data_3rwd_1 # 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 . ILE A ? 1 ? -51.174 60.732 65.644 1.0 35.33 1 C 1 ATOM 2 C CA . ILE A ? 1 ? -50.832 60.442 64.267 1.0 27.77 1 C 1 ATOM 3 C C . ILE A ? 1 ? -49.327 60.302 64.188 1.0 28.6 1 C 1 ATOM 4 O O . ILE A ? 1 ? -48.715 59.993 65.144 1.0 25.96 1 C 1 ATOM 5 C CB . ILE A ? 1 ? -51.313 61.560 63.436 1.0 29.57 1 C 1 ATOM 6 C CG1 . ILE A ? 1 ? -51.410 62.795 64.280 1.0 29.66 1 C 1 ATOM 7 C CG2 . ILE A ? 1 ? -52.675 61.311 63.088 1.0 33.32 1 C 1 ATOM 8 C CD1 . ILE A ? 1 ? -51.598 63.925 63.498 1.0 25.2 1 C 1 ATOM 9 N N . ARG A ? 2 ? -48.730 60.484 63.045 1.0 22.6 2 C 1 ATOM 10 C CA . ARG A ? 2 ? -47.273 60.445 62.998 1.0 24.99 2 C 1 ATOM 11 C C . ARG A ? 2 ? -46.658 61.457 63.958 1.0 30.5 2 C 1 ATOM 12 O O . ARG A ? 2 ? -47.334 62.372 64.428 1.0 26.9 2 C 1 ATOM 13 C CB . ARG A ? 2 ? -46.769 60.707 61.577 1.0 22.38 2 C 1 ATOM 14 C CG . ARG A ? 2 ? -47.125 59.627 60.572 1.0 26.7 2 C 1 ATOM 15 C CD . ARG A ? 2 ? -46.453 59.895 59.236 1.0 19.87 2 C 1 ATOM 16 N NE . ARG A ? 2 ? -46.741 58.854 58.254 1.0 27.05 2 C 1 ATOM 17 C CZ . ARG A ? 2 ? -46.047 57.728 58.136 1.0 26.76 2 C 1 ATOM 18 N NH1 . ARG A ? 2 ? -45.022 57.493 58.943 1.0 27.61 2 C 1 ATOM 19 N NH2 . ARG A ? 2 ? -46.377 56.836 57.212 1.0 17.85 2 C 1 ATOM 20 N N . TYR A ? 3 ? -45.373 61.287 64.248 1.0 28.32 3 C 1 ATOM 21 C CA . TYR A ? 3 ? -44.663 62.210 65.123 1.0 28.63 3 C 1 ATOM 22 C C . TYR A ? 3 ? -44.221 63.452 64.359 1.0 27.02 3 C 1 ATOM 23 O O . TYR A ? 3 ? -43.473 63.354 63.386 1.0 28.13 3 C 1 ATOM 24 C CB . TYR A ? 3 ? -43.453 61.531 65.768 1.0 23.76 3 C 1 ATOM 25 C CG . TYR A ? 3 ? -42.616 62.468 66.612 1.0 22.36 3 C 1 ATOM 26 C CD1 . TYR A ? 3 ? -42.989 62.781 67.912 1.0 24.94 3 C 1 ATOM 27 C CD2 . TYR A ? 3 ? -41.455 63.039 66.107 1.0 26.69 3 C 1 ATOM 28 C CE1 . TYR A ? 3 ? -42.230 63.638 68.686 1.0 27.2 3 C 1 ATOM 29 C CE2 . TYR A ? 3 ? -40.689 63.895 66.875 1.0 33.82 3 C 1 ATOM 30 C CZ . TYR A ? 3 ? -41.080 64.191 68.163 1.0 24.18 3 C 1 ATOM 31 O OH . TYR A ? 3 ? -40.321 65.044 68.931 1.0 24.61 3 C 1 ATOM 32 N N . PRO A ? 4 ? -44.688 64.626 64.801 1.0 33.43 4 C 1 ATOM 33 C CA . PRO A ? 4 ? -44.337 65.903 64.174 1.0 35.94 4 C 1 ATOM 34 C C . PRO A ? 4 ? -42.924 66.339 64.547 1.0 34.57 4 C 1 ATOM 35 O O . PRO A ? 4 ? -42.651 66.592 65.719 1.0 35.35 4 C 1 ATOM 36 C CB . PRO A ? 4 ? -45.363 66.870 64.768 1.0 31.4 4 C 1 ATOM 37 C CG . PRO A ? 4 ? -45.681 66.292 66.104 1.0 25.45 4 C 1 ATOM 38 C CD . PRO A ? 4 ? -45.611 64.799 65.938 1.0 27.54 4 C 1 ATOM 39 N N . LYS A ? 5 ? -42.037 66.421 63.561 1.0 37.24 5 C 1 ATOM 40 C CA . LYS A ? 5 ? -40.663 66.839 63.815 1.0 34.27 5 C 1 ATOM 41 C C . LYS A ? 5 ? -40.579 68.351 63.981 1.0 35.88 5 C 1 ATOM 42 O O . LYS A ? 5 ? -40.907 69.103 63.063 1.0 46.09 5 C 1 ATOM 43 C CB . LYS A ? 5 ? -39.737 66.395 62.680 1.0 33.27 5 C 1 ATOM 44 C CG . LYS A ? 5 ? -38.261 66.444 63.047 1.0 37.16 5 C 1 ATOM 45 C CD . LYS A ? 5 ? -37.374 66.642 61.828 1.0 34.36 5 C 1 ATOM 46 C CE . LYS A ? 5 ? -37.494 68.058 61.289 1.0 39.9 5 C 1 ATOM 47 N NZ . LYS A ? 5 ? -36.528 68.318 60.186 1.0 44.05 5 C 1 ATOM 48 N N . THR A ? 6 ? -40.139 68.792 65.155 1.0 36.74 6 C 1 ATOM 49 C CA . THR A ? 6 ? -39.966 70.217 65.419 1.0 42.14 6 C 1 ATOM 50 C C . THR A ? 6 ? -38.495 70.618 65.371 1.0 48.17 6 C 1 ATOM 51 O O . THR A ? 6 ? -38.133 71.601 64.728 1.0 59.14 6 C 1 ATOM 52 C CB . THR A ? 6 ? -40.570 70.624 66.778 1.0 46.41 6 C 1 ATOM 53 C CG2 . THR A ? 6 ? -42.052 70.928 66.632 1.0 27.11 6 C 1 ATOM 54 O OG1 . THR A ? 6 ? -40.402 69.555 67.716 1.0 42.42 6 C 1 ATOM 55 N N . PHE A ? 7 ? -37.651 69.853 66.056 1.0 42.66 7 C 1 ATOM 56 C CA . PHE A ? 7 ? -36.217 70.111 66.050 1.0 36.53 7 C 1 ATOM 57 C C . PHE A ? 7 ? -35.472 68.998 65.328 1.0 35.72 7 C 1 ATOM 58 O O . PHE A ? 7 ? -34.467 69.240 64.662 1.0 36.13 7 C 1 ATOM 59 C CB . PHE A ? 7 ? -35.685 70.251 67.476 1.0 42.08 7 C 1 ATOM 60 C CG . PHE A ? 7 ? -34.198 70.438 67.548 1.0 44.74 7 C 1 ATOM 61 C CD1 . PHE A ? 7 ? -33.361 69.364 67.800 1.0 35.19 7 C 1 ATOM 62 C CD2 . PHE A ? 7 ? -33.634 71.687 67.353 1.0 39.38 7 C 1 ATOM 63 C CE1 . PHE A ? 7 ? -31.991 69.533 67.864 1.0 34.01 7 C 1 ATOM 64 C CE2 . PHE A ? 7 ? -32.266 71.865 67.417 1.0 37.58 7 C 1 ATOM 65 C CZ . PHE A ? 7 ? -31.442 70.786 67.671 1.0 28.87 7 C 1 ATOM 66 N N . GLY A ? 8 ? -35.967 67.773 65.469 1.0 32.8 8 C 1 ATOM 67 C CA . GLY A ? 8 ? -35.356 66.628 64.820 1.0 33.15 8 C 1 ATOM 68 C C . GLY A ? 8 ? -34.715 65.657 65.795 1.0 36.92 8 C 1 ATOM 69 O O . GLY A ? 8 ? -34.516 65.976 66.967 1.0 34.71 8 C 1 ATOM 70 N N . TRP A ? 9 ? -34.391 64.464 65.308 1.0 34.53 9 C 1 ATOM 71 C CA . TRP A ? 9 ? -33.753 63.447 66.137 1.0 27.92 9 C 1 ATOM 72 C C . TRP A ? 9 ? -32.500 62.903 65.454 1.0 27.6 9 C 1 ATOM 73 O O . TRP A ? 9 ? -32.304 61.692 65.356 1.0 25.56 9 C 1 ATOM 74 C CB . TRP A ? 9 ? -34.735 62.313 66.455 1.0 26.66 9 C 1 ATOM 75 C CG . TRP A ? 9 ? -35.327 61.661 65.239 1.0 32.23 9 C 1 ATOM 76 C CD1 . TRP A ? 9 ? -34.830 60.587 64.555 1.0 30.45 9 C 1 ATOM 77 C CD2 . TRP A ? 9 ? -36.525 62.046 64.560 1.0 33.35 9 C 1 ATOM 78 C CE2 . TRP A ? 9 ? -36.696 61.161 63.476 1.0 34.48 9 C 1 ATOM 79 C CE3 . TRP A ? 9 ? -37.472 63.051 64.765 1.0 30.61 9 C 1 ATOM 80 N NE1 . TRP A ? 9 ? -35.647 60.280 63.494 1.0 29.28 9 C 1 ATOM 81 C CZ2 . TRP A ? 9 ? -37.774 61.254 62.601 1.0 36.28 9 C 1 ATOM 82 C CZ3 . TRP A ? 9 ? -38.538 63.142 63.898 1.0 33.91 9 C 1 ATOM 83 C CH2 . TRP A ? 9 ? -38.683 62.251 62.829 1.0 38.18 9 C 1 ATOM 84 N N . LEU A ? 10 ? -31.654 63.813 64.982 1.0 23.04 10 C 1 ATOM 85 C CA . LEU A ? 10 ? -30.417 63.433 64.307 1.0 23.48 10 C 1 ATOM 86 C C . LEU A ? 10 ? -29.527 62.572 65.200 1.0 21.04 10 C 1 ATOM 87 O O . LEU A ? 10 ? -29.364 62.851 66.387 1.0 24.29 10 C 1 ATOM 88 C CB . LEU A ? 10 ? -29.648 64.678 63.862 1.0 20.81 10 C 1 ATOM 89 C CG . LEU A ? 10 ? -30.385 65.647 62.935 1.0 24.12 10 C 1 ATOM 90 C CD1 . LEU A ? 10 ? -29.548 66.894 62.691 1.0 7.74 10 C 1 ATOM 91 C CD2 . LEU A ? 10 ? -30.744 64.969 61.622 1.0 20.67 10 C 1 ATOM 92 N N . TRP A ? 11 ? -28.953 61.523 64.617 1.0 18.68 11 C 1 ATOM 93 C CA . TRP A ? 11 ? -28.041 60.649 65.344 1.0 17.05 11 C 1 ATOM 94 C C . TRP A ? 11 ? -26.693 61.324 65.563 1.0 18.07 11 C 1 ATOM 95 O O . TRP A ? 11 ? -25.951 60.978 66.484 1.0 18.65 11 C 1 ATOM 96 C CB . TRP A ? 11 ? -27.847 59.326 64.600 1.0 22.41 11 C 1 ATOM 97 C CG . TRP A ? 11 ? -29.044 58.426 64.638 1.0 21.67 11 C 1 ATOM 98 C CD1 . TRP A ? 11 ? -30.282 58.731 65.123 1.0 22.79 11 C 1 ATOM 99 C CD2 . TRP A ? 11 ? -29.114 57.071 64.179 1.0 25.14 11 C 1 ATOM 100 C CE2 . TRP A ? 11 ? -30.427 56.618 64.415 1.0 24.25 11 C 1 ATOM 101 C CE3 . TRP A ? 11 ? -28.195 56.198 63.590 1.0 19.8 11 C 1 ATOM 102 N NE1 . TRP A ? 11 ? -31.121 57.650 64.991 1.0 24.03 11 C 1 ATOM 103 C CZ2 . TRP A ? 11 ? -30.844 55.330 64.082 1.0 16.24 11 C 1 ATOM 104 C CZ3 . TRP A ? 11 ? -28.610 54.920 63.261 1.0 16.73 11 C 1 ATOM 105 C CH2 . TRP A ? 11 ? -29.922 54.499 63.507 1.0 19.49 11 C 1 ATOM 106 O OXT . TRP A ? 11 ? -26.312 62.231 64.825 1.0 23.32 11 C 1 #