 -4.217 1.00 93.90 59 A 1 ATOM 457 C CB . ILE A 0 59 . 9.541 -1.267 -6.589 1.00 93.90 59 A 1 ATOM 458 O O . ILE A 0 59 . 10.363 0.581 -4.397 1.00 93.90 59 A 1 ATOM 459 C CG1 . ILE A 0 59 . 8.476 -1.935 -7.487 1.00 93.90 59 A 1 ATOM 460 C CG2 . ILE A 0 59 . 10.921 -1.931 -6.779 1.00 93.90 59 A 1 ATOM 461 C CD1 . ILE A 0 59 . 8.746 -1.783 -8.987 1.00 93.90 59 A 1 ATOM 462 N N . VAL A 0 60 . 10.744 -1.324 -3.276 1.00 92.74 60 A 1 ATOM 463 C CA . VAL A 0 60 . 11.826 -0.828 -2.426 1.00 92.74 60 A 1 ATOM 464 C C . VAL A 0 60 . 13.140 -1.366 -2.972 1.00 92.74 60 A 1 ATOM 465 C CB . VAL A 0 60 . 11.608 -1.246 -0.962 1.00 92.74 60 A 1 ATOM 466 O O . VAL A 0 60 . 13.320 -2.578 -3.054 1.00 92.74 60 A 1 ATOM 467 C CG1 . VAL A 0 60 . 12.732 -0.720 -0.070 1.00 92.74 60 A 1 ATOM 468 C CG2 . VAL A 0 60 . 10.278 -0.700 -0.421 1.00 92.74 60 A 1 ATOM 469 N N . ARG A 0 61 . 14.052 -0.471 -3.352 1.00 92.98 61 A 1 ATOM 470 C CA . ARG A 0 61 . 15.403 -0.817 -3.796 1.00 92.98 61 A 1 ATOM 471 C C . ARG A 0 61 . 16.388 -0.542 -2.675 1.00 92.98 61 A 1 ATOM 472 C CB . ARG A 0 61 . 15.794 -0.050 -5.065 1.00 92.98 61 A 1 ATOM 473 O O . ARG A 0 61 . 16.494 0.596 -2.212 1.00 92.98 61 A 1 ATOM 474 C CG . ARG A 0 61 . 14.832 -0.292 -6.237 1.00 92.98 61 A 1 ATOM 475 C CD . ARG A 0 61 . 15.556 -0.005 -7.558 1.00 92.98 61 A 1 ATOM 476 N NE . ARG A 0 61 . 14.745 -0.383 -8.732 1.00 92.98 61 A 1 ATOM 477 N NH1 . ARG A 0 61 . 13.937 1.694 -9.296 1.00 92.98 61 A 1 ATOM 478 N NH2 . ARG A 0 61 . 13.448 -0.068 -10.576 1.00 92.98 61 A 1 ATOM 479 C CZ . ARG A 0 61 . 14.052 0.415 -9.525 1.00 92.98 61 A 1 ATOM 480 N N . LEU A 0 62 . 17.114 -1.571 -2.269 1.00 93.32 62 A 1 ATOM 481 C CA . LEU A 0 62 . 18.180 -1.502 -1.281 1.00 93.32 62 A 1 ATOM 482 C C . LEU A 0 62 . 19.530 -1.690 -1.979 1.00 93.32 62 A 1 ATOM 483 C CB . LEU A 0 62 . 17.960 -2.554 -0.178 1.00 93.32 62 A 1 ATOM 484 O O . LEU A 0 62 . 19.637 -2.519 -2.880 1.00 93.32 62 A 1 ATOM 485 C CG . LEU A 0 62 . 16.568 -2.562 0.484 1.00 93.32 62 A 1 ATOM 486 C CD1 . LEU A 0 62 . 16.478 -3.674 1.523 1.00 93.32 62 A 1 ATOM 487 C CD2 . LEU A 0 62 . 16.254 -1.243 1.180 1.00 93.32 62 A 1 ATOM 488 N N . LYS A 0 63 . 20.550 -0.944 -1.552 1.00 94.38 63 A 1 ATOM 489 C CA . LYS A 0 63 . 21.949 -1.103 -1.968 1.00 94.38 63 A 1 ATOM 490 C C . LYS A 0 63 . 22.783 -1.383 -0.727 1.00 94.38 63 A 1 ATOM 491 C CB . LYS A 0 63 . 22.435 0.174 -2.670 1.00 94.38 63 A 1 ATOM 492 O O . LYS A 0 63 . 22.772 -0.571 0.193 1.00 94.38 63 A 1 ATOM 493 C CG . LYS A 0 63 . 23.793 -0.036 -3.359 1.00 94.38 63 A 1 ATOM 494 C CD . LYS A 0 63 . 24.329 1.287 -3.922 1.00 94.38 63 A 1 ATOM 495 C CE . LYS A 0 63 . 25.643 1.046 -4.673 1.00 94.38 63 A 1 ATOM 496 N NZ . LYS A 0 63 . 26.200 2.309 -5.222 1.00 94.38 63 A 1 ATOM 497 N N . ASN A 0 64 . 23.487 -2.510 -0.677 1.00 93.30 64 A 1 ATOM 498 C CA . ASN A 0 64 . 24.245 -2.940 0.507 1.00 93.30 64 A 1 ATOM 499 C C . ASN A 0 64 . 23.388 -2.954 1.792 1.00 93.30 64 A 1 ATOM 500 C CB . ASN A 0 64 . 25.527 -2.093 0.644 1.00 93.30 64 A 1 ATOM 501 O O . ASN A 0 64 . 23.854 -2.575 2.859 1.00 93.30 64 A 1 ATOM 502 C CG . ASN A 0 64 . 26.478 -2.255 -0.520 1.00 93.30 64 A 1 ATOM 503 N ND2 . ASN A 0 64 . 27.272 -1.257 -0.824 1.00 93.30 64 A 1 ATOM 504 O OD1 . ASN A 0 64 . 26.538 -3.281 -1.165 1.00 93.30 64 A 1 ATOM 505 N N . GLY A 0 65 . 22.105 -3.314 1.677 1.00 89.88 65 A 1 ATOM 506 C CA . GLY A 0 65 . 21.150 -3.300 2.794 1.00 89.88 65 A 1 ATOM 507 C C . GLY A 0 65 . 20.562 -1.925 3.145 1.00 89.88 65 A 1 ATOM 508 O O . GLY A 0 65 . 19.583 -1.863 3.885 1.00 89.88 65 A 1 ATOM 509 N N . PHE A 0 66 . 21.075 -0.830 2.579 1.00 91.02 66 A 1 ATOM 510 C CA . PHE A 0 66 . 20.559 0.519 2.821 1.00 91.02 66 A 1 ATOM 511 C C . PHE A 0 66 . 19.480 0.904 1.814 1.00 91.02 66 A 1 ATOM 512 C CB . PHE A 0 66 . 21.704 1.534 2.816 1.00 91.02 66 A 1 ATOM 513 O O . PHE A 0 66 . 19.581 0.588 0.628 1.00 91.02 66 A 1 ATOM 514 C CG . PHE A 0 66 . 22.689 1.301 3.939 1.00 91.02 66 A 1 ATOM 515 C CD1 . PHE A 0 66 . 22.429 1.818 5.222 1.00 91.02 66 A 1 ATOM 516 C CD2 . PHE A 0 66 . 23.840 0.524 3.716 1.00 91.02 66 A 1 ATOM 517 C CE1 . PHE A 0 66 . 23.321 1.561 6.278 1.00 91.02 66 A 1 ATOM 518 C CE2 . PHE A 0 66 . 24.726 0.260 4.774 1.00 91.02 66 A 1 ATOM 519 C CZ . PHE A 0 66 . 24.468 0.781 6.054 1.00 91.02 66 A 1 ATOM 520 N N . LEU A 0 67 . 18.454 1.623 2.276 1.00 89.80 67 A 1 ATOM 521 C CA . LEU A 0 67 . 17.395 2.146 1.416 1.00 89.80 67 A 1 ATOM 522 C C . LEU A 0 67 . 17.976 3.102 0.372 1.00 89.80 67 A 1 ATOM 523 C CB . LEU A 0 67 . 16.311 2.817 2.279 1.00 89.80 67 A 1 ATOM 524 O O . LEU A 0 67 . 18.400 4.202 0.706 1.00 89.80 67 A 1 ATOM 525 C CG . LEU A 0 67 . 15.142 3.401 1.462 1.00 89.80 67 A 1 ATOM 526 C CD1 . LEU A 0 67 . 14.355 2.308 0.743 1.00 89.80 67 A 1 ATOM 527 C CD2 . LEU A 0 67 . 14.179 4.151 2.381 1.00 89.80 67 A 1 ATOM 528 N N . ASN A 0 68 . 17.949 2.691 -0.894 1.00 91.17 68 A 1 ATOM 529 C CA . ASN A 0 68 . 18.399 3.518 -2.006 1.00 91.17 68 A 1 ATOM 530 C C . ASN A 0 68 . 17.234 4.300 -2.612 1.00 91.17 68 A 1 ATOM 531 C CB . ASN A 0 68 . 19.106 2.625 -3.033 1.00 91.17 68 A 1 ATOM 532 O O . ASN A 0 68 . 17.301 5.515 -2.761 1.00 91.17 68 A 1 ATOM 533 C CG . ASN A 0 68 . 19.602 3.435 -4.213 1.00 91.17 68 A 1 ATOM 534 N ND2 . ASN A 0 68 . 18.855 3.498 -5.292 1.00 91.17 68 A 1 ATOM 535 O OD1 . ASN A 0 68 . 20.673 4.008 -4.192 1.00 91.17 68 A 1 ATOM 536 N N . SER A 0 69 . 16.147 3.615 -2.975 1.00 90.42 69 A 1 ATOM 537 C CA . SER A 0 69 . 14.964 4.297 -3.497 1.00 90.42 69 A 1 ATOM 538 C C . SER A 0 69 . 13.684 3.505 -3.280 1.00 90.42 69 A 1 ATOM 539 C CB . SER A 0 69 . 15.163 4.702 -4.967 1.00 90.42 69 A 1 ATOM 540 O O . SER A 0 69 . 13.693 2.312 -2.980 1.00 90.42 69 A 1 ATOM 541 O OG . SER A 0 69 . 14.984 3.663 -5.914 1.00 90.42 69 A 1 ATOM 542 N N . THR A 0 70 . 12.546 4.182 -3.397 1.00 91.81 70 A 1 ATOM 543 C CA . THR A 0 70 . 11.236 3.532 -3.408 1.00 91.81 70 A 1 ATOM 544 C C . THR A 0 70 . 10.420 4.076 -4.566 1.00 91.81 70 A 1 ATOM 545 C CB . THR A 0 70 . 10.530 3.674 -2.057 1.00 91.81 70 A 1 ATOM 546 O O . THR A 0 70 . 10.409 5.275 -4.817 1.00 91.81 70 A 1 ATOM 547 C CG2 . THR A 0 70 . 9.111 3.112 -2.034 1.00 91.81 70 A 1 ATOM 548 O OG1 . THR A 0 70 . 11.247 2.952 -1.089 1.00 91.81 70 A 1 ATOM 549 N N . THR A 0 71 . 9.770 3.190 -5.307 1.00 93.06 71 A 1 ATOM 550 C CA . THR A 0 71 . 8.870 3.533 -6.412 1.00 93.06 71 A 1 ATOM 551 C C . THR A 0 71 . 7.487 3.012 -6.076 1.00 93.06 71 A 1 ATOM 552 C CB . THR A 0 71 . 9.384 2.961 -7.737 1.00 93.06 71 A 1 ATOM 553 O O . THR A 0 71 . 7.355 1.928 -5.508 1.00 93.06 71 A 1 ATOM 554 C CG2 . THR A 0 71 . 8.520 3.321 -8.943 1.00 93.06 71 A 1 ATOM 555 O OG1 . THR A 0 71 . 10.680 3.475 -7.963 1.00 93.06 71 A 1 ATOM 556 N N . ARG A 0 72 . 6.460 3.795 -6.383 1.00 94.47 72 A 1 ATOM 557 C CA . ARG A 0 72 . 5.064 3.446 -6.140 1.00 94.47 72 A 1 ATOM 558 C C . ARG A 0 72 . 4.271 3.626 -7.423 1.00 94.47 72 A 1 ATOM 559 C CB . ARG A 0 72 . 4.501 4.306 -5.007 1.00 94.47 72 A 1 ATOM 560 O O . ARG A 0 72 . 4.484 4.610 -8.129 1.00 94.47 72 A 1 ATOM 561 C CG . ARG A 0 72 . 5.153 4.022 -3.652 1.00 94.47 72 A 1 ATOM 562 C CD . ARG A 0 72 . 4.478 4.882 -2.578 1.00 94.47 72 A 1 ATOM 563 N NE . ARG A 0 72 . 5.053 4.660 -1.241 1.00 94.47 72 A 1 ATOM 564 N NH1 . ARG A 0 72 . 7.036 5.772 -1.543 1.00 94.47 72 A 1 ATOM 565 N NH2 . ARG A 0 72 . 6.564 4.856 0.443 1.00 94.47 72 A 1 ATOM 566 C CZ . ARG A 0 72 . 6.213 5.097 -0.788 1.00 94.47 72 A 1 ATOM 567 N N . SER A 0 73 . 3.376 2.687 -7.705 1.00 95.63 73 A 1 ATOM 568 C CA . SER A 0 73 . 2.632 2.656 -8.964 1.00 95.63 73 A 1 ATOM 569 C C . SER A 0 73 . 1.184 2.231 -8.753 1.00 95.63 73 A 1 ATOM 570 C CB . SER A 0 73 . 3.320 1.734 -9.983 1.00 95.63 73 A 1 ATOM 571 O O . SER A 0 73 . 0.870 1.451 -7.852 1.00 95.63 73 A 1 ATOM 572 O OG . SER A 0 73 . 4.674 2.115 -10.155 1.00 95.63 73 A 1 ATOM 573 N N . CYS A 0 74 . 0.325 2.750 -9.623 1.00 96.62 74 A 1 ATOM 574 C CA . CYS A 0 74 . -1.056 2.338 -9.825 1.00 96.62 74 A 1 ATOM 575 C C . CYS A 0 74 . -1.075 1.369 -11.009 1.00 96.62 74 A 1 ATOM 576 C CB . CYS A 0 74 . -1.861 3.601 -10.141 1.00 96.62 74 A 1 ATOM 577 O O . CYS A 0 74 . -0.608 1.731 -12.087 1.00 96.62 74 A 1 ATOM 578 S SG . CYS A 0 74 . -3.572 3.348 -10.656 1.00 96.62 74 A 1 ATOM 579 N N . LEU A 0 75 . -1.551 0.142 -10.806 1.00 96.21 75 A 1 ATOM 580 C CA . LEU A 0 75 . -1.576 -0.891 -11.839 1.00 96.21 75 A 1 ATOM 581 C C . LEU A 0 75 . -3.012 -1.335 -12.102 1.00 96.21 75 A 1 ATOM 582 C CB . LEU A 0 75 . -0.707 -2.088 -11.416 1.00 96.21 75 A 1 ATOM 583 O O . LEU A 0 75 . -3.749 -1.633 -11.162 1.00 96.21 75 A 1 ATOM 584 C CG . LEU A 0 75 . 0.775 -1.775 -11.144 1.00 96.21 75 A 1 ATOM 585 C CD1 . LEU A 0 75 . 1.474 -3.060 -10.707 1.00 96.21 75 A 1 ATOM 586 C CD2 . LEU A 0 75 . 1.507 -1.230 -12.369 1.00 96.21 75 A 1 ATOM 587 N N . THR A 0 76 . -3.392 -1.418 -13.372 1.00 92.40 76 A 1 ATOM 588 C CA . THR A 0 76 . -4.654 -2.019 -13.839 1.00 92.40 76 A 1 ATOM 589 C C . THR A 0 76 . -4.510 -3.516 -14.114 1.00 92.40 76 A 1 ATOM 590 C CB . THR A 0 76 . -5.124 -1.306 -15.113 1.00 92.40 76 A 1 ATOM 591 O O . THR A 0 76 . -5.485 -4.263 -14.015 1.00 92.40 76 A 1 ATOM 592 C CG2 . THR A 0 76 . -5.543 0.133 -14.797 1.00 92.40 76 A 1 ATOM 593 O OG1 . THR A 0 76 . -4.060 -1.246 -16.038 1.00 92.40 76 A 1 ATOM 594 N N . ASP A 0 77 . -3.282 -3.954 -14.395 1.00 91.08 77 A 1 ATOM 595 C CA . ASP A 0 77 . -2.933 -5.339 -14.708 1.00 91.08 77 A 1 ATOM 596 C C . ASP A 0 77 . -2.494 -6.108 -13.458 1.00 91.08 77 A 1 ATOM 597 C CB . ASP A 0 77 . -1.852 -5.349 -15.801 1.00 91.08 77 A 1 ATOM 598 O O . ASP A 0 77 . -2.818 -5.749 -12.331 1.00 91.08 77 A 1 ATOM 599 C CG . ASP A 0 77 . -2.319 -4.661 -17.079 1.00 91.08 77 A 1 ATOM 600 O OD1 . ASP A 0 77 . -3.532 -4.748 -17.371 1.00 91.08 77 A 1 ATOM 601 O OD2 . ASP A 0 77 . -1.452 -4.032 -17.715 1.00 91.08 77 A 1 ATOM 602 N N . THR A 0 78 . -1.772 -7.211 -13.629 1.00 93.79 78 A 1 ATOM 603 C CA . THR A 0 78 . -1.297 -8.048 -12.526 1.00 93.79 78 A 1 ATOM 604 C C . THR A 0 78 . -0.177 -7.385 -11.727 1.00 93.79 78 A 1 ATOM 605 C CB . THR A 0 78 . -0.801 -9.396 -13.055 1.00 93.79 78 A 1 ATOM 606 O O . THR A 0 78 . 0.708 -6.744 -12.288 1.00 93.79 78 A 1 ATOM 607 C CG2 . THR A 0 78 . -1.915 -10.185 -13.746 1.00 93.79 78 A 1 ATOM 608 O OG1 . THR A 0 78 . 0.230 -9.198 -13.991 1.00 93.79 78 A 1 ATOM 609 N N . CYS A 0 79 . -0.145 -7.637 -10.420 1.00 94.65 79 A 1 ATOM 610 C CA . CYS A 0 79 . 0.974 -7.283 -9.553 1.00 94.65 79 A 1 ATOM 611 C C . CYS A 0 79 . 1.424 -8.526 -8.780 1.00 94.65 79 A 1 ATOM 612 C CB . CYS A 0 79 . 0.535 -6.137 -8.638 1.00 94.65 79 A 1 ATOM 613 O O . CYS A 0 79 . 0.609 -9.172 -8.121 1.00 94.65 79 A 1 ATOM 614 S SG . CYS A 0 79 . 1.861 -5.313 -7.712 1.00 94.65 79 A 1 ATOM 615 N N . VAL A 0 80 . 2.717 -8.855 -8.853 1.00 94.56 80 A 1 ATOM 616 C CA . VAL A 0 80 . 3.301 -10.025 -8.185 1.00 94.56 80 A 1 ATOM 617 C C . VAL A 0 80 . 4.317 -9.570 -7.142 1.00 94.56 80 A 1 ATOM 618 C CB . VAL A 0 80 . 3.922 -11.002 -9.204 1.00 94.56 80 A 1 ATOM 619 O O . VAL A 0 80 . 5.273 -8.854 -7.456 1.00 94.56 80 A 1 ATOM 620 C CG1 . VAL A 0 80 . 4.490 -12.250 -8.517 1.00 94.56 80 A 1 ATOM 621 C CG2 . VAL A 0 80 . 2.877 -11.471 -10.226 1.00 94.56 80 A 1 ATOM 622 N N . ASN A 0 81 . 4.120 -10.007 -5.897 1.00 93.61 81 A 1 ATOM 623 C CA . ASN A 0 81 . 5.111 -9.814 -4.843 1.00 93.61 81 A 1 ATOM 624 C C . ASN A 0 81 . 6.393 -10.560 -5.219 1.00 93.61 81 A 1 ATOM 625 C CB . ASN A 0 81 . 4.573 -10.312 -3.490 1.00 93.61 81 A 1 ATOM 626 O O . ASN A 0 81 . 6.347 -11.739 -5.560 1.00 93.61 81 A 1 ATOM 627 C CG . ASN A 0 81 . 3.473 -9.451 -2.906 1.00 93.61 81 A 1 ATOM 628 N ND2 . ASN A 0 81 . 2.935 -9.823 -1.770 1.00 93.61 81 A 1 ATOM 629 O OD1 . ASN A 0 81 . 3.085 -8.425 -3.428 1.00 93.61 81 A 1 ATOM 630 N N . SER A 0 82 . 7.540 -9.891 -5.160 1.00 94.91 82 A 1 ATOM 631 C CA . SER A 0 82 . 8.818 -10.513 -5.513 1.00 94.91 82 A 1 ATOM 632 C C . SER A 0 82 . 9.979 -9.858 -4.786 1.00 94.91 82 A 1 ATOM 633 C CB . SER A 0 82 . 9.056 -10.484 -7.031 1.00 94.91 82 A 1 ATOM 634 O O . SER A 0 82 . 9.978 -8.650 -4.575 1.00 94.91 82 A 1 ATOM 635 O OG . SER A 0 82 . 8.974 -9.176 -7.568 1.00 94.91 82 A 1 ATOM 636 N N . ASN A 0 83 . 10.989 -10.657 -4.454 1.00 93.86 83 A 1 ATOM 637 C CA . ASN A 0 83 . 12.253 -10.196 -3.895 1.00 93.86 83 A 1 ATOM 638 C C . ASN A 0 83 . 13.362 -10.628 -4.851 1.00 93.86 83 A 1 ATOM 639 C CB . ASN A 0 83 . 12.432 -10.793 -2.490 1.00 93.86 83 A 1 ATOM 640 O O . ASN A 0 83 . 13.654 -11.816 -4.955 1.00 93.86 83 A 1 ATOM 641 C CG . ASN A 0 83 . 11.434 -10.266 -1.476 1.00 93.86 83 A 1 ATOM 642 N ND2 . ASN A 0 83 . 11.283 -10.947 -0.366 1.00 93.86 83 A 1 ATOM 643 O OD1 . ASN A 0 83 . 10.793 -9.246 -1.645 1.00 93.86 83 A 1 ATOM 644 N N . LYS A 0 84 . 13.949 -9.680 -5.582 1.00 94.08 84 A 1 ATOM 645 C CA . LYS A 0 84 . 15.062 -9.942 -6.502 1.00 94.08 84 A 1 ATOM 646 C C . LYS A 0 84 . 16.349 -9.437 -5.873 1.00 94.08 84 A 1 ATOM 647 C CB . LYS A 0 84 . 14.812 -9.293 -7.869 1.00 94.08 84 A 1 ATOM 648 O O . LYS A 0 84 . 16.435 -8.251 -5.565 1.00 94.08 84 A 1 ATOM 649 C CG . LYS A 0 84 . 13.573 -9.859 -8.578 1.00 94.08 84 A 1 ATOM 650 C CD . LYS A 0 84 . 13.456 -9.266 -9.987 1.00 94.08 84 A 1 ATOM 651 C CE . LYS A 0 84 . 12.223 -9.828 -10.701 1.00 94.08 84 A 1 ATOM 652 N NZ . LYS A 0 84 . 12.173 -9.391 -12.119 1.00 94.08 84 A 1 ATOM 653 N N . SER A 0 85 . 17.322 -10.318 -5.677 1.00 92.90 85 A 1 ATOM 654 C CA . SER A 0 85 . 18.630 -9.961 -5.132 1.00 92.90 85 A 1 ATOM 655 C C . SER A 0 85 . 19.701 -10.154 -6.194 1.00 92.90 85 A 1 ATOM 656 C CB . SER A 0 85 . 18.941 -10.785 -3.884 1.00 92.90 85 A 1 ATOM 657 O O . SER A 0 85 . 19.864 -11.248 -6.719 1.00 92.90 85 A 1 ATOM 658 O OG . SER A 0 85 . 20.094 -10.278 -3.242 1.00 92.90 85 A 1 ATOM 659 N N . GLU A 0 86 . 20.425 -9.083 -6.484 1.00 91.66 86 A 1 ATOM 660 C CA . GLU A 0 86 . 21.588 -9.056 -7.366 1.00 91.66 86 A 1 ATOM 661 C C . GLU A 0 86 . 22.617 -8.164 -6.687 1.00 91.66 86 A 1 ATOM 662 C CB . GLU A 0 86 . 21.219 -8.470 -8.737 1.00 91.66 86 A 1 ATOM 663 O O . GLU A 0 86 . 22.542 -6.946 -6.813 1.00 91.66 86 A 1 ATOM 664 C CG . GLU A 0 86 . 20.451 -9.450 -9.628 1.00 91.66 86 A 1 ATOM 665 C CD . GLU A 0 86 . 19.985 -8.801 -10.940 1.00 91.66 86 A 1 ATOM 666 O OE1 . GLU A 0 86 . 19.077 -9.392 -11.569 1.00 91.66 86 A 1 ATOM 667 O OE2 . GLU A 0 86 . 20.452 -7.686 -11.267 1.00 91.66 86 A 1 ATOM 668 N N . SER A 0 87 . 23.525 -8.748 -5.899 1.00 90.01 87 A 1 ATOM 669 C CA . SER A 0 87 . 24.492 -7.985 -5.098 1.00 90.01 87 A 1 ATOM 670 C C . SER A 0 87 . 25.172 -6.882 -5.932 1.00 90.01 87 A 1 ATOM 671 C CB . SER A 0 87 . 25.558 -8.919 -4.527 1.00 90.01 87 A 1 ATOM 672 O O . SER A 0 87 . 25.665 -7.177 -7.022 1.00 90.01 87 A 1 ATOM 673 O OG . SER A 0 87 . 26.344 -8.206 -3.595 1.00 90.01 87 A 1 ATOM 674 N N . PRO A 0 88 . 25.193 -5.612 -5.472 1.00 92.96 88 A 1 ATOM 675 C CA . PRO A 0 88 . 24.845 -5.130 -4.126 1.00 92.96 88 A 1 ATOM 676 C C . PRO A 0 88 . 23.355 -4.807 -3.899 1.00 92.96 88 A 1 ATOM 677 C CB . PRO A 0 88 . 25.702 -3.874 -3.968 1.00 92.96 88 A 1 ATOM 678 O O . PRO A 0 88 . 22.993 -4.232 -2.870 1.00 92.96 88 A 1 ATOM 679 C CG . PRO A 0 88 . 25.746 -3.292 -5.373 1.00 92.96 88 A 1 ATOM 680 C CD . PRO A 0 88 . 25.807 -4.540 -6.245 1.00 92.96 88 A 1 ATOM 681 N N . TRP A 0 89 . 22.493 -5.102 -4.864 1.00 94.99 89 A 1 ATOM 682 C CA . TRP A 0 89 . 21.101 -4.679 -4.916 1.00 94.99 89 A 1 ATOM 683 C C . TRP A 0 89 . 20.116 -5.726 -4.391 1.00 94.99 89 A 1 ATOM 684 C CB . TRP A 0 89 . 20.748 -4.249 -6.343 1.00 94.99 89 A 1 ATOM 685 O O . TRP A 0 89 . 20.249 -6.933 -4.601 1.00 94.99 89 A 1 ATOM 686 C CG . TRP A 0 89 . 21.620 -3.161 -6.883 1.00 94.99 89 A 1 ATOM 687 C CD1 . TRP A 0 89 . 22.655 -3.323 -7.737 1.00 94.99 89 A 1 ATOM 688 C CD2 . TRP A 0 89 . 21.544 -1.735 -6.611 1.00 94.99 89 A 1 ATOM 689 C CE2 . TRP A 0 89 . 22.576 -1.075 -7.342 1.00 94.99 89 A 1 ATOM 690 C CE3 . TRP A 0 89 . 20.680 -0.934 -5.837 1.00 94.99 89 A 1 ATOM 691 N NE1 . TRP A 0 89 . 23.226 -2.093 -8.010 1.00 94.99 89 A 1 ATOM 692 C CH2 . TRP A 0 89 . 21.846 1.093 -6.548 1.00 94.99 89 A 1 ATOM 693 C CZ2 . TRP A 0 89 . 22.740 0.319 -7.310 1.00 94.99 89 A 1 ATOM 694 C CZ3 . TRP A 0 89 . 20.821 0.463 -5.820 1.00 94.99 89 A 1 ATOM 695 N N . LEU A 0 90 . 19.058 -5.235 -3.750 1.00 95.02 90 A 1 ATOM 696 C CA . LEU A 0 90 . 17.880 -6.010 -3.379 1.00 95.02 90 A 1 ATOM 697 C C . LEU A 0 90 . 16.623 -5.196 -3.699 1.00 95.02 90 A 1 ATOM 698 C CB . LEU A 0 90 . 18.002 -6.428 -1.902 1.00 95.02 90 A 1 ATOM 699 O O . LEU A 0 90 . 16.409 -4.118 -3.152 1.00 95.02 90 A 1 ATOM 700 C CG . LEU A 0 90 . 16.742 -7.062 -1.289 1.00 95.02 90 A 1 ATOM 701 C CD1 . LEU A 0 90 . 16.318 -8.341 -2.009 1.00 95.02 90 A 1 ATOM 702 C CD2 . LEU A 0 90 . 17.001 -7.432 0.170 1.00 95.02 90 A 1 ATOM 703 N N . ASN A 0 91 . 15.788 -5.725 -4.588 1.00 94.19 91 A 1 ATOM 704 C CA . ASN A 0 91 . 14.533 -5.126 -5.019 1.00 94.19 91 A 1 ATOM 705 C C . ASN A 0 91 . 13.361 -5.911 -4.428 1.00 94.19 91 A 1 ATOM 706 C CB . ASN A 0 91 . 14.489 -5.100 -6.555 1.00 94.19 91 A 1 ATOM 707 O O . ASN A 0 91 . 13.130 -7.061 -4.797 1.00 94.19 91 A 1 ATOM 708 C CG . ASN A 0 91 . 15.542 -4.200 -7.176 1.00 94.19 91 A 1 ATOM 709 N ND2 . ASN A 0 91 . 15.937 -4.466 -8.399 1.00 94.19 91 A 1 ATOM 710 O OD1 . ASN A 0 91 . 15.990 -3.220 -6.608 1.00 94.19 91 A 1 ATOM 711 N N . ILE A 0 92 . 12.609 -5.273 -3.538 1.00 94.19 92 A 1 ATOM 712 C CA . ILE A 0 92 . 11.437 -5.834 -2.863 1.00 94.19 92 A 1 ATOM 713 C C . ILE A 0 92 . 10.188 -5.205 -3.472 1.00 94.19 92 A 1 ATOM 714 C CB . ILE A 0 92 . 11.532 -5.582 -1.343 1.00 94.19 92 A 1 ATOM 715 O O . ILE A 0 92 . 9.951 -4.008 -3.322 1.00 94.19 92 A 1 ATOM 716 C CG1 . ILE A 0 92 . 12.767 -6.293 -0.745 1.00 94.19 92 A 1 ATOM 717 C CG2 . ILE A 0 92 . 10.234 -6.003 -0.628 1.00 94.19 92 A 1 ATOM 718 C CD1 . ILE A 0 92 . 13.091 -5.855 0.689 1.00 94.19 92 A 1 ATOM 719 N N . THR A 0 93 . 9.379 -6.011 -4.143 1.00 94.70 93 A 1 ATOM 720 C CA . THR A 0 93 . 8.107 -5.618 -4.750 1.00 94.70 93 A 1 ATOM 721 C C . THR A 0 93 . 6.964 -6.108 -3.880 1.00 94.70 93 A 1 ATOM 722 C CB . THR A 0 93 . 7.960 -6.172 -6.170 1.00 94.70 93 A 1 ATOM 723 O O . THR A 0 93 . 6.853 -7.297 -3.587 1.00 94.70 93 A 1 ATOM 724 C CG2 . THR A 0 93 . 6.701 -5.655 -6.866 1.00 94.70 93 A 1 ATOM 725 O OG1 . THR A 0 93 . 9.069 -5.784 -6.945 1.00 94.70 93 A 1 ATOM 726 N N . THR A 0 94 . 6.093 -5.184 -3.495 1.00 93.81 94 A 1 ATOM 727 C CA . THR A 0 94 . 4.904 -5.442 -2.683 1.00 93.81 94 A 1 ATOM 728 C C . THR A 0 94 . 3.668 -4.898 -3.382 1.00 93.81 94 A 1 ATOM 729 C CB . THR A 0 94 . 5.035 -4.854 -1.269 1.00 93.81 94 A 1 ATOM 730 O O . THR A 0 94 . 3.680 -3.789 -3.916 1.00 93.81 94 A 1 ATOM 731 C CG2 . THR A 0 94 . 6.080 -5.598 -0.442 1.00 93.81 94 A 1 ATOM 732 O OG1 . THR A 0 94 . 5.433 -3.502 -1.296 1.00 93.81 94 A 1 ATOM 733 N N . CYS A 0 95 . 2.610 -5.697 -3.374 1.00 94.93 95 A 1 ATOM 734 C CA . CYS A 0 95 . 1.341 -5.440 -4.031 1.00 94.93 95 A 1 ATOM 735 C C . CYS A 0 95 . 0.214 -5.446 -3.001 1.00 94.93 95 A 1 ATOM 736 C CB . CYS A 0 95 . 1.109 -6.523 -5.085 1.00 94.93 95 A 1 ATOM 737 O O . CYS A 0 95 . 0.216 -6.240 -2.056 1.00 94.93 95 A 1 ATOM 738 S SG . CYS A 0 95 . 2.425 -6.656 -6.317 1.00 94.93 95 A 1 ATOM 739 N N . CYS A 0 96 . -0.772 -4.577 -3.187 1.00 92.71 96 A 1 ATOM 740 C CA . CYS A 0 96 . -1.954 -4.530 -2.340 1.00 92.71 96 A 1 ATOM 741 C C . CYS A 0 96 . -3.164 -4.011 -3.116 1.00 92.71 96 A 1 ATOM 742 C CB . CYS A 0 96 . -1.638 -3.672 -1.110 1.00 92.71 96 A 1 ATOM 743 O O . CYS A 0 96 . -3.021 -3.271 -4.084 1.00 92.71 96 A 1 ATOM 744 S SG . CYS A 0 96 . -1.098 -1.992 -1.498 1.00 92.71 96 A 1 ATOM 745 N N . THR A 0 97 . -4.356 -4.416 -2.685 1.00 91.11 97 A 1 ATOM 746 C CA . THR A 0 97 . -5.623 -4.037 -3.327 1.00 91.11 97 A 1 ATOM 747 C C . THR A 0 97 . -6.551 -3.242 -2.416 1.00 91.11 97 A 1 ATOM 748 C CB . THR A 0 97 . -6.369 -5.283 -3.819 1.00 91.11 97 A 1 ATOM 749 O O . THR A 0 97 . -7.482 -2.636 -2.922 1.00 91.11 97 A 1 ATOM 750 C CG2 . THR A 0 97 . -5.609 -6.011 -4.921 1.00 91.11 97 A 1 ATOM 751 O OG1 . THR A 0 97 . -6.506 -6.201 -2.753 1.00 91.11 97 A 1 ATOM 752 N N . LYS A 0 98 . -6.343 -3.261 -1.088 1.00 86.21 98 A 1 ATOM 753 C CA . LYS A 0 98 . -7.131 -2.518 -0.082 1.00 86.21 98 A 1 ATOM 754 C C . LYS A 0 98 . -6.348 -2.313 1.219 1.00 86.21 98 A 1 ATOM 755 C CB . LYS A 0 98 . -8.423 -3.276 0.283 1.00 86.21 98 A 1 ATOM 756 O O . LYS A 0 98 . -5.562 -3.206 1.561 1.00 86.21 98 A 1 ATOM 757 C CG . LYS A 0 98 . -9.417 -3.371 -0.878 1.00 86.21 98 A 1 ATOM 758 C CD . LYS A 0 98 . -10.800 -3.848 -0.443 1.00 86.21 98 A 1 ATOM 759 C CE . LYS A 0 98 . -11.679 -3.906 -1.697 1.00 86.21 98 A 1 ATOM 760 N NZ . LYS A 0 98 . -13.098 -4.192 -1.373 1.00 86.21 98 A 1 ATOM 761 N N . PRO A 0 99 . -6.593 -1.243 2.004 1.00 87.89 99 A 1 ATOM 762 C CA . PRO A 0 99 . -7.482 -0.120 1.679 1.00 87.89 99 A 1 ATOM 763 C C . PRO A 0 99 . -6.858 0.799 0.621 1.00 87.89 99 A 1 ATOM 764 C CB . PRO A 0 99 . -7.705 0.596 3.019 1.00 87.89 99 A 1 ATOM 765 O O . PRO A 0 99 . -5.787 0.492 0.093 1.00 87.89 99 A 1 ATOM 766 C CG . PRO A 0 99 . -6.377 0.398 3.739 1.00 87.89 99 A 1 ATOM 767 C CD . PRO A 0 99 . -5.982 -1.014 3.313 1.00 87.89 99 A 1 ATOM 768 N N . ASP A 0 100 . -7.521 1.910 0.320 1.00 90.42 100 A 1 ATOM 769 C CA . ASP A 0 100 . -6.924 2.983 -0.470 1.00 90.42 100 A 1 ATOM 770 C C . ASP A 0 100 . -5.562 3.392 0.086 1.00 90.42 100 A 1 ATOM 771 C CB . ASP A 0 100 . -7.861 4.198 -0.525 1.00 90.42 100 A 1 ATOM 772 O O . ASP A 0 100 . -5.304 3.331 1.291 1.00 90.42 100 A 1 ATOM 773 C CG . ASP A 0 100 . -9.055 3.981 -1.454 1.00 90.42 100 A 1 ATOM 774 O OD1 . ASP A 0 100 . -8.913 3.161 -2.389 1.00 90.42 100 A 1 ATOM 775 O OD2 . ASP A 0 100 . -10.083 4.651 -1.224 1.00 90.42 100 A 1 ATOM 776 N N . LEU A 0 101 . -4.676 3.787 -0.826 1.00 91.17 101 A 1 ATOM 777 C CA . LEU A 0 101 . -3.330 4.259 -0.529 1.00 91.17 101 A 1 ATOM 778 C C . LEU A 0 101 . -2.479 3.208 0.207 1.00 91.17 101 A 1 ATOM 779 C CB . LEU A 0 101 . -3.442 5.618 0.186 1.00 91.17 101 A 1 ATOM 780 O O . LEU A 0 101 . -1.503 3.520 0.889 1.00 91.17 101 A 1 ATOM 781 C CG . LEU A 0 101 . -4.250 6.688 -0.574 1.00 91.17 101 A 1 ATOM 782 C CD1 . LEU A 0 101 . -4.378 7.942 0.286 1.00 91.17 101 A 1 ATOM 783 C CD2 . LEU A 0 101 . -3.599 7.067 -1.907 1.00 91.17 101 A 1 ATOM 784 N N . CYS A 0 102 . -2.800 1.923 0.028 1.00 91.33 102 A 1 ATOM 785 C CA . CYS A 0 102 . -2.166 0.821 0.744 1.00 91.33 102 A 1 ATOM 786 C C . CYS A 0 102 . -0.655 0.666 0.531 1.00 91.33 102 A 1 ATOM 787 C CB . CYS A 0 102 . -2.825 -0.485 0.327 1.00 91.33 102 A 1 ATOM 788 O O . CYS A 0 102 . -0.013 -0.073 1.281 1.00 91.33 102 A 1 ATOM 789 S SG . CYS A 0 102 . -2.818 -0.923 -1.414 1.00 91.33 102 A 1 ATOM 790 N N . ASN A 0 103 . -0.095 1.316 -0.488 1.00 92.48 103 A 1 ATOM 791 C CA . ASN A 0 103 . 1.327 1.309 -0.800 1.00 92.48 103 A 1 ATOM 792 C C . ASN A 0 103 . 2.118 2.408 -0.056 1.00 92.48 103 A 1 ATOM 793 C CB . ASN A 0 103 . 1.502 1.309 -2.329 1.00 92.48 103 A 1 ATOM 794 O O . ASN A 0 103 . 3.285 2.649 -0.372 1.00 92.48 103 A 1 ATOM 795 C CG . ASN A 0 103 . 1.029 2.560 -3.043 1.00 92.48 103 A 1 ATOM 796 N ND2 . ASN A 0 103 . 1.442 2.714 -4.278 1.00 92.48 103 A 1 ATOM 797 O OD1 . ASN A 0 103 . 0.292 3.380 -2.521 1.00 92.48 103 A 1 ATOM 798 N N . GLN A 0 104 . 1.525 3.062 0.951 1.00 88.30 104 A 1 ATOM 799 C CA . GLN A 0 104 . 2.178 4.089 1.768 1.00 88.30 104 A 1 ATOM 800 C C . GLN A 0 104 . 3.387 3.539 2.549 1.00 88.30 104 A 1 ATOM 801 C CB . GLN A 0 104 . 1.140 4.700 2.729 1.00 88.30 104 A 1 ATOM 802 O O . GLN A 0 104 . 4.538 3.930 2.311 1.00 88.30 104 A 1 ATOM 803 C CG . GLN A 0 104 . 1.548 6.084 3.264 1.00 88.30 104 A 1 ATOM 804 C CD . GLN A 0 104 . 0.497 6.713 4.170 1.00 88.30 104 A 1 ATOM 805 N NE2 . GLN A 0 104 . 0.804 7.805 4.833 1.00 88.30 104 A 1 ATOM 806 O OE1 . GLN A 0 104 . -0.610 6.233 4.307 1.00 88.30 104 A 1 ATOM 807 N N . SER A 0 105 . 3.140 2.585 3.451 1.00 77.28 105 A 1 ATOM 808 C CA . SER A 0 105 . 4.078 2.101 4.472 1.00 77.28 105 A 1 ATOM 809 C C . SER A 0 105 . 4.324 0.589 4.369 1.00 77.28 105 A 1 ATOM 810 C CB . SER A 0 105 . 3.554 2.496 5.860 1.00 77.28 105 A 1 ATOM 811 O O . SER A 0 105 . 3.887 -0.070 3.426 1.00 77.28 105 A 1 ATOM 812 O OG . SER A 0 105 . 2.341 1.824 6.107 1.00 77.28 105 A 1 ATOM 813 N N . VAL A 0 106 . 5.143 0.049 5.274 1.00 68.40 106 A 1 ATOM 814 C CA . VAL A 0 106 . 5.279 -1.403 5.459 1.00 68.40 106 A 1 ATOM 815 C C . VAL A 0 106 . 4.030 -1.889 6.190 1.00 68.40 106 A 1 ATOM 816 C CB . VAL A 0 106 . 6.550 -1.754 6.259 1.00 68.40 106 A 1 ATOM 817 O O . VAL A 0 106 . 3.674 -1.336 7.228 1.00 68.40 106 A 1 ATOM 818 C CG1 . VAL A 0 106 . 6.742 -3.269 6.392 1.00 68.40 106 A 1 ATOM 819 C CG2 . VAL A 0 106 . 7.805 -1.188 5.577 1.00 68.40 106 A 1 ATOM 820 N N . ARG A 0 107 . 3.357 -2.910 5.654 1.00 62.69 107 A 1 ATOM 821 C CA . ARG A 0 107 . 2.209 -3.520 6.329 1.00 62.69 107 A 1 ATOM 822 C C . ARG A 0 107 . 2.689 -4.377 7.488 1.00 62.69 107 A 1 ATOM 823 C CB . ARG A 0 107 . 1.384 -4.375 5.359 1.00 62.69 107 A 1 ATOM 824 O O . ARG A 0 107 . 3.289 -5.423 7.267 1.00 62.69 107 A 1 ATOM 825 C CG . ARG A 0 107 . 0.601 -3.496 4.390 1.00 62.69 107 A 1 ATOM 826 C CD . ARG A 0 107 . -0.273 -4.364 3.487 1.00 62.69 107 A 1 ATOM 827 N NE . ARG A 0 107 . -1.171 -3.485 2.743 1.00 62.69 107 A 1 ATOM 828 N NH1 . ARG A 0 107 . -3.150 -4.700 2.841 1.00 62.69 107 A 1 ATOM 829 N NH2 . ARG A 0 107 . -3.155 -2.542 2.454 1.00 62.69 107 A 1 ATOM 830 C CZ . ARG A 0 107 . -2.476 -3.601 2.676 1.00 62.69 107 A 1 ATOM 831 N N . THR A 0 108 . 2.348 -3.981 8.703 1.00 59.04 108 A 1 ATOM 832 C CA . THR A 0 108 . 2.258 -4.912 9.822 1.00 59.04 108 A 1 ATOM 833 C C . THR A 0 108 . 0.875 -5.553 9.748 1.00 59.04 108 A 1 ATOM 834 C CB . THR A 0 108 . 2.522 -4.194 11.154 1.00 59.04 108 A 1 ATOM 835 O O . THR A 0 108 . -0.149 -4.910 9.960 1.00 59.04 108 A 1 ATOM 836 C CG2 . THR A 0 108 . 3.991 -3.784 11.263 1.00 59.04 108 A 1 ATOM 837 O OG1 . THR A 0 108 . 1.771 -3.008 11.244 1.00 59.04 108 A 1 ATOM 838 N N . THR A 0 109 . 0.798 -6.817 9.334 1.00 58.20 109 A 1 ATOM 839 C CA . THR A 0 109 . -0.478 -7.540 9.303 1.00 58.20 109 A 1 ATOM 840 C C . THR A 0 109 . -0.869 -7.938 10.725 1.00 58.20 109 A 1 ATOM 841 C CB . THR A 0 109 . -0.420 -8.770 8.381 1.00 58.20 109 A 1 ATOM 842 O O . THR A 0 109 . -0.614 -9.066 11.140 1.00 58.20 109 A 1 ATOM 843 C CG2 . THR A 0 109 . -0.277 -8.387 6.909 1.00 58.20 109 A 1 ATOM 844 O OG1 . THR A 0 109 . 0.678 -9.583 8.713 1.00 58.20 109 A 1 ATOM 845 N N . SER A 0 110 . -1.487 -7.042 11.493 1.00 57.79 110 A 1 ATOM 846 C CA . SER A 0 110 . -2.196 -7.432 12.713 1.00 57.79 110 A 1 ATOM 847 C C . SER A 0 110 . -3.598 -7.910 12.329 1.00 57.79 110 A 1 ATOM 848 C CB . SER A 0 110 . -2.197 -6.307 13.758 1.00 57.79 110 A 1 ATOM 849 O O . SER A 0 110 . -4.536 -7.134 12.179 1.00 57.79 110 A 1 ATOM 850 O OG . SER A 0 110 . -2.654 -5.090 13.207 1.00 57.79 110 A 1 ATOM 851 N N . LYS A 0 111 . -3.771 -9.225 12.153 1.00 60.42 111 A 1 ATOM 852 C CA . LYS A 0 111 . -5.109 -9.844 12.112 1.00 60.42 111 A 1 ATOM 853 C C . LYS A 0 111 . -5.659 -9.939 13.538 1.00 60.42 111 A 1 ATOM 854 C CB . LYS A 0 111 . -5.079 -11.221 11.432 1.00 60.42 111 A 1 ATOM 855 O O . LYS A 0 111 . -5.851 -11.028 14.066 1.00 60.42 111 A 1 ATOM 856 C CG . LYS A 0 111 . -4.758 -11.184 9.933 1.00 60.42 111 A 1 ATOM 857 C CD . LYS A 0 111 . -4.893 -12.609 9.377 1.00 60.42 111 A 1 ATOM 858 C CE . LYS A 0 111 . -4.558 -12.672 7.884 1.00 60.42 111 A 1 ATOM 859 N NZ . LYS A 0 111 . -4.703 -14.057 7.365 1.00 60.42 111 A 1 ATOM 860 N N . MET A 0 112 . -5.807 -8.807 14.216 1.00 63.45 112 A 1 ATOM 861 C CA . MET A 0 112 . -6.269 -8.800 15.598 1.00 63.45 112 A 1 ATOM 862 C C . MET A 0 112 . -7.800 -8.830 15.590 1.00 63.45 112 A 1 ATOM 863 C CB . MET A 0 112 . -5.627 -7.623 16.344 1.00 63.45 112 A 1 ATOM 864 O O . MET A 0 112 . -8.451 -7.834 15.284 1.00 63.45 112 A 1 ATOM 865 C CG . MET A 0 112 . -5.571 -7.853 17.855 1.00 63.45 112 A 1 ATOM 866 S SD . MET A 0 112 . -4.415 -6.725 18.676 1.00 63.45 112 A 1 ATOM 867 C CE . MET A 0 112 . -4.916 -6.960 20.400 1.00 63.45 112 A 1 ATOM 868 N N . ASN A 0 113 . -8.382 -9.999 15.868 1.00 67.02 113 A 1 ATOM 869 C CA . ASN A 0 113 . -9.832 -10.185 15.940 1.00 67.02 113 A 1 ATOM 870 C C . ASN A 0 113 . -10.377 -9.606 17.256 1.00 67.02 113 A 1 ATOM 871 C CB . ASN A 0 113 . -10.190 -11.672 15.773 1.00 67.02 113 A 1 ATOM 872 O O . ASN A 0 113 . -10.711 -10.341 18.183 1.00 67.02 113 A 1 ATOM 873 C CG . ASN A 0 113 . -9.977 -12.199 14.371 1.00 67.02 113 A 1 ATOM 874 N ND2 . ASN A 0 113 . -9.262 -13.288 14.217 1.00 67.02 113 A 1 ATOM 875 O OD1 . ASN A 0 113 . -10.463 -11.651 13.399 1.00 67.02 113 A 1 ATOM 876 N N . ILE A 0 114 . -10.474 -8.277 17.338 1.00 73.59 114 A 1 ATOM 877 C CA . ILE A 0 114 . -10.977 -7.550 18.519 1.00 73.59 114 A 1 ATOM 878 C C . ILE A 0 114 . -12.428 -7.957 18.865 1.00 73.59 114 A 1 ATOM 879 C CB . ILE A 0 114 . -10.801 -6.026 18.287 1.00 73.59 114 A 1 ATOM 880 O O . ILE A 0 114 . -12.848 -7.844 20.013 1.00 73.59 114 A 1 ATOM 881 C CG1 . ILE A 0 114 . -9.298 -5.667 18.161 1.00 73.59 114 A 1 ATOM 882 C CG2 . ILE A 0 114 . -11.438 -5.193 19.412 1.00 73.59 114 A 1 ATOM 883 C CD1 . ILE A 0 114 . -9.031 -4.253 17.628 1.00 73.59 114 A 1 ATOM 884 N N . GLN A 0 115 . -13.174 -8.518 17.907 1.00 71.89 115 A 1 ATOM 885 C CA . GLN A 0 115 . -14.552 -8.987 18.094 1.00 71.89 115 A 1 ATOM 886 C C . GLN A 0 115 . -14.697 -10.056 19.191 1.00 71.89 115 A 1 ATOM 887 C CB . GLN A 0 115 . -15.086 -9.518 16.749 1.00 71.89 115 A 1 ATOM 888 O O . GLN A 0 115 . -15.656 -10.014 19.958 1.00 71.89 115 A 1 ATOM 889 C CG . GLN A 0 115 . -15.208 -8.438 15.653 1.00 71.89 115 A 1 ATOM 890 C CD . GLN A 0 115 . -16.257 -7.371 15.961 1.00 71.89 115 A 1 ATOM 891 N NE2 . GLN A 0 115 . -16.359 -6.318 15.183 1.00 71.89 115 A 1 ATOM 892 O OE1 . GLN A 0 115 . -17.005 -7.462 16.913 1.00 71.89 115 A 1 ATOM 893 N N . PHE A 0 116 . -13.731 -10.974 19.337 1.00 77.03 116 A 1 ATOM 894 C CA . PHE A 0 116 . -13.806 -12.004 20.383 1.00 77.03 116 A 1 ATOM 895 C C . PHE A 0 116 . -13.721 -11.410 21.793 1.00 77.03 116 A 1 ATOM 896 C CB . PHE A 0 116 . -12.709 -13.056 20.179 1.00 77.03 116 A 1 ATOM 897 O O . PHE A 0 116 . -14.380 -11.904 22.704 1.00 77.03 116 A 1 ATOM 898 C CG . PHE A 0 116 . -12.977 -13.993 19.020 1.00 77.03 116 A 1 ATOM 899 C CD1 . PHE A 0 116 . -13.955 -14.998 19.140 1.00 77.03 116 A 1 ATOM 900 C CD2 . PHE A 0 116 . -12.254 -13.864 17.822 1.00 77.03 116 A 1 ATOM 901 C CE1 . PHE A 0 116 . -14.213 -15.863 18.063 1.00 77.03 116 A 1 ATOM 902 C CE2 . PHE A 0 116 . -12.518 -14.721 16.738 1.00 77.03 116 A 1 ATOM 903 C CZ . PHE A 0 116 . -13.498 -15.722 16.860 1.00 77.03 116 A 1 ATOM 904 N N . ILE A 0 117 . -12.962 -10.326 21.970 1.00 80.57 117 A 1 ATOM 905 C CA . ILE A 0 117 . -12.783 -9.674 23.274 1.00 80.57 117 A 1 ATOM 906 C C . ILE A 0 117 . -14.109 -9.062 23.745 1.00 80.57 117 A 1 ATOM 907 C CB . ILE A 0 117 . -11.641 -8.632 23.203 1.00 80.57 117 A 1 ATOM 908 O O . ILE A 0 117 . -14.493 -9.238 24.899 1.00 80.57 117 A 1 ATOM 909 C CG1 . ILE A 0 117 . -10.312 -9.317 22.796 1.00 80.57 117 A 1 ATOM 910 C CG2 . ILE A 0 117 . -11.487 -7.903 24.551 1.00 80.57 117 A 1 ATOM 911 C CD1 . ILE A 0 117 . -9.142 -8.352 22.567 1.00 80.57 117 A 1 ATOM 912 N N . TRP A 0 118 . -14.847 -8.411 22.841 1.00 76.38 118 A 1 ATOM 913 C CA . TRP A 0 118 . -16.153 -7.824 23.154 1.00 76.38 118 A 1 ATOM 914 C C . TRP A 0 118 . -17.210 -8.876 23.496 1.00 76.38 118 A 1 ATOM 915 C CB . TRP A 0 118 . -16.610 -6.952 21.984 1.00 76.38 118 A 1 ATOM 916 O O . TRP A 0 118 . -17.965 -8.691 24.449 1.00 76.38 118 A 1 ATOM 917 C CG . TRP A 0 118 . -15.822 -5.691 21.836 1.00 76.38 118 A 1 ATOM 918 C CD1 . TRP A 0 118 . -14.927 -5.418 20.861 1.00 76.38 118 A 1 ATOM 919 C CD2 . TRP A 0 118 . -15.844 -4.517 22.701 1.00 76.38 118 A 1 ATOM 920 C CE2 . TRP A 0 118 . -14.921 -3.560 22.186 1.00 76.38 118 A 1 ATOM 921 C CE3 . TRP A 0 118 . -16.557 -4.165 23.867 1.00 76.38 118 A 1 ATOM 922 N NE1 . TRP A 0 118 . -14.390 -4.161 21.066 1.00 76.38 118 A 1 ATOM 923 C CH2 . TRP A 0 118 . -15.440 -1.993 23.952 1.00 76.38 118 A 1 ATOM 924 C CZ2 . TRP A 0 118 . -14.713 -2.314 22.793 1.00 76.38 118 A 1 ATOM 925 C CZ3 . TRP A 0 118 . -16.357 -2.917 24.486 1.00 76.38 118 A 1 ATOM 926 N N . ILE A 0 119 . -17.231 -10.002 22.772 1.00 78.45 119 A 1 ATOM 927 C CA . ILE A 0 119 . -18.160 -11.105 23.056 1.00 78.45 119 A 1 ATOM 928 C C . ILE A 0 119 . -17.883 -11.679 24.450 1.00 78.45 119 A 1 ATOM 929 C CB . ILE A 0 119 . -18.095 -12.181 21.949 1.00 78.45 119 A 1 ATOM 930 O O . ILE A 0 119 . -18.801 -11.783 25.261 1.00 78.45 119 A 1 ATOM 931 C CG1 . ILE A 0 119 . -18.605 -11.596 20.610 1.00 78.45 119 A 1 ATOM 932 C CG2 . ILE A 0 119 . -18.933 -13.416 22.336 1.00 78.45 119 A 1 ATOM 933 C CD1 . ILE A 0 119 . -18.314 -12.485 19.394 1.00 78.45 119 A 1 ATOM 934 N N . LEU A 0 120 . -16.620 -11.968 24.775 1.00 82.09 120 A 1 ATOM 935 C CA . LEU A 0 120 . -16.245 -12.483 26.095 1.00 82.09 120 A 1 ATOM 936 C C . LEU A 0 120 . -16.584 -11.501 27.224 1.00 82.09 120 A 1 ATOM 937 C CB . LEU A 0 120 . -14.747 -12.826 26.100 1.00 82.09 120 A 1 ATOM 938 O O . LEU A 0 120 . -17.088 -11.920 28.263 1.00 82.09 120 A 1 ATOM 939 C CG . LEU A 0 120 . -14.368 -14.030 25.217 1.00 82.09 120 A 1 ATOM 940 C CD1 . LEU A 0 120 . -12.845 -14.167 25.182 1.00 82.09 120 A 1 ATOM 941 C CD2 . LEU A 0 120 . -14.964 -15.342 25.730 1.00 82.09 120 A 1 ATOM 942 N N . PHE A 0 121 . -16.378 -10.199 27.009 1.00 82.43 121 A 1 ATOM 943 C CA . PHE A 0 121 . -16.738 -9.172 27.987 1.00 82.43 121 A 1 ATOM 944 C C . PHE A 0 121 . -18.255 -9.092 28.207 1.00 82.43 121 A 1 ATOM 945 C CB . PHE A 0 121 . -16.153 -7.829 27.536 1.00 82.43 121 A 1 ATOM 946 O O . PHE A 0 121 . -18.706 -9.009 29.346 1.00 82.43 121 A 1 ATOM 947 C CG . PHE A 0 121 . -16.255 -6.734 28.577 1.00 82.43 121 A 1 ATOM 948 C CD1 . PHE A 0 121 . -17.052 -5.598 28.345 1.00 82.43 121 A 1 ATOM 949 C CD2 . PHE A 0 121 . -15.525 -6.841 29.777 1.00 82.43 121 A 1 ATOM 950 C CE1 . PHE A 0 121 . -17.104 -4.569 29.302 1.00 82.43 121 A 1 ATOM 951 C CE2 . PHE A 0 121 . -15.601 -5.825 30.745 1.00 82.43 121 A 1 ATOM 952 C CZ . PHE A 0 121 . -16.392 -4.688 30.508 1.00 82.43 121 A 1 ATOM 953 N N . SER A 0 122 . -19.058 -9.194 27.142 1.00 77.70 122 A 1 ATOM 954 C CA . SER A 0 122 . -20.524 -9.196 27.254 1.00 77.70 122 A 1 ATOM 955 C C . SER A 0 122 . -21.065 -10.422 27.998 1.00 77.70 122 A 1 ATOM 956 C CB . SER A 0 122 . -21.165 -9.052 25.871 1.00 77.70 122 A 1 ATOM 957 O O . SER A 0 122 . -21.951 -10.284 28.840 1.00 77.70 122 A 1 ATOM 958 O OG . SER A 0 122 . -20.970 -10.180 25.041 1.00 77.70 122 A 1 ATOM 959 N N . ILE A 0 123 . -20.483 -11.602 27.760 1.00 80.68 123 A 1 ATOM 960 C CA . ILE A 0 123 . -20.813 -12.834 28.485 1.00 80.68 123 A 1 ATOM 961 C C . ILE A 0 123 . -20.430 -12.689 29.962 1.00 80.68 123 A 1 ATOM 962 C CB . ILE A 0 123 . -20.111 -14.040 27.817 1.00 80.68 123 A 1 ATOM 963 O O . ILE A 0 123 . -21.217 -13.026 30.842 1.00 80.68 123 A 1 ATOM 964 C CG1 . ILE A 0 123 . -20.687 -14.303 26.407 1.00 80.68 123 A 1 ATOM 965 C CG2 . ILE A 0 123 . -20.278 -15.303 28.672 1.00 80.68 123 A 1 ATOM 966 C CD1 . ILE A 0 123 . -19.846 -15.280 25.574 1.00 80.68 123 A 1 ATOM 967 N N . TRP A 0 124 . -19.245 -12.143 30.249 1.00 84.75 124 A 1 ATOM 968 C CA . TRP A 0 124 . -18.796 -11.913 31.622 1.00 84.75 124 A 1 ATOM 969 C C . TRP A 0 124 . -19.721 -10.958 32.383 1.00 84.75 124 A 1 ATOM 970 C CB . TRP A 0 124 . -17.357 -11.392 31.614 1.00 84.75 124 A 1 ATOM 971 O O . TRP A 0 124 . -20.098 -11.256 33.518 1.00 84.75 124 A 1 ATOM 972 C CG . TRP A 0 124 . -16.823 -11.105 32.980 1.00 84.75 124 A 1 ATOM 973 C CD1 . TRP A 0 124 . -16.376 -12.031 33.857 1.00 84.75 124 A 1 ATOM 974 C CD2 . TRP A 0 124 . -16.746 -9.823 33.676 1.00 84.75 124 A 1 ATOM 975 C CE2 . TRP A 0 124 . -16.250 -10.057 34.993 1.00 84.75 124 A 1 ATOM 976 C CE3 . TRP A 0 124 . -17.055 -8.489 33.334 1.00 84.75 124 A 1 ATOM 977 N NE1 . TRP A 0 124 . -16.034 -11.416 35.045 1.00 84.75 124 A 1 ATOM 978 C CH2 . TRP A 0 124 . -16.403 -7.710 35.557 1.00 84.75 124 A 1 ATOM 979 C CZ2 . TRP A 0 124 . -16.078 -9.026 35.926 1.00 84.75 124 A 1 ATOM 980 C CZ3 . TRP A 0 124 . -16.891 -7.444 34.264 1.00 84.75 124 A 1 ATOM 981 N N . ILE A 0 125 . -20.136 -9.856 31.751 1.00 79.43 125 A 1 ATOM 982 C CA . ILE A 0 125 . -21.101 -8.927 32.342 1.00 79.43 125 A 1 ATOM 983 C C . ILE A 0 125 . -22.443 -9.625 32.593 1.00 79.43 125 A 1 ATOM 984 C CB . ILE A 0 125 . -21.280 -7.680 31.456 1.00 79.43 125 A 1 ATOM 985 O O . ILE A 0 125 . -23.039 -9.416 33.642 1.00 79.43 125 A 1 ATOM 986 C CG1 . ILE A 0 125 . -20.008 -6.811 31.384 1.00 79.43 125 A 1 ATOM 987 C CG2 . ILE A 0 125 . -22.395 -6.814 32.055 1.00 79.43 125 A 1 ATOM 988 C CD1 . ILE A 0 125 . -20.032 -5.810 30.220 1.00 79.43 125 A 1 ATOM 989 N N . TRP A 0 126 . -22.898 -10.486 31.679 1.00 76.25 126 A 1 ATOM 990 C CA . TRP A 0 126 . -24.156 -11.214 31.850 1.00 76.25 126 A 1 ATOM 991 C C . TRP A 0 126 . -24.145 -12.180 33.047 1.00 76.25 126 A 1 ATOM 992 C CB . TRP A 0 126 . -24.494 -11.943 30.544 1.00 76.25 126 A 1 ATOM 993 O O . TRP A 0 126 . -25.157 -12.308 33.727 1.00 76.25 126 A 1 ATOM 994 C CG . TRP A 0 126 . -25.813 -12.651 30.514 1.00 76.25 126 A 1 ATOM 995 C CD1 . TRP A 0 126 . -26.923 -12.295 31.203 1.00 76.25 126 A 1 ATOM 996 C CD2 . TRP A 0 126 . -26.169 -13.870 29.793 1.00 76.25 126 A 1 ATOM 997 C CE2 . TRP A 0 126 . -27.532 -14.180 30.080 1.00 76.25 126 A 1 ATOM 998 C CE3 . TRP A 0 126 . -25.475 -14.753 28.937 1.00 76.25 126 A 1 ATOM 999 N NE1 . TRP A 0 126 . -27.939 -13.192 30.948 1.00 76.25 126 A 1 ATOM 1000 C CH2 . TRP A 0 126 . -27.465 -16.151 28.681 1.00 76.25 126 A 1 ATOM 1001 C CZ2 . TRP A 0 126 . -28.181 -15.298 29.537 1.00 76.25 126 A 1 ATOM 1002 C CZ3 . TRP A 0 126 . -26.115 -15.881 28.387 1.00 76.25 126 A 1 ATOM 1003 N N . TYR A 0 127 . -23.014 -12.828 33.342 1.00 79.87 127 A 1 ATOM 1004 C CA . TYR A 0 127 . -22.909 -13.743 34.488 1.00 79.87 127 A 1 ATOM 1005 C C . TYR A 0 127 . -22.708 -13.046 35.840 1.00 79.87 127 A 1 ATOM 1006 C CB . TYR A 0 127 . -21.782 -14.756 34.243 1.00 79.87 127 A 1 ATOM 1007 O O . TYR A 0 127 . -23.025 -13.636 36.870 1.00 79.87 127 A 1 ATOM 1008 C CG . TYR A 0 127 . -22.159 -15.875 33.293 1.00 79.87 127 A 1 ATOM 1009 C CD1 . TYR A 0 127 . -23.110 -16.836 33.692 1.00 79.87 127 A 1 ATOM 1010 C CD2 . TYR A 0 127 . -21.552 -15.978 32.030 1.00 79.87 127 A 1 ATOM 1011 C CE1 . TYR A 0 127 . -23.478 -17.877 32.819 1.00 79.87 127 A 1 ATOM 1012 C CE2 . TYR A 0 127 . -21.908 -17.026 31.160 1.00 79.87 127 A 1 ATOM 1013 O OH . TYR A 0 127 . -23.225 -18.960 30.685 1.00 79.87 127 A 1 ATOM 1014 C CZ . TYR A 0 127 . -22.882 -17.964 31.543 1.00 79.87 127 A 1 ATOM 1015 N N . ASN A 0 128 . -22.165 -11.824 35.860 1.00 78.78 128 A 1 ATOM 1016 C CA . ASN A 0 128 . -21.795 -11.124 37.098 1.00 78.78 128 A 1 ATOM 1017 C C . ASN A 0 128 . -22.722 -9.938 37.447 1.00 78.78 128 A 1 ATOM 1018 C CB . ASN A 0 128 . -20.303 -10.732 37.042 1.00 78.78 128 A 1 ATOM 1019 O O . ASN A 0 128 . -22.428 -9.213 38.399 1.00 78.78 128 A 1 ATOM 1020 C CG . ASN A 0 128 . -19.375 -11.933 37.058 1.00 78.78 128 A 1 ATOM 1021 N ND2 . ASN A 0 128 . -19.003 -12.443 35.909 1.00 78.78 128 A 1 ATOM 1022 O OD1 . ASN A 0 128 . -18.964 -12.432 38.091 1.00 78.78 128 A 1 ATOM 1023 N N . CYS A 0 129 . -23.814 -9.710 36.704 1.00 60.63 129 A 1 ATOM 1024 C CA . CYS A 0 129 . -24.800 -8.637 36.934 1.00 60.63 129 A 1 ATOM 1025 C C . CYS A 0 129 . -26.254 -9.121 36.806 1.00 60.63 129 A 1 ATOM 1026 C CB . CYS A 0 129 . -24.548 -7.489 35.943 1.00 60.63 129 A 1 ATOM 1027 O O . CYS A 0 129 . -27.085 -8.639 37.610 1.00 60.63 129 A 1 ATOM 1028 S SG . CYS A 0 129 . -23.114 -6.505 36.456 1.00 60.63 129 A 1 ATOM 1029 O OXT . CYS A 0 129 . -26.556 -9.848 35.838 1.00 60.63 129 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 83.93 # loop_ _atom_type.symbol C N O S #