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 SER 0 3 GLN 0 4 ILE 0 5 LEU 0 6 GLN 0 7 VAL 0 8 HIS 0 9 ALA 0 10 PHE 0 11 LEU 0 12 GLU 0 13 HIS 0 14 SER 0 15 PHE 0 16 PRO 0 17 LYS 0 18 ASN 0 19 GLU 0 20 ASN 0 21 LEU 0 22 ILE 0 23 PRO 0 24 ASP 0 25 SER 0 26 LEU 0 27 LYS 0 28 HIS 0 29 ASP 0 30 LEU 0 31 ILE 0 32 HIS 0 33 GLN 0 34 ARG 0 35 THR 0 36 GLN 0 37 ILE 0 38 PRO 0 39 TYR 0 40 HIS 0 41 ASN 0 42 ILE 0 43 PRO 0 44 ILE 0 45 HIS 0 46 ARG 0 47 ASP 0 48 GLY 0 49 MET 0 50 THR 0 51 GLY 0 52 LYS 0 53 VAL 0 54 LEU 0 55 ASP 0 56 PRO 0 57 ASP 0 58 VAL 0 59 ASN 0 60 PHE 0 61 LYS 0 62 ARG 0 63 SER 0 64 CYS 0 65 ALA 0 66 THR 0 67 ALA 0 68 THR 0 69 SER 0 70 HIS 0 71 GLY 0 72 ILE 0 73 ASN 0 74 THR 0 75 ALA 0 76 ASN 0 77 VAL 0 78 ARG 0 79 VAL 0 80 GLU 0 81 PRO 0 82 THR 0 83 ILE 0 84 MET 0 85 LYS 0 86 SER 0 87 ILE 0 88 HIS 0 89 GLU 0 90 ILE 0 91 SER 0 92 LYS 0 93 GLN 0 94 ALA 0 95 LEU 0 96 ARG 0 97 SER 0 98 THR 0 99 LYS 0 100 THR 0 101 GLU 0 102 PHE 0 103 ASN 0 104 LEU 0 105 TRP 0 106 SER 0 107 CYS 0 108 VAL 0 109 PHE 0 110 LEU 0 111 ILE 0 112 PRO 0 113 ASN 0 114 SER 0 115 TRP 0 116 HIS 0 117 ILE 0 118 SER 0 119 VAL 0 120 MET 0 121 ARG # 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 . -4.642 -11.736 -7.998 1.00 46.05 1 A 1 ATOM 2 C CA . MET A 0 1 . -5.814 -11.167 -7.287 1.00 46.05 1 A 1 ATOM 3 C C . MET A 0 1 . -6.077 -11.831 -5.921 1.00 46.05 1 A 1 ATOM 4 C CB . MET A 0 1 . -7.085 -11.250 -8.158 1.00 46.05 1 A 1 ATOM 5 O O . MET A 0 1 . -7.179 -11.716 -5.411 1.00 46.05 1 A 1 ATOM 6 C CG . MET A 0 1 . -7.020 -10.487 -9.483 1.00 46.05 1 A 1 ATOM 7 S SD . MET A 0 1 . -8.636 -10.467 -10.296 1.00 46.05 1 A 1 ATOM 8 C CE . MET A 0 1 . -8.169 -10.133 -12.013 1.00 46.05 1 A 1 ATOM 9 N N . SER A 0 2 . -5.107 -12.508 -5.289 1.00 52.79 2 A 1 ATOM 10 C CA . SER A 0 2 . -5.345 -13.282 -4.051 1.00 52.79 2 A 1 ATOM 11 C C . SER A 0 2 . -5.129 -12.493 -2.753 1.00 52.79 2 A 1 ATOM 12 C CB . SER A 0 2 . -4.441 -14.520 -4.049 1.00 52.79 2 A 1 ATOM 13 O O . SER A 0 2 . -5.847 -12.710 -1.785 1.00 52.79 2 A 1 ATOM 14 O OG . SER A 0 2 . -3.118 -14.131 -4.381 1.00 52.79 2 A 1 ATOM 15 N N . GLN A 0 3 . -4.181 -11.552 -2.723 1.00 50.61 3 A 1 ATOM 16 C CA . GLN A 0 3 . -3.791 -10.874 -1.476 1.00 50.61 3 A 1 ATOM 17 C C . GLN A 0 3 . -4.863 -9.909 -0.939 1.00 50.61 3 A 1 ATOM 18 C CB . GLN A 0 3 . -2.451 -10.154 -1.689 1.00 50.61 3 A 1 ATOM 19 O O . GLN A 0 3 . -5.019 -9.788 0.272 1.00 50.61 3 A 1 ATOM 20 C CG . GLN A 0 3 . -1.272 -11.129 -1.900 1.00 50.61 3 A 1 ATOM 21 C CD . GLN A 0 3 . 0.047 -10.412 -2.192 1.00 50.61 3 A 1 ATOM 22 N NE2 . GLN A 0 3 . 1.108 -11.129 -2.498 1.00 50.61 3 A 1 ATOM 23 O OE1 . GLN A 0 3 . 0.128 -9.194 -2.195 1.00 50.61 3 A 1 ATOM 24 N N . ILE A 0 4 . -5.656 -9.275 -1.815 1.00 51.79 4 A 1 ATOM 25 C CA . ILE A 0 4 . -6.737 -8.360 -1.398 1.00 51.79 4 A 1 ATOM 26 C C . ILE A 0 4 . -7.790 -9.107 -0.567 1.00 51.79 4 A 1 ATOM 27 C CB . ILE A 0 4 . -7.356 -7.639 -2.622 1.00 51.79 4 A 1 ATOM 28 O O . ILE A 0 4 . -8.197 -8.619 0.484 1.00 51.79 4 A 1 ATOM 29 C CG1 . ILE A 0 4 . -6.303 -6.700 -3.260 1.00 51.79 4 A 1 ATOM 30 C CG2 . ILE A 0 4 . -8.618 -6.844 -2.232 1.00 51.79 4 A 1 ATOM 31 C CD1 . ILE A 0 4 . -6.736 -6.067 -4.590 1.00 51.79 4 A 1 ATOM 32 N N . LEU A 0 5 . -8.172 -10.322 -0.976 1.00 47.78 5 A 1 ATOM 33 C CA . LEU A 0 5 . -9.140 -11.139 -0.233 1.00 47.78 5 A 1 ATOM 34 C C . LEU A 0 5 . -8.622 -11.527 1.162 1.00 47.78 5 A 1 ATOM 35 C CB . LEU A 0 5 . -9.490 -12.392 -1.058 1.00 47.78 5 A 1 ATOM 36 O O . LEU A 0 5 . -9.400 -11.630 2.106 1.00 47.78 5 A 1 ATOM 37 C CG . LEU A 0 5 . -10.264 -12.110 -2.360 1.00 47.78 5 A 1 ATOM 38 C CD1 . LEU A 0 5 . -10.404 -13.401 -3.167 1.00 47.78 5 A 1 ATOM 39 C CD2 . LEU A 0 5 . -11.665 -11.557 -2.091 1.00 47.78 5 A 1 ATOM 40 N N . GLN A 0 6 . -7.306 -11.687 1.315 1.00 45.61 6 A 1 ATOM 41 C CA . GLN A 0 6 . -6.690 -12.072 2.584 1.00 45.61 6 A 1 ATOM 42 C C . GLN A 0 6 . -6.730 -10.948 3.632 1.00 45.61 6 A 1 ATOM 43 C CB . GLN A 0 6 . -5.253 -12.544 2.309 1.00 45.61 6 A 1 ATOM 44 O O . GLN A 0 6 . -6.940 -11.223 4.812 1.00 45.61 6 A 1 ATOM 45 C CG . GLN A 0 6 . -4.997 -13.926 2.922 1.00 45.61 6 A 1 ATOM 46 C CD . GLN A 0 6 . -3.615 -14.472 2.581 1.00 45.61 6 A 1 ATOM 47 N NE2 . GLN A 0 6 . -3.283 -15.655 3.047 1.00 45.61 6 A 1 ATOM 48 O OE1 . GLN A 0 6 . -2.813 -13.872 1.883 1.00 45.61 6 A 1 ATOM 49 N N . VAL A 0 7 . -6.583 -9.685 3.212 1.00 48.52 7 A 1 ATOM 50 C CA . VAL A 0 7 . -6.691 -8.528 4.121 1.00 48.52 7 A 1 ATOM 51 C C . VAL A 0 7 . -8.118 -8.390 4.656 1.00 48.52 7 A 1 ATOM 52 C CB . VAL A 0 7 . -6.232 -7.225 3.436 1.00 48.52 7 A 1 ATOM 53 O O . VAL A 0 7 . -8.302 -8.134 5.844 1.00 48.52 7 A 1 ATOM 54 C CG1 . VAL A 0 7 . -6.348 -6.012 4.370 1.00 48.52 7 A 1 ATOM 55 C CG2 . VAL A 0 7 . -4.764 -7.324 2.997 1.00 48.52 7 A 1 ATOM 56 N N . HIS A 0 8 . -9.125 -8.632 3.810 1.00 43.58 8 A 1 ATOM 57 C CA . HIS A 0 8 . -10.524 -8.636 4.245 1.00 43.58 8 A 1 ATOM 58 C C . HIS A 0 8 . -10.802 -9.733 5.284 1.00 43.58 8 A 1 ATOM 59 C CB . HIS A 0 8 . -11.452 -8.741 3.028 1.00 43.58 8 A 1 ATOM 60 O O . HIS A 0 8 . -11.430 -9.446 6.302 1.00 43.58 8 A 1 ATOM 61 C CG . HIS A 0 8 . -11.656 -7.411 2.349 1.00 43.58 8 A 1 ATOM 62 C CD2 . HIS A 0 8 . -10.998 -6.923 1.253 1.00 43.58 8 A 1 ATOM 63 N ND1 . HIS A 0 8 . -12.550 -6.443 2.744 1.00 43.58 8 A 1 ATOM 64 C CE1 . HIS A 0 8 . -12.432 -5.399 1.907 1.00 43.58 8 A 1 ATOM 65 N NE2 . HIS A 0 8 . -11.494 -5.644 0.979 1.00 43.58 8 A 1 ATOM 66 N N . ALA A 0 9 . -10.263 -10.942 5.093 1.00 43.98 9 A 1 ATOM 67 C CA . ALA A 0 9 . -10.434 -12.038 6.051 1.00 43.98 9 A 1 ATOM 68 C C . ALA A 0 9 . -9.832 -11.724 7.436 1.00 43.98 9 A 1 ATOM 69 C CB . ALA A 0 9 . -9.814 -13.304 5.448 1.00 43.98 9 A 1 ATOM 70 O O . ALA A 0 9 . -10.401 -12.086 8.463 1.00 43.98 9 A 1 ATOM 71 N N . PHE A 0 10 . -8.699 -11.015 7.489 1.00 50.13 10 A 1 ATOM 72 C CA . PHE A 0 10 . -8.053 -10.686 8.764 1.00 50.13 10 A 1 ATOM 73 C C . PHE A 0 10 . -8.862 -9.677 9.594 1.00 50.13 10 A 1 ATOM 74 C CB . PHE A 0 10 . -6.629 -10.181 8.497 1.00 50.13 10 A 1 ATOM 75 O O . PHE A 0 10 . -8.911 -9.760 10.824 1.00 50.13 10 A 1 ATOM 76 C CG . PHE A 0 10 . -5.688 -10.464 9.650 1.00 50.13 10 A 1 ATOM 77 C CD1 . PHE A 0 10 . -5.569 -9.560 10.722 1.00 50.13 10 A 1 ATOM 78 C CD2 . PHE A 0 10 . -4.962 -11.670 9.669 1.00 50.13 10 A 1 ATOM 79 C CE1 . PHE A 0 10 . -4.721 -9.860 11.804 1.00 50.13 10 A 1 ATOM 80 C CE2 . PHE A 0 10 . -4.114 -11.969 10.749 1.00 50.13 10 A 1 ATOM 81 C CZ . PHE A 0 10 . -3.992 -11.062 11.816 1.00 50.13 10 A 1 ATOM 82 N N . LEU A 0 11 . -9.530 -8.734 8.925 1.00 48.41 11 A 1 ATOM 83 C CA . LEU A 0 11 . -10.372 -7.750 9.600 1.00 48.41 11 A 1 ATOM 84 C C . LEU A 0 11 . -11.654 -8.388 10.137 1.00 48.41 11 A 1 ATOM 85 C CB . LEU A 0 11 . -10.658 -6.582 8.644 1.00 48.41 11 A 1 ATOM 86 O O . LEU A 0 11 . -12.059 -8.078 11.251 1.00 48.41 11 A 1 ATOM 87 C CG . LEU A 0 11 . -9.412 -5.734 8.323 1.00 48.41 11 A 1 ATOM 88 C CD1 . LEU A 0 11 . -9.752 -4.712 7.239 1.00 48.41 11 A 1 ATOM 89 C CD2 . LEU A 0 11 . -8.892 -4.977 9.550 1.00 48.41 11 A 1 ATOM 90 N N . GLU A 0 12 . -12.245 -9.332 9.406 1.00 49.20 12 A 1 ATOM 91 C CA . GLU A 0 12 . -13.514 -9.965 9.785 1.00 49.20 12 A 1 ATOM 92 C C . GLU A 0 12 . -13.427 -10.774 11.093 1.00 49.20 12 A 1 ATOM 93 C CB . GLU A 0 12 . -13.977 -10.834 8.604 1.00 49.20 12 A 1 ATOM 94 O O . GLU A 0 12 . -14.412 -10.912 11.814 1.00 49.20 12 A 1 ATOM 95 C CG . GLU A 0 12 . -15.505 -10.920 8.508 1.00 49.20 12 A 1 ATOM 96 C CD . GLU A 0 12 . -15.978 -11.643 7.236 1.00 49.20 12 A 1 ATOM 97 O OE1 . GLU A 0 12 . -17.166 -11.466 6.886 1.00 49.20 12 A 1 ATOM 98 O OE2 . GLU A 0 12 . -15.170 -12.386 6.632 1.00 49.20 12 A 1 ATOM 99 N N . HIS A 0 13 . -12.240 -11.277 11.447 1.00 55.22 13 A 1 ATOM 100 C CA . HIS A 0 13 . -12.016 -12.020 12.694 1.00 55.22 13 A 1 ATOM 101 C C . HIS A 0 13 . -11.660 -11.143 13.898 1.00 55.22 13 A 1 ATOM 102 C CB . HIS A 0 13 . -10.928 -13.071 12.455 1.00 55.22 13 A 1 ATOM 103 O O . HIS A 0 13 . -11.682 -11.630 15.027 1.00 55.22 13 A 1 ATOM 104 C CG . HIS A 0 13 . -11.276 -14.056 11.370 1.00 55.22 13 A 1 ATOM 105 C CD2 . HIS A 0 13 . -10.402 -14.641 10.498 1.00 55.22 13 A 1 ATOM 106 N ND1 . HIS A 0 13 . -12.539 -14.484 11.028 1.00 55.22 13 A 1 ATOM 107 C CE1 . HIS A 0 13 . -12.423 -15.304 9.971 1.00 55.22 13 A 1 ATOM 108 N NE2 . HIS A 0 13 . -11.135 -15.456 9.630 1.00 55.22 13 A 1 ATOM 109 N N . SER A 0 14 . -11.325 -9.870 13.682 1.00 55.09 14 A 1 ATOM 110 C CA . SER A 0 14 . -10.912 -8.973 14.772 1.00 55.09 14 A 1 ATOM 111 C C . SER A 0 14 . -12.094 -8.348 15.510 1.00 55.09 14 A 1 ATOM 112 C CB . SER A 0 14 . -9.979 -7.889 14.238 1.00 55.09 14 A 1 ATOM 113 O O . SER A 0 14 . -11.911 -7.730 16.557 1.00 55.09 14 A 1 ATOM 114 O OG . SER A 0 14 . -8.840 -8.478 13.632 1.00 55.09 14 A 1 ATOM 115 N N . PHE A 0 15 . -13.304 -8.517 14.983 1.00 51.56 15 A 1 ATOM 116 C CA . PHE A 0 15 . -14.494 -7.900 15.529 1.00 51.56 15 A 1 ATOM 117 C C . PHE A 0 15 . -15.464 -8.961 16.055 1.00 51.56 15 A 1 ATOM 118 C CB . PHE A 0 15 . -15.106 -7.013 14.460 1.00 51.56 15 A 1 ATOM 119 O O . PHE A 0 15 . -15.756 -9.933 15.350 1.00 51.56 15 A 1 ATOM 120 C CG . PHE A 0 15 . -14.204 -5.857 14.044 1.00 51.56 15 A 1 ATOM 121 C CD1 . PHE A 0 15 . -13.908 -4.810 14.939 1.00 51.56 15 A 1 ATOM 122 C CD2 . PHE A 0 15 . -13.642 -5.839 12.755 1.00 51.56 15 A 1 ATOM 123 C CE1 . PHE A 0 15 . -13.063 -3.757 14.545 1.00 51.56 15 A 1 ATOM 124 C CE2 . PHE A 0 15 . -12.777 -4.801 12.367 1.00 51.56 15 A 1 ATOM 125 C CZ . PHE A 0 15 . -12.489 -3.756 13.262 1.00 51.56 15 A 1 ATOM 126 N N . PRO A 0 16 . -15.965 -8.821 17.294 1.00 54.62 16 A 1 ATOM 127 C CA . PRO A 0 16 . -16.961 -9.740 17.820 1.00 54.62 16 A 1 ATOM 128 C C . PRO A 0 16 . -18.200 -9.723 16.916 1.00 54.62 16 A 1 ATOM 129 C CB . PRO A 0 16 . -17.238 -9.278 19.256 1.00 54.62 16 A 1 ATOM 130 O O . PRO A 0 16 . -18.771 -8.669 16.651 1.00 54.62 16 A 1 ATOM 131 C CG . PRO A 0 16 . -16.804 -7.813 19.278 1.00 54.62 16 A 1 ATOM 132 C CD . PRO A 0 16 . -15.698 -7.740 18.232 1.00 54.62 16 A 1 ATOM 133 N N . LYS A 0 17 . -18.627 -10.911 16.461 1.00 59.00 17 A 1 ATOM 134 C CA . LYS A 0 17 . -19.723 -11.124 15.487 1.00 59.00 17 A 1 ATOM 135 C C . LYS A 0 17 . -21.060 -10.454 15.840 1.00 59.00 17 A 1 ATOM 136 C CB . LYS A 0 17 . -19.973 -12.637 15.317 1.00 59.00 17 A 1 ATOM 137 O O . LYS A 0 17 . -21.944 -10.404 14.992 1.00 59.00 17 A 1 ATOM 138 C CG . LYS A 0 17 . -18.932 -13.327 14.426 1.00 59.00 17 A 1 ATOM 139 C CD . LYS A 0 17 . -19.300 -14.805 14.228 1.00 59.00 17 A 1 ATOM 140 C CE . LYS A 0 17 . -18.327 -15.456 13.241 1.00 59.00 17 A 1 ATOM 141 N NZ . LYS A 0 17 . -18.666 -16.879 12.997 1.00 59.00 17 A 1 ATOM 142 N N . ASN A 0 18 . -21.218 -9.987 17.075 1.00 57.94 18 A 1 ATOM 143 C CA . ASN A 0 18 . -22.487 -9.528 17.629 1.00 57.94 18 A 1 ATOM 144 C C . ASN A 0 18 . -22.552 -8.006 17.802 1.00 57.94 18 A 1 ATOM 145 C CB . ASN A 0 18 . -22.736 -10.260 18.956 1.00 57.94 18 A 1 ATOM 146 O O . ASN A 0 18 . -23.571 -7.498 18.263 1.00 57.94 18 A 1 ATOM 147 C CG . ASN A 0 18 . -22.795 -11.775 18.847 1.00 57.94 18 A 1 ATOM 148 N ND2 . ASN A 0 18 . -23.050 -12.435 19.950 1.00 57.94 18 A 1 ATOM 149 O OD1 . ASN A 0 18 . -22.601 -12.403 17.819 1.00 57.94 18 A 1 ATOM 150 N N . GLU A 0 19 . -21.492 -7.278 17.458 1.00 55.90 19 A 1 ATOM 151 C CA . GLU A 0 19 . -21.495 -5.822 17.515 1.00 55.90 19 A 1 ATOM 152 C C . GLU A 0 19 . -21.667 -5.272 16.103 1.00 55.90 19 A 1 ATOM 153 C CB . GLU A 0 19 . -20.241 -5.302 18.231 1.00 55.90 19 A 1 ATOM 154 O O . GLU A 0 19 . -20.853 -5.519 15.212 1.00 55.90 19 A 1 ATOM 155 C CG . GLU A 0 19 . -20.295 -5.672 19.725 1.00 55.90 19 A 1 ATOM 156 C CD . GLU A 0 19 . -19.094 -5.173 20.540 1.00 55.90 19 A 1 ATOM 157 O OE1 . GLU A 0 19 . -18.988 -5.612 21.708 1.00 55.90 19 A 1 ATOM 158 O OE2 . GLU A 0 19 . -18.281 -4.390 20.001 1.00 55.90 19 A 1 ATOM 159 N N . ASN A 0 20 . -22.746 -4.517 15.886 1.00 57.73 20 A 1 ATOM 160 C CA . ASN A 0 20 . -22.874 -3.682 14.700 1.00 57.73 20 A 1 ATOM 161 C C . ASN A 0 20 . -21.748 -2.638 14.748 1.00 57.73 20 A 1 ATOM 162 C CB . ASN A 0 20 . -24.271 -3.034 14.664 1.00 57.73 20 A 1 ATOM 163 O O . ASN A 0 20 . -21.892 -1.586 15.364 1.00 57.73 20 A 1 ATOM 164 C CG . ASN A 0 20 . -25.388 -4.004 14.322 1.00 57.73 20 A 1 ATOM 165 N ND2 . ASN A 0 20 . -26.584 -3.755 14.799 1.00 57.73 20 A 1 ATOM 166 O OD1 . ASN A 0 20 . -25.218 -4.975 13.605 1.00 57.73 20 A 1 ATOM 167 N N . LEU A 0 21 . -20.612 -2.946 14.116 1.00 59.64 21 A 1 ATOM 168 C CA . LEU A 0 21 . -19.421 -2.083 14.082 1.00 59.64 21 A 1 ATOM 169 C C . LEU A 0 21 . -19.697 -0.710 13.474 1.00 59.64 21 A 1 ATOM 170 C CB . LEU A 0 21 . -18.343 -2.759 13.226 1.00 59.64 21 A 1 ATOM 171 O O . LEU A 0 21 . -18.959 0.245 13.704 1.00 59.64 21 A 1 ATOM 172 C CG . LEU A 0 21 . -17.829 -4.088 13.785 1.00 59.64 21 A 1 ATOM 173 C CD1 . LEU A 0 21 . -16.949 -4.719 12.706 1.00 59.64 21 A 1 ATOM 174 C CD2 . LEU A 0 21 . -17.071 -3.850 15.094 1.00 59.64 21 A 1 ATOM 175 N N . ILE A 0 22 . -20.753 -0.630 12.671 1.00 57.97 22 A 1 ATOM 176 C CA . ILE A 0 22 . -21.225 0.595 12.059 1.00 57.97 22 A 1 ATOM 177 C C . ILE A 0 22 . -22.609 0.861 12.654 1.00 57.97 22 A 1 ATOM 178 C CB . ILE A 0 22 . -21.223 0.474 10.524 1.00 57.97 22 A 1 ATOM 179 O O . ILE A 0 22 . -23.537 0.107 12.357 1.00 57.97 22 A 1 ATOM 180 C CG1 . ILE A 0 22 . -19.814 0.076 10.017 1.00 57.97 22 A 1 ATOM 181 C CG2 . ILE A 0 22 . -21.671 1.816 9.919 1.00 57.97 22 A 1 ATOM 182 C CD1 . ILE A 0 22 . -19.733 -0.163 8.507 1.00 57.97 22 A 1 ATOM 183 N N . PRO A 0 23 . -22.762 1.905 13.485 1.00 60.31 23 A 1 ATOM 184 C CA . PRO A 0 23 . -24.069 2.404 13.886 1.00 60.31 23 A 1 ATOM 185 C C . PRO A 0 23 . -24.935 2.608 12.642 1.00 60.31 23 A 1 ATOM 186 C CB . PRO A 0 23 . -23.796 3.734 14.602 1.00 60.31 23 A 1 ATOM 187 O O . PRO A 0 23 . -24.463 3.203 11.671 1.00 60.31 23 A 1 ATOM 188 C CG . PRO A 0 23 . -22.351 3.609 15.080 1.00 60.31 23 A 1 ATOM 189 C CD . PRO A 0 23 . -21.699 2.735 14.014 1.00 60.31 23 A 1 ATOM 190 N N . ASP A 0 24 . -26.188 2.150 12.654 1.00 67.89 24 A 1 ATOM 191 C CA . ASP A 0 24 . -27.075 2.253 11.482 1.00 67.89 24 A 1 ATOM 192 C C . ASP A 0 24 . -27.193 3.696 10.960 1.00 67.89 24 A 1 ATOM 193 C CB . ASP A 0 24 . -28.467 1.704 11.828 1.00 67.89 24 A 1 ATOM 194 O O . ASP A 0 24 . -27.318 3.916 9.755 1.00 67.89 24 A 1 ATOM 195 C CG . ASP A 0 24 . -28.491 0.180 11.979 1.00 67.89 24 A 1 ATOM 196 O OD1 . ASP A 0 24 . -27.843 -0.498 11.147 1.00 67.89 24 A 1 ATOM 197 O OD2 . ASP A 0 24 . -29.169 -0.290 12.917 1.00 67.89 24 A 1 ATOM 198 N N . SER A 0 25 . -27.047 4.684 11.851 1.00 67.33 25 A 1 ATOM 199 C CA . SER A 0 25 . -26.983 6.107 11.510 1.00 67.33 25 A 1 ATOM 200 C C . SER A 0 25 . -25.825 6.466 10.572 1.00 67.33 25 A 1 ATOM 201 C CB . SER A 0 25 . -26.874 6.944 12.790 1.00 67.33 25 A 1 ATOM 202 O O . SER A 0 25 . -26.010 7.264 9.661 1.00 67.33 25 A 1 ATOM 203 O OG . SER A 0 25 . -25.775 6.535 13.591 1.00 67.33 25 A 1 ATOM 204 N N . LEU A 0 26 . -24.649 5.857 10.745 1.00 58.59 26 A 1 ATOM 205 C CA . LEU A 0 26 . -23.454 6.139 9.943 1.00 58.59 26 A 1 ATOM 206 C C . LEU A 0 26 . -23.424 5.367 8.627 1.00 58.59 26 A 1 ATOM 207 C CB . LEU A 0 26 . -22.193 5.825 10.769 1.00 58.59 26 A 1 ATOM 208 O O . LEU A 0 26 . -22.658 5.715 7.732 1.00 58.59 26 A 1 ATOM 209 C CG . LEU A 0 26 . -21.908 6.838 11.890 1.00 58.59 26 A 1 ATOM 210 C CD1 . LEU A 0 26 . -20.700 6.375 12.705 1.00 58.59 26 A 1 ATOM 211 C CD2 . LEU A 0 26 . -21.570 8.227 11.343 1.00 58.59 26 A 1 ATOM 212 N N . LYS A 0 27 . -24.239 4.318 8.474 1.00 58.75 27 A 1 ATOM 213 C CA . LYS A 0 27 . -24.236 3.495 7.260 1.00 58.75 27 A 1 ATOM 214 C C . LYS A 0 27 . -24.587 4.320 6.021 1.00 58.75 27 A 1 ATOM 215 C CB . LYS A 0 27 . -25.189 2.316 7.470 1.00 58.75 27 A 1 ATOM 216 O O . LYS A 0 27 . -23.949 4.159 4.984 1.00 58.75 27 A 1 ATOM 217 C CG . LYS A 0 27 . -25.027 1.243 6.386 1.00 58.75 27 A 1 ATOM 218 C CD . LYS A 0 27 . -25.929 0.057 6.731 1.00 58.75 27 A 1 ATOM 219 C CE . LYS A 0 27 . -25.766 -1.083 5.726 1.00 58.75 27 A 1 ATOM 220 N NZ . LYS A 0 27 . -26.603 -2.236 6.139 1.00 58.75 27 A 1 ATOM 221 N N . HIS A 0 28 . -25.555 5.228 6.139 1.00 57.67 28 A 1 ATOM 222 C CA . HIS A 0 28 . -25.910 6.139 5.052 1.00 57.67 28 A 1 ATOM 223 C C . HIS A 0 28 . -24.791 7.147 4.764 1.00 57.67 28 A 1 ATOM 224 C CB . HIS A 0 28 . -27.253 6.809 5.366 1.00 57.67 28 A 1 ATOM 225 O O . HIS A 0 28 . -24.419 7.320 3.604 1.00 57.67 28 A 1 ATOM 226 C CG . HIS A 0 28 . -28.402 5.842 5.226 1.00 57.67 28 A 1 ATOM 227 C CD2 . HIS A 0 28 . -29.234 5.382 6.213 1.00 57.67 28 A 1 ATOM 228 N ND1 . HIS A 0 28 . -28.783 5.226 4.055 1.00 57.67 28 A 1 ATOM 229 C CE1 . HIS A 0 28 . -29.820 4.419 4.326 1.00 57.67 28 A 1 ATOM 230 N NE2 . HIS A 0 28 . -30.130 4.476 5.628 1.00 57.67 28 A 1 ATOM 231 N N . ASP A 0 29 . -24.182 7.724 5.799 1.00 58.74 29 A 1 ATOM 232 C CA . ASP A 0 29 . -23.114 8.718 5.634 1.00 58.74 29 A 1 ATOM 233 C C . ASP A 0 29 . -21.837 8.116 5.026 1.00 58.74 29 A 1 ATOM 234 C CB . ASP A 0 29 . -22.813 9.371 6.992 1.00 58.74 29 A 1 ATOM 235 O O . ASP A 0 29 . -21.201 8.728 4.166 1.00 58.74 29 A 1 ATOM 236 C CG . ASP A 0 29 . -23.974 10.210 7.538 1.00 58.74 29 A 1 ATOM 237 O OD1 . ASP A 0 29 . -24.835 10.625 6.730 1.00 58.74 29 A 1 ATOM 238 O OD2 . ASP A 0 29 . -23.967 10.439 8.767 1.00 58.74 29 A 1 ATOM 239 N N . LEU A 0 30 . -21.479 6.889 5.417 1.00 54.04 30 A 1 ATOM 240 C CA . LEU A 0 30 . -20.281 6.200 4.932 1.00 54.04 30 A 1 ATOM 241 C C . LEU A 0 30 . -20.426 5.723 3.483 1.00 54.04 30 A 1 ATOM 242 C CB . LEU A 0 30 . -19.948 5.025 5.866 1.00 54.04 30 A 1 ATOM 243 O O . LEU A 0 30 . -19.476 5.837 2.712 1.00 54.04 30 A 1 ATOM 244 C CG . LEU A 0 30 . -19.462 5.440 7.269 1.00 54.04 30 A 1 ATOM 245 C CD1 . LEU A 0 30 . -19.367 4.194 8.150 1.00 54.04 30 A 1 ATOM 246 C CD2 . LEU A 0 30 . -18.090 6.115 7.239 1.00 54.04 30 A 1 ATOM 247 N N . ILE A 0 31 . -21.605 5.236 3.076 1.00 55.39 31 A 1 ATOM 248 C CA . ILE A 0 31 . -21.842 4.808 1.683 1.00 55.39 31 A 1 ATOM 249 C C . ILE A 0 31 . -21.755 6.004 0.720 1.00 55.39 31 A 1 ATOM 250 C CB . ILE A 0 31 . -23.188 4.050 1.571 1.00 55.39 31 A 1 ATOM 251 O O . ILE A 0 31 . -21.349 5.849 -0.434 1.00 55.39 31 A 1 ATOM 252 C CG1 . ILE A 0 31 . -23.095 2.694 2.311 1.00 55.39 31 A 1 ATOM 253 C CG2 . ILE A 0 31 . -23.584 3.795 0.102 1.00 55.39 31 A 1 ATOM 254 C CD1 . ILE A 0 31 . -24.450 2.001 2.517 1.00 55.39 31 A 1 ATOM 255 N N . HIS A 0 32 . -22.089 7.209 1.187 1.00 51.88 32 A 1 ATOM 256 C CA . HIS A 0 32 . -22.016 8.428 0.383 1.00 51.88 32 A 1 ATOM 257 C C . HIS A 0 32 . -20.646 9.108 0.380 1.00 51.88 32 A 1 ATOM 258 C CB . HIS A 0 32 . -23.147 9.377 0.779 1.00 51.88 32 A 1 ATOM 259 O O . HIS A 0 32 . -20.473 10.093 -0.345 1.00 51.88 32 A 1 ATOM 260 C CG . HIS A 0 32 . -24.494 8.826 0.398 1.00 51.88 32 A 1 ATOM 261 C CD2 . HIS A 0 32 . -25.584 8.687 1.212 1.00 51.88 32 A 1 ATOM 262 N ND1 . HIS A 0 32 . -24.848 8.336 -0.840 1.00 51.88 32 A 1 ATOM 263 C CE1 . HIS A 0 32 . -26.117 7.906 -0.768 1.00 51.88 32 A 1 ATOM 264 N NE2 . HIS A 0 32 . -26.609 8.096 0.462 1.00 51.88 32 A 1 ATOM 265 N N . GLN A 0 33 . -19.643 8.558 1.071 1.00 51.08 33 A 1 ATOM 266 C CA . GLN A 0 33 . -18.254 8.935 0.839 1.00 51.08 33 A 1 ATOM 267 C C . GLN A 0 33 . -17.817 8.401 -0.531 1.00 51.08 33 A 1 ATOM 268 C CB . GLN A 0 33 . -17.337 8.472 1.983 1.00 51.08 33 A 1 ATOM 269 O O . GLN A 0 33 . -17.082 7.424 -0.650 1.00 51.08 33 A 1 ATOM 270 C CG . GLN A 0 33 . -17.644 9.201 3.300 1.00 51.08 33 A 1 ATOM 271 C CD . GLN A 0 33 . -16.640 8.883 4.404 1.00 51.08 33 A 1 ATOM 272 N NE2 . GLN A 0 33 . -16.598 9.676 5.451 1.00 51.08 33 A 1 ATOM 273 O OE1 . GLN A 0 33 . -15.867 7.941 4.357 1.00 51.08 33 A 1 ATOM 274 N N . ARG A 0 34 . -18.247 9.081 -1.603 1.00 48.29 34 A 1 ATOM 275 C CA . ARG A 0 34 . -17.502 9.107 -2.861 1.00 48.29 34 A 1 ATOM 276 C C . ARG A 0 34 . -16.136 9.675 -2.513 1.00 48.29 34 A 1 ATOM 277 C CB . ARG A 0 34 . -18.200 9.974 -3.925 1.00 48.29 34 A 1 ATOM 278 O O . ARG A 0 34 . -15.930 10.886 -2.548 1.00 48.29 34 A 1 ATOM 279 C CG . ARG A 0 34 . -19.179 9.191 -4.804 1.00 48.29 34 A 1 ATOM 280 C CD . ARG A 0 34 . -19.746 10.131 -5.876 1.00 48.29 34 A 1 ATOM 281 N NE . ARG A 0 34 . -20.624 9.422 -6.825 1.00 48.29 34 A 1 ATOM 282 N NH1 . ARG A 0 34 . -21.458 11.277 -7.898 1.00 48.29 34 A 1 ATOM 283 N NH2 . ARG A 0 34 . -22.123 9.243 -8.532 1.00 48.29 34 A 1 ATOM 284 C CZ . ARG A 0 34 . -21.393 9.982 -7.744 1.00 48.29 34 A 1 ATOM 285 N N . THR A 0 35 . -15.210 8.801 -2.148 1.00 50.38 35 A 1 ATOM 286 C CA . THR A 0 35 . -13.793 9.111 -2.131 1.00 50.38 35 A 1 ATOM 287 C C . THR A 0 35 . -13.435 9.449 -3.571 1.00 50.38 35 A 1 ATOM 288 C CB . THR A 0 35 . -12.968 7.946 -1.553 1.00 50.38 35 A 1 ATOM 289 O O . THR A 0 35 . -13.167 8.585 -4.401 1.00 50.38 35 A 1 ATOM 290 C CG2 . THR A 0 35 . -12.996 7.965 -0.025 1.00 50.38 35 A 1 ATOM 291 O OG1 . THR A 0 35 . -13.495 6.696 -1.939 1.00 50.38 35 A 1 ATOM 292 N N . GLN A 0 36 . -13.510 10.737 -3.911 1.00 46.62 36 A 1 ATOM 293 C CA . GLN A 0 36 . -12.816 11.264 -5.072 1.00 46.62 36 A 1 ATOM 294 C C . GLN A 0 36 . -11.341 11.079 -4.757 1.00 46.62 36 A 1 ATOM 295 C CB . GLN A 0 36 . -13.155 12.743 -5.313 1.00 46.62 36 A 1 ATOM 296 O O . GLN A 0 36 . -10.727 11.936 -4.136 1.00 46.62 36 A 1 ATOM 297 C CG . GLN A 0 36 . -14.541 12.952 -5.934 1.00 46.62 36 A 1 ATOM 298 C CD . GLN A 0 36 . -14.801 14.416 -6.288 1.00 46.62 36 A 1 ATOM 299 N NE2 . GLN A 0 36 . -15.914 14.724 -6.914 1.00 46.62 36 A 1 ATOM 300 O OE1 . GLN A 0 36 . -14.024 15.316 -6.027 1.00 46.62 36 A 1 ATOM 301 N N . ILE A 0 37 . -10.801 9.908 -5.087 1.00 50.81 37 A 1 ATOM 302 C CA . ILE A 0 37 . -9.367 9.676 -5.031 1.00 50.81 37 A 1 ATOM 303 C C . ILE A 0 37 . -8.801 10.596 -6.112 1.00 50.81 37 A 1 ATOM 304 C CB . ILE A 0 37 . -9.023 8.190 -5.271 1.00 50.81 37 A 1 ATOM 305 O O . ILE A 0 37 . -9.089 10.361 -7.291 1.00 50.81 37 A 1 ATOM 306 C CG1 . ILE A 0 37 . -9.700 7.296 -4.205 1.00 50.81 37 A 1 ATOM 307 C CG2 . ILE A 0 37 . -7.493 8.010 -5.247 1.00 50.81 37 A 1 ATOM 308 C CD1 . ILE A 0 37 . -9.529 5.792 -4.446 1.00 50.81 37 A 1 ATOM 309 N N . PRO A 0 38 . -8.070 11.668 -5.759 1.00 48.05 38 A 1 ATOM 310 C CA . PRO A 0 38 . -7.469 12.517 -6.767 1.00 48.05 38 A 1 ATOM 311 C C . PRO A 0 38 . -6.449 11.665 -7.523 1.00 48.05 38 A 1 ATOM 312 C CB . PRO A 0 38 . -6.876 13.705 -6.011 1.00 48.05 38 A 1 ATOM 313 O O . PRO A 0 38 . -5.409 11.271 -6.995 1.00 48.05 38 A 1 ATOM 314 C CG . PRO A 0 38 . -6.592 13.151 -4.617 1.00 48.05 38 A 1 ATOM 315 C CD . PRO A 0 38 . -7.667 12.088 -4.422 1.00 48.05 38 A 1 ATOM 316 N N . TYR A 0 39 . -6.800 11.302 -8.754 1.00 44.16 39 A 1 ATOM 317 C CA . TYR A 0 39 . -5.943 10.507 -9.613 1.00 44.16 39 A 1 ATOM 318 C C . TYR A 0 39 . -4.951 11.450 -10.285 1.00 44.16 39 A 1 ATOM 319 C CB . TYR A 0 39 . -6.789 9.693 -10.597 1.00 44.16 39 A 1 ATOM 320 O O . TYR A 0 39 . -5.284 12.166 -11.228 1.00 44.16 39 A 1 ATOM 321 C CG . TYR A 0 39 . -6.007 8.598 -11.294 1.00 44.16 39 A 1 ATOM 322 C CD1 . TYR A 0 39 . -5.639 8.733 -12.644 1.00 44.16 39 A 1 ATOM 323 C CD2 . TYR A 0 39 . -5.677 7.423 -10.590 1.00 44.16 39 A 1 ATOM 324 C CE1 . TYR A 0 39 . -4.972 7.677 -13.290 1.00 44.16 39 A 1 ATOM 325 C CE2 . TYR A 0 39 . -4.955 6.392 -11.223 1.00 44.16 39 A 1 ATOM 326 O OH . TYR A 0 39 . -3.909 5.530 -13.207 1.00 44.16 39 A 1 ATOM 327 C CZ . TYR A 0 39 . -4.592 6.523 -12.579 1.00 44.16 39 A 1 ATOM 328 N N . HIS A 0 40 . -3.729 11.493 -9.766 1.00 52.26 40 A 1 ATOM 329 C CA . HIS A 0 40 . -2.638 12.218 -10.399 1.00 52.26 40 A 1 ATOM 330 C C . HIS A 0 40 . -1.861 11.246 -11.290 1.00 52.26 40 A 1 ATOM 331 C CB . HIS A 0 40 . -1.784 12.913 -9.332 1.00 52.26 40 A 1 ATOM 332 O O . HIS A 0 40 . -1.139 10.381 -10.796 1.00 52.26 40 A 1 ATOM 333 C CG . HIS A 0 40 . -2.564 13.914 -8.510 1.00 52.26 40 A 1 ATOM 334 C CD2 . HIS A 0 40 . -2.633 13.970 -7.144 1.00 52.26 40 A 1 ATOM 335 N ND1 . HIS A 0 40 . -3.358 14.932 -8.993 1.00 52.26 40 A 1 ATOM 336 C CE1 . HIS A 0 40 . -3.880 15.589 -7.944 1.00 52.26 40 A 1 ATOM 337 N NE2 . HIS A 0 40 . -3.460 15.041 -6.794 1.00 52.26 40 A 1 ATOM 338 N N . ASN A 0 41 . -2.010 11.392 -12.610 1.00 55.31 41 A 1 ATOM 339 C CA . ASN A 0 41 . -1.154 10.725 -13.589 1.00 55.31 41 A 1 ATOM 340 C C . ASN A 0 41 . 0.235 11.363 -13.549 1.00 55.31 41 A 1 ATOM 341 C CB . ASN A 0 41 . -1.784 10.816 -14.996 1.00 55.31 41 A 1 ATOM 342 O O . ASN A 0 41 . 0.518 12.294 -14.299 1.00 55.31 41 A 1 ATOM 343 C CG . ASN A 0 41 . -2.708 9.662 -15.309 1.00 55.31 41 A 1 ATOM 344 N ND2 . ASN A 0 41 . -3.590 9.811 -16.269 1.00 55.31 41 A 1 ATOM 345 O OD1 . ASN A 0 41 . -2.611 8.596 -14.739 1.00 55.31 41 A 1 ATOM 346 N N . ILE A 0 42 . 1.087 10.889 -12.645 1.00 59.08 42 A 1 ATOM 347 C CA . ILE A 0 42 . 2.490 11.296 -12.604 1.00 59.08 42 A 1 ATOM 348 C C . ILE A 0 42 . 3.267 10.289 -13.460 1.00 59.08 42 A 1 ATOM 349 C CB . ILE A 0 42 . 3.011 11.414 -11.157 1.00 59.08 42 A 1 ATOM 350 O O . ILE A 0 42 . 3.325 9.113 -13.091 1.00 59.08 42 A 1 ATOM 351 C CG1 . ILE A 0 42 . 2.157 12.444 -10.376 1.00 59.08 42 A 1 ATOM 352 C CG2 . ILE A 0 42 . 4.491 11.846 -11.184 1.00 59.08 42 A 1 ATOM 353 C CD1 . ILE A 0 42 . 2.451 12.519 -8.875 1.00 59.08 42 A 1 ATOM 354 N N . PRO A 0 43 . 3.824 10.693 -14.616 1.00 62.62 43 A 1 ATOM 355 C CA . PRO A 0 43 . 4.639 9.800 -15.424 1.00 62.62 43 A 1 ATOM 356 C C . PRO A 0 43 . 5.893 9.410 -14.634 1.00 62.62 43 A 1 ATOM 357 C CB . PRO A 0 43 . 4.947 10.570 -16.713 1.00 62.62 43 A 1 ATOM 358 O O . PRO A 0 43 . 6.683 10.260 -14.235 1.00 62.62 43 A 1 ATOM 359 C CG . PRO A 0 43 . 4.847 12.037 -16.297 1.00 62.62 43 A 1 ATOM 360 C CD . PRO A 0 43 . 3.788 12.028 -15.197 1.00 62.62 43 A 1 ATOM 361 N N . ILE A 0 44 . 6.063 8.111 -14.383 1.00 66.58 44 A 1 ATOM 362 C CA . ILE A 0 44 . 7.256 7.569 -13.727 1.00 66.58 44 A 1 ATOM 363 C C . ILE A 0 44 . 8.152 6.990 -14.812 1.00 66.58 44 A 1 ATOM 364 C CB . ILE A 0 44 . 6.904 6.528 -12.641 1.00 66.58 44 A 1 ATOM 365 O O . ILE A 0 44 . 7.835 5.956 -15.405 1.00 66.58 44 A 1 ATOM 366 C CG1 . ILE A 0 44 . 5.975 7.142 -11.568 1.00 66.58 44 A 1 ATOM 367 C CG2 . ILE A 0 44 . 8.197 5.999 -11.987 1.00 66.58 44 A 1 ATOM 368 C CD1 . ILE A 0 44 . 5.507 6.151 -10.495 1.00 66.58 44 A 1 ATOM 369 N N . HIS A 0 45 . 9.287 7.634 -15.050 1.00 69.95 45 A 1 ATOM 370 C CA . HIS A 0 45 . 10.282 7.129 -15.982 1.00 69.95 45 A 1 ATOM 371 C C . HIS A 0 45 . 11.099 6.020 -15.318 1.00 69.95 45 A 1 ATOM 372 C CB . HIS A 0 45 . 11.119 8.291 -16.523 1.00 69.95 45 A 1 ATOM 373 O O . HIS A 0 45 . 11.486 6.108 -14.153 1.00 69.95 45 A 1 ATOM 374 C CG . HIS A 0 45 . 10.261 9.258 -17.303 1.00 69.95 45 A 1 ATOM 375 C CD2 . HIS A 0 45 . 9.709 10.424 -16.839 1.00 69.95 45 A 1 ATOM 376 N ND1 . HIS A 0 45 . 9.798 9.076 -18.588 1.00 69.95 45 A 1 ATOM 377 C CE1 . HIS A 0 45 . 8.995 10.108 -18.892 1.00 69.95 45 A 1 ATOM 378 N NE2 . HIS A 0 45 . 8.903 10.949 -17.855 1.00 69.95 45 A 1 ATOM 379 N N . ARG A 0 46 . 11.337 4.931 -16.048 1.00 73.85 46 A 1 ATOM 380 C CA . ARG A 0 46 . 12.176 3.819 -15.597 1.00 73.85 46 A 1 ATOM 381 C C . ARG A 0 46 . 13.258 3.553 -16.621 1.00 73.85 46 A 1 ATOM 382 C CB . ARG A 0 46 . 11.352 2.552 -15.322 1.00 73.85 46 A 1 ATOM 383 O O . ARG A 0 46 . 13.041 3.702 -17.819 1.00 73.85 46 A 1 ATOM 384 C CG . ARG A 0 46 . 10.405 2.714 -14.128 1.00 73.85 46 A 1 ATOM 385 C CD . ARG A 0 46 . 9.711 1.383 -13.834 1.00 73.85 46 A 1 ATOM 386 N NE . ARG A 0 46 . 8.787 1.494 -12.690 1.00 73.85 46 A 1 ATOM 387 N NH1 . ARG A 0 46 . 8.385 -0.751 -12.442 1.00 73.85 46 A 1 ATOM 388 N NH2 . ARG A 0 46 . 7.371 0.707 -11.087 1.00 73.85 46 A 1 ATOM 389 C CZ . ARG A 0 46 . 8.189 0.487 -12.079 1.00 73.85 46 A 1 ATOM 390 N N . ASP A 0 47 . 14.407 3.136 -16.124 1.00 71.96 47 A 1 ATOM 391 C CA . ASP A 0 47 . 15.516 2.676 -16.933 1.00 71.96 47 A 1 ATOM 392 C C . ASP A 0 47 . 15.122 1.359 -17.600 1.00 71.96 47 A 1 ATOM 393 C CB . ASP A 0 47 . 16.736 2.515 -16.030 1.00 71.96 47 A 1 ATOM 394 O O . ASP A 0 47 . 14.787 0.392 -16.915 1.00 71.96 47 A 1 ATOM 395 C CG . ASP A 0 47 . 17.919 2.031 -16.849 1.00 71.96 47 A 1 ATOM 396 O OD1 . ASP A 0 47 . 18.287 0.853 -16.650 1.00 71.96 47 A 1 ATOM 397 O OD2 . ASP A 0 47 . 18.394 2.798 -17.703 1.00 71.96 47 A 1 ATOM 398 N N . GLY A 0 48 . 15.132 1.324 -18.933 1.00 75.37 48 A 1 ATOM 399 C CA . GLY A 0 48 . 14.657 0.166 -19.694 1.00 75.37 48 A 1 ATOM 400 C C . GLY A 0 48 . 15.477 -1.104 -19.455 1.00 75.37 48 A 1 ATOM 401 O O . GLY A 0 48 . 14.951 -2.202 -19.609 1.00 75.37 48 A 1 ATOM 402 N N . MET A 0 49 . 16.739 -0.964 -19.038 1.00 80.82 49 A 1 ATOM 403 C CA . MET A 0 49 . 17.656 -2.088 -18.839 1.00 80.82 49 A 1 ATOM 404 C C . MET A 0 49 . 17.609 -2.648 -17.415 1.00 80.82 49 A 1 ATOM 405 C CB . MET A 0 49 . 19.082 -1.642 -19.197 1.00 80.82 49 A 1 ATOM 406 O O . MET A 0 49 . 17.646 -3.860 -17.220 1.00 80.82 49 A 1 ATOM 407 C CG . MET A 0 49 . 19.229 -1.244 -20.673 1.00 80.82 49 A 1 ATOM 408 S SD . MET A 0 49 . 18.767 -2.514 -21.888 1.00 80.82 49 A 1 ATOM 409 C CE . MET A 0 49 . 19.985 -3.803 -21.515 1.00 80.82 49 A 1 ATOM 410 N N . THR A 0 50 . 17.534 -1.782 -16.405 1.00 84.65 50 A 1 ATOM 411 C CA . THR A 0 50 . 17.583 -2.168 -14.984 1.00 84.65 50 A 1 ATOM 412 C C . THR A 0 50 . 16.220 -2.144 -14.298 1.00 84.65 50 A 1 ATOM 413 C CB . THR A 0 50 . 18.556 -1.282 -14.193 1.00 84.65 50 A 1 ATOM 414 O O . THR A 0 50 . 16.084 -2.662 -13.190 1.00 84.65 50 A 1 ATOM 415 C CG2 . THR A 0 50 . 19.977 -1.278 -14.756 1.00 84.65 50 A 1 ATOM 416 O OG1 . THR A 0 50 . 18.112 0.051 -14.144 1.00 84.65 50 A 1 ATOM 417 N N . GLY A 0 51 . 15.216 -1.507 -14.907 1.00 73.60 51 A 1 ATOM 418 C CA . GLY A 0 51 . 13.885 -1.303 -14.333 1.00 73.60 51 A 1 ATOM 419 C C . GLY A 0 51 . 13.836 -0.294 -13.179 1.00 73.60 51 A 1 ATOM 420 O O . GLY A 0 51 . 12.771 -0.095 -12.588 1.00 73.60 51 A 1 ATOM 421 N N . LYS A 0 52 . 14.962 0.346 -12.832 1.00 72.03 52 A 1 ATOM 422 C CA . LYS A 0 52 . 15.030 1.348 -11.760 1.00 72.03 52 A 1 ATOM 423 C C . LYS A 0 52 . 14.310 2.626 -12.179 1.00 72.03 52 A 1 ATOM 424 C CB . LYS A 0 52 . 16.491 1.640 -11.394 1.00 72.03 52 A 1 ATOM 425 O O . LYS A 0 52 . 14.383 3.021 -13.335 1.00 72.03 52 A 1 ATOM 426 C CG . LYS A 0 52 . 17.159 0.435 -10.717 1.00 72.03 52 A 1 ATOM 427 C CD . LYS A 0 52 . 18.595 0.779 -10.313 1.00 72.03 52 A 1 ATOM 428 C CE . LYS A 0 52 . 19.229 -0.404 -9.576 1.00 72.03 52 A 1 ATOM 429 N NZ . LYS A 0 52 . 20.634 -0.109 -9.203 1.00 72.03 52 A 1 ATOM 430 N N . VAL A 0 53 . 13.630 3.287 -11.242 1.00 67.42 53 A 1 ATOM 431 C CA . VAL A 0 53 . 13.023 4.603 -11.502 1.00 67.42 53 A 1 ATOM 432 C C . VAL A 0 53 . 14.135 5.609 -11.795 1.00 67.42 53 A 1 ATOM 433 C CB . VAL A 0 53 . 12.124 5.064 -10.340 1.00 67.42 53 A 1 ATOM 434 O O . VAL A 0 53 . 15.042 5.779 -10.979 1.00 67.42 53 A 1 ATOM 435 C CG1 . VAL A 0 53 . 11.542 6.458 -10.592 1.00 67.42 53 A 1 ATOM 436 C CG2 . VAL A 0 53 . 10.954 4.085 -10.148 1.00 67.42 53 A 1 ATOM 437 N N . LEU A 0 54 . 14.063 6.232 -12.969 1.00 67.46 54 A 1 ATOM 438 C CA . LEU A 0 54 . 14.926 7.331 -13.373 1.00 67.46 54 A 1 ATOM 439 C C . LEU A 0 54 . 14.289 8.618 -12.875 1.00 67.46 54 A 1 ATOM 440 C CB . LEU A 0 54 . 15.086 7.356 -14.901 1.00 67.46 54 A 1 ATOM 441 O O . LEU A 0 54 . 13.120 8.862 -13.155 1.00 67.46 54 A 1 ATOM 442 C CG . LEU A 0 54 . 15.906 6.189 -15.466 1.00 67.46 54 A 1 ATOM 443 C CD1 . LEU A 0 54 . 15.897 6.258 -16.993 1.00 67.46 54 A 1 ATOM 444 C CD2 . LEU A 0 54 . 17.357 6.213 -14.978 1.00 67.46 54 A 1 ATOM 445 N N . ASP A 0 55 . 15.066 9.391 -12.124 1.00 67.02 55 A 1 ATOM 446 C CA . ASP A 0 55 . 14.642 10.661 -11.538 1.00 67.02 55 A 1 ATOM 447 C C . ASP A 0 55 . 13.325 10.539 -10.747 1.00 67.02 55 A 1 ATOM 448 C CB . ASP A 0 55 . 14.628 11.739 -12.633 1.00 67.02 55 A 1 ATOM 449 O O . ASP A 0 55 . 12.274 11.017 -11.181 1.00 67.02 55 A 1 ATOM 450 C CG . ASP A 0 55 . 14.704 13.156 -12.064 1.00 67.02 55 A 1 ATOM 451 O OD1 . ASP A 0 55 . 14.949 13.287 -10.840 1.00 67.02 55 A 1 ATOM 452 O OD2 . ASP A 0 55 . 14.613 14.094 -12.883 1.00 67.02 55 A 1 ATOM 453 N N . PRO A 0 56 . 13.327 9.810 -9.609 1.00 63.06 56 A 1 ATOM 454 C CA . PRO A 0 56 . 12.147 9.736 -8.768 1.00 63.06 56 A 1 ATOM 455 C C . PRO A 0 56 . 11.878 11.147 -8.265 1.00 63.06 56 A 1 ATOM 456 C CB . PRO A 0 56 . 12.499 8.755 -7.643 1.00 63.06 56 A 1 ATOM 457 O O . PRO A 0 56 . 12.545 11.577 -7.322 1.00 63.06 56 A 1 ATOM 458 C CG . PRO A 0 56 . 14.020 8.879 -7.521 1.00 63.06 56 A 1 ATOM 459 C CD . PRO A 0 56 . 14.470 9.194 -8.949 1.00 63.06 56 A 1 ATOM 460 N N . ASP A 0 57 . 10.927 11.841 -8.898 1.00 58.98 57 A 1 ATOM 461 C CA . ASP A 0 57 . 10.493 13.166 -8.477 1.00 58.98 57 A 1 ATOM 462 C C . ASP A 0 57 . 10.341 13.114 -6.960 1.00 58.98 57 A 1 ATOM 463 C CB . ASP A 0 57 . 9.188 13.575 -9.182 1.00 58.98 57 A 1 ATOM 464 O O . ASP A 0 57 . 9.545 12.344 -6.408 1.00 58.98 57 A 1 ATOM 465 C CG . ASP A 0 57 . 8.733 15.000 -8.828 1.00 58.98 57 A 1 ATOM 466 O OD1 . ASP A 0 57 . 9.354 15.632 -7.937 1.00 58.98 57 A 1 ATOM 467 O OD2 . ASP A 0 57 . 7.698 15.435 -9.368 1.00 58.98 57 A 1 ATOM 468 N N . VAL A 0 58 . 11.206 13.850 -6.265 1.00 55.74 58 A 1 ATOM 469 C CA . VAL A 0 58 . 11.314 13.793 -4.806 1.00 55.74 58 A 1 ATOM 470 C C . VAL A 0 58 . 9.957 14.156 -4.186 1.00 55.74 58 A 1 ATOM 471 C CB . VAL A 0 58 . 12.457 14.707 -4.321 1.00 55.74 58 A 1 ATOM 472 O O . VAL A 0 58 . 9.627 13.714 -3.082 1.00 55.74 58 A 1 ATOM 473 C CG1 . VAL A 0 58 . 12.799 14.434 -2.851 1.00 55.74 58 A 1 ATOM 474 C CG2 . VAL A 0 58 . 13.751 14.503 -5.129 1.00 55.74 58 A 1 ATOM 475 N N . ASN A 0 59 . 9.116 14.868 -4.944 1.00 48.09 59 A 1 ATOM 476 C CA . ASN A 0 59 . 7.744 15.195 -4.597 1.00 48.09 59 A 1 ATOM 477 C C . ASN A 0 59 . 6.785 13.993 -4.639 1.00 48.09 59 A 1 ATOM 478 C CB . ASN A 0 59 . 7.273 16.324 -5.518 1.00 48.09 59 A 1 ATOM 479 O O . ASN A 0 59 . 5.865 13.953 -3.825 1.00 48.09 59 A 1 ATOM 480 C CG . ASN A 0 59 . 8.173 17.541 -5.414 1.00 48.09 59 A 1 ATOM 481 N ND2 . ASN A 0 59 . 8.769 17.954 -6.503 1.00 48.09 59 A 1 ATOM 482 O OD1 . ASN A 0 59 . 8.365 18.095 -4.339 1.00 48.09 59 A 1 ATOM 483 N N . PHE A 0 60 . 7.017 12.967 -5.468 1.00 50.54 60 A 1 ATOM 484 C CA . PHE A 0 60 . 6.209 11.737 -5.477 1.00 50.54 60 A 1 ATOM 485 C C . PHE A 0 60 . 6.277 11.003 -4.129 1.00 50.54 60 A 1 ATOM 486 C CB . PHE A 0 60 . 6.668 10.811 -6.615 1.00 50.54 60 A 1 ATOM 487 O O . PHE A 0 60 . 5.267 10.503 -3.626 1.00 50.54 60 A 1 ATOM 488 C CG . PHE A 0 60 . 5.791 9.582 -6.778 1.00 50.54 60 A 1 ATOM 489 C CD1 . PHE A 0 60 . 6.143 8.356 -6.179 1.00 50.54 60 A 1 ATOM 490 C CD2 . PHE A 0 60 . 4.591 9.679 -7.503 1.00 50.54 60 A 1 ATOM 491 C CE1 . PHE A 0 60 . 5.292 7.241 -6.298 1.00 50.54 60 A 1 ATOM 492 C CE2 . PHE A 0 60 . 3.738 8.568 -7.621 1.00 50.54 60 A 1 ATOM 493 C CZ . PHE A 0 60 . 4.087 7.349 -7.016 1.00 50.54 60 A 1 ATOM 494 N N . LYS A 0 61 . 7.452 11.008 -3.473 1.00 51.35 61 A 1 ATOM 495 C CA . LYS A 0 61 . 7.576 10.502 -2.093 1.00 51.35 61 A 1 ATOM 496 C C . LYS A 0 61 . 6.700 11.292 -1.117 1.00 51.35 61 A 1 ATOM 497 C CB . LYS A 0 61 . 9.035 10.526 -1.611 1.00 51.35 61 A 1 ATOM 498 O O . LYS A 0 61 . 6.185 10.719 -0.160 1.00 51.35 61 A 1 ATOM 499 C CG . LYS A 0 61 . 9.889 9.416 -2.236 1.00 51.35 61 A 1 ATOM 500 C CD . LYS A 0 61 . 11.286 9.416 -1.599 1.00 51.35 61 A 1 ATOM 501 C CE . LYS A 0 61 . 12.132 8.269 -2.158 1.00 51.35 61 A 1 ATOM 502 N NZ . LYS A 0 61 . 13.500 8.281 -1.584 1.00 51.35 61 A 1 ATOM 503 N N . ARG A 0 62 . 6.507 12.592 -1.361 1.00 45.42 62 A 1 ATOM 504 C CA . ARG A 0 62 . 5.702 13.479 -0.513 1.00 45.42 62 A 1 ATOM 505 C C . ARG A 0 62 . 4.204 13.205 -0.659 1.00 45.42 62 A 1 ATOM 506 C CB . ARG A 0 62 . 6.059 14.939 -0.834 1.00 45.42 62 A 1 ATOM 507 O O . ARG A 0 62 . 3.499 13.191 0.348 1.00 45.42 62 A 1 ATOM 508 C CG . ARG A 0 62 . 5.947 15.835 0.403 1.00 45.42 62 A 1 ATOM 509 C CD . ARG A 0 62 . 6.365 17.264 0.039 1.00 45.42 62 A 1 ATOM 510 N NE . ARG A 0 62 . 6.789 18.026 1.227 1.00 45.42 62 A 1 ATOM 511 N NH1 . ARG A 0 62 . 7.544 19.883 0.108 1.00 45.42 62 A 1 ATOM 512 N NH2 . ARG A 0 62 . 7.784 19.757 2.324 1.00 45.42 62 A 1 ATOM 513 C CZ . ARG A 0 62 . 7.367 19.214 1.214 1.00 45.42 62 A 1 ATOM 514 N N . SER A 0 63 . 3.729 12.906 -1.869 1.00 44.77 63 A 1 ATOM 515 C CA . SER A 0 63 . 2.309 12.630 -2.136 1.00 44.77 63 A 1 ATOM 516 C C . SER A 0 63 . 1.787 11.427 -1.344 1.00 44.77 63 A 1 ATOM 517 C CB . SER A 0 63 . 2.087 12.388 -3.633 1.00 44.77 63 A 1 ATOM 518 O O . SER A 0 63 . 0.693 11.487 -0.793 1.00 44.77 63 A 1 ATOM 519 O OG . SER A 0 63 . 2.740 13.382 -4.398 1.00 44.77 63 A 1 ATOM 520 N N . CYS A 0 64 . 2.589 10.366 -1.200 1.00 45.25 64 A 1 ATOM 521 C CA . CYS A 0 64 . 2.190 9.196 -0.408 1.00 45.25 64 A 1 ATOM 522 C C . CYS A 0 64 . 2.314 9.429 1.110 1.00 45.25 64 A 1 ATOM 523 C CB . CYS A 0 64 . 3.009 7.979 -0.854 1.00 45.25 64 A 1 ATOM 524 O O . CYS A 0 64 . 1.584 8.817 1.885 1.00 45.25 64 A 1 ATOM 525 S SG . CYS A 0 64 . 2.689 7.596 -2.603 1.00 45.25 64 A 1 ATOM 526 N N . ALA A 0 65 . 3.208 10.322 1.547 1.00 45.66 65 A 1 ATOM 527 C CA . ALA A 0 65 . 3.431 10.600 2.968 1.00 45.66 65 A 1 ATOM 528 C C . ALA A 0 65 . 2.383 11.543 3.588 1.00 45.66 65 A 1 ATOM 529 C CB . ALA A 0 65 . 4.852 11.151 3.130 1.00 45.66 65 A 1 ATOM 530 O O . ALA A 0 65 . 2.240 11.582 4.807 1.00 45.66 65 A 1 ATOM 531 N N . THR A 0 66 . 1.630 12.298 2.780 1.00 39.69 66 A 1 ATOM 532 C CA . THR A 0 66 . 0.711 13.324 3.316 1.00 39.69 66 A 1 ATOM 533 C C . THR A 0 66 . -0.679 12.770 3.670 1.00 39.69 66 A 1 ATOM 534 C CB . THR A 0 66 . 0.637 14.576 2.421 1.00 39.69 66 A 1 ATOM 535 O O . THR A 0 66 . -1.498 13.483 4.241 1.00 39.69 66 A 1 ATOM 536 C CG2 . THR A 0 66 . 0.350 15.844 3.232 1.00 39.69 66 A 1 ATOM 537 O OG1 . THR A 0 66 . 1.875 14.858 1.797 1.00 39.69 66 A 1 ATOM 538 N N . ALA A 0 67 . -0.952 11.485 3.406 1.00 44.77 67 A 1 ATOM 539 C CA . ALA A 0 67 . -2.189 10.836 3.856 1.00 44.77 67 A 1 ATOM 540 C C . ALA A 0 67 . -2.169 10.453 5.350 1.00 44.77 67 A 1 ATOM 541 C CB . ALA A 0 67 . -2.480 9.635 2.953 1.00 44.77 67 A 1 ATOM 542 O O . ALA A 0 67 . -3.198 10.073 5.905 1.00 44.77 67 A 1 ATOM 543 N N . THR A 0 68 . -1.028 10.575 6.032 1.00 40.24 68 A 1 ATOM 544 C CA . THR A 0 68 . -0.967 10.406 7.484 1.00 40.24 68 A 1 ATOM 545 C C . THR A 0 68 . -1.034 11.757 8.189 1.00 40.24 68 A 1 ATOM 546 C CB . THR A 0 68 . 0.241 9.568 7.926 1.00 40.24 68 A 1 ATOM 547 O O . THR A 0 68 . -0.171 12.610 8.016 1.00 40.24 68 A 1 ATOM 548 C CG2 . THR A 0 68 . -0.019 8.081 7.673 1.00 40.24 68 A 1 ATOM 549 O OG1 . THR A 0 68 . 1.409 9.903 7.217 1.00 40.24 68 A 1 ATOM 550 N N . SER A 0 69 . -2.059 11.891 9.032 1.00 41.92 69 A 1 ATOM 551 C CA . SER A 0 69 . -2.095 12.735 10.230 1.00 41.92 69 A 1 ATOM 552 C C . SER A 0 69 . -2.330 14.246 10.107 1.00 41.92 69 A 1 ATOM 553 C CB . SER A 0 69 . -0.931 12.404 11.184 1.00 41.92 69 A 1 ATOM 554 O O . SER A 0 69 . -1.725 14.998 10.869 1.00 41.92 69 A 1 ATOM 555 O OG . SER A 0 69 . 0.285 13.002 10.797 1.00 41.92 69 A 1 ATOM 556 N N . HIS A 0 70 . -3.317 14.718 9.337 1.00 39.85 70 A 1 ATOM 557 C CA . HIS A 0 70 . -3.925 16.033 9.641 1.00 39.85 70 A 1 ATOM 558 C C . HIS A 0 70 . -4.874 15.984 10.865 1.00 39.85 70 A 1 ATOM 559 C CB . HIS A 0 70 . -4.544 16.689 8.398 1.00 39.85 70 A 1 ATOM 560 O O . HIS A 0 70 . -5.938 16.589 10.879 1.00 39.85 70 A 1 ATOM 561 C CG . HIS A 0 70 . -4.539 18.195 8.524 1.00 39.85 70 A 1 ATOM 562 C CD2 . HIS A 0 70 . -5.612 19.022 8.733 1.00 39.85 70 A 1 ATOM 563 N ND1 . HIS A 0 70 . -3.414 18.991 8.514 1.00 39.85 70 A 1 ATOM 564 C CE1 . HIS A 0 70 . -3.799 20.264 8.701 1.00 39.85 70 A 1 ATOM 565 N NE2 . HIS A 0 70 . -5.129 20.333 8.833 1.00 39.85 70 A 1 ATOM 566 N N . GLY A 0 71 . -4.506 15.228 11.903 1.00 43.63 71 A 1 ATOM 567 C CA . GLY A 0 71 . -5.351 15.051 13.090 1.00 43.63 71 A 1 ATOM 568 C C . GLY A 0 71 . -4.734 14.255 14.238 1.00 43.63 71 A 1 ATOM 569 O O . GLY A 0 71 . -5.289 14.245 15.332 1.00 43.63 71 A 1 ATOM 570 N N . ILE A 0 72 . -3.571 13.622 14.049 1.00 40.86 72 A 1 ATOM 571 C CA . ILE A 0 72 . -2.873 12.963 15.157 1.00 40.86 72 A 1 ATOM 572 C C . ILE A 0 72 . -1.880 13.970 15.725 1.00 40.86 72 A 1 ATOM 573 C CB . ILE A 0 72 . -2.250 11.607 14.758 1.00 40.86 72 A 1 ATOM 574 O O . ILE A 0 72 . -0.769 14.114 15.225 1.00 40.86 72 A 1 ATOM 575 C CG1 . ILE A 0 72 . -3.311 10.705 14.081 1.00 40.86 72 A 1 ATOM 576 C CG2 . ILE A 0 72 . -1.673 10.930 16.016 1.00 40.86 72 A 1 ATOM 577 C CD1 . ILE A 0 72 . -2.776 9.355 13.593 1.00 40.86 72 A 1 ATOM 578 N N . ASN A 0 73 . -2.314 14.690 16.758 1.00 43.64 73 A 1 ATOM 579 C CA . ASN A 0 73 . -1.455 15.503 17.614 1.00 43.64 73 A 1 ATOM 580 C C . ASN A 0 73 . -0.371 14.595 18.227 1.00 43.64 73 A 1 ATOM 581 C CB . ASN A 0 73 . -2.338 16.200 18.683 1.00 43.64 73 A 1 ATOM 582 O O . ASN A 0 73 . -0.569 13.958 19.263 1.00 43.64 73 A 1 ATOM 583 C CG . ASN A 0 73 . -2.437 17.707 18.525 1.00 43.64 73 A 1 ATOM 584 N ND2 . ASN A 0 73 . -3.442 18.320 19.104 1.00 43.64 73 A 1 ATOM 585 O OD1 . ASN A 0 73 . -1.604 18.357 17.922 1.00 43.64 73 A 1 ATOM 586 N N . THR A 0 74 . 0.784 14.509 17.571 1.00 49.07 74 A 1 ATOM 587 C CA . THR A 0 74 . 1.917 13.653 17.960 1.00 49.07 74 A 1 ATOM 588 C C . THR A 0 74 . 2.565 14.059 19.281 1.00 49.07 74 A 1 ATOM 589 C CB . THR A 0 74 . 2.982 13.601 16.848 1.00 49.07 74 A 1 ATOM 590 O O . THR A 0 74 . 3.378 13.304 19.801 1.00 49.07 74 A 1 ATOM 591 C CG2 . THR A 0 74 . 2.704 12.465 15.867 1.00 49.07 74 A 1 ATOM 592 O OG1 . THR A 0 74 . 2.990 14.799 16.102 1.00 49.07 74 A 1 ATOM 593 N N . ALA A 0 75 . 2.176 15.188 19.880 1.00 52.52 75 A 1 ATOM 594 C CA . ALA A 0 75 . 2.656 15.582 21.201 1.00 52.52 75 A 1 ATOM 595 C C . ALA A 0 75 . 2.203 14.626 22.326 1.00 52.52 75 A 1 ATOM 596 C CB . ALA A 0 75 . 2.216 17.027 21.463 1.00 52.52 75 A 1 ATOM 597 O O . ALA A 0 75 . 2.911 14.500 23.320 1.00 52.52 75 A 1 ATOM 598 N N . ASN A 0 76 . 1.070 13.921 22.173 1.00 48.46 76 A 1 ATOM 599 C CA . ASN A 0 76 . 0.480 13.139 23.273 1.00 48.46 76 A 1 ATOM 600 C C . ASN A 0 76 . 0.356 11.634 23.026 1.00 48.46 76 A 1 ATOM 601 C CB . ASN A 0 76 . -0.869 13.765 23.664 1.00 48.46 76 A 1 ATOM 602 O O . ASN A 0 76 . -0.012 10.898 23.944 1.00 48.46 76 A 1 ATOM 603 C CG . ASN A 0 76 . -0.714 14.996 24.537 1.00 48.46 76 A 1 ATOM 604 N ND2 . ASN A 0 76 . -1.790 15.699 24.793 1.00 48.46 76 A 1 ATOM 605 O OD1 . ASN A 0 76 . 0.345 15.342 25.023 1.00 48.46 76 A 1 ATOM 606 N N . VAL A 0 77 . 0.672 11.139 21.831 1.00 50.40 77 A 1 ATOM 607 C CA . VAL A 0 77 . 0.582 9.700 21.577 1.00 50.40 77 A 1 ATOM 608 C C . VAL A 0 77 . 1.885 9.059 22.033 1.00 50.40 77 A 1 ATOM 609 C CB . VAL A 0 77 . 0.188 9.369 20.127 1.00 50.40 77 A 1 ATOM 610 O O . VAL A 0 77 . 2.840 8.940 21.267 1.00 50.40 77 A 1 ATOM 611 C CG1 . VAL A 0 77 . -0.120 7.871 19.989 1.00 50.40 77 A 1 ATOM 612 C CG2 . VAL A 0 77 . -1.076 10.136 19.712 1.00 50.40 77 A 1 ATOM 613 N N . ARG A 0 78 . 1.925 8.616 23.297 1.00 53.34 78 A 1 ATOM 614 C CA . ARG A 0 78 . 2.793 7.494 23.673 1.00 53.34 78 A 1 ATOM 615 C C . ARG A 0 78 . 2.386 6.348 22.761 1.00 53.34 78 A 1 ATOM 616 C CB . ARG A 0 78 . 2.604 7.075 25.140 1.00 53.34 78 A 1 ATOM 617 O O . ARG A 0 78 . 1.381 5.693 23.012 1.00 53.34 78 A 1 ATOM 618 C CG . ARG A 0 78 . 3.140 8.095 26.143 1.00 53.34 78 A 1 ATOM 619 C CD . ARG A 0 78 . 2.985 7.547 27.568 1.00 53.34 78 A 1 ATOM 620 N NE . ARG A 0 78 . 2.828 8.651 28.531 1.00 53.34 78 A 1 ATOM 621 N NH1 . ARG A 0 78 . 4.205 7.901 30.214 1.00 53.34 78 A 1 ATOM 622 N NH2 . ARG A 0 78 . 3.088 9.818 30.457 1.00 53.34 78 A 1 ATOM 623 C CZ . ARG A 0 78 . 3.375 8.779 29.725 1.00 53.34 78 A 1 ATOM 624 N N . VAL A 0 79 . 3.098 6.179 21.652 1.00 55.60 79 A 1 ATOM 625 C CA . VAL A 0 79 . 2.859 5.062 20.746 1.00 55.60 79 A 1 ATOM 626 C C . VAL A 0 79 . 3.091 3.815 21.579 1.00 55.60 79 A 1 ATOM 627 C CB . VAL A 0 79 . 3.772 5.115 19.509 1.00 55.60 79 A 1 ATOM 628 O O . VAL A 0 79 . 4.211 3.579 22.039 1.00 55.60 79 A 1 ATOM 629 C CG1 . VAL A 0 79 . 3.475 3.935 18.574 1.00 55.60 79 A 1 ATOM 630 C CG2 . VAL A 0 79 . 3.554 6.413 18.718 1.00 55.60 79 A 1 ATOM 631 N N . GLU A 0 80 . 2.016 3.078 21.855 1.00 58.07 80 A 1 ATOM 632 C CA . GLU A 0 80 . 2.100 1.870 22.659 1.00 58.07 80 A 1 ATOM 633 C C . GLU A 0 80 . 3.173 0.958 22.051 1.00 58.07 80 A 1 ATOM 634 C CB . GLU A 0 80 . 0.762 1.130 22.717 1.00 58.07 80 A 1 ATOM 635 O O . GLU A 0 80 . 3.141 0.701 20.840 1.00 58.07 80 A 1 ATOM 636 C CG . GLU A 0 80 . -0.129 1.625 23.863 1.00 58.07 80 A 1 ATOM 637 C CD . GLU A 0 80 . -1.395 0.767 23.991 1.00 58.07 80 A 1 ATOM 638 O OE1 . GLU A 0 80 . -1.851 0.595 25.141 1.00 58.07 80 A 1 ATOM 639 O OE2 . GLU A 0 80 . -1.850 0.257 22.943 1.00 58.07 80 A 1 ATOM 640 N N . PRO A 0 81 . 4.125 0.451 22.854 1.00 61.77 81 A 1 ATOM 641 C CA . PRO A 0 81 . 5.192 -0.423 22.370 1.00 61.77 81 A 1 ATOM 642 C C . PRO A 0 81 . 4.674 -1.593 21.516 1.00 61.77 81 A 1 ATOM 643 C CB . PRO A 0 81 . 5.890 -0.914 23.643 1.00 61.77 81 A 1 ATOM 644 O O . PRO A 0 81 . 5.339 -2.029 20.576 1.00 61.77 81 A 1 ATOM 645 C CG . PRO A 0 81 . 5.686 0.235 24.630 1.00 61.77 81 A 1 ATOM 646 C CD . PRO A 0 81 . 4.307 0.767 24.264 1.00 61.77 81 A 1 ATOM 647 N N . THR A 0 82 . 3.456 -2.060 21.798 1.00 68.09 82 A 1 ATOM 648 C CA . THR A 0 82 . 2.743 -3.108 21.058 1.00 68.09 82 A 1 ATOM 649 C C . THR A 0 82 . 2.440 -2.724 19.608 1.00 68.09 82 A 1 ATOM 650 C CB . THR A 0 82 . 1.422 -3.430 21.777 1.00 68.09 82 A 1 ATOM 651 O O . THR A 0 82 . 2.639 -3.539 18.703 1.00 68.09 82 A 1 ATOM 652 C CG2 . THR A 0 82 . 0.818 -4.747 21.299 1.00 68.09 82 A 1 ATOM 653 O OG1 . THR A 0 82 . 1.656 -3.554 23.162 1.00 68.09 82 A 1 ATOM 654 N N . ILE A 0 83 . 2.010 -1.483 19.357 1.00 65.29 83 A 1 ATOM 655 C CA . ILE A 0 83 . 1.706 -0.991 18.005 1.00 65.29 83 A 1 ATOM 656 C C . ILE A 0 83 . 3.000 -0.912 17.195 1.00 65.29 83 A 1 ATOM 657 C CB . ILE A 0 83 . 0.979 0.375 18.054 1.00 65.29 83 A 1 ATOM 658 O O . ILE A 0 83 . 3.069 -1.431 16.081 1.00 65.29 83 A 1 ATOM 659 C CG1 . ILE A 0 83 . -0.370 0.239 18.799 1.00 65.29 83 A 1 ATOM 660 C CG2 . ILE A 0 83 . 0.761 0.919 16.628 1.00 65.29 83 A 1 ATOM 661 C CD1 . ILE A 0 83 . -1.120 1.564 18.988 1.00 65.29 83 A 1 ATOM 662 N N . MET A 0 84 . 4.058 -0.346 17.783 1.00 70.92 84 A 1 ATOM 663 C CA . MET A 0 84 . 5.361 -0.246 17.120 1.00 70.92 84 A 1 ATOM 664 C C . MET A 0 84 . 5.935 -1.631 16.785 1.00 70.92 84 A 1 ATOM 665 C CB . MET A 0 84 . 6.320 0.564 18.004 1.00 70.92 84 A 1 ATOM 666 O O . MET A 0 84 . 6.433 -1.853 15.680 1.00 70.92 84 A 1 ATOM 667 C CG . MET A 0 84 . 7.631 0.890 17.276 1.00 70.92 84 A 1 ATOM 668 S SD . MET A 0 84 . 7.458 1.868 15.755 1.00 70.92 84 A 1 ATOM 669 C CE . MET A 0 84 . 7.005 3.480 16.449 1.00 70.92 84 A 1 ATOM 670 N N . LYS A 0 85 . 5.802 -2.596 17.705 1.00 70.52 85 A 1 ATOM 671 C CA . LYS A 0 85 . 6.205 -3.990 17.472 1.00 70.52 85 A 1 ATOM 672 C C . LYS A 0 85 . 5.419 -4.632 16.325 1.00 70.52 85 A 1 ATOM 673 C CB . LYS A 0 85 . 6.049 -4.773 18.783 1.00 70.52 85 A 1 ATOM 674 O O . LYS A 0 85 . 6.010 -5.324 15.499 1.00 70.52 85 A 1 ATOM 675 C CG . LYS A 0 85 . 6.629 -6.190 18.677 1.00 70.52 85 A 1 ATOM 676 C CD . LYS A 0 85 . 6.466 -6.935 20.006 1.00 70.52 85 A 1 ATOM 677 C CE . LYS A 0 85 . 7.054 -8.344 19.886 1.00 70.52 85 A 1 ATOM 678 N NZ . LYS A 0 85 . 6.851 -9.123 21.134 1.00 70.52 85 A 1 ATOM 679 N N . SER A 0 86 . 4.114 -4.378 16.249 1.00 70.92 86 A 1 ATOM 680 C CA . SER A 0 86 . 3.252 -4.916 15.189 1.00 70.92 86 A 1 ATOM 681 C C . SER A 0 86 . 3.639 -4.363 13.817 1.00 70.92 86 A 1 ATOM 682 C CB . SER A 0 86 . 1.780 -4.622 15.492 1.00 70.92 86 A 1 ATOM 683 O O . SER A 0 86 . 3.817 -5.131 12.875 1.00 70.92 86 A 1 ATOM 684 O OG . SER A 0 86 . 1.436 -5.173 16.749 1.00 70.92 86 A 1 ATOM 685 N N . ILE A 0 87 . 3.874 -3.049 13.715 1.00 71.27 87 A 1 ATOM 686 C CA . ILE A 0 87 . 4.352 -2.407 12.478 1.00 71.27 87 A 1 ATOM 687 C C . ILE A 0 87 . 5.700 -2.999 12.046 1.00 71.27 87 A 1 ATOM 688 C CB . ILE A 0 87 . 4.440 -0.874 12.675 1.00 71.27 87 A 1 ATOM 689 O O . ILE A 0 87 . 5.907 -3.287 10.865 1.00 71.27 87 A 1 ATOM 690 C CG1 . ILE A 0 87 . 3.024 -0.279 12.860 1.00 71.27 87 A 1 ATOM 691 C CG2 . ILE A 0 87 . 5.146 -0.197 11.482 1.00 71.27 87 A 1 ATOM 692 C CD1 . ILE A 0 87 . 3.019 1.184 13.321 1.00 71.27 87 A 1 ATOM 693 N N . HIS A 0 88 . 6.611 -3.220 12.998 1.00 73.47 88 A 1 ATOM 694 C CA . HIS A 0 88 . 7.916 -3.807 12.712 1.00 73.47 88 A 1 ATOM 695 C C . HIS A 0 88 . 7.810 -5.235 12.150 1.00 73.47 88 A 1 ATOM 696 C CB . HIS A 0 88 . 8.778 -3.759 13.978 1.00 73.47 88 A 1 ATOM 697 O O . HIS A 0 88 . 8.462 -5.551 11.152 1.00 73.47 88 A 1 ATOM 698 C CG . HIS A 0 88 . 10.199 -4.171 13.708 1.00 73.47 88 A 1 ATOM 699 C CD2 . HIS A 0 88 . 10.781 -5.374 14.010 1.00 73.47 88 A 1 ATOM 700 N ND1 . HIS A 0 88 . 11.141 -3.418 13.047 1.00 73.47 88 A 1 ATOM 701 C CE1 . HIS A 0 88 . 12.266 -4.145 12.959 1.00 73.47 88 A 1 ATOM 702 N NE2 . HIS A 0 88 . 12.097 -5.348 13.529 1.00 73.47 88 A 1 ATOM 703 N N . GLU A 0 89 . 6.963 -6.088 12.732 1.00 74.69 89 A 1 ATOM 704 C CA . GLU A 0 89 . 6.763 -7.455 12.235 1.00 74.69 89 A 1 ATOM 705 C C . GLU A 0 89 . 6.046 -7.493 10.879 1.00 74.69 89 A 1 ATOM 706 C CB . GLU A 0 89 . 6.042 -8.317 13.284 1.00 74.69 89 A 1 ATOM 707 O O . GLU A 0 89 . 6.467 -8.244 9.999 1.00 74.69 89 A 1 ATOM 708 C CG . GLU A 0 89 . 6.977 -8.768 14.425 1.00 74.69 89 A 1 ATOM 709 C CD . GLU A 0 89 . 8.180 -9.620 13.950 1.00 74.69 89 A 1 ATOM 710 O OE1 . GLU A 0 89 . 9.283 -9.523 14.541 1.00 74.69 89 A 1 ATOM 711 O OE2 . GLU A 0 89 . 8.055 -10.379 12.962 1.00 74.69 89 A 1 ATOM 712 N N . ILE A 0 90 . 5.045 -6.635 10.649 1.00 74.20 90 A 1 ATOM 713 C CA . ILE A 0 90 . 4.385 -6.512 9.336 1.00 74.20 90 A 1 ATOM 714 C C . ILE A 0 90 . 5.404 -6.109 8.263 1.00 74.20 90 A 1 ATOM 715 C CB . ILE A 0 90 . 3.209 -5.511 9.410 1.00 74.20 90 A 1 ATOM 716 O O . ILE A 0 90 . 5.478 -6.735 7.206 1.00 74.20 90 A 1 ATOM 717 C CG1 . ILE A 0 90 . 2.068 -6.087 10.281 1.00 74.20 90 A 1 ATOM 718 C CG2 . ILE A 0 90 . 2.668 -5.177 8.004 1.00 74.20 90 A 1 ATOM 719 C CD1 . ILE A 0 90 . 1.036 -5.036 10.711 1.00 74.20 90 A 1 ATOM 720 N N . SER A 0 91 . 6.244 -5.111 8.549 1.00 68.56 91 A 1 ATOM 721 C CA . SER A 0 91 . 7.297 -4.659 7.631 1.00 68.56 91 A 1 ATOM 722 C C . SER A 0 91 . 8.293 -5.778 7.300 1.00 68.56 91 A 1 ATOM 723 C CB . SER A 0 91 . 8.012 -3.462 8.260 1.00 68.56 91 A 1 ATOM 724 O O . SER A 0 91 . 8.642 -6.011 6.140 1.00 68.56 91 A 1 ATOM 725 O OG . SER A 0 91 . 9.020 -2.975 7.399 1.00 68.56 91 A 1 ATOM 726 N N . LYS A 0 92 . 8.700 -6.550 8.311 1.00 72.48 92 A 1 ATOM 727 C CA . LYS A 0 92 . 9.598 -7.698 8.149 1.00 72.48 92 A 1 ATOM 728 C C . LYS A 0 92 . 8.971 -8.820 7.322 1.00 72.48 92 A 1 ATOM 729 C CB . LYS A 0 92 . 9.968 -8.160 9.554 1.00 72.48 92 A 1 ATOM 730 O O . LYS A 0 92 . 9.665 -9.424 6.502 1.00 72.48 92 A 1 ATOM 731 C CG . LYS A 0 92 . 11.026 -9.267 9.621 1.00 72.48 92 A 1 ATOM 732 C CD . LYS A 0 92 . 11.199 -9.540 11.115 1.00 72.48 92 A 1 ATOM 733 C CE . LYS A 0 92 . 12.146 -10.673 11.477 1.00 72.48 92 A 1 ATOM 734 N NZ . LYS A 0 92 . 12.051 -10.852 12.947 1.00 72.48 92 A 1 ATOM 735 N N . GLN A 0 93 . 7.685 -9.106 7.516 1.00 70.28 93 A 1 ATOM 736 C CA . GLN A 0 93 . 6.951 -10.089 6.717 1.00 70.28 93 A 1 ATOM 737 C C . GLN A 0 93 . 6.808 -9.639 5.264 1.00 70.28 93 A 1 ATOM 738 C CB . GLN A 0 93 . 5.568 -10.348 7.320 1.00 70.28 93 A 1 ATOM 739 O O . GLN A 0 93 . 7.107 -10.426 4.366 1.00 70.28 93 A 1 ATOM 740 C CG . GLN A 0 93 . 5.640 -11.185 8.603 1.00 70.28 93 A 1 ATOM 741 C CD . GLN A 0 93 . 4.257 -11.466 9.181 1.00 70.28 93 A 1 ATOM 742 N NE2 . GLN A 0 93 . 4.175 -11.998 10.379 1.00 70.28 93 A 1 ATOM 743 O OE1 . GLN A 0 93 . 3.230 -11.239 8.571 1.00 70.28 93 A 1 ATOM 744 N N . ALA A 0 94 . 6.453 -8.374 5.029 1.00 67.52 94 A 1 ATOM 745 C CA . ALA A 0 94 . 6.375 -7.805 3.688 1.00 67.52 94 A 1 ATOM 746 C C . ALA A 0 94 . 7.720 -7.940 2.960 1.00 67.52 94 A 1 ATOM 747 C CB . ALA A 0 94 . 5.914 -6.347 3.796 1.00 67.52 94 A 1 ATOM 748 O O . ALA A 0 94 . 7.773 -8.506 1.871 1.00 67.52 94 A 1 ATOM 749 N N . LEU A 0 95 . 8.824 -7.545 3.607 1.00 66.85 95 A 1 ATOM 750 C CA . LEU A 0 95 . 10.168 -7.658 3.034 1.00 66.85 95 A 1 ATOM 751 C C . LEU A 0 95 . 10.554 -9.109 2.703 1.00 66.85 95 A 1 ATOM 752 C CB . LEU A 0 95 . 11.171 -7.036 4.021 1.00 66.85 95 A 1 ATOM 753 O O . LEU A 0 95 . 11.203 -9.361 1.685 1.00 66.85 95 A 1 ATOM 754 C CG . LEU A 0 95 . 12.624 -7.014 3.508 1.00 66.85 95 A 1 ATOM 755 C CD1 . LEU A 0 95 . 12.787 -6.130 2.270 1.00 66.85 95 A 1 ATOM 756 C CD2 . LEU A 0 95 . 13.555 -6.492 4.602 1.00 66.85 95 A 1 ATOM 757 N N . ARG A 0 96 . 10.176 -10.068 3.557 1.00 67.15 96 A 1 ATOM 758 C CA . ARG A 0 96 . 10.390 -11.498 3.293 1.00 67.15 96 A 1 ATOM 759 C C . ARG A 0 96 . 9.585 -11.952 2.081 1.00 67.15 96 A 1 ATOM 760 C CB . ARG A 0 96 . 10.050 -12.336 4.530 1.00 67.15 96 A 1 ATOM 761 O O . ARG A 0 96 . 10.179 -12.530 1.180 1.00 67.15 96 A 1 ATOM 762 C CG . ARG A 0 96 . 11.141 -12.237 5.603 1.00 67.15 96 A 1 ATOM 763 C CD . ARG A 0 96 . 10.656 -12.923 6.882 1.00 67.15 96 A 1 ATOM 764 N NE . ARG A 0 96 . 11.698 -12.931 7.925 1.00 67.15 96 A 1 ATOM 765 N NH1 . ARG A 0 96 . 10.558 -14.235 9.431 1.00 67.15 96 A 1 ATOM 766 N NH2 . ARG A 0 96 . 12.646 -13.597 9.888 1.00 67.15 96 A 1 ATOM 767 C CZ . ARG A 0 96 . 11.627 -13.582 9.073 1.00 67.15 96 A 1 ATOM 768 N N . SER A 0 97 . 8.295 -11.621 2.024 1.00 60.98 97 A 1 ATOM 769 C CA . SER A 0 97 . 7.414 -11.981 0.908 1.00 60.98 97 A 1 ATOM 770 C C . SER A 0 97 . 7.951 -11.464 -0.426 1.00 60.98 97 A 1 ATOM 771 C CB . SER A 0 97 . 6.009 -11.421 1.149 1.00 60.98 97 A 1 ATOM 772 O O . SER A 0 97 . 8.040 -12.221 -1.388 1.00 60.98 97 A 1 ATOM 773 O OG . SER A 0 97 . 5.074 -12.046 0.297 1.00 60.98 97 A 1 ATOM 774 N N . THR A 0 98 . 8.397 -10.203 -0.474 1.00 58.37 98 A 1 ATOM 775 C CA . THR A 0 98 . 8.934 -9.615 -1.710 1.00 58.37 98 A 1 ATOM 776 C C . THR A 0 98 . 10.230 -10.294 -2.153 1.00 58.37 98 A 1 ATOM 777 C CB . THR A 0 98 . 9.200 -8.109 -1.561 1.00 58.37 98 A 1 ATOM 778 O O . THR A 0 98 . 10.449 -10.480 -3.347 1.00 58.37 98 A 1 ATOM 779 C CG2 . THR A 0 98 . 9.162 -7.392 -2.906 1.00 58.37 98 A 1 ATOM 780 O OG1 . THR A 0 98 . 8.239 -7.475 -0.756 1.00 58.37 98 A 1 ATOM 781 N N . LYS A 0 99 . 11.090 -10.702 -1.208 1.00 57.50 99 A 1 ATOM 782 C CA . LYS A 0 99 . 12.310 -11.453 -1.538 1.00 57.50 99 A 1 ATOM 783 C C . LYS A 0 99 . 12.011 -12.861 -2.045 1.00 57.50 99 A 1 ATOM 784 C CB . LYS A 0 99 . 13.263 -11.515 -0.338 1.00 57.50 99 A 1 ATOM 785 O O . LYS A 0 99 . 12.742 -13.339 -2.904 1.00 57.50 99 A 1 ATOM 786 C CG . LYS A 0 99 . 14.088 -10.230 -0.205 1.00 57.50 99 A 1 ATOM 787 C CD . LYS A 0 99 . 15.139 -10.389 0.900 1.00 57.50 99 A 1 ATOM 788 C CE . LYS A 0 99 . 16.038 -9.151 0.938 1.00 57.50 99 A 1 ATOM 789 N NZ . LYS A 0 99 . 17.134 -9.304 1.927 1.00 57.50 99 A 1 ATOM 790 N N . THR A 0 100 . 10.985 -13.529 -1.520 1.00 57.05 100 A 1 ATOM 791 C CA . THR A 0 100 . 10.661 -14.905 -1.925 1.00 57.05 100 A 1 ATOM 792 C C . THR A 0 100 . 9.967 -14.961 -3.288 1.00 57.05 100 A 1 ATOM 793 C CB . THR A 0 100 . 9.822 -15.629 -0.859 1.00 57.05 100 A 1 ATOM 794 O O . THR A 0 100 . 10.228 -15.884 -4.053 1.00 57.05 100 A 1 ATOM 795 C CG2 . THR A 0 100 . 9.935 -17.147 -0.986 1.00 57.05 100 A 1 ATOM 796 O OG1 . THR A 0 100 . 10.294 -15.340 0.437 1.00 57.05 100 A 1 ATOM 797 N N . GLU A 0 101 . 9.138 -13.971 -3.632 1.00 53.87 101 A 1 ATOM 798 C CA . GLU A 0 101 . 8.450 -13.944 -4.933 1.00 53.87 101 A 1 ATOM 799 C C . GLU A 0 101 . 9.357 -13.523 -6.098 1.00 53.87 101 A 1 ATOM 800 C CB . GLU A 0 101 . 7.198 -13.059 -4.860 1.00 53.87 101 A 1 ATOM 801 O O . GLU A 0 101 . 9.098 -13.902 -7.241 1.00 53.87 101 A 1 ATOM 802 C CG . GLU A 0 101 . 6.052 -13.775 -4.125 1.00 53.87 101 A 1 ATOM 803 C CD . GLU A 0 101 . 4.746 -12.961 -4.089 1.00 53.87 101 A 1 ATOM 804 O OE1 . GLU A 0 101 . 3.683 -13.572 -3.830 1.00 53.87 101 A 1 ATOM 805 O OE2 . GLU A 0 101 . 4.802 -11.724 -4.272 1.00 53.87 101 A 1 ATOM 806 N N . PHE A 0 102 . 10.466 -12.822 -5.835 1.00 47.48 102 A 1 ATOM 807 C CA . PHE A 0 102 . 11.439 -12.466 -6.870 1.00 47.48 102 A 1 ATOM 808 C C . PHE A 0 102 . 12.412 -13.620 -7.165 1.00 47.48 102 A 1 ATOM 809 C CB . PHE A 0 102 . 12.105 -11.117 -6.557 1.00 47.48 102 A 1 ATOM 810 O O . PHE A 0 102 . 13.632 -13.479 -7.095 1.00 47.48 102 A 1 ATOM 811 C CG . PHE A 0 102 . 12.321 -10.279 -7.804 1.00 47.48 102 A 1 ATOM 812 C CD1 . PHE A 0 102 . 13.499 -10.399 -8.565 1.00 47.48 102 A 1 ATOM 813 C CD2 . PHE A 0 102 . 11.304 -9.401 -8.226 1.00 47.48 102 A 1 ATOM 814 C CE1 . PHE A 0 102 . 13.664 -9.628 -9.732 1.00 47.48 102 A 1 ATOM 815 C CE2 . PHE A 0 102 . 11.469 -8.632 -9.390 1.00 47.48 102 A 1 ATOM 816 C CZ . PHE A 0 102 . 12.652 -8.743 -10.142 1.00 47.48 102 A 1 ATOM 817 N N . ASN A 0 103 . 11.870 -14.796 -7.481 1.00 52.23 103 A 1 ATOM 818 C CA . ASN A 0 103 . 12.661 -15.881 -8.038 1.00 52.23 103 A 1 ATOM 819 C C . ASN A 0 103 . 12.787 -15.657 -9.549 1.00 52.23 103 A 1 ATOM 820 C CB . ASN A 0 103 . 12.055 -17.238 -7.646 1.00 52.23 103 A 1 ATOM 821 O O . ASN A 0 103 . 11.794 -15.659 -10.272 1.00 52.23 103 A 1 ATOM 822 C CG . ASN A 0 103 . 13.046 -18.373 -7.826 1.00 52.23 103 A 1 ATOM 823 N ND2 . ASN A 0 103 . 12.716 -19.557 -7.369 1.00 52.23 103 A 1 ATOM 824 O OD1 . ASN A 0 103 . 14.127 -18.213 -8.370 1.00 52.23 103 A 1 ATOM 825 N N . LEU A 0 104 . 14.012 -15.449 -10.028 1.00 53.30 104 A 1 ATOM 826 C CA . LEU A 0 104 . 14.325 -15.124 -11.426 1.00 53.30 104 A 1 ATOM 827 C C . LEU A 0 104 . 13.773 -16.172 -12.416 1.00 53.30 104 A 1 ATOM 828 C CB . LEU A 0 104 . 15.861 -14.966 -11.513 1.00 53.30 104 A 1 ATOM 829 O O . LEU A 0 104 . 13.455 -15.852 -13.559 1.00 53.30 104 A 1 ATOM 830 C CG . LEU A 0 104 . 16.335 -13.775 -12.371 1.00 53.30 104 A 1 ATOM 831 C CD1 . LEU A 0 104 . 17.456 -13.020 -11.651 1.00 53.30 104 A 1 ATOM 832 C CD2 . LEU A 0 104 . 16.863 -14.238 -13.727 1.00 53.30 104 A 1 ATOM 833 N N . TRP A 0 105 . 13.572 -17.407 -11.945 1.00 52.21 105 A 1 ATOM 834 C CA . TRP A 0 105 . 12.935 -18.497 -12.687 1.00 52.21 105 A 1 ATOM 835 C C . TRP A 0 105 . 11.482 -18.214 -13.089 1.00 52.21 105 A 1 ATOM 836 C CB . TRP A 0 105 . 13.023 -19.765 -11.834 1.00 52.21 105 A 1 ATOM 837 O O . TRP A 0 105 . 11.058 -18.659 -14.155 1.00 52.21 105 A 1 ATOM 838 C CG . TRP A 0 105 . 14.400 -20.346 -11.774 1.00 52.21 105 A 1 ATOM 839 C CD1 . TRP A 0 105 . 15.366 -20.050 -10.874 1.00 52.21 105 A 1 ATOM 840 C CD2 . TRP A 0 105 . 14.997 -21.306 -12.694 1.00 52.21 105 A 1 ATOM 841 C CE2 . TRP A 0 105 . 16.338 -21.558 -12.278 1.00 52.21 105 A 1 ATOM 842 C CE3 . TRP A 0 105 . 14.539 -21.982 -13.845 1.00 52.21 105 A 1 ATOM 843 N NE1 . TRP A 0 105 . 16.509 -20.767 -11.164 1.00 52.21 105 A 1 ATOM 844 C CH2 . TRP A 0 105 . 16.694 -23.107 -14.098 1.00 52.21 105 A 1 ATOM 845 C CZ2 . TRP A 0 105 . 17.183 -22.443 -12.960 1.00 52.21 105 A 1 ATOM 846 C CZ3 . TRP A 0 105 . 15.378 -22.875 -14.538 1.00 52.21 105 A 1 ATOM 847 N N . SER A 0 106 . 10.739 -17.425 -12.307 1.00 51.39 106 A 1 ATOM 848 C CA . SER A 0 106 . 9.369 -17.014 -12.642 1.00 51.39 106 A 1 ATOM 849 C C . SER A 0 106 . 9.316 -16.178 -13.928 1.00 51.39 106 A 1 ATOM 850 C CB . SER A 0 106 . 8.766 -16.198 -11.493 1.00 51.39 106 A 1 ATOM 851 O O . SER A 0 106 . 8.309 -16.196 -14.630 1.00 51.39 106 A 1 ATOM 852 O OG . SER A 0 106 . 8.916 -16.864 -10.250 1.00 51.39 106 A 1 ATOM 853 N N . CYS A 0 107 . 10.403 -15.478 -14.272 1.00 50.73 107 A 1 ATOM 854 C CA . CYS A 0 107 . 10.485 -14.679 -15.495 1.00 50.73 107 A 1 ATOM 855 C C . CYS A 0 107 . 10.796 -15.521 -16.742 1.00 50.73 107 A 1 ATOM 856 C CB . CYS A 0 107 . 11.534 -13.574 -15.306 1.00 50.73 107 A 1 ATOM 857 O O . CYS A 0 107 . 10.426 -15.126 -17.843 1.00 50.73 107 A 1 ATOM 858 S SG . CYS A 0 107 . 11.035 -12.449 -13.968 1.00 50.73 107 A 1 ATOM 859 N N . VAL A 0 108 . 11.449 -16.681 -16.597 1.00 51.71 108 A 1 ATOM 860 C CA . VAL A 0 108 . 11.895 -17.487 -17.751 1.00 51.71 108 A 1 ATOM 861 C C . VAL A 0 108 . 10.741 -18.276 -18.381 1.00 51.71 108 A 1 ATOM 862 C CB . VAL A 0 108 . 13.086 -18.391 -17.366 1.00 51.71 108 A 1 ATOM 863 O O . VAL A 0 108 . 10.738 -18.502 -19.587 1.00 51.71 108 A 1 ATOM 864 C CG1 . VAL A 0 108 . 13.629 -19.182 -18.564 1.00 51.71 108 A 1 ATOM 865 C CG2 . VAL A 0 108 . 14.254 -17.557 -16.813 1.00 51.71 108 A 1 ATOM 866 N N . PHE A 0 109 . 9.711 -18.636 -17.610 1.00 46.94 109 A 1 ATOM 867 C CA . PHE A 0 109 . 8.575 -19.418 -18.119 1.00 46.94 109 A 1 ATOM 868 C C . PHE A 0 109 . 7.452 -18.593 -18.770 1.00 46.94 109 A 1 ATOM 869 C CB . PHE A 0 109 . 8.073 -20.369 -17.025 1.00 46.94 109 A 1 ATOM 870 O O . PHE A 0 109 . 6.486 -19.167 -19.266 1.00 46.94 109 A 1 ATOM 871 C CG . PHE A 0 109 . 8.931 -21.613 -16.917 1.00 46.94 109 A 1 ATOM 872 C CD1 . PHE A 0 109 . 8.749 -22.661 -17.841 1.00 46.94 109 A 1 ATOM 873 C CD2 . PHE A 0 109 . 9.927 -21.718 -15.929 1.00 46.94 109 A 1 ATOM 874 C CE1 . PHE A 0 109 . 9.552 -23.812 -17.773 1.00 46.94 109 A 1 ATOM 875 C CE2 . PHE A 0 109 . 10.728 -22.872 -15.858 1.00 46.94 109 A 1 ATOM 876 C CZ . PHE A 0 109 . 10.541 -23.919 -16.779 1.00 46.94 109 A 1 ATOM 877 N N . LEU A 0 110 . 7.583 -17.264 -18.839 1.00 43.35 110 A 1 ATOM 878 C CA . LEU A 0 110 . 6.641 -16.389 -19.549 1.00 43.35 110 A 1 ATOM 879 C C . LEU A 0 110 . 7.090 -16.061 -20.981 1.00 43.35 110 A 1 ATOM 880 C CB . LEU A 0 110 . 6.328 -15.139 -18.706 1.00 43.35 110 A 1 ATOM 881 O O . LEU A 0 110 . 6.754 -15.001 -21.504 1.00 43.35 110 A 1 ATOM 882 C CG . LEU A 0 110 . 5.490 -15.408 -17.446 1.00 43.35 110 A 1 ATOM 883 C CD1 . LEU A 0 110 . 5.390 -14.112 -16.641 1.00 43.35 110 A 1 ATOM 884 C CD2 . LEU A 0 110 . 4.064 -15.870 -17.770 1.00 43.35 110 A 1 ATOM 885 N N . ILE A 0 111 . 7.800 -16.977 -21.646 1.00 37.89 111 A 1 ATOM 886 C CA . ILE A 0 111 . 7.931 -16.964 -23.109 1.00 37.89 111 A 1 ATOM 887 C C . ILE A 0 111 . 6.896 -17.957 -23.668 1.00 37.89 111 A 1 ATOM 888 C CB . ILE A 0 111 . 9.382 -17.257 -23.571 1.00 37.89 111 A 1 ATOM 889 O O . ILE A 0 111 . 7.235 -19.113 -23.922 1.00 37.89 111 A 1 ATOM 890 C CG1 . ILE A 0 111 . 10.412 -16.360 -22.843 1.00 37.89 111 A 1 ATOM 891 C CG2 . ILE A 0 111 . 9.472 -17.049 -25.098 1.00 37.89 111 A 1 ATOM 892 C CD1 . ILE A 0 111 . 11.873 -16.653 -23.208 1.00 37.89 111 A 1 ATOM 893 N N . PRO A 0 112 . 5.609 -17.583 -23.816 1.00 43.62 112 A 1 ATOM 894 C CA . PRO A 0 112 . 4.664 -18.435 -24.511 1.00 43.62 112 A 1 ATOM 895 C C . PRO A 0 112 . 5.016 -18.431 -26.000 1.00 43.62 112 A 1 ATOM 896 C CB . PRO A 0 112 . 3.275 -17.875 -24.204 1.00 43.62 112 A 1 ATOM 897 O O . PRO A 0 112 . 5.203 -17.376 -26.607 1.00 43.62 112 A 1 ATOM 898 C CG . PRO A 0 112 . 3.528 -16.391 -23.953 1.00 43.62 112 A 1 ATOM 899 C CD . PRO A 0 112 . 4.964 -16.334 -23.438 1.00 43.62 112 A 1 ATOM 900 N N . ASN A 0 113 . 5.095 -19.636 -26.563 1.00 43.98 113 A 1 ATOM 901 C CA . ASN A 0 113 . 5.323 -19.985 -27.968 1.00 43.98 113 A 1 ATOM 902 C C . ASN A 0 113 . 4.282 -19.364 -28.925 1.00 43.98 113 A 1 ATOM 903 C CB . ASN A 0 113 . 5.306 -21.525 -28.056 1.00 43.98 113 A 1 ATOM 904 O O . ASN A 0 113 . 3.484 -20.063 -29.542 1.00 43.98 113 A 1 ATOM 905 C CG . ASN A 0 113 . 6.448 -22.184 -27.312 1.00 43.98 113 A 1 ATOM 906 N ND2 . ASN A 0 113 . 6.193 -23.260 -26.605 1.00 43.98 113 A 1 ATOM 907 O OD1 . ASN A 0 113 . 7.580 -21.746 -27.359 1.00 43.98 113 A 1 ATOM 908 N N . SER A 0 114 . 4.268 -18.039 -29.044 1.00 39.29 114 A 1 ATOM 909 C CA . SER A 0 114 . 3.247 -17.271 -29.756 1.00 39.29 114 A 1 ATOM 910 C C . SER A 0 114 . 3.871 -16.106 -30.525 1.00 39.29 114 A 1 ATOM 911 C CB . SER A 0 114 . 2.168 -16.823 -28.764 1.00 39.29 114 A 1 ATOM 912 O O . SER A 0 114 . 3.409 -14.972 -30.465 1.00 39.29 114 A 1 ATOM 913 O OG . SER A 0 114 . 1.223 -15.976 -29.380 1.00 39.29 114 A 1 ATOM 914 N N . TRP A 0 115 . 4.916 -16.390 -31.292 1.00 34.83 115 A 1 ATOM 915 C CA . TRP A 0 115 . 5.239 -15.585 -32.470 1.00 34.83 115 A 1 ATOM 916 C C . TRP A 0 115 . 5.348 -16.520 -33.665 1.00 34.83 115 A 1 ATOM 917 C CB . TRP A 0 115 . 6.427 -14.652 -32.226 1.00 34.83 115 A 1 ATOM 918 O O . TRP A 0 115 . 6.358 -16.604 -34.355 1.00 34.83 115 A 1 ATOM 919 C CG . TRP A 0 115 . 6.133 -13.558 -31.242 1.00 34.83 115 A 1 ATOM 920 C CD1 . TRP A 0 115 . 6.416 -13.610 -29.921 1.00 34.83 115 A 1 ATOM 921 C CD2 . TRP A 0 115 . 5.463 -12.270 -31.452 1.00 34.83 115 A 1 ATOM 922 C CE2 . TRP A 0 115 . 5.400 -11.587 -30.199 1.00 34.83 115 A 1 ATOM 923 C CE3 . TRP A 0 115 . 4.899 -11.603 -32.563 1.00 34.83 115 A 1 ATOM 924 N NE1 . TRP A 0 115 . 5.985 -12.453 -29.304 1.00 34.83 115 A 1 ATOM 925 C CH2 . TRP A 0 115 . 4.307 -9.669 -31.190 1.00 34.83 115 A 1 ATOM 926 C CZ2 . TRP A 0 115 . 4.836 -10.310 -30.058 1.00 34.83 115 A 1 ATOM 927 C CZ3 . TRP A 0 115 . 4.335 -10.317 -32.438 1.00 34.83 115 A 1 ATOM 928 N N . HIS A 0 116 . 4.248 -17.234 -33.907 1.00 33.31 116 A 1 ATOM 929 C CA . HIS A 0 116 . 3.908 -17.730 -35.231 1.00 33.31 116 A 1 ATOM 930 C C . HIS A 0 116 . 3.567 -16.496 -36.084 1.00 33.31 116 A 1 ATOM 931 C CB . HIS A 0 116 . 2.774 -18.768 -35.103 1.00 33.31 116 A 1 ATOM 932 O O . HIS A 0 116 . 2.406 -16.216 -36.376 1.00 33.31 116 A 1 ATOM 933 C CG . HIS A 0 116 . 2.817 -19.850 -36.151 1.00 33.31 116 A 1 ATOM 934 C CD2 . HIS A 0 116 . 3.340 -21.105 -35.986 1.00 33.31 116 A 1 ATOM 935 N ND1 . HIS A 0 116 . 2.308 -19.789 -37.428 1.00 33.31 116 A 1 ATOM 936 C CE1 . HIS A 0 116 . 2.524 -20.979 -38.017 1.00 33.31 116 A 1 ATOM 937 N NE2 . HIS A 0 116 . 3.152 -21.812 -37.176 1.00 33.31 116 A 1 ATOM 938 N N . ILE A 0 117 . 4.586 -15.696 -36.420 1.00 40.50 117 A 1 ATOM 939 C CA . ILE A 0 117 . 4.480 -14.666 -37.449 1.00 40.50 117 A 1 ATOM 940 C C . ILE A 0 117 . 4.402 -15.441 -38.758 1.00 40.50 117 A 1 ATOM 941 C CB . ILE A 0 117 . 5.629 -13.633 -37.403 1.00 40.50 117 A 1 ATOM 942 O O . ILE A 0 117 . 5.395 -15.738 -39.415 1.00 40.50 117 A 1 ATOM 943 C CG1 . ILE A 0 117 . 5.678 -12.938 -36.026 1.00 40.50 117 A 1 ATOM 944 C CG2 . ILE A 0 117 . 5.415 -12.571 -38.499 1.00 40.50 117 A 1 ATOM 945 C CD1 . ILE A 0 117 . 6.858 -11.974 -35.850 1.00 40.50 117 A 1 ATOM 946 N N . SER A 0 118 . 3.178 -15.839 -39.084 1.00 33.55 118 A 1 ATOM 947 C CA . SER A 0 118 . 2.800 -16.233 -40.423 1.00 33.55 118 A 1 ATOM 948 C C . SER A 0 118 . 2.911 -14.970 -41.276 1.00 33.55 118 A 1 ATOM 949 C CB . SER A 0 118 . 1.388 -16.836 -40.390 1.00 33.55 118 A 1 ATOM 950 O O . SER A 0 118 . 1.966 -14.195 -41.389 1.00 33.55 118 A 1 ATOM 951 O OG . SER A 0 118 . 1.197 -17.743 -41.456 1.00 33.55 118 A 1 ATOM 952 N N . VAL A 0 119 . 4.100 -14.722 -41.829 1.00 37.80 119 A 1 ATOM 953 C CA . VAL A 0 119 . 4.236 -13.866 -43.008 1.00 37.80 119 A 1 ATOM 954 C C . VAL A 0 119 . 3.657 -14.683 -44.159 1.00 37.80 119 A 1 ATOM 955 C CB . VAL A 0 119 . 5.689 -13.409 -43.258 1.00 37.80 119 A 1 ATOM 956 O O . VAL A 0 119 . 4.355 -15.431 -44.838 1.00 37.80 119 A 1 ATOM 957 C CG1 . VAL A 0 119 . 5.751 -12.427 -44.434 1.00 37.80 119 A 1 ATOM 958 C CG2 . VAL A 0 119 . 6.277 -12.698 -42.032 1.00 37.80 119 A 1 ATOM 959 N N . MET A 0 120 . 2.330 -14.649 -44.286 1.00 34.57 120 A 1 ATOM 960 C CA . MET A 0 120 . 1.649 -15.154 -45.465 1.00 34.57 120 A 1 ATOM 961 C C . MET A 0 120 . 1.786 -14.125 -46.585 1.00 34.57 120 A 1 ATOM 962 C CB . MET A 0 120 . 0.167 -15.481 -45.200 1.00 34.57 120 A 1 ATOM 963 O O . MET A 0 120 . 1.138 -13.081 -46.545 1.00 34.57 120 A 1 ATOM 964 C CG . MET A 0 120 . -0.042 -16.909 -44.690 1.00 34.57 120 A 1 ATOM 965 S SD . MET A 0 120 . -1.785 -17.422 -44.664 1.00 34.57 120 A 1 ATOM 966 C CE . MET A 0 120 . -1.626 -19.017 -43.819 1.00 34.57 120 A 1 ATOM 967 N N . ARG A 0 121 . 2.532 -14.568 -47.602 1.00 36.42 121 A 1 ATOM 968 C CA . ARG A 0 121 . 2.554 -14.151 -49.010 1.00 36.42 121 A 1 ATOM 969 C C . ARG A 0 121 . 3.478 -13.009 -49.415 1.00 36.42 121 A 1 ATOM 970 C CB . ARG A 0 121 . 1.133 -14.003 -49.568 1.00 36.42 121 A 1 ATOM 971 O O . ARG A 0 121 . 3.336 -11.889 -48.890 1.00 36.42 121 A 1 ATOM 972 C CG . ARG A 0 121 . 0.998 -14.757 -50.889 1.00 36.42 121 A 1 ATOM 973 C CD . ARG A 0 121 . -0.435 -14.611 -51.402 1.00 36.42 121 A 1 ATOM 974 N NE . ARG A 0 121 . -0.875 -15.811 -52.132 1.00 36.42 121 A 1 ATOM 975 N NH1 . ARG A 0 121 . -3.113 -15.329 -52.100 1.00 36.42 121 A 1 ATOM 976 N NH2 . ARG A 0 121 . -2.413 -17.263 -52.965 1.00 36.42 121 A 1 ATOM 977 C CZ . ARG A 0 121 . -2.126 -16.128 -52.396 1.00 36.42 121 A 1 ATOM 978 O OXT . ARG A 0 121 . 4.272 -13.325 -50.323 1.00 36.42 121 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 54.70 # loop_ _atom_type.symbol C N O S #