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 LYS 0 3 LEU 0 4 GLU 0 5 VAL 0 6 CYS 0 7 SER 0 8 TYR 0 9 SER 0 10 GLY 0 11 PHE 0 12 LYS 0 13 VAL 0 14 TYR 0 15 PRO 0 16 GLY 0 17 HIS 0 18 GLY 0 19 LYS 0 20 ARG 0 21 ALA 0 22 ILE 0 23 ARG 0 24 ILE 0 25 ASP 0 26 GLY 0 27 ARG 0 28 GLY 0 29 PHE 0 30 TYR 0 31 PHE 0 32 ILE 0 33 ASN 0 34 LYS 0 35 LYS 0 36 CYS 0 37 GLU 0 38 ARG 0 39 SER 0 40 HIS 0 41 PHE 0 42 LEU 0 43 LYS 0 44 ARG 0 45 ASN 0 46 PRO 0 47 ARG 0 48 GLU 0 49 ILE 0 50 SER 0 51 TRP 0 52 THR 0 53 VAL 0 54 LEU 0 55 TYR 0 56 ARG 0 57 ARG 0 58 LYS 0 59 TYR 0 60 LYS 0 61 LYS 0 62 GLY 0 63 ILE 0 64 SER 0 65 GLU 0 66 GLU 0 67 LEU 0 68 VAL 0 69 LYS 0 70 LYS 0 71 ARG 0 72 THR 0 73 LYS 0 74 ARG 0 75 VAL 0 76 THR 0 77 LYS 0 78 SER 0 79 ALA 0 80 ARG 0 81 GLY 0 82 ILE 0 83 ALA 0 84 GLY 0 85 ALA 0 86 SER 0 87 LEU 0 88 ALA 0 89 GLU 0 90 ILE 0 91 MET 0 92 ALA 0 93 LYS 0 94 ARG 0 95 ASN 0 96 GLN 0 97 LYS 0 98 PRO 0 99 GLU 0 100 VAL 0 101 ARG 0 102 LYS 0 103 ALA 0 104 MET 0 105 ARG 0 106 ASP 0 107 GLN 0 108 ALA 0 109 ILE 0 110 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 . 14.194 17.960 5.741 1.00 81.10 1 A 1 ATOM 2 C CA . MET A 0 1 . 14.046 17.715 4.286 1.00 81.10 1 A 1 ATOM 3 C C . MET A 0 1 . 13.011 16.614 4.069 1.00 81.10 1 A 1 ATOM 4 C CB . MET A 0 1 . 15.405 17.312 3.698 1.00 81.10 1 A 1 ATOM 5 O O . MET A 0 1 . 13.149 15.561 4.678 1.00 81.10 1 A 1 ATOM 6 C CG . MET A 0 1 . 15.634 17.855 2.296 1.00 81.10 1 A 1 ATOM 7 S SD . MET A 0 1 . 17.289 17.379 1.729 1.00 81.10 1 A 1 ATOM 8 C CE . MET A 0 1 . 17.669 18.760 0.623 1.00 81.10 1 A 1 ATOM 9 N N . LYS A 0 2 . 11.945 16.846 3.291 1.00 87.69 2 A 1 ATOM 10 C CA . LYS A 0 2 . 10.869 15.856 3.087 1.00 87.69 2 A 1 ATOM 11 C C . LYS A 0 2 . 11.224 14.929 1.921 1.00 87.69 2 A 1 ATOM 12 C CB . LYS A 0 2 . 9.536 16.596 2.866 1.00 87.69 2 A 1 ATOM 13 O O . LYS A 0 2 . 11.535 15.417 0.841 1.00 87.69 2 A 1 ATOM 14 C CG . LYS A 0 2 . 8.310 15.667 2.784 1.00 87.69 2 A 1 ATOM 15 C CD . LYS A 0 2 . 7.025 16.502 2.664 1.00 87.69 2 A 1 ATOM 16 C CE . LYS A 0 2 . 5.772 15.620 2.586 1.00 87.69 2 A 1 ATOM 17 N NZ . LYS A 0 2 . 4.536 16.445 2.529 1.00 87.69 2 A 1 ATOM 18 N N . LEU A 0 3 . 11.166 13.614 2.134 1.00 91.87 3 A 1 ATOM 19 C CA . LEU A 0 3 . 11.306 12.634 1.052 1.00 91.87 3 A 1 ATOM 20 C C . LEU A 0 3 . 9.981 12.508 0.307 1.00 91.87 3 A 1 ATOM 21 C CB . LEU A 0 3 . 11.765 11.265 1.591 1.00 91.87 3 A 1 ATOM 22 O O . LEU A 0 3 . 8.941 12.249 0.919 1.00 91.87 3 A 1 ATOM 23 C CG . LEU A 0 3 . 13.163 11.268 2.232 1.00 91.87 3 A 1 ATOM 24 C CD1 . LEU A 0 3 . 13.461 9.904 2.853 1.00 91.87 3 A 1 ATOM 25 C CD2 . LEU A 0 3 . 14.261 11.566 1.219 1.00 91.87 3 A 1 ATOM 26 N N . GLU A 0 4 . 10.026 12.664 -1.010 1.00 93.48 4 A 1 ATOM 27 C CA . GLU A 0 4 . 8.866 12.427 -1.862 1.00 93.48 4 A 1 ATOM 28 C C . GLU A 0 4 . 8.785 10.958 -2.258 1.00 93.48 4 A 1 ATOM 29 C CB . GLU A 0 4 . 8.858 13.374 -3.067 1.00 93.48 4 A 1 ATOM 30 O O . GLU A 0 4 . 9.741 10.196 -2.128 1.00 93.48 4 A 1 ATOM 31 C CG . GLU A 0 4 . 8.678 14.810 -2.561 1.00 93.48 4 A 1 ATOM 32 C CD . GLU A 0 4 . 8.313 15.827 -3.641 1.00 93.48 4 A 1 ATOM 33 O OE1 . GLU A 0 4 . 8.419 17.032 -3.324 1.00 93.48 4 A 1 ATOM 34 O OE2 . GLU A 0 4 . 7.803 15.455 -4.726 1.00 93.48 4 A 1 ATOM 35 N N . VAL A 0 5 . 7.616 10.531 -2.720 1.00 95.73 5 A 1 ATOM 36 C CA . VAL A 0 5 . 7.401 9.161 -3.182 1.00 95.73 5 A 1 ATOM 37 C C . VAL A 0 5 . 7.143 9.201 -4.676 1.00 95.73 5 A 1 ATOM 38 C CB . VAL A 0 5 . 6.272 8.470 -2.400 1.00 95.73 5 A 1 ATOM 39 O O . VAL A 0 5 . 6.316 9.975 -5.151 1.00 95.73 5 A 1 ATOM 40 C CG1 . VAL A 0 5 . 6.051 7.037 -2.900 1.00 95.73 5 A 1 ATOM 41 C CG2 . VAL A 0 5 . 6.612 8.389 -0.905 1.00 95.73 5 A 1 ATOM 42 N N . CYS A 0 6 . 7.840 8.346 -5.419 1.00 96.49 6 A 1 ATOM 43 C CA . CYS A 0 6 . 7.618 8.189 -6.844 1.00 96.49 6 A 1 ATOM 44 C C . CYS A 0 6 . 6.187 7.702 -7.096 1.00 96.49 6 A 1 ATOM 45 C CB . CYS A 0 6 . 8.654 7.210 -7.399 1.00 96.49 6 A 1 ATOM 46 O O . CYS A 0 6 . 5.805 6.619 -6.643 1.00 96.49 6 A 1 ATOM 47 S SG . CYS A 0 6 . 8.377 6.929 -9.176 1.00 96.49 6 A 1 ATOM 48 N N . SER A 0 7 . 5.420 8.460 -7.873 1.00 96.07 7 A 1 ATOM 49 C CA . SER A 0 7 . 4.016 8.186 -8.184 1.00 96.07 7 A 1 ATOM 50 C C . SER A 0 7 . 3.809 6.880 -8.956 1.00 96.07 7 A 1 ATOM 51 C CB . SER A 0 7 . 3.443 9.346 -9.005 1.00 96.07 7 A 1 ATOM 52 O O . SER A 0 7 . 2.723 6.312 -8.913 1.00 96.07 7 A 1 ATOM 53 O OG . SER A 0 7 . 3.663 10.588 -8.362 1.00 96.07 7 A 1 ATOM 54 N N . TYR A 0 8 . 4.839 6.388 -9.653 1.00 96.78 8 A 1 ATOM 55 C CA . TYR A 0 8 . 4.775 5.134 -10.408 1.00 96.78 8 A 1 ATOM 56 C C . TYR A 0 8 . 5.294 3.935 -9.605 1.00 96.78 8 A 1 ATOM 57 C CB . TYR A 0 8 . 5.541 5.305 -11.724 1.00 96.78 8 A 1 ATOM 58 O O . TYR A 0 8 . 4.594 2.940 -9.427 1.00 96.78 8 A 1 ATOM 59 C CG . TYR A 0 8 . 5.377 4.132 -12.664 1.00 96.78 8 A 1 ATOM 60 C CD1 . TYR A 0 8 . 6.299 3.066 -12.647 1.00 96.78 8 A 1 ATOM 61 C CD2 . TYR A 0 8 . 4.266 4.096 -13.525 1.00 96.78 8 A 1 ATOM 62 C CE1 . TYR A 0 8 . 6.086 1.943 -13.470 1.00 96.78 8 A 1 ATOM 63 C CE2 . TYR A 0 8 . 4.059 2.986 -14.358 1.00 96.78 8 A 1 ATOM 64 O OH . TYR A 0 8 . 4.730 0.833 -15.110 1.00 96.78 8 A 1 ATOM 65 C CZ . TYR A 0 8 . 4.954 1.903 -14.314 1.00 96.78 8 A 1 ATOM 66 N N . SER A 0 9 . 6.537 4.005 -9.118 1.00 96.31 9 A 1 ATOM 67 C CA . SER A 0 9 . 7.199 2.859 -8.484 1.00 96.31 9 A 1 ATOM 68 C C . SER A 0 9 . 6.877 2.700 -6.999 1.00 96.31 9 A 1 ATOM 69 C CB . SER A 0 9 . 8.711 2.938 -8.687 1.00 96.31 9 A 1 ATOM 70 O O . SER A 0 9 . 6.958 1.586 -6.484 1.00 96.31 9 A 1 ATOM 71 O OG . SER A 0 9 . 9.251 4.111 -8.104 1.00 96.31 9 A 1 ATOM 72 N N . GLY A 0 10 . 6.512 3.787 -6.313 1.00 95.65 10 A 1 ATOM 73 C CA . GLY A 0 10 . 6.321 3.826 -4.862 1.00 95.65 10 A 1 ATOM 74 C C . GLY A 0 10 . 7.619 3.904 -4.048 1.00 95.65 10 A 1 ATOM 75 O O . GLY A 0 10 . 7.563 3.814 -2.823 1.00 95.65 10 A 1 ATOM 76 N N . PHE A 0 11 . 8.779 4.062 -4.695 1.00 96.14 11 A 1 ATOM 77 C CA . PHE A 0 11 . 10.053 4.277 -4.001 1.00 96.14 11 A 1 ATOM 78 C C . PHE A 0 11 . 10.185 5.710 -3.490 1.00 96.14 11 A 1 ATOM 79 C CB . PHE A 0 11 . 11.241 3.906 -4.901 1.00 96.14 11 A 1 ATOM 80 O O . PHE A 0 11 . 9.643 6.641 -4.087 1.00 96.14 11 A 1 ATOM 81 C CG . PHE A 0 11 . 11.345 2.420 -5.177 1.00 96.14 11 A 1 ATOM 82 C CD1 . PHE A 0 11 . 11.518 1.515 -4.111 1.00 96.14 11 A 1 ATOM 83 C CD2 . PHE A 0 11 . 11.287 1.932 -6.494 1.00 96.14 11 A 1 ATOM 84 C CE1 . PHE A 0 11 . 11.586 0.134 -4.359 1.00 96.14 11 A 1 ATOM 85 C CE2 . PHE A 0 11 . 11.344 0.551 -6.739 1.00 96.14 11 A 1 ATOM 86 C CZ . PHE A 0 11 . 11.483 -0.350 -5.673 1.00 96.14 11 A 1 ATOM 87 N N . LYS A 0 12 . 10.931 5.882 -2.397 1.00 95.83 12 A 1 ATOM 88 C CA . LYS A 0 12 . 11.294 7.203 -1.877 1.00 95.83 12 A 1 ATOM 89 C C . LYS A 0 12 . 12.293 7.864 -2.828 1.00 95.83 12 A 1 ATOM 90 C CB . LYS A 0 12 . 11.869 7.090 -0.458 1.00 95.83 12 A 1 ATOM 91 O O . LYS A 0 12 . 13.221 7.208 -3.294 1.00 95.83 12 A 1 ATOM 92 C CG . LYS A 0 12 . 10.854 6.534 0.557 1.00 95.83 12 A 1 ATOM 93 C CD . LYS A 0 12 . 11.484 6.461 1.955 1.00 95.83 12 A 1 ATOM 94 C CE . LYS A 0 12 . 10.513 5.870 2.985 1.00 95.83 12 A 1 ATOM 95 N NZ . LYS A 0 12 . 11.143 5.778 4.330 1.00 95.83 12 A 1 ATOM 96 N N . VAL A 0 13 . 12.090 9.142 -3.112 1.00 95.56 13 A 1 ATOM 97 C CA . VAL A 0 13 . 12.960 9.965 -3.949 1.00 95.56 13 A 1 ATOM 98 C C . VAL A 0 13 . 13.674 10.957 -3.046 1.00 95.56 13 A 1 ATOM 99 C CB . VAL A 0 13 . 12.183 10.677 -5.067 1.00 95.56 13 A 1 ATOM 100 O O . VAL A 0 13 . 13.037 11.716 -2.310 1.00 95.56 13 A 1 ATOM 101 C CG1 . VAL A 0 13 . 13.164 11.346 -6.038 1.00 95.56 13 A 1 ATOM 102 C CG2 . VAL A 0 13 . 11.325 9.693 -5.871 1.00 95.56 13 A 1 ATOM 103 N N . TYR A 0 14 . 15.001 10.899 -3.078 1.00 94.11 14 A 1 ATOM 104 C CA . TYR A 0 14 . 15.848 11.814 -2.333 1.00 94.11 14 A 1 ATOM 105 C C . TYR A 0 14 . 15.976 13.148 -3.074 1.00 94.11 14 A 1 ATOM 106 C CB . TYR A 0 14 . 17.216 11.183 -2.059 1.00 94.11 14 A 1 ATOM 107 O O . TYR A 0 14 . 15.926 13.178 -4.305 1.00 94.11 14 A 1 ATOM 108 C CG . TYR A 0 14 . 17.149 10.092 -1.009 1.00 94.11 14 A 1 ATOM 109 C CD1 . TYR A 0 14 . 17.327 10.416 0.350 1.00 94.11 14 A 1 ATOM 110 C CD2 . TYR A 0 14 . 16.888 8.761 -1.387 1.00 94.11 14 A 1 ATOM 111 C CE1 . TYR A 0 14 . 17.242 9.413 1.334 1.00 94.11 14 A 1 ATOM 112 C CE2 . TYR A 0 14 . 16.793 7.757 -0.406 1.00 94.11 14 A 1 ATOM 113 O OH . TYR A 0 14 . 16.883 7.105 1.897 1.00 94.11 14 A 1 ATOM 114 C CZ . TYR A 0 14 . 16.973 8.080 0.955 1.00 94.11 14 A 1 ATOM 115 N N . PRO A 0 15 . 16.166 14.254 -2.347 1.00 93.44 15 A 1 ATOM 116 C CA . PRO A 0 15 . 16.432 15.552 -2.952 1.00 93.44 15 A 1 ATOM 117 C C . PRO A 0 15 . 17.657 15.503 -3.873 1.00 93.44 15 A 1 ATOM 118 C CB . PRO A 0 15 . 16.553 16.522 -1.776 1.00 93.44 15 A 1 ATOM 119 O O . PRO A 0 15 . 18.581 14.721 -3.654 1.00 93.44 15 A 1 ATOM 120 C CG . PRO A 0 15 . 15.575 15.859 -0.803 1.00 93.44 15 A 1 ATOM 121 C CD . PRO A 0 15 . 15.951 14.402 -0.927 1.00 93.44 15 A 1 ATOM 122 N N . GLY A 0 16 . 17.612 16.275 -4.959 1.00 92.26 16 A 1 ATOM 123 C CA . GLY A 0 16 . 18.590 16.199 -6.053 1.00 92.26 16 A 1 ATOM 124 C C . GLY A 0 16 . 18.328 15.085 -7.076 1.00 92.26 16 A 1 ATOM 125 O O . GLY A 0 16 . 19.024 15.022 -8.082 1.00 92.26 16 A 1 ATOM 126 N N . HIS A 0 17 . 17.317 14.235 -6.864 1.00 93.58 17 A 1 ATOM 127 C CA . HIS A 0 17 . 16.953 13.165 -7.792 1.00 93.58 17 A 1 ATOM 128 C C . HIS A 0 17 . 15.517 13.300 -8.295 1.00 93.58 17 A 1 ATOM 129 C CB . HIS A 0 17 . 17.162 11.791 -7.139 1.00 93.58 17 A 1 ATOM 130 O O . HIS A 0 17 . 14.647 13.879 -7.646 1.00 93.58 17 A 1 ATOM 131 C CG . HIS A 0 17 . 18.586 11.528 -6.735 1.00 93.58 17 A 1 ATOM 132 C CD2 . HIS A 0 17 . 19.479 10.732 -7.398 1.00 93.58 17 A 1 ATOM 133 N ND1 . HIS A 0 17 . 19.241 12.059 -5.644 1.00 93.58 17 A 1 ATOM 134 C CE1 . HIS A 0 17 . 20.501 11.593 -5.658 1.00 93.58 17 A 1 ATOM 135 N NE2 . HIS A 0 17 . 20.683 10.763 -6.696 1.00 93.58 17 A 1 ATOM 136 N N . GLY A 0 18 . 15.256 12.665 -9.435 1.00 93.76 18 A 1 ATOM 137 C CA . GLY A 0 18 . 13.923 12.566 -10.007 1.00 93.76 18 A 1 ATOM 138 C C . GLY A 0 18 . 13.448 13.826 -10.727 1.00 93.76 18 A 1 ATOM 139 O O . GLY A 0 18 . 14.193 14.774 -10.955 1.00 93.76 18 A 1 ATOM 140 N N . LYS A 0 19 . 12.184 13.795 -11.147 1.00 94.62 19 A 1 ATOM 141 C CA . LYS A 0 19 . 11.535 14.854 -11.923 1.00 94.62 19 A 1 ATOM 142 C C . LYS A 0 19 . 10.061 14.948 -11.553 1.00 94.62 19 A 1 ATOM 143 C CB . LYS A 0 19 . 11.734 14.559 -13.418 1.00 94.62 19 A 1 ATOM 144 O O . LYS A 0 19 . 9.394 13.926 -11.382 1.00 94.62 19 A 1 ATOM 145 C CG . LYS A 0 19 . 11.191 15.658 -14.346 1.00 94.62 19 A 1 ATOM 146 C CD . LYS A 0 19 . 11.461 15.267 -15.802 1.00 94.62 19 A 1 ATOM 147 C CE . LYS A 0 19 . 10.835 16.258 -16.786 1.00 94.62 19 A 1 ATOM 148 N NZ . LYS A 0 19 . 10.762 15.644 -18.135 1.00 94.62 19 A 1 ATOM 149 N N . ARG A 0 20 . 9.542 16.174 -11.482 1.00 94.99 20 A 1 ATOM 150 C CA . ARG A 0 20 . 8.110 16.444 -11.339 1.00 94.99 20 A 1 ATOM 151 C C . ARG A 0 20 . 7.496 16.709 -12.710 1.00 94.99 20 A 1 ATOM 152 C CB . ARG A 0 20 . 7.901 17.609 -10.361 1.00 94.99 20 A 1 ATOM 153 O O . ARG A 0 20 . 7.979 17.569 -13.437 1.00 94.99 20 A 1 ATOM 154 C CG . ARG A 0 20 . 6.419 17.791 -10.000 1.00 94.99 20 A 1 ATOM 155 C CD . ARG A 0 20 . 6.245 18.763 -8.828 1.00 94.99 20 A 1 ATOM 156 N NE . ARG A 0 20 . 6.601 18.132 -7.544 1.00 94.99 20 A 1 ATOM 157 N NH1 . ARG A 0 20 . 6.944 20.032 -6.276 1.00 94.99 20 A 1 ATOM 158 N NH2 . ARG A 0 20 . 7.113 18.011 -5.372 1.00 94.99 20 A 1 ATOM 159 C CZ . ARG A 0 20 . 6.886 18.737 -6.410 1.00 94.99 20 A 1 ATOM 160 N N . ALA A 0 21 . 6.437 15.986 -13.047 1.00 94.51 21 A 1 ATOM 161 C CA . ALA A 0 21 . 5.600 16.257 -14.208 1.00 94.51 21 A 1 ATOM 162 C C . ALA A 0 21 . 4.241 16.760 -13.721 1.00 94.51 21 A 1 ATOM 163 C CB . ALA A 0 21 . 5.477 14.984 -15.050 1.00 94.51 21 A 1 ATOM 164 O O . ALA A 0 21 . 3.588 16.093 -12.919 1.00 94.51 21 A 1 ATOM 165 N N . ILE A 0 22 . 3.823 17.932 -14.188 1.00 95.10 22 A 1 ATOM 166 C CA . ILE A 0 22 . 2.520 18.515 -13.863 1.00 95.10 22 A 1 ATOM 167 C C . ILE A 0 22 . 1.648 18.374 -15.104 1.00 95.10 22 A 1 ATOM 168 C CB . ILE A 0 22 . 2.659 19.975 -13.381 1.00 95.10 22 A 1 ATOM 169 O O . ILE A 0 22 . 2.050 18.761 -16.200 1.00 95.10 22 A 1 ATOM 170 C CG1 . ILE A 0 22 . 3.581 20.042 -12.139 1.00 95.10 22 A 1 ATOM 171 C CG2 . ILE A 0 22 . 1.270 20.558 -13.063 1.00 95.10 22 A 1 ATOM 172 C CD1 . ILE A 0 22 . 3.924 21.467 -11.691 1.00 95.10 22 A 1 ATOM 173 N N . ARG A 0 23 . 0.479 17.762 -14.942 1.00 92.82 23 A 1 ATOM 174 C CA . ARG A 0 23 . -0.512 17.637 -16.008 1.00 92.82 23 A 1 ATOM 175 C C . ARG A 0 23 . -1.401 18.887 -16.042 1.00 92.82 23 A 1 ATOM 176 C CB . ARG A 0 23 . -1.250 16.308 -15.791 1.00 92.82 23 A 1 ATOM 177 O O . ARG A 0 23 . -1.504 19.612 -15.059 1.00 92.82 23 A 1 ATOM 178 C CG . ARG A 0 23 . -2.315 16.014 -16.854 1.00 92.82 23 A 1 ATOM 179 C CD . ARG A 0 23 . -2.990 14.670 -16.594 1.00 92.82 23 A 1 ATOM 180 N NE . ARG A 0 23 . -3.995 14.388 -17.636 1.00 92.82 23 A 1 ATOM 181 N NH1 . ARG A 0 23 . -5.606 13.440 -16.298 1.00 92.82 23 A 1 ATOM 182 N NH2 . ARG A 0 23 . -5.908 13.514 -18.500 1.00 92.82 23 A 1 ATOM 183 C CZ . ARG A 0 23 . -5.154 13.778 -17.469 1.00 92.82 23 A 1 ATOM 184 N N . ILE A 0 24 . -2.064 19.118 -17.175 1.00 95.22 24 A 1 ATOM 185 C CA . ILE A 0 24 . -2.967 20.260 -17.399 1.00 95.22 24 A 1 ATOM 186 C C . ILE A 0 24 . -4.138 20.343 -16.400 1.00 95.22 24 A 1 ATOM 187 C CB . ILE A 0 24 . -3.462 20.215 -18.864 1.00 95.22 24 A 1 ATOM 188 O O . ILE A 0 24 . -4.662 21.419 -16.158 1.00 95.22 24 A 1 ATOM 189 C CG1 . ILE A 0 24 . -3.898 21.613 -19.346 1.00 95.22 24 A 1 ATOM 190 C CG2 . ILE A 0 24 . -4.574 19.165 -19.071 1.00 95.22 24 A 1 ATOM 191 C CD1 . ILE A 0 24 . -4.024 21.709 -20.872 1.00 95.22 24 A 1 ATOM 192 N N . ASP A 0 25 . -4.519 19.223 -15.778 1.00 95.39 25 A 1 ATOM 193 C CA . ASP A 0 25 . -5.553 19.139 -14.735 1.00 95.39 25 A 1 ATOM 194 C C . ASP A 0 25 . -5.036 19.521 -13.332 1.00 95.39 25 A 1 ATOM 195 C CB . ASP A 0 25 . -6.188 17.728 -14.757 1.00 95.39 25 A 1 ATOM 196 O O . ASP A 0 25 . -5.715 19.284 -12.334 1.00 95.39 25 A 1 ATOM 197 C CG . ASP A 0 25 . -5.220 16.579 -14.435 1.00 95.39 25 A 1 ATOM 198 O OD1 . ASP A 0 25 . -3.999 16.818 -14.334 1.00 95.39 25 A 1 ATOM 199 O OD2 . ASP A 0 25 . -5.655 15.399 -14.381 1.00 95.39 25 A 1 ATOM 200 N N . GLY A 0 26 . -3.811 20.048 -13.231 1.00 93.67 26 A 1 ATOM 201 C CA . GLY A 0 26 . -3.167 20.424 -11.972 1.00 93.67 26 A 1 ATOM 202 C C . GLY A 0 26 . -2.588 19.246 -11.182 1.00 93.67 26 A 1 ATOM 203 O O . GLY A 0 26 . -2.025 19.441 -10.103 1.00 93.67 26 A 1 ATOM 204 N N . ARG A 0 27 . -2.678 18.008 -11.689 1.00 93.72 27 A 1 ATOM 205 C CA . ARG A 0 27 . -2.124 16.839 -10.993 1.00 93.72 27 A 1 ATOM 206 C C . ARG A 0 27 . -0.610 16.769 -11.177 1.00 93.72 27 A 1 ATOM 207 C CB . ARG A 0 27 . -2.822 15.550 -11.438 1.00 93.72 27 A 1 ATOM 208 O O . ARG A 0 27 . -0.111 16.627 -12.293 1.00 93.72 27 A 1 ATOM 209 C CG . ARG A 0 27 . -4.312 15.569 -11.067 1.00 93.72 27 A 1 ATOM 210 C CD . ARG A 0 27 . -4.964 14.236 -11.435 1.00 93.72 27 A 1 ATOM 211 N NE . ARG A 0 27 . -6.411 14.266 -11.162 1.00 93.72 27 A 1 ATOM 212 N NH1 . ARG A 0 27 . -6.897 12.146 -11.882 1.00 93.72 27 A 1 ATOM 213 N NH2 . ARG A 0 27 . -8.534 13.448 -11.095 1.00 93.72 27 A 1 ATOM 214 C CZ . ARG A 0 27 . -7.272 13.291 -11.381 1.00 93.72 27 A 1 ATOM 215 N N . GLY A 0 28 . 0.118 16.832 -10.064 1.00 93.87 28 A 1 ATOM 216 C CA . GLY A 0 28 . 1.567 16.641 -10.020 1.00 93.87 28 A 1 ATOM 217 C C . GLY A 0 28 . 1.951 15.179 -9.789 1.00 93.87 28 A 1 ATOM 218 O O . GLY A 0 28 . 1.543 14.571 -8.801 1.00 93.87 28 A 1 ATOM 219 N N . PHE A 0 29 . 2.784 14.630 -10.669 1.00 95.23 29 A 1 ATOM 220 C CA . PHE A 0 29 . 3.404 13.315 -10.528 1.00 95.23 29 A 1 ATOM 221 C C . PHE A 0 29 . 4.905 13.470 -10.305 1.00 95.23 29 A 1 ATOM 222 C CB . PHE A 0 29 . 3.115 12.453 -11.762 1.00 95.23 29 A 1 ATOM 223 O O . PHE A 0 29 . 5.562 14.263 -10.979 1.00 95.23 29 A 1 ATOM 224 C CG . PHE A 0 29 . 1.638 12.236 -12.019 1.00 95.23 29 A 1 ATOM 225 C CD1 . PHE A 0 29 . 0.931 11.263 -11.290 1.00 95.23 29 A 1 ATOM 226 C CD2 . PHE A 0 29 . 0.960 13.037 -12.955 1.00 95.23 29 A 1 ATOM 227 C CE1 . PHE A 0 29 . -0.446 11.076 -11.507 1.00 95.23 29 A 1 ATOM 228 C CE2 . PHE A 0 29 . -0.417 12.855 -13.170 1.00 95.23 29 A 1 ATOM 229 C CZ . PHE A 0 29 . -1.118 11.872 -12.452 1.00 95.23 29 A 1 ATOM 230 N N . TYR A 0 30 . 5.462 12.700 -9.374 1.00 95.91 30 A 1 ATOM 231 C CA . TYR A 0 30 . 6.896 12.687 -9.104 1.00 95.91 30 A 1 ATOM 232 C C . TYR A 0 30 . 7.497 11.364 -9.566 1.00 95.91 30 A 1 ATOM 233 C CB . TYR A 0 30 . 7.158 12.984 -7.621 1.00 95.91 30 A 1 ATOM 234 O O . TYR A 0 30 . 6.994 10.294 -9.223 1.00 95.91 30 A 1 ATOM 235 C CG . TYR A 0 30 . 8.499 13.641 -7.376 1.00 95.91 30 A 1 ATOM 236 C CD1 . TYR A 0 30 . 9.477 13.016 -6.582 1.00 95.91 30 A 1 ATOM 237 C CD2 . TYR A 0 30 . 8.742 14.923 -7.909 1.00 95.91 30 A 1 ATOM 238 C CE1 . TYR A 0 30 . 10.681 13.694 -6.310 1.00 95.91 30 A 1 ATOM 239 C CE2 . TYR A 0 30 . 9.960 15.585 -7.661 1.00 95.91 30 A 1 ATOM 240 O OH . TYR A 0 30 . 12.104 15.583 -6.563 1.00 95.91 30 A 1 ATOM 241 C CZ . TYR A 0 30 . 10.931 14.966 -6.851 1.00 95.91 30 A 1 ATOM 242 N N . PHE A 0 31 . 8.568 11.411 -10.350 1.00 97.13 31 A 1 ATOM 243 C CA . PHE A 0 31 . 9.228 10.225 -10.887 1.00 97.13 31 A 1 ATOM 244 C C . PHE A 0 31 . 10.668 10.150 -10.408 1.00 97.13 31 A 1 ATOM 245 C CB . PHE A 0 31 . 9.147 10.210 -12.418 1.00 97.13 31 A 1 ATOM 246 O O . PHE A 0 31 . 11.411 11.113 -10.527 1.00 97.13 31 A 1 ATOM 247 C CG . PHE A 0 31 . 7.731 10.210 -12.955 1.00 97.13 31 A 1 ATOM 248 C CD1 . PHE A 0 31 . 6.849 9.160 -12.631 1.00 97.13 31 A 1 ATOM 249 C CD2 . PHE A 0 31 . 7.285 11.278 -13.755 1.00 97.13 31 A 1 ATOM 250 C CE1 . PHE A 0 31 . 5.516 9.198 -13.076 1.00 97.13 31 A 1 ATOM 251 C CE2 . PHE A 0 31 . 5.960 11.302 -14.216 1.00 97.13 31 A 1 ATOM 252 C CZ . PHE A 0 31 . 5.073 10.278 -13.855 1.00 97.13 31 A 1 ATOM 253 N N . ILE A 0 32 . 11.083 8.978 -9.923 1.00 96.54 32 A 1 ATOM 254 C CA . ILE A 0 32 . 12.473 8.726 -9.506 1.00 96.54 32 A 1 ATOM 255 C C . ILE A 0 32 . 13.455 8.742 -10.687 1.00 96.54 32 A 1 ATOM 256 C CB . ILE A 0 32 . 12.551 7.400 -8.711 1.00 96.54 32 A 1 ATOM 257 O O . ILE A 0 32 . 14.596 9.159 -10.536 1.00 96.54 32 A 1 ATOM 258 C CG1 . ILE A 0 32 . 13.960 7.181 -8.125 1.00 96.54 32 A 1 ATOM 259 C CG2 . ILE A 0 32 . 12.113 6.178 -9.538 1.00 96.54 32 A 1 ATOM 260 C CD1 . ILE A 0 32 . 13.994 6.160 -6.981 1.00 96.54 32 A 1 ATOM 261 N N . ASN A 0 33 . 13.029 8.265 -11.861 1.00 95.34 33 A 1 ATOM 262 C CA . ASN A 0 33 . 13.863 8.147 -13.056 1.00 95.34 33 A 1 ATOM 263 C C . ASN A 0 33 . 13.018 8.087 -14.342 1.00 95.34 33 A 1 ATOM 264 C CB . ASN A 0 33 . 14.776 6.907 -12.908 1.00 95.34 33 A 1 ATOM 265 O O . ASN A 0 33 . 11.796 7.897 -14.304 1.00 95.34 33 A 1 ATOM 266 C CG . ASN A 0 33 . 14.050 5.577 -12.767 1.00 95.34 33 A 1 ATOM 267 N ND2 . ASN A 0 33 . 14.682 4.613 -12.142 1.00 95.34 33 A 1 ATOM 268 O OD1 . ASN A 0 33 . 12.931 5.369 -13.218 1.00 95.34 33 A 1 ATOM 269 N N . LYS A 0 34 . 13.699 8.157 -15.493 1.00 96.22 34 A 1 ATOM 270 C CA . LYS A 0 34 . 13.093 8.102 -16.836 1.00 96.22 34 A 1 ATOM 271 C C . LYS A 0 34 . 12.308 6.809 -17.105 1.00 96.22 34 A 1 ATOM 272 C CB . LYS A 0 34 . 14.209 8.323 -17.875 1.00 96.22 34 A 1 ATOM 273 O O . LYS A 0 34 . 11.331 6.828 -17.847 1.00 96.22 34 A 1 ATOM 274 C CG . LYS A 0 34 . 13.683 8.569 -19.302 1.00 96.22 34 A 1 ATOM 275 C CD . LYS A 0 34 . 14.836 8.928 -20.256 1.00 96.22 34 A 1 ATOM 276 C CE . LYS A 0 34 . 14.323 9.245 -21.669 1.00 96.22 34 A 1 ATOM 277 N NZ . LYS A 0 34 . 15.423 9.662 -22.583 1.00 96.22 34 A 1 ATOM 278 N N . LYS A 0 35 . 12.681 5.678 -16.484 1.00 96.59 35 A 1 ATOM 279 C CA . LYS A 0 35 . 11.945 4.399 -16.604 1.00 96.59 35 A 1 ATOM 280 C C . LYS A 0 35 . 10.518 4.528 -16.065 1.00 96.59 35 A 1 ATOM 281 C CB . LYS A 0 35 . 12.728 3.278 -15.888 1.00 96.59 35 A 1 ATOM 282 O O . LYS A 0 35 . 9.576 4.047 -16.698 1.00 96.59 35 A 1 ATOM 283 C CG . LYS A 0 35 . 12.040 1.899 -15.927 1.00 96.59 35 A 1 ATOM 284 C CD . LYS A 0 35 . 12.825 0.876 -15.087 1.00 96.59 35 A 1 ATOM 285 C CE . LYS A 0 35 . 12.182 -0.517 -15.154 1.00 96.59 35 A 1 ATOM 286 N NZ . LYS A 0 35 . 12.884 -1.497 -14.281 1.00 96.59 35 A 1 ATOM 287 N N . CYS A 0 36 . 10.365 5.173 -14.910 1.00 96.77 36 A 1 ATOM 288 C CA . CYS A 0 36 . 9.065 5.421 -14.288 1.00 96.77 36 A 1 ATOM 289 C C . CYS A 0 36 . 8.235 6.419 -15.099 1.00 96.77 36 A 1 ATOM 290 C CB . CYS A 0 36 . 9.290 5.937 -12.864 1.00 96.77 36 A 1 ATOM 291 O O . CYS A 0 36 . 7.071 6.148 -15.376 1.00 96.77 36 A 1 ATOM 292 S SG . CYS A 0 36 . 10.071 4.645 -11.861 1.00 96.77 36 A 1 ATOM 293 N N . GLU A 0 37 . 8.858 7.518 -15.528 1.00 96.19 37 A 1 ATOM 294 C CA . GLU A 0 37 . 8.229 8.552 -16.360 1.00 96.19 37 A 1 ATOM 295 C C . GLU A 0 37 . 7.697 7.960 -17.675 1.00 96.19 37 A 1 ATOM 296 C CB . GLU A 0 37 . 9.276 9.653 -16.609 1.00 96.19 37 A 1 ATOM 297 O O . GLU A 0 37 . 6.506 8.051 -17.969 1.00 96.19 37 A 1 ATOM 298 C CG . GLU A 0 37 . 8.742 10.866 -17.387 1.00 96.19 37 A 1 ATOM 299 C CD . GLU A 0 37 . 9.821 11.931 -17.675 1.00 96.19 37 A 1 ATOM 300 O OE1 . GLU A 0 37 . 9.474 13.105 -17.959 1.00 96.19 37 A 1 ATOM 301 O OE2 . GLU A 0 37 . 11.020 11.581 -17.612 1.00 96.19 37 A 1 ATOM 302 N N . ARG A 0 38 . 8.547 7.245 -18.427 1.00 96.57 38 A 1 ATOM 303 C CA . ARG A 0 38 . 8.152 6.599 -19.688 1.00 96.57 38 A 1 ATOM 304 C C . ARG A 0 38 . 7.018 5.602 -19.483 1.00 96.57 38 A 1 ATOM 305 C CB . ARG A 0 38 . 9.376 5.932 -20.339 1.00 96.57 38 A 1 ATOM 306 O O . ARG A 0 38 . 6.081 5.574 -20.271 1.00 96.57 38 A 1 ATOM 307 C CG . ARG A 0 38 . 9.035 5.306 -21.703 1.00 96.57 38 A 1 ATOM 308 C CD . ARG A 0 38 . 10.286 4.759 -22.402 1.00 96.57 38 A 1 ATOM 309 N NE . ARG A 0 38 . 9.966 4.209 -23.736 1.00 96.57 38 A 1 ATOM 310 N NH1 . ARG A 0 38 . 12.119 3.900 -24.496 1.00 96.57 38 A 1 ATOM 311 N NH2 . ARG A 0 38 . 10.409 3.408 -25.829 1.00 96.57 38 A 1 ATOM 312 C CZ . ARG A 0 38 . 10.828 3.843 -24.674 1.00 96.57 38 A 1 ATOM 313 N N . SER A 0 39 . 7.089 4.782 -18.436 1.00 96.88 39 A 1 ATOM 314 C CA . SER A 0 39 . 6.043 3.788 -18.173 1.00 96.88 39 A 1 ATOM 315 C C . SER A 0 39 . 4.702 4.440 -17.821 1.00 96.88 39 A 1 ATOM 316 C CB . SER A 0 39 . 6.455 2.837 -17.055 1.00 96.88 39 A 1 ATOM 317 O O . SER A 0 39 . 3.661 3.939 -18.240 1.00 96.88 39 A 1 ATOM 318 O OG . SER A 0 39 . 7.678 2.184 -17.349 1.00 96.88 39 A 1 ATOM 319 N N . HIS A 0 40 . 4.729 5.569 -17.105 1.00 95.82 40 A 1 ATOM 320 C CA . HIS A 0 40 . 3.537 6.354 -16.796 1.00 95.82 40 A 1 ATOM 321 C C . HIS A 0 40 . 2.905 6.961 -18.056 1.00 95.82 40 A 1 ATOM 322 C CB . HIS A 0 40 . 3.906 7.439 -15.780 1.00 95.82 40 A 1 ATOM 323 O O . HIS A 0 40 . 1.703 6.808 -18.261 1.00 95.82 40 A 1 ATOM 324 C CG . HIS A 0 40 . 2.727 8.289 -15.388 1.00 95.82 40 A 1 ATOM 325 C CD2 . HIS A 0 40 . 2.390 9.507 -15.918 1.00 95.82 40 A 1 ATOM 326 N ND1 . HIS A 0 40 . 1.787 7.986 -14.430 1.00 95.82 40 A 1 ATOM 327 C CE1 . HIS A 0 40 . 0.916 9.007 -14.369 1.00 95.82 40 A 1 ATOM 328 N NE2 . HIS A 0 40 . 1.247 9.956 -15.253 1.00 95.82 40 A 1 ATOM 329 N N . PHE A 0 41 . 3.698 7.579 -18.937 1.00 94.58 41 A 1 ATOM 330 C CA . PHE A 0 41 . 3.181 8.153 -20.187 1.00 94.58 41 A 1 ATOM 331 C C . PHE A 0 41 . 2.716 7.095 -21.196 1.00 94.58 41 A 1 ATOM 332 C CB . PHE A 0 41 . 4.224 9.091 -20.799 1.00 94.58 41 A 1 ATOM 333 O O . PHE A 0 41 . 1.761 7.331 -21.929 1.00 94.58 41 A 1 ATOM 334 C CG . PHE A 0 41 . 4.376 10.394 -20.039 1.00 94.58 41 A 1 ATOM 335 C CD1 . PHE A 0 41 . 3.283 11.276 -19.936 1.00 94.58 41 A 1 ATOM 336 C CD2 . PHE A 0 41 . 5.608 10.748 -19.462 1.00 94.58 41 A 1 ATOM 337 C CE1 . PHE A 0 41 . 3.415 12.492 -19.246 1.00 94.58 41 A 1 ATOM 338 C CE2 . PHE A 0 41 . 5.745 11.975 -18.788 1.00 94.58 41 A 1 ATOM 339 C CZ . PHE A 0 41 . 4.647 12.842 -18.671 1.00 94.58 41 A 1 ATOM 340 N N . LEU A 0 42 . 3.302 5.894 -21.165 1.00 96.32 42 A 1 ATOM 341 C CA . LEU A 0 42 . 2.791 4.716 -21.879 1.00 96.32 42 A 1 ATOM 342 C C . LEU A 0 42 . 1.536 4.102 -21.229 1.00 96.32 42 A 1 ATOM 343 C CB . LEU A 0 42 . 3.912 3.666 -22.010 1.00 96.32 42 A 1 ATOM 344 O O . LEU A 0 42 . 1.096 3.039 -21.656 1.00 96.32 42 A 1 ATOM 345 C CG . LEU A 0 42 . 5.056 4.052 -22.962 1.00 96.32 42 A 1 ATOM 346 C CD1 . LEU A 0 42 . 6.134 2.964 -22.891 1.00 96.32 42 A 1 ATOM 347 C CD2 . LEU A 0 42 . 4.599 4.172 -24.415 1.00 96.32 42 A 1 ATOM 348 N N . LYS A 0 43 . 0.979 4.732 -20.185 1.00 95.43 43 A 1 ATOM 349 C CA . LYS A 0 43 . -0.226 4.296 -19.461 1.00 95.43 43 A 1 ATOM 350 C C . LYS A 0 43 . -0.139 2.865 -18.914 1.00 95.43 43 A 1 ATOM 351 C CB . LYS A 0 43 . -1.482 4.525 -20.323 1.00 95.43 43 A 1 ATOM 352 O O . LYS A 0 43 . -1.154 2.194 -18.754 1.00 95.43 43 A 1 ATOM 353 C CG . LYS A 0 43 . -1.656 5.980 -20.789 1.00 95.43 43 A 1 ATOM 354 C CD . LYS A 0 43 . -2.930 6.105 -21.636 1.00 95.43 43 A 1 ATOM 355 C CE . LYS A 0 43 . -3.119 7.542 -22.136 1.00 95.43 43 A 1 ATOM 356 N NZ . LYS A 0 43 . -4.291 7.651 -23.045 1.00 95.43 43 A 1 ATOM 357 N N . ARG A 0 44 . 1.068 2.389 -18.590 1.00 96.90 44 A 1 ATOM 358 C CA . ARG A 0 44 . 1.258 1.062 -17.989 1.00 96.90 44 A 1 ATOM 359 C C . ARG A 0 44 . 0.744 1.071 -16.558 1.00 96.90 44 A 1 ATOM 360 C CB . ARG A 0 44 . 2.727 0.635 -18.039 1.00 96.90 44 A 1 ATOM 361 O O . ARG A 0 44 . 1.072 1.969 -15.784 1.00 96.90 44 A 1 ATOM 362 C CG . ARG A 0 44 . 3.205 0.455 -19.483 1.00 96.90 44 A 1 ATOM 363 C CD . ARG A 0 44 . 4.665 0.002 -19.497 1.00 96.90 44 A 1 ATOM 364 N NE . ARG A 0 44 . 5.120 -0.256 -20.873 1.00 96.90 44 A 1 ATOM 365 N NH1 . ARG A 0 44 . 7.229 -0.997 -20.363 1.00 96.90 44 A 1 ATOM 366 N NH2 . ARG A 0 44 . 6.529 -1.031 -22.483 1.00 96.90 44 A 1 ATOM 367 C CZ . ARG A 0 44 . 6.287 -0.756 -21.233 1.00 96.90 44 A 1 ATOM 368 N N . ASN A 0 45 . -0.021 0.052 -16.187 1.00 96.22 45 A 1 ATOM 369 C CA . ASN A 0 45 . -0.561 -0.071 -14.843 1.00 96.22 45 A 1 ATOM 370 C C . ASN A 0 45 . 0.539 -0.528 -13.865 1.00 96.22 45 A 1 ATOM 371 C CB . ASN A 0 45 . -1.732 -1.056 -14.899 1.00 96.22 45 A 1 ATOM 372 O O . ASN A 0 45 . 1.028 -1.655 -13.982 1.00 96.22 45 A 1 ATOM 373 C CG . ASN A 0 45 . -2.493 -1.179 -13.596 1.00 96.22 45 A 1 ATOM 374 N ND2 . ASN A 0 45 . -3.534 -1.973 -13.621 1.00 96.22 45 A 1 ATOM 375 O OD1 . ASN A 0 45 . -2.156 -0.606 -12.560 1.00 96.22 45 A 1 ATOM 376 N N . PRO A 0 46 . 0.913 0.266 -12.841 1.00 97.29 46 A 1 ATOM 377 C CA . PRO A 0 46 . 1.923 -0.154 -11.871 1.00 97.29 46 A 1 ATOM 378 C C . PRO A 0 46 . 1.572 -1.467 -11.161 1.00 97.29 46 A 1 ATOM 379 C CB . PRO A 0 46 . 2.020 0.994 -10.864 1.00 97.29 46 A 1 ATOM 380 O O . PRO A 0 46 . 2.469 -2.205 -10.769 1.00 97.29 46 A 1 ATOM 381 C CG . PRO A 0 46 . 1.552 2.213 -11.653 1.00 97.29 46 A 1 ATOM 382 C CD . PRO A 0 46 . 0.485 1.631 -12.573 1.00 97.29 46 A 1 ATOM 383 N N . ARG A 0 47 . 0.277 -1.791 -11.021 1.00 95.89 47 A 1 ATOM 384 C CA . ARG A 0 47 . -0.213 -3.010 -10.351 1.00 95.89 47 A 1 ATOM 385 C C . ARG A 0 47 . 0.042 -4.299 -11.137 1.00 95.89 47 A 1 ATOM 386 C CB . ARG A 0 47 . -1.715 -2.875 -10.069 1.00 95.89 47 A 1 ATOM 387 O O . ARG A 0 47 . -0.140 -5.375 -10.570 1.00 95.89 47 A 1 ATOM 388 C CG . ARG A 0 47 . -2.053 -1.698 -9.147 1.00 95.89 47 A 1 ATOM 389 C CD . ARG A 0 47 . -3.573 -1.590 -8.988 1.00 95.89 47 A 1 ATOM 390 N NE . ARG A 0 47 . -3.950 -0.415 -8.182 1.00 95.89 47 A 1 ATOM 391 N NH1 . ARG A 0 47 . -3.978 -1.400 -6.103 1.00 95.89 47 A 1 ATOM 392 N NH2 . ARG A 0 47 . -4.535 0.751 -6.321 1.00 95.89 47 A 1 ATOM 393 C CZ . ARG A 0 47 . -4.149 -0.363 -6.876 1.00 95.89 47 A 1 ATOM 394 N N . GLU A 0 48 . 0.443 -4.194 -12.399 1.00 96.47 48 A 1 ATOM 395 C CA . GLU A 0 48 . 0.830 -5.320 -13.263 1.00 96.47 48 A 1 ATOM 396 C C . GLU A 0 48 . 2.353 -5.455 -13.386 1.00 96.47 48 A 1 ATOM 397 C CB . GLU A 0 48 . 0.188 -5.120 -14.640 1.00 96.47 48 A 1 ATOM 398 O O . GLU A 0 48 . 2.858 -6.505 -13.767 1.00 96.47 48 A 1 ATOM 399 C CG . GLU A 0 48 . -1.325 -5.383 -14.586 1.00 96.47 48 A 1 ATOM 400 C CD . GLU A 0 48 . -2.077 -4.676 -15.715 1.00 96.47 48 A 1 ATOM 401 O OE1 . GLU A 0 48 . -3.216 -4.247 -15.416 1.00 96.47 48 A 1 ATOM 402 O OE2 . GLU A 0 48 . -1.466 -4.434 -16.777 1.00 96.47 48 A 1 ATOM 403 N N . ILE A 0 49 . 3.109 -4.425 -12.998 1.00 96.55 49 A 1 ATOM 404 C CA . ILE A 0 49 . 4.566 -4.416 -13.101 1.00 96.55 49 A 1 ATOM 405 C C . ILE A 0 49 . 5.205 -4.949 -11.817 1.00 96.55 49 A 1 ATOM 406 C CB . ILE A 0 49 . 5.048 -3.008 -13.480 1.00 96.55 49 A 1 ATOM 407 O O . ILE A 0 49 . 5.193 -4.284 -10.782 1.00 96.55 49 A 1 ATOM 408 C CG1 . ILE A 0 49 . 4.460 -2.516 -14.818 1.00 96.55 49 A 1 ATOM 409 C CG2 . ILE A 0 49 . 6.579 -2.960 -13.549 1.00 96.55 49 A 1 ATOM 410 C CD1 . ILE A 0 49 . 4.688 -3.410 -16.042 1.00 96.55 49 A 1 ATOM 411 N N . SER A 0 50 . 5.832 -6.121 -11.926 1.00 95.53 50 A 1 ATOM 412 C CA . SER A 0 50 . 6.327 -6.951 -10.816 1.00 95.53 50 A 1 ATOM 413 C C . SER A 0 50 . 7.175 -6.234 -9.758 1.00 95.53 50 A 1 ATOM 414 C CB . SER A 0 50 . 7.117 -8.130 -11.390 1.00 95.53 50 A 1 ATOM 415 O O . SER A 0 50 . 7.050 -6.498 -8.561 1.00 95.53 50 A 1 ATOM 416 O OG . SER A 0 50 . 8.195 -7.665 -12.186 1.00 95.53 50 A 1 ATOM 417 N N . TRP A 0 51 . 8.041 -5.316 -10.186 1.00 94.69 51 A 1 ATOM 418 C CA . TRP A 0 51 . 9.007 -4.644 -9.316 1.00 94.69 51 A 1 ATOM 419 C C . TRP A 0 51 . 8.443 -3.418 -8.582 1.00 94.69 51 A 1 ATOM 420 C CB . TRP A 0 51 . 10.256 -4.299 -10.137 1.00 94.69 51 A 1 ATOM 421 O O . TRP A 0 51 . 9.124 -2.864 -7.720 1.00 94.69 51 A 1 ATOM 422 C CG . TRP A 0 51 . 10.039 -3.336 -11.266 1.00 94.69 51 A 1 ATOM 423 C CD1 . TRP A 0 51 . 9.746 -3.669 -12.542 1.00 94.69 51 A 1 ATOM 424 C CD2 . TRP A 0 51 . 10.077 -1.879 -11.233 1.00 94.69 51 A 1 ATOM 425 C CE2 . TRP A 0 51 . 9.744 -1.387 -12.530 1.00 94.69 51 A 1 ATOM 426 C CE3 . TRP A 0 51 . 10.362 -0.927 -10.236 1.00 94.69 51 A 1 ATOM 427 N NE1 . TRP A 0 51 . 9.581 -2.522 -13.295 1.00 94.69 51 A 1 ATOM 428 C CH2 . TRP A 0 51 . 9.960 0.905 -11.799 1.00 94.69 51 A 1 ATOM 429 C CZ2 . TRP A 0 51 . 9.656 -0.017 -12.814 1.00 94.69 51 A 1 ATOM 430 C CZ3 . TRP A 0 51 . 10.330 0.451 -10.521 1.00 94.69 51 A 1 ATOM 431 N N . THR A 0 52 . 7.223 -2.967 -8.897 1.00 96.80 52 A 1 ATOM 432 C CA . THR A 0 52 . 6.638 -1.808 -8.208 1.00 96.80 52 A 1 ATOM 433 C C . THR A 0 52 . 6.142 -2.184 -6.814 1.00 96.80 52 A 1 ATOM 434 C CB . THR A 0 52 . 5.502 -1.128 -8.984 1.00 96.80 52 A 1 ATOM 435 O O . THR A 0 52 . 5.702 -3.306 -6.547 1.00 96.80 52 A 1 ATOM 436 C CG2 . THR A 0 52 . 5.861 -0.801 -10.431 1.00 96.80 52 A 1 ATOM 437 O OG1 . THR A 0 52 . 4.340 -1.916 -8.906 1.00 96.80 52 A 1 ATOM 438 N N . VAL A 0 53 . 6.136 -1.210 -5.903 1.00 94.91 53 A 1 ATOM 439 C CA . VAL A 0 53 . 5.604 -1.406 -4.548 1.00 94.91 53 A 1 ATOM 440 C C . VAL A 0 53 . 4.115 -1.772 -4.584 1.00 94.91 53 A 1 ATOM 441 C CB . VAL A 0 53 . 5.858 -0.144 -3.702 1.00 94.91 53 A 1 ATOM 442 O O . VAL A 0 53 . 3.661 -2.593 -3.786 1.00 94.91 53 A 1 ATOM 443 C CG1 . VAL A 0 53 . 5.240 -0.246 -2.301 1.00 94.91 53 A 1 ATOM 444 C CG2 . VAL A 0 53 . 7.364 0.100 -3.524 1.00 94.91 53 A 1 ATOM 445 N N . LEU A 0 54 . 3.352 -1.210 -5.528 1.00 95.01 54 A 1 ATOM 446 C CA . LEU A 0 54 . 1.921 -1.489 -5.680 1.00 95.01 54 A 1 ATOM 447 C C . LEU A 0 54 . 1.650 -2.935 -6.106 1.00 95.01 54 A 1 ATOM 448 C CB . LEU A 0 54 . 1.300 -0.495 -6.678 1.00 95.01 54 A 1 ATOM 449 O O . LEU A 0 54 . 0.764 -3.567 -5.529 1.00 95.01 54 A 1 ATOM 450 C CG . LEU A 0 54 . 1.145 0.936 -6.131 1.00 95.01 54 A 1 ATOM 451 C CD1 . LEU A 0 54 . 0.665 1.858 -7.250 1.00 95.01 54 A 1 ATOM 452 C CD2 . LEU A 0 54 . 0.128 1.012 -4.987 1.00 95.01 54 A 1 ATOM 453 N N . TYR A 0 55 . 2.427 -3.480 -7.047 1.00 96.29 55 A 1 ATOM 454 C CA . TYR A 0 55 . 2.353 -4.898 -7.405 1.00 96.29 55 A 1 ATOM 455 C C . TYR A 0 55 . 2.652 -5.784 -6.195 1.00 96.29 55 A 1 ATOM 456 C CB . TYR A 0 55 . 3.343 -5.186 -8.534 1.00 96.29 55 A 1 ATOM 457 O O . TYR A 0 55 . 1.874 -6.677 -5.859 1.00 96.29 55 A 1 ATOM 458 C CG . TYR A 0 55 . 3.382 -6.640 -8.961 1.00 96.29 55 A 1 ATOM 459 C CD1 . TYR A 0 55 . 4.131 -7.589 -8.232 1.00 96.29 55 A 1 ATOM 460 C CD2 . TYR A 0 55 . 2.696 -7.038 -10.120 1.00 96.29 55 A 1 ATOM 461 C CE1 . TYR A 0 55 . 4.163 -8.937 -8.645 1.00 96.29 55 A 1 ATOM 462 C CE2 . TYR A 0 55 . 2.743 -8.375 -10.549 1.00 96.29 55 A 1 ATOM 463 O OH . TYR A 0 55 . 3.473 -10.620 -10.223 1.00 96.29 55 A 1 ATOM 464 C CZ . TYR A 0 55 . 3.456 -9.332 -9.802 1.00 96.29 55 A 1 ATOM 465 N N . ARG A 0 56 . 3.745 -5.500 -5.475 1.00 94.61 56 A 1 ATOM 466 C CA . ARG A 0 56 . 4.145 -6.302 -4.309 1.00 94.61 56 A 1 ATOM 467 C C . ARG A 0 56 . 3.097 -6.280 -3.198 1.00 94.61 56 A 1 ATOM 468 C CB . ARG A 0 56 . 5.516 -5.848 -3.792 1.00 94.61 56 A 1 ATOM 469 O O . ARG A 0 56 . 2.910 -7.302 -2.551 1.00 94.61 56 A 1 ATOM 470 C CG . ARG A 0 56 . 6.629 -6.112 -4.819 1.00 94.61 56 A 1 ATOM 471 C CD . ARG A 0 56 . 8.010 -5.720 -4.283 1.00 94.61 56 A 1 ATOM 472 N NE . ARG A 0 56 . 8.588 -6.769 -3.417 1.00 94.61 56 A 1 ATOM 473 N NH1 . ARG A 0 56 . 8.226 -5.845 -1.336 1.00 94.61 56 A 1 ATOM 474 N NH2 . ARG A 0 56 . 9.315 -7.778 -1.523 1.00 94.61 56 A 1 ATOM 475 C CZ . ARG A 0 56 . 8.698 -6.791 -2.100 1.00 94.61 56 A 1 ATOM 476 N N . ARG A 0 57 . 2.382 -5.165 -3.003 1.00 91.19 57 A 1 ATOM 477 C CA . ARG A 0 57 . 1.234 -5.084 -2.080 1.00 91.19 57 A 1 ATOM 478 C C . ARG A 0 57 . 0.033 -5.892 -2.575 1.00 91.19 57 A 1 ATOM 479 C CB . ARG A 0 57 . 0.834 -3.621 -1.843 1.00 91.19 57 A 1 ATOM 480 O O . ARG A 0 57 . -0.550 -6.620 -1.782 1.00 91.19 57 A 1 ATOM 481 C CG . ARG A 0 57 . 1.833 -2.871 -0.952 1.00 91.19 57 A 1 ATOM 482 C CD . ARG A 0 57 . 1.398 -1.408 -0.815 1.00 91.19 57 A 1 ATOM 483 N NE . ARG A 0 57 . 2.354 -0.624 -0.011 1.00 91.19 57 A 1 ATOM 484 N NH1 . ARG A 0 57 . 1.268 1.398 -0.148 1.00 91.19 57 A 1 ATOM 485 N NH2 . ARG A 0 57 . 3.193 1.256 0.965 1.00 91.19 57 A 1 ATOM 486 C CZ . ARG A 0 57 . 2.268 0.667 0.263 1.00 91.19 57 A 1 ATOM 487 N N . LYS A 0 58 . -0.308 -5.808 -3.870 1.00 93.02 58 A 1 ATOM 488 C CA . LYS A 0 58 . -1.413 -6.578 -4.480 1.00 93.02 58 A 1 ATOM 489 C C . LYS A 0 58 . -1.210 -8.087 -4.308 1.00 93.02 58 A 1 ATOM 490 C CB . LYS A 0 58 . -1.559 -6.198 -5.969 1.00 93.02 58 A 1 ATOM 491 O O . LYS A 0 58 . -2.135 -8.779 -3.905 1.00 93.02 58 A 1 ATOM 492 C CG . LYS A 0 58 . -2.725 -6.932 -6.662 1.00 93.02 58 A 1 ATOM 493 C CD . LYS A 0 58 . -2.796 -6.634 -8.169 1.00 93.02 58 A 1 ATOM 494 C CE . LYS A 0 58 . -3.911 -7.473 -8.818 1.00 93.02 58 A 1 ATOM 495 N NZ . LYS A 0 58 . -3.862 -7.452 -10.306 1.00 93.02 58 A 1 ATOM 496 N N . TYR A 0 59 . 0.002 -8.572 -4.573 1.00 93.25 59 A 1 ATOM 497 C CA . TYR A 0 59 . 0.363 -9.992 -4.476 1.00 93.25 59 A 1 ATOM 498 C C . TYR A 0 59 . 1.023 -10.371 -3.151 1.00 93.25 59 A 1 ATOM 499 C CB . TYR A 0 59 . 1.241 -10.384 -5.667 1.00 93.25 59 A 1 ATOM 500 O O . TYR A 0 59 . 1.598 -11.453 -3.045 1.00 93.25 59 A 1 ATOM 501 C CG . TYR A 0 59 . 0.512 -10.278 -6.981 1.00 93.25 59 A 1 ATOM 502 C CD1 . TYR A 0 59 . -0.404 -11.278 -7.360 1.00 93.25 59 A 1 ATOM 503 C CD2 . TYR A 0 59 . 0.732 -9.170 -7.816 1.00 93.25 59 A 1 ATOM 504 C CE1 . TYR A 0 59 . -1.086 -11.174 -8.588 1.00 93.25 59 A 1 ATOM 505 C CE2 . TYR A 0 59 . 0.056 -9.066 -9.042 1.00 93.25 59 A 1 ATOM 506 O OH . TYR A 0 59 . -1.475 -9.970 -10.633 1.00 93.25 59 A 1 ATOM 507 C CZ . TYR A 0 59 . -0.839 -10.077 -9.438 1.00 93.25 59 A 1 ATOM 508 N N . LYS A 0 60 . 0.965 -9.482 -2.151 1.00 88.96 60 A 1 ATOM 509 C CA . LYS A 0 60 . 1.370 -9.783 -0.774 1.00 88.96 60 A 1 ATOM 510 C C . LYS A 0 60 . 2.817 -10.283 -0.645 1.00 88.96 60 A 1 ATOM 511 C CB . LYS A 0 60 . 0.354 -10.771 -0.194 1.00 88.96 60 A 1 ATOM 512 O O . LYS A 0 60 . 3.150 -11.073 0.226 1.00 88.96 60 A 1 ATOM 513 C CG . LYS A 0 60 . -1.100 -10.282 -0.339 1.00 88.96 60 A 1 ATOM 514 C CD . LYS A 0 60 . -2.056 -11.369 0.152 1.00 88.96 60 A 1 ATOM 515 C CE . LYS A 0 60 . -3.285 -10.752 0.816 1.00 88.96 60 A 1 ATOM 516 N NZ . LYS A 0 60 . -3.553 -11.491 2.060 1.00 88.96 60 A 1 ATOM 517 N N . LYS A 0 61 . 3.710 -9.806 -1.516 1.00 88.60 61 A 1 ATOM 518 C CA . LYS A 0 61 . 5.119 -10.230 -1.611 1.00 88.60 61 A 1 ATOM 519 C C . LYS A 0 61 . 6.018 -9.605 -0.531 1.00 88.60 61 A 1 ATOM 520 C CB . LYS A 0 61 . 5.641 -9.987 -3.046 1.00 88.60 61 A 1 ATOM 521 O O . LYS A 0 61 . 7.210 -9.432 -0.757 1.00 88.60 61 A 1 ATOM 522 C CG . LYS A 0 61 . 4.965 -10.829 -4.143 1.00 88.60 61 A 1 ATOM 523 C CD . LYS A 0 61 . 5.252 -12.335 -3.996 1.00 88.60 61 A 1 ATOM 524 C CE . LYS A 0 61 . 4.709 -13.134 -5.191 1.00 88.60 61 A 1 ATOM 525 N NZ . LYS A 0 61 . 5.031 -14.584 -5.082 1.00 88.60 61 A 1 ATOM 526 N N . GLY A 0 62 . 5.474 -9.193 0.611 1.00 83.23 62 A 1 ATOM 527 C CA . GLY A 0 62 . 6.213 -8.531 1.689 1.00 83.23 62 A 1 ATOM 528 C C . GLY A 0 62 . 5.895 -9.133 3.052 1.00 83.23 62 A 1 ATOM 529 O O . GLY A 0 62 . 4.894 -9.817 3.211 1.00 83.23 62 A 1 ATOM 530 N N . ILE A 0 63 . 6.740 -8.833 4.037 1.00 79.40 63 A 1 ATOM 531 C CA . ILE A 0 63 . 6.678 -9.416 5.390 1.00 79.40 63 A 1 ATOM 532 C C . ILE A 0 63 . 5.445 -8.916 6.181 1.00 79.40 63 A 1 ATOM 533 C CB . ILE A 0 63 . 8.028 -9.128 6.107 1.00 79.40 63 A 1 ATOM 534 O O . ILE A 0 63 . 4.986 -9.557 7.115 1.00 79.40 63 A 1 ATOM 535 C CG1 . ILE A 0 63 . 9.222 -9.727 5.313 1.00 79.40 63 A 1 ATOM 536 C CG2 . ILE A 0 63 . 8.046 -9.676 7.544 1.00 79.40 63 A 1 ATOM 537 C CD1 . ILE A 0 63 . 10.603 -9.236 5.770 1.00 79.40 63 A 1 ATOM 538 N N . SER A 0 64 . 4.843 -7.789 5.789 1.00 66.16 64 A 1 ATOM 539 C CA . SER A 0 64 . 3.854 -7.054 6.597 1.00 66.16 64 A 1 ATOM 540 C C . SER A 0 64 . 2.440 -7.658 6.678 1.00 66.16 64 A 1 ATOM 541 C CB . SER A 0 64 . 3.790 -5.603 6.107 1.00 66.16 64 A 1 ATOM 542 O O . SER A 0 64 . 1.535 -7.000 7.188 1.00 66.16 64 A 1 ATOM 543 O OG . SER A 0 64 . 3.331 -5.548 4.765 1.00 66.16 64 A 1 ATOM 544 N N . GLU A 0 65 . 2.205 -8.863 6.157 1.00 63.53 65 A 1 ATOM 545 C CA . GLU A 0 65 . 0.880 -9.509 6.166 1.00 63.53 65 A 1 ATOM 546 C C . GLU A 0 65 . 0.373 -9.840 7.580 1.00 63.53 65 A 1 ATOM 547 C CB . GLU A 0 65 . 0.952 -10.820 5.369 1.00 63.53 65 A 1 ATOM 548 O O . GLU A 0 65 . -0.838 -9.815 7.816 1.00 63.53 65 A 1 ATOM 549 C CG . GLU A 0 65 . 0.919 -10.660 3.843 1.00 63.53 65 A 1 ATOM 550 C CD . GLU A 0 65 . -0.471 -10.947 3.269 1.00 63.53 65 A 1 ATOM 551 O OE1 . GLU A 0 65 . -1.012 -10.060 2.585 1.00 63.53 65 A 1 ATOM 552 O OE2 . GLU A 0 65 . -1.102 -12.009 3.525 1.00 63.53 65 A 1 ATOM 553 N N . GLU A 0 66 . 1.268 -10.154 8.519 1.00 59.71 66 A 1 ATOM 554 C CA . GLU A 0 66 . 0.866 -10.678 9.832 1.00 59.71 66 A 1 ATOM 555 C C . GLU A 0 66 . 0.220 -9.630 10.743 1.00 59.71 66 A 1 ATOM 556 C CB . GLU A 0 66 . 2.060 -11.340 10.528 1.00 59.71 66 A 1 ATOM 557 O O . GLU A 0 66 . -0.638 -9.967 11.559 1.00 59.71 66 A 1 ATOM 558 C CG . GLU A 0 66 . 2.354 -12.709 9.903 1.00 59.71 66 A 1 ATOM 559 C CD . GLU A 0 66 . 3.428 -13.479 10.676 1.00 59.71 66 A 1 ATOM 560 O OE1 . GLU A 0 66 . 3.294 -14.718 10.730 1.00 59.71 66 A 1 ATOM 561 O OE2 . GLU A 0 66 . 4.347 -12.810 11.197 1.00 59.71 66 A 1 ATOM 562 N N . LEU A 0 67 . 0.548 -8.346 10.575 1.00 64.80 67 A 1 ATOM 563 C CA . LEU A 0 67 . 0.113 -7.305 11.511 1.00 64.80 67 A 1 ATOM 564 C C . LEU A 0 67 . -1.386 -6.984 11.411 1.00 64.80 67 A 1 ATOM 565 C CB . LEU A 0 67 . 0.977 -6.048 11.310 1.00 64.80 67 A 1 ATOM 566 O O . LEU A 0 67 . -2.027 -6.712 12.422 1.00 64.80 67 A 1 ATOM 567 C CG . LEU A 0 67 . 2.458 -6.233 11.698 1.00 64.80 67 A 1 ATOM 568 C CD1 . LEU A 0 67 . 3.239 -4.973 11.323 1.00 64.80 67 A 1 ATOM 569 C CD2 . LEU A 0 67 . 2.640 -6.485 13.197 1.00 64.80 67 A 1 ATOM 570 N N . VAL A 0 68 . -1.971 -7.034 10.211 1.00 66.12 68 A 1 ATOM 571 C CA . VAL A 0 68 . -3.360 -6.580 9.990 1.00 66.12 68 A 1 ATOM 572 C C . VAL A 0 68 . -4.384 -7.683 10.277 1.00 66.12 68 A 1 ATOM 573 C CB . VAL A 0 68 . -3.520 -5.988 8.574 1.00 66.12 68 A 1 ATOM 574 O O . VAL A 0 68 . -5.547 -7.401 10.562 1.00 66.12 68 A 1 ATOM 575 C CG1 . VAL A 0 68 . -4.918 -5.402 8.328 1.00 66.12 68 A 1 ATOM 576 C CG2 . VAL A 0 68 . -2.511 -4.855 8.334 1.00 66.12 68 A 1 ATOM 577 N N . LYS A 0 69 . -3.975 -8.959 10.242 1.00 64.33 69 A 1 ATOM 578 C CA . LYS A 0 69 . -4.900 -10.093 10.415 1.00 64.33 69 A 1 ATOM 579 C C . LYS A 0 69 . -5.373 -10.302 11.854 1.00 64.33 69 A 1 ATOM 580 C CB . LYS A 0 69 . -4.305 -11.380 9.829 1.00 64.33 69 A 1 ATOM 581 O O . LYS A 0 69 . -6.312 -11.072 12.056 1.00 64.33 69 A 1 ATOM 582 C CG . LYS A 0 69 . -4.310 -11.361 8.294 1.00 64.33 69 A 1 ATOM 583 C CD . LYS A 0 69 . -3.747 -12.679 7.745 1.00 64.33 69 A 1 ATOM 584 C CE . LYS A 0 69 . -3.578 -12.591 6.223 1.00 64.33 69 A 1 ATOM 585 N NZ . LYS A 0 69 . -2.714 -13.682 5.698 1.00 64.33 69 A 1 ATOM 586 N N . LYS A 0 70 . -4.821 -9.592 12.844 1.00 68.03 70 A 1 ATOM 587 C CA . LYS A 0 70 . -5.380 -9.571 14.203 1.00 68.03 70 A 1 ATOM 588 C C . LYS A 0 70 . -6.669 -8.744 14.224 1.00 68.03 70 A 1 ATOM 589 C CB . LYS A 0 70 . -4.336 -9.108 15.234 1.00 68.03 70 A 1 ATOM 590 O O . LYS A 0 70 . -6.701 -7.608 14.686 1.00 68.03 70 A 1 ATOM 591 C CG . LYS A 0 70 . -3.266 -10.188 15.472 1.00 68.03 70 A 1 ATOM 592 C CD . LYS A 0 70 . -2.325 -9.812 16.627 1.00 68.03 70 A 1 ATOM 593 C CE . LYS A 0 70 . -1.289 -10.926 16.844 1.00 68.03 70 A 1 ATOM 594 N NZ . LYS A 0 70 . -0.344 -10.619 17.950 1.00 68.03 70 A 1 ATOM 595 N N . ARG A 0 71 . -7.758 -9.334 13.721 1.00 71.65 71 A 1 ATOM 596 C CA . ARG A 0 71 . -9.114 -8.840 13.970 1.00 71.65 71 A 1 ATOM 597 C C . ARG A 0 71 . -9.373 -8.940 15.469 1.00 71.65 71 A 1 ATOM 598 C CB . ARG A 0 71 . -10.161 -9.643 13.181 1.00 71.65 71 A 1 ATOM 599 O O . ARG A 0 71 . -9.553 -10.032 16.002 1.00 71.65 71 A 1 ATOM 600 C CG . ARG A 0 71 . -10.194 -9.280 11.691 1.00 71.65 71 A 1 ATOM 601 C CD . ARG A 0 71 . -11.359 -10.011 11.008 1.00 71.65 71 A 1 ATOM 602 N NE . ARG A 0 71 . -11.505 -9.618 9.593 1.00 71.65 71 A 1 ATOM 603 N NH1 . ARG A 0 71 . -13.415 -10.823 9.149 1.00 71.65 71 A 1 ATOM 604 N NH2 . ARG A 0 71 . -12.502 -9.583 7.541 1.00 71.65 71 A 1 ATOM 605 C CZ . ARG A 0 71 . -12.469 -10.009 8.772 1.00 71.65 71 A 1 ATOM 606 N N . THR A 0 72 . -9.382 -7.805 16.152 1.00 78.92 72 A 1 ATOM 607 C CA . THR A 0 72 . -9.838 -7.739 17.537 1.00 78.92 72 A 1 ATOM 608 C C . THR A 0 72 . -11.350 -7.953 17.559 1.00 78.92 72 A 1 ATOM 609 C CB . THR A 0 72 . -9.422 -6.417 18.199 1.00 78.92 72 A 1 ATOM 610 O O . THR A 0 72 . -12.097 -7.351 16.782 1.00 78.92 72 A 1 ATOM 611 C CG2 . THR A 0 72 . -7.904 -6.343 18.369 1.00 78.92 72 A 1 ATOM 612 O OG1 . THR A 0 72 . -9.790 -5.314 17.405 1.00 78.92 72 A 1 ATOM 613 N N . LYS A 0 73 . -11.828 -8.857 18.421 1.00 81.33 73 A 1 ATOM 614 C CA . LYS A 0 73 . -13.268 -8.993 18.664 1.00 81.33 73 A 1 ATOM 615 C C . LYS A 0 73 . -13.747 -7.705 19.335 1.00 81.33 73 A 1 ATOM 616 C CB . LYS A 0 73 . -13.582 -10.235 19.519 1.00 81.33 73 A 1 ATOM 617 O O . LYS A 0 73 . -13.127 -7.243 20.292 1.00 81.33 73 A 1 ATOM 618 C CG . LYS A 0 73 . -13.311 -11.557 18.777 1.00 81.33 73 A 1 ATOM 619 C CD . LYS A 0 73 . -13.706 -12.770 19.638 1.00 81.33 73 A 1 ATOM 620 C CE . LYS A 0 73 . -13.456 -14.091 18.892 1.00 81.33 73 A 1 ATOM 621 N NZ . LYS A 0 73 . -13.821 -15.279 19.713 1.00 81.33 73 A 1 ATOM 622 N N . ARG A 0 74 . -14.842 -7.119 18.845 1.00 82.01 74 A 1 ATOM 623 C CA . ARG A 0 74 . -15.502 -6.017 19.556 1.00 82.01 74 A 1 ATOM 624 C C . ARG A 0 74 . -16.098 -6.590 20.841 1.00 82.01 74 A 1 ATOM 625 C CB . ARG A 0 74 . -16.581 -5.352 18.685 1.00 82.01 74 A 1 ATOM 626 O O . ARG A 0 74 . -16.956 -7.462 20.772 1.00 82.01 74 A 1 ATOM 627 C CG . ARG A 0 74 . -15.992 -4.562 17.506 1.00 82.01 74 A 1 ATOM 628 C CD . ARG A 0 74 . -17.117 -3.862 16.731 1.00 82.01 74 A 1 ATOM 629 N NE . ARG A 0 74 . -16.606 -3.121 15.561 1.00 82.01 74 A 1 ATOM 630 N NH1 . ARG A 0 74 . -18.639 -2.375 14.781 1.00 82.01 74 A 1 ATOM 631 N NH2 . ARG A 0 74 . -16.777 -1.839 13.681 1.00 82.01 74 A 1 ATOM 632 C CZ . ARG A 0 74 . -17.340 -2.452 14.684 1.00 82.01 74 A 1 ATOM 633 N N . VAL A 0 75 . -15.623 -6.125 21.992 1.00 84.65 75 A 1 ATOM 634 C CA . VAL A 0 75 . -16.171 -6.498 23.301 1.00 84.65 75 A 1 ATOM 635 C C . VAL A 0 75 . -17.238 -5.478 23.680 1.00 84.65 75 A 1 ATOM 636 C CB . VAL A 0 75 . -15.062 -6.594 24.369 1.00 84.65 75 A 1 ATOM 637 O O . VAL A 0 75 . -16.959 -4.281 23.749 1.00 84.65 75 A 1 ATOM 638 C CG1 . VAL A 0 75 . -15.628 -6.952 25.748 1.00 84.65 75 A 1 ATOM 639 C CG2 . VAL A 0 75 . -14.028 -7.663 23.991 1.00 84.65 75 A 1 ATOM 640 N N . THR A 0 76 . -18.461 -5.934 23.934 1.00 84.97 76 A 1 ATOM 641 C CA . THR A 0 76 . -19.489 -5.120 24.590 1.00 84.97 76 A 1 ATOM 642 C C . THR A 0 76 . -19.188 -5.062 26.083 1.00 84.97 76 A 1 ATOM 643 C CB . THR A 0 76 . -20.894 -5.691 24.355 1.00 84.97 76 A 1 ATOM 644 O O . THR A 0 76 . -18.995 -6.099 26.716 1.00 84.97 76 A 1 ATOM 645 C CG2 . THR A 0 76 . -21.324 -5.512 22.899 1.00 84.97 76 A 1 ATOM 646 O OG1 . THR A 0 76 . -20.906 -7.071 24.632 1.00 84.97 76 A 1 ATOM 647 N N . LYS A 0 77 . -19.133 -3.860 26.663 1.00 82.33 77 A 1 ATOM 648 C CA . LYS A 0 77 . -18.926 -3.700 28.107 1.00 82.33 77 A 1 ATOM 649 C C . LYS A 0 77 . -20.169 -4.188 28.857 1.00 82.33 77 A 1 ATOM 650 C CB . LYS A 0 77 . -18.620 -2.233 28.459 1.00 82.33 77 A 1 ATOM 651 O O . LYS A 0 77 . -21.266 -3.708 28.585 1.00 82.33 77 A 1 ATOM 652 C CG . LYS A 0 77 . -17.293 -1.726 27.869 1.00 82.33 77 A 1 ATOM 653 C CD . LYS A 0 77 . -17.025 -0.274 28.298 1.00 82.33 77 A 1 ATOM 654 C CE . LYS A 0 77 . -15.700 0.236 27.714 1.00 82.33 77 A 1 ATOM 655 N NZ . LYS A 0 77 . -15.417 1.639 28.122 1.00 82.33 77 A 1 ATOM 656 N N . SER A 0 78 . -19.996 -5.094 29.815 1.00 79.05 78 A 1 ATOM 657 C CA . SER A 0 78 . -21.057 -5.450 30.763 1.00 79.05 78 A 1 ATOM 658 C C . SER A 0 78 . -21.389 -4.243 31.644 1.00 79.05 78 A 1 ATOM 659 C CB . SER A 0 78 . -20.645 -6.640 31.638 1.00 79.05 78 A 1 ATOM 660 O O . SER A 0 78 . -20.480 -3.552 32.114 1.00 79.05 78 A 1 ATOM 661 O OG . SER A 0 78 . -20.093 -7.665 30.833 1.00 79.05 78 A 1 ATOM 662 N N . ALA A 0 79 . -22.677 -3.985 31.879 1.00 78.77 79 A 1 ATOM 663 C CA . ALA A 0 79 . -23.104 -2.957 32.824 1.00 78.77 79 A 1 ATOM 664 C C . ALA A 0 79 . -22.633 -3.320 34.245 1.00 78.77 79 A 1 ATOM 665 C CB . ALA A 0 79 . -24.625 -2.787 32.738 1.00 78.77 79 A 1 ATOM 666 O O . ALA A 0 79 . -22.730 -4.475 34.657 1.00 78.77 79 A 1 ATOM 667 N N . ARG A 0 80 . -22.112 -2.337 34.984 1.00 79.83 80 A 1 ATOM 668 C CA . ARG A 0 80 . -21.678 -2.476 36.384 1.00 79.83 80 A 1 ATOM 669 C C . ARG A 0 80 . -22.594 -1.658 37.293 1.00 79.83 80 A 1 ATOM 670 C CB . ARG A 0 80 . -20.202 -2.059 36.538 1.00 79.83 80 A 1 ATOM 671 O O . ARG A 0 80 . -23.284 -0.757 36.817 1.00 79.83 80 A 1 ATOM 672 C CG . ARG A 0 80 . -19.240 -2.991 35.783 1.00 79.83 80 A 1 ATOM 673 C CD . ARG A 0 80 . -17.783 -2.575 36.026 1.00 79.83 80 A 1 ATOM 674 N NE . ARG A 0 80 . -16.837 -3.464 35.320 1.00 79.83 80 A 1 ATOM 675 N NH1 . ARG A 0 80 . -14.898 -2.438 36.005 1.00 79.83 80 A 1 ATOM 676 N NH2 . ARG A 0 80 . -14.784 -4.259 34.722 1.00 79.83 80 A 1 ATOM 677 C CZ . ARG A 0 80 . -15.517 -3.381 35.350 1.00 79.83 80 A 1 ATOM 678 N N . GLY A 0 81 . -22.583 -1.980 38.585 1.00 83.03 81 A 1 ATOM 679 C CA . GLY A 0 81 . -23.168 -1.117 39.611 1.00 83.03 81 A 1 ATOM 680 C C . GLY A 0 81 . -22.492 0.255 39.633 1.00 83.03 81 A 1 ATOM 681 O O . GLY A 0 81 . -21.362 0.410 39.162 1.00 83.03 81 A 1 ATOM 682 N N . ILE A 0 82 . -23.203 1.243 40.163 1.00 82.43 82 A 1 ATOM 683 C CA . ILE A 0 82 . -22.710 2.611 40.350 1.00 82.43 82 A 1 ATOM 684 C C . ILE A 0 82 . -22.414 2.779 41.847 1.00 82.43 82 A 1 ATOM 685 C CB . ILE A 0 82 . -23.729 3.628 39.775 1.00 82.43 82 A 1 ATOM 686 O O . ILE A 0 82 . -23.022 2.098 42.671 1.00 82.43 82 A 1 ATOM 687 C CG1 . ILE A 0 82 . -23.953 3.378 38.259 1.00 82.43 82 A 1 ATOM 688 C CG2 . ILE A 0 82 . -23.256 5.076 40.002 1.00 82.43 82 A 1 ATOM 689 C CD1 . ILE A 0 82 . -25.112 4.175 37.646 1.00 82.43 82 A 1 ATOM 690 N N . ALA A 0 83 . -21.474 3.646 42.231 1.00 82.41 83 A 1 ATOM 691 C CA . ALA A 0 83 . -21.274 3.957 43.647 1.00 82.41 83 A 1 ATOM 692 C C . ALA A 0 83 . -22.610 4.417 44.264 1.00 82.41 83 A 1 ATOM 693 C CB . ALA A 0 83 . -20.172 5.014 43.785 1.00 82.41 83 A 1 ATOM 694 O O . ALA A 0 83 . -23.241 5.340 43.751 1.00 82.41 83 A 1 ATOM 695 N N . GLY A 0 84 . -23.064 3.725 45.311 1.00 82.40 84 A 1 ATOM 696 C CA . GLY A 0 84 . -24.362 3.971 45.949 1.00 82.40 84 A 1 ATOM 697 C C . GLY A 0 84 . -25.569 3.241 45.340 1.00 82.40 84 A 1 ATOM 698 O O . GLY A 0 84 . -26.673 3.436 45.836 1.00 82.40 84 A 1 ATOM 699 N N . ALA A 0 85 . -25.398 2.407 44.306 1.00 83.76 85 A 1 ATOM 700 C CA . ALA A 0 85 . -26.460 1.520 43.822 1.00 83.76 85 A 1 ATOM 701 C C . ALA A 0 85 . -25.909 0.216 43.223 1.00 83.76 85 A 1 ATOM 702 C CB . ALA A 0 85 . -27.332 2.262 42.802 1.00 83.76 85 A 1 ATOM 703 O O . ALA A 0 85 . -25.145 0.223 42.247 1.00 83.76 85 A 1 ATOM 704 N N . SER A 0 86 . -26.340 -0.925 43.763 1.00 87.27 86 A 1 ATOM 705 C CA . SER A 0 86 . -25.944 -2.230 43.226 1.00 87.27 86 A 1 ATOM 706 C C . SER A 0 86 . -26.546 -2.471 41.831 1.00 87.27 86 A 1 ATOM 707 C CB . SER A 0 86 . -26.272 -3.357 44.213 1.00 87.27 86 A 1 ATOM 708 O O . SER A 0 86 . -27.581 -1.913 41.458 1.00 87.27 86 A 1 ATOM 709 O OG . SER A 0 86 . -27.659 -3.595 44.279 1.00 87.27 86 A 1 ATOM 710 N N . LEU A 0 87 . -25.910 -3.326 41.016 1.00 84.52 87 A 1 ATOM 711 C CA . LEU A 0 87 . -26.447 -3.685 39.692 1.00 84.52 87 A 1 ATOM 712 C C . LEU A 0 87 . -27.861 -4.284 39.806 1.00 84.52 87 A 1 ATOM 713 C CB . LEU A 0 87 . -25.482 -4.667 38.998 1.00 84.52 87 A 1 ATOM 714 O O . LEU A 0 87 . -28.711 -4.008 38.960 1.00 84.52 87 A 1 ATOM 715 C CG . LEU A 0 87 . -25.922 -5.109 37.586 1.00 84.52 87 A 1 ATOM 716 C CD1 . LEU A 0 87 . -25.969 -3.933 36.603 1.00 84.52 87 A 1 ATOM 717 C CD2 . LEU A 0 87 . -24.944 -6.151 37.045 1.00 84.52 87 A 1 ATOM 718 N N . ALA A 0 88 . -28.108 -5.054 40.870 1.00 85.94 88 A 1 ATOM 719 C CA . ALA A 0 88 . -29.406 -5.641 41.176 1.00 85.94 88 A 1 ATOM 720 C C . ALA A 0 88 . -30.469 -4.566 41.448 1.00 85.94 88 A 1 ATOM 721 C CB . ALA A 0 88 . -29.239 -6.589 42.369 1.00 85.94 88 A 1 ATOM 722 O O . ALA A 0 88 . -31.552 -4.633 40.873 1.00 85.94 88 A 1 ATOM 723 N N . GLU A 0 89 . -30.155 -3.530 42.230 1.00 86.14 89 A 1 ATOM 724 C CA . GLU A 0 89 . -31.064 -2.397 42.465 1.00 86.14 89 A 1 ATOM 725 C C . GLU A 0 89 . -31.379 -1.629 41.176 1.00 86.14 89 A 1 ATOM 726 C CB . GLU A 0 89 . -30.425 -1.417 43.450 1.00 86.14 89 A 1 ATOM 727 O O . GLU A 0 89 . -32.533 -1.269 40.924 1.00 86.14 89 A 1 ATOM 728 C CG . GLU A 0 89 . -30.412 -1.925 44.896 1.00 86.14 89 A 1 ATOM 729 C CD . GLU A 0 89 . -29.208 -1.355 45.646 1.00 86.14 89 A 1 ATOM 730 O OE1 . GLU A 0 89 . -28.580 -2.147 46.373 1.00 86.14 89 A 1 ATOM 731 O OE2 . GLU A 0 89 . -28.785 -0.224 45.327 1.00 86.14 89 A 1 ATOM 732 N N . ILE A 0 90 . -30.370 -1.402 40.327 1.00 85.93 90 A 1 ATOM 733 C CA . ILE A 0 90 . -30.550 -0.735 39.030 1.00 85.93 90 A 1 ATOM 734 C C . ILE A 0 90 . -31.457 -1.578 38.122 1.00 85.93 90 A 1 ATOM 735 C CB . ILE A 0 90 . -29.183 -0.441 38.367 1.00 85.93 90 A 1 ATOM 736 O O . ILE A 0 90 . -32.364 -1.036 37.484 1.00 85.93 90 A 1 ATOM 737 C CG1 . ILE A 0 90 . -28.365 0.562 39.216 1.00 85.93 90 A 1 ATOM 738 C CG2 . ILE A 0 90 . -29.375 0.110 36.937 1.00 85.93 90 A 1 ATOM 739 C CD1 . ILE A 0 90 . -26.900 0.700 38.777 1.00 85.93 90 A 1 ATOM 740 N N . MET A 0 91 . -31.241 -2.896 38.067 1.00 86.89 91 A 1 ATOM 741 C CA . MET A 0 91 . -32.088 -3.816 37.305 1.00 86.89 91 A 1 ATOM 742 C C . MET A 0 91 . -33.510 -3.875 37.865 1.00 86.89 91 A 1 ATOM 743 C CB . MET A 0 91 . -31.478 -5.222 37.269 1.00 86.89 91 A 1 ATOM 744 O O . MET A 0 91 . -34.455 -3.799 37.085 1.00 86.89 91 A 1 ATOM 745 C CG . MET A 0 91 . -30.295 -5.317 36.303 1.00 86.89 91 A 1 ATOM 746 S SD . MET A 0 91 . -29.686 -7.013 36.128 1.00 86.89 91 A 1 ATOM 747 C CE . MET A 0 91 . -28.301 -6.756 34.995 1.00 86.89 91 A 1 ATOM 748 N N . ALA A 0 92 . -33.682 -3.928 39.187 1.00 86.58 92 A 1 ATOM 749 C CA . ALA A 0 92 . -34.992 -3.937 39.831 1.00 86.58 92 A 1 ATOM 750 C C . ALA A 0 92 . -35.800 -2.680 39.473 1.00 86.58 92 A 1 ATOM 751 C CB . ALA A 0 92 . -34.802 -4.092 41.344 1.00 86.58 92 A 1 ATOM 752 O O . ALA A 0 92 . -36.940 -2.795 39.032 1.00 86.58 92 A 1 ATOM 753 N N . LYS A 0 93 . -35.193 -1.484 39.549 1.00 84.99 93 A 1 ATOM 754 C CA . LYS A 0 93 . -35.835 -0.219 39.137 1.00 84.99 93 A 1 ATOM 755 C C . LYS A 0 93 . -36.149 -0.180 37.634 1.00 84.99 93 A 1 ATOM 756 C CB . LYS A 0 93 . -34.948 0.973 39.544 1.00 84.99 93 A 1 ATOM 757 O O . LYS A 0 93 . -37.207 0.307 37.223 1.00 84.99 93 A 1 ATOM 758 C CG . LYS A 0 93 . -34.944 1.215 41.064 1.00 84.99 93 A 1 ATOM 759 C CD . LYS A 0 93 . -34.049 2.406 41.453 1.00 84.99 93 A 1 ATOM 760 C CE . LYS A 0 93 . -34.085 2.621 42.975 1.00 84.99 93 A 1 ATOM 761 N NZ . LYS A 0 93 . -33.202 3.732 43.424 1.00 84.99 93 A 1 ATOM 762 N N . ARG A 0 94 . -35.255 -0.704 36.785 1.00 86.02 94 A 1 ATOM 763 C CA . ARG A 0 94 . -35.463 -0.762 35.324 1.00 86.02 94 A 1 ATOM 764 C C . ARG A 0 94 . -36.541 -1.759 34.902 1.00 86.02 94 A 1 ATOM 765 C CB . ARG A 0 94 . -34.155 -1.088 34.598 1.00 86.02 94 A 1 ATOM 766 O O . ARG A 0 94 . -37.268 -1.456 33.959 1.00 86.02 94 A 1 ATOM 767 C CG . ARG A 0 94 . -33.267 0.153 34.469 1.00 86.02 94 A 1 ATOM 768 C CD . ARG A 0 94 . -32.025 -0.206 33.656 1.00 86.02 94 A 1 ATOM 769 N NE . ARG A 0 94 . -31.122 0.948 33.512 1.00 86.02 94 A 1 ATOM 770 N NH1 . ARG A 0 94 . -29.517 -0.111 32.262 1.00 86.02 94 A 1 ATOM 771 N NH2 . ARG A 0 94 . -29.232 2.027 32.846 1.00 86.02 94 A 1 ATOM 772 C CZ . ARG A 0 94 . -29.965 0.950 32.877 1.00 86.02 94 A 1 ATOM 773 N N . ASN A 0 95 . -36.675 -2.871 35.613 1.00 88.50 95 A 1 ATOM 774 C CA . ASN A 0 95 . -37.605 -3.952 35.290 1.00 88.50 95 A 1 ATOM 775 C C . ASN A 0 95 . -38.963 -3.821 36.004 1.00 88.50 95 A 1 ATOM 776 C CB . ASN A 0 95 . -36.915 -5.301 35.558 1.00 88.50 95 A 1 ATOM 777 O O . ASN A 0 95 . -39.782 -4.734 35.925 1.00 88.50 95 A 1 ATOM 778 C CG . ASN A 0 95 . -35.725 -5.571 34.651 1.00 88.50 95 A 1 ATOM 779 N ND2 . ASN A 0 95 . -34.921 -6.553 34.985 1.00 88.50 95 A 1 ATOM 780 O OD1 . ASN A 0 95 . -35.501 -4.929 33.636 1.00 88.50 95 A 1 ATOM 781 N N . GLN A 0 96 . -39.237 -2.698 36.681 1.00 88.36 96 A 1 ATOM 782 C CA . GLN A 0 96 . -40.575 -2.407 37.200 1.00 88.36 96 A 1 ATOM 783 C C . GLN A 0 96 . -41.599 -2.424 36.061 1.00 88.36 96 A 1 ATOM 784 C CB . GLN A 0 96 . -40.616 -1.044 37.901 1.00 88.36 96 A 1 ATOM 785 O O . GLN A 0 96 . -41.450 -1.703 35.067 1.00 88.36 96 A 1 ATOM 786 C CG . GLN A 0 96 . -39.925 -1.068 39.269 1.00 88.36 96 A 1 ATOM 787 C CD . GLN A 0 96 . -39.879 0.305 39.926 1.00 88.36 96 A 1 ATOM 788 N NE2 . GLN A 0 96 . -39.438 0.392 41.161 1.00 88.36 96 A 1 ATOM 789 O OE1 . GLN A 0 96 . -40.205 1.320 39.333 1.00 88.36 96 A 1 ATOM 790 N N . LYS A 0 97 . -42.648 -3.235 36.233 1.00 89.65 97 A 1 ATOM 791 C CA . LYS A 0 97 . -43.764 -3.327 35.290 1.00 89.65 97 A 1 ATOM 792 C C . LYS A 0 97 . -44.378 -1.939 35.045 1.00 89.65 97 A 1 ATOM 793 C CB . LYS A 0 97 . -44.825 -4.316 35.805 1.00 89.65 97 A 1 ATOM 794 O O . LYS A 0 97 . -44.412 -1.114 35.965 1.00 89.65 97 A 1 ATOM 795 C CG . LYS A 0 97 . -44.359 -5.780 35.742 1.00 89.65 97 A 1 ATOM 796 C CD . LYS A 0 97 . -45.509 -6.707 36.161 1.00 89.65 97 A 1 ATOM 797 C CE . LYS A 0 97 . -45.128 -8.189 36.056 1.00 89.65 97 A 1 ATOM 798 N NZ . LYS A 0 97 . -46.287 -9.050 36.411 1.00 89.65 97 A 1 ATOM 799 N N . PRO A 0 98 . -44.883 -1.668 33.828 1.00 88.89 98 A 1 ATOM 800 C CA . PRO A 0 98 . -45.466 -0.370 33.488 1.00 88.89 98 A 1 ATOM 801 C C . PRO A 0 98 . -46.626 0.022 34.415 1.00 88.89 98 A 1 ATOM 802 C CB . PRO A 0 98 . -45.907 -0.494 32.024 1.00 88.89 98 A 1 ATOM 803 O O . PRO A 0 98 . -46.773 1.200 34.725 1.00 88.89 98 A 1 ATOM 804 C CG . PRO A 0 98 . -46.066 -1.999 31.803 1.00 88.89 98 A 1 ATOM 805 C CD . PRO A 0 98 . -44.988 -2.589 32.704 1.00 88.89 98 A 1 ATOM 806 N N . GLU A 0 99 . -47.381 -0.957 34.919 1.00 89.29 99 A 1 ATOM 807 C CA . GLU A 0 99 . -48.462 -0.784 35.901 1.00 89.29 99 A 1 ATOM 808 C C . GLU A 0 99 . -47.962 -0.172 37.216 1.00 89.29 99 A 1 ATOM 809 C CB . GLU A 0 99 . -49.066 -2.163 36.191 1.00 89.29 99 A 1 ATOM 810 O O . GLU A 0 99 . -48.495 0.838 37.669 1.00 89.29 99 A 1 ATOM 811 C CG . GLU A 0 99 . -49.769 -2.787 34.972 1.00 89.29 99 A 1 ATOM 812 C CD . GLU A 0 99 . -49.881 -4.317 35.056 1.00 89.29 99 A 1 ATOM 813 O OE1 . GLU A 0 99 . -50.303 -4.899 34.037 1.00 89.29 99 A 1 ATOM 814 O OE2 . GLU A 0 99 . -49.409 -4.907 36.057 1.00 89.29 99 A 1 ATOM 815 N N . VAL A 0 100 . -46.881 -0.724 37.784 1.00 88.20 100 A 1 ATOM 816 C CA . VAL A 0 100 . -46.261 -0.227 39.025 1.00 88.20 100 A 1 ATOM 817 C C . VAL A 0 100 . -45.756 1.199 38.827 1.00 88.20 100 A 1 ATOM 818 C CB . VAL A 0 100 . -45.107 -1.147 39.478 1.00 88.20 100 A 1 ATOM 819 O O . VAL A 0 100 . -45.979 2.068 39.665 1.00 88.20 100 A 1 ATOM 820 C CG1 . VAL A 0 100 . -44.439 -0.649 40.766 1.00 88.20 100 A 1 ATOM 821 C CG2 . VAL A 0 100 . -45.600 -2.580 39.728 1.00 88.20 100 A 1 ATOM 822 N N . ARG A 0 101 . -45.129 1.476 37.677 1.00 88.15 101 A 1 ATOM 823 C CA . ARG A 0 101 . -44.674 2.833 37.345 1.00 88.15 101 A 1 ATOM 824 C C . ARG A 0 101 . -45.829 3.817 37.199 1.00 88.15 101 A 1 ATOM 825 C CB . ARG A 0 101 . -43.847 2.830 36.062 1.00 88.15 101 A 1 ATOM 826 O O . ARG A 0 101 . -45.676 4.963 37.604 1.00 88.15 101 A 1 ATOM 827 C CG . ARG A 0 101 . -42.470 2.211 36.287 1.00 88.15 101 A 1 ATOM 828 C CD . ARG A 0 101 . -41.659 2.378 35.006 1.00 88.15 101 A 1 ATOM 829 N NE . ARG A 0 101 . -40.284 1.917 35.210 1.00 88.15 101 A 1 ATOM 830 N NH1 . ARG A 0 101 . -39.780 1.432 33.015 1.00 88.15 101 A 1 ATOM 831 N NH2 . ARG A 0 101 . -38.336 0.954 34.638 1.00 88.15 101 A 1 ATOM 832 C CZ . ARG A 0 101 . -39.478 1.445 34.284 1.00 88.15 101 A 1 ATOM 833 N N . LYS A 0 102 . -46.948 3.399 36.599 1.00 89.92 102 A 1 ATOM 834 C CA . LYS A 0 102 . -48.134 4.246 36.442 1.00 89.92 102 A 1 ATOM 835 C C . LYS A 0 102 . -48.743 4.579 37.805 1.00 89.92 102 A 1 ATOM 836 C CB . LYS A 0 102 . -49.138 3.580 35.488 1.00 89.92 102 A 1 ATOM 837 O O . LYS A 0 102 . -48.922 5.755 38.082 1.00 89.92 102 A 1 ATOM 838 C CG . LYS A 0 102 . -50.285 4.548 35.171 1.00 89.92 102 A 1 ATOM 839 C CD . LYS A 0 102 . -51.353 3.917 34.274 1.00 89.92 102 A 1 ATOM 840 C CE . LYS A 0 102 . -52.499 4.928 34.155 1.00 89.92 102 A 1 ATOM 841 N NZ . LYS A 0 102 . -53.670 4.369 33.435 1.00 89.92 102 A 1 ATOM 842 N N . ALA A 0 103 . -48.920 3.587 38.679 1.00 90.36 103 A 1 ATOM 843 C CA . ALA A 0 103 . -49.417 3.804 40.038 1.00 90.36 103 A 1 ATOM 844 C C . ALA A 0 103 . -48.546 4.796 40.834 1.00 90.36 103 A 1 ATOM 845 C CB . ALA A 0 103 . -49.508 2.443 40.740 1.00 90.36 103 A 1 ATOM 846 O O . ALA A 0 103 . -49.074 5.717 41.449 1.00 90.36 103 A 1 ATOM 847 N N . MET A 0 104 . -47.212 4.669 40.761 1.00 88.89 104 A 1 ATOM 848 C CA . MET A 0 104 . -46.296 5.620 41.410 1.00 88.89 104 A 1 ATOM 849 C C . MET A 0 104 . -46.398 7.041 40.832 1.00 88.89 104 A 1 ATOM 850 C CB . MET A 0 104 . -44.841 5.136 41.299 1.00 88.89 104 A 1 ATOM 851 O O . MET A 0 104 . -46.261 8.006 41.578 1.00 88.89 104 A 1 ATOM 852 C CG . MET A 0 104 . -44.552 3.873 42.118 1.00 88.89 104 A 1 ATOM 853 S SD . MET A 0 104 . -42.808 3.357 42.084 1.00 88.89 104 A 1 ATOM 854 C CE . MET A 0 104 . -42.174 4.395 43.431 1.00 88.89 104 A 1 ATOM 855 N N . ARG A 0 105 . -46.628 7.191 39.517 1.00 90.61 105 A 1 ATOM 856 C CA . ARG A 0 105 . -46.832 8.510 38.886 1.00 90.61 105 A 1 ATOM 857 C C . ARG A 0 105 . -48.157 9.135 39.297 1.00 90.61 105 A 1 ATOM 858 C CB . ARG A 0 105 . -46.806 8.424 37.359 1.00 90.61 105 A 1 ATOM 859 O O . ARG A 0 105 . -48.167 10.304 39.654 1.00 90.61 105 A 1 ATOM 860 C CG . ARG A 0 105 . -45.410 8.207 36.773 1.00 90.61 105 A 1 ATOM 861 C CD . ARG A 0 105 . -45.553 8.165 35.248 1.00 90.61 105 A 1 ATOM 862 N NE . ARG A 0 105 . -44.518 7.326 34.617 1.00 90.61 105 A 1 ATOM 863 N NH1 . ARG A 0 105 . -45.864 6.408 32.996 1.00 90.61 105 A 1 ATOM 864 N NH2 . ARG A 0 105 . -43.710 5.841 33.093 1.00 90.61 105 A 1 ATOM 865 C CZ . ARG A 0 105 . -44.704 6.529 33.581 1.00 90.61 105 A 1 ATOM 866 N N . ASP A 0 106 . -49.240 8.365 39.258 1.00 91.09 106 A 1 ATOM 867 C CA . ASP A 0 106 . -50.579 8.844 39.606 1.00 91.09 106 A 1 ATOM 868 C C . ASP A 0 106 . -50.625 9.278 41.082 1.00 91.09 106 A 1 ATOM 869 C CB . ASP A 0 106 . -51.625 7.752 39.295 1.00 91.09 106 A 1 ATOM 870 O O . ASP A 0 106 . -51.204 10.312 41.404 1.00 91.09 106 A 1 ATOM 871 C CG . ASP A 0 106 . -51.784 7.404 37.800 1.00 91.09 106 A 1 ATOM 872 O OD1 . ASP A 0 106 . -51.322 8.179 36.932 1.00 91.09 106 A 1 ATOM 873 O OD2 . ASP A 0 106 . -52.357 6.328 37.497 1.00 91.09 106 A 1 ATOM 874 N N . GLN A 0 107 . -49.938 8.547 41.971 1.00 90.75 107 A 1 ATOM 875 C CA . GLN A 0 107 . -49.773 8.939 43.373 1.00 90.75 107 A 1 ATOM 876 C C . GLN A 0 107 . -48.960 10.231 43.541 1.00 90.75 107 A 1 ATOM 877 C CB . GLN A 0 107 . -49.123 7.784 44.152 1.00 90.75 107 A 1 ATOM 878 O O . GLN A 0 107 . -49.282 11.013 44.421 1.00 90.75 107 A 1 ATOM 879 C CG . GLN A 0 107 . -49.039 8.081 45.660 1.00 90.75 107 A 1 ATOM 880 C CD . GLN A 0 107 . -48.431 6.947 46.477 1.00 90.75 107 A 1 ATOM 881 N NE2 . GLN A 0 107 . -48.437 7.063 47.786 1.00 90.75 107 A 1 ATOM 882 O OE1 . GLN A 0 107 . -47.934 5.950 45.976 1.00 90.75 107 A 1 ATOM 883 N N . ALA A 0 108 . -47.918 10.454 42.733 1.00 89.96 108 A 1 ATOM 884 C CA . ALA A 0 108 . -47.063 11.641 42.833 1.00 89.96 108 A 1 ATOM 885 C C . ALA A 0 108 . -47.688 12.917 42.239 1.00 89.96 108 A 1 ATOM 886 C CB . ALA A 0 108 . -45.727 11.321 42.151 1.00 89.96 108 A 1 ATOM 887 O O . ALA A 0 108 . -47.210 14.012 42.516 1.00 89.96 108 A 1 ATOM 888 N N . ILE A 0 109 . -48.704 12.777 41.380 1.00 89.23 109 A 1 ATOM 889 C CA . ILE A 0 109 . -49.479 13.902 40.832 1.00 89.23 109 A 1 ATOM 890 C C . ILE A 0 109 . -50.499 14.422 41.856 1.00 89.23 109 A 1 ATOM 891 C CB . ILE A 0 109 . -50.154 13.461 39.509 1.00 89.23 109 A 1 ATOM 892 O O . ILE A 0 109 . -50.892 15.586 41.786 1.00 89.23 109 A 1 ATOM 893 C CG1 . ILE A 0 109 . -49.080 13.292 38.408 1.00 89.23 109 A 1 ATOM 894 C CG2 . ILE A 0 109 . -51.231 14.452 39.022 1.00 89.23 109 A 1 ATOM 895 C CD1 . ILE A 0 109 . -49.574 12.540 37.165 1.00 89.23 109 A 1 ATOM 896 N N . ARG A 0 110 . -50.940 13.556 42.772 1.00 76.16 110 A 1 ATOM 897 C CA . ARG A 0 110 . -51.873 13.892 43.845 1.00 76.16 110 A 1 ATOM 898 C C . ARG A 0 110 . -51.165 14.582 45.006 1.00 76.16 110 A 1 ATOM 899 C CB . ARG A 0 110 . -52.582 12.607 44.284 1.00 76.16 110 A 1 ATOM 900 O O . ARG A 0 110 . -51.816 15.472 45.591 1.00 76.16 110 A 1 ATOM 901 C CG . ARG A 0 110 . -53.661 12.913 45.323 1.00 76.16 110 A 1 ATOM 902 C CD . ARG A 0 110 . -54.426 11.638 45.667 1.00 76.16 110 A 1 ATOM 903 N NE . ARG A 0 110 . -55.477 11.916 46.657 1.00 76.16 110 A 1 ATOM 904 N NH1 . ARG A 0 110 . -56.606 9.936 46.455 1.00 76.16 110 A 1 ATOM 905 N NH2 . ARG A 0 110 . -57.349 11.497 47.868 1.00 76.16 110 A 1 ATOM 906 C CZ . ARG A 0 110 . -56.469 11.117 46.987 1.00 76.16 110 A 1 ATOM 907 O OXT . ARG A 0 110 . -50.058 14.119 45.343 1.00 76.16 110 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 89.29 # loop_ _atom_type.symbol C N O S #