data_3rwf_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 . GLN A ? 1 ? -51.950 59.799 63.678 1.0 43.36 1 C 1 ATOM 2 C CA . GLN A ? 1 ? -51.025 60.507 62.802 1.0 48.37 1 C 1 ATOM 3 C C . GLN A ? 1 ? -49.604 60.393 63.344 1.0 33.96 1 C 1 ATOM 4 O O . GLN A ? 1 ? -49.402 60.207 64.543 1.0 29.45 1 C 1 ATOM 5 C CB . GLN A ? 1 ? -51.437 61.975 62.665 1.0 60.57 1 C 1 ATOM 6 C CG . GLN A ? 1 ? -50.911 62.659 61.411 1.0 77.08 1 C 1 ATOM 7 C CD . GLN A ? 1 ? -51.601 63.983 61.134 1.0 84.91 1 C 1 ATOM 8 N NE2 . GLN A ? 1 ? -51.534 64.437 59.887 1.0 74.32 1 C 1 ATOM 9 O OE1 . GLN A ? 1 ? -52.195 64.585 62.029 1.0 90.39 1 C 1 ATOM 10 N N . THR A ? 2 ? -48.620 60.494 62.456 1.0 28.31 2 C 1 ATOM 11 C CA . THR A ? 2 ? -47.223 60.342 62.851 1.0 31.08 2 C 1 ATOM 12 C C . THR A ? 2 ? -46.771 61.472 63.766 1.0 33.46 2 C 1 ATOM 13 O O . THR A ? 2 ? -47.479 62.462 63.943 1.0 34.04 2 C 1 ATOM 14 C CB . THR A ? 2 ? -46.290 60.271 61.629 1.0 29.41 2 C 1 ATOM 15 C CG2 . THR A ? 2 ? -46.554 59.007 60.830 1.0 24.45 2 C 1 ATOM 16 O OG1 . THR A ? 2 ? -46.506 61.414 60.793 1.0 41.75 2 C 1 ATOM 17 N N . SER A ? 3 ? -45.586 61.318 64.346 1.0 43.55 3 C 1 ATOM 18 C CA . SER A ? 3 ? -45.057 62.316 65.264 1.0 42.88 3 C 1 ATOM 19 C C . SER A ? 3 ? -44.371 63.460 64.529 1.0 53.38 3 C 1 ATOM 20 O O . SER A ? 3 ? -43.759 63.270 63.476 1.0 44.64 3 C 1 ATOM 21 C CB . SER A ? 3 ? -44.084 61.680 66.258 1.0 44.51 3 C 1 ATOM 22 O OG . SER A ? 3 ? -43.579 62.650 67.162 1.0 38.64 3 C 1 ATOM 23 N N . GLN A ? 4 ? -44.480 64.651 65.103 1.0 62.24 4 C 1 ATOM 24 C CA . GLN A ? 4 ? -43.862 65.842 64.545 1.0 60.51 4 C 1 ATOM 25 C C . GLN A ? 4 ? -42.351 65.808 64.747 1.0 55.44 4 C 1 ATOM 26 O O . GLN A ? 4 ? -41.601 66.443 64.007 1.0 65.69 4 C 1 ATOM 27 C CB . GLN A ? 4 ? -44.451 67.083 65.217 1.0 60.12 4 C 1 ATOM 28 C CG . GLN A ? 4 ? -43.820 68.396 64.797 1.0 65.51 4 C 1 ATOM 29 C CD . GLN A ? 4 ? -44.288 69.556 65.654 1.0 74.71 4 C 1 ATOM 30 N NE2 . GLN A ? 4 ? -43.851 70.762 65.309 1.0 80.35 4 C 1 ATOM 31 O OE1 . GLN A ? 4 ? -45.033 69.368 66.616 1.0 69.76 4 C 1 ATOM 32 N N . TRP A ? 5 ? -41.910 65.054 65.746 1.0 47.71 5 C 1 ATOM 33 C CA . TRP A ? 5 ? -40.509 65.071 66.150 1.0 54.22 5 C 1 ATOM 34 C C . TRP A ? 5 ? -39.735 63.823 65.734 1.0 46.87 5 C 1 ATOM 35 O O . TRP A ? 5 ? -40.157 62.694 65.988 1.0 47.23 5 C 1 ATOM 36 C CB . TRP A ? 5 ? -40.398 65.280 67.661 1.0 62.41 5 C 1 ATOM 37 C CG . TRP A ? 5 ? -41.230 66.424 68.151 1.0 74.78 5 C 1 ATOM 38 C CD1 . TRP A ? 5 ? -42.339 66.352 68.941 1.0 77.56 5 C 1 ATOM 39 C CD2 . TRP A ? 5 ? -41.029 67.814 67.867 1.0 82.47 5 C 1 ATOM 40 C CE2 . TRP A ? 5 ? -42.051 68.526 68.526 1.0 81.88 5 C 1 ATOM 41 C CE3 . TRP A ? 5 ? -40.081 68.525 67.122 1.0 84.28 5 C 1 ATOM 42 N NE1 . TRP A ? 5 ? -42.837 67.611 69.175 1.0 80.73 5 C 1 ATOM 43 C CZ2 . TRP A ? 5 ? -42.151 69.915 68.463 1.0 76.96 5 C 1 ATOM 44 C CZ3 . TRP A ? 5 ? -40.184 69.904 67.063 1.0 81.22 5 C 1 ATOM 45 C CH2 . TRP A ? 5 ? -41.211 70.583 67.728 1.0 75.12 5 C 1 ATOM 46 N N . ASP A ? 6 ? -38.591 64.045 65.098 1.0 30.94 6 C 1 ATOM 47 C CA . ASP A ? 6 ? -37.731 62.961 64.648 1.0 41.72 6 C 1 ATOM 48 C C . ASP A ? 6 ? -36.293 63.466 64.563 1.0 36.46 6 C 1 ATOM 49 O O . ASP A ? 6 ? -35.790 63.765 63.480 1.0 44.75 6 C 1 ATOM 50 C CB . ASP A ? 6 ? -38.202 62.441 63.285 1.0 51.83 6 C 1 ATOM 51 C CG . ASP A ? 6 ? -37.605 61.092 62.934 1.0 60.38 6 C 1 ATOM 52 O OD1 . ASP A ? 6 ? -36.434 60.841 63.292 1.0 74.35 6 C 1 ATOM 53 O OD2 . ASP A ? 6 ? -38.308 60.277 62.301 1.0 48.23 6 C 1 ATOM 54 N N . ASP A ? 7 ? -35.640 63.566 65.717 1.0 23.51 7 C 1 ATOM 55 C CA . ASP A ? 7 ? -34.286 64.108 65.794 1.0 24.06 7 C 1 ATOM 56 C C . ASP A ? 7 ? -33.255 63.254 65.064 1.0 26.56 7 C 1 ATOM 57 O O . ASP A ? 7 ? -33.328 62.026 65.082 1.0 31.25 7 C 1 ATOM 58 C CB . ASP A ? 7 ? -33.866 64.305 67.252 1.0 31.76 7 C 1 ATOM 59 C CG . ASP A ? 7 ? -34.472 65.547 67.869 1.0 46.2 7 C 1 ATOM 60 O OD1 . ASP A ? 7 ? -35.557 65.969 67.412 1.0 46.72 7 C 1 ATOM 61 O OD2 . ASP A ? 7 ? -33.864 66.105 68.806 1.0 51.09 7 C 1 ATOM 62 N N . PRO A ? 8 ? -32.281 63.914 64.424 1.0 27.15 8 C 1 ATOM 63 C CA . PRO A ? 8 ? -31.191 63.270 63.685 1.0 27.38 8 C 1 ATOM 64 C C . PRO A ? 8 ? -30.318 62.413 64.594 1.0 29.08 8 C 1 ATOM 65 O O . PRO A ? 8 ? -30.271 62.649 65.801 1.0 21.04 8 C 1 ATOM 66 C CB . PRO A ? 8 ? -30.373 64.457 63.164 1.0 23.04 8 C 1 ATOM 67 C CG . PRO A ? 8 ? -31.309 65.614 63.188 1.0 17.6 8 C 1 ATOM 68 C CD . PRO A ? 8 ? -32.197 65.382 64.361 1.0 24.47 8 C 1 ATOM 69 N N . TRP A ? 9 ? -29.636 61.433 64.010 1.0 31.67 9 C 1 ATOM 70 C CA . TRP A ? 9 ? -28.694 60.602 64.748 1.0 33.62 9 C 1 ATOM 71 C C . TRP A ? 9 ? -27.395 61.353 65.011 1.0 35.51 9 C 1 ATOM 72 O O . TRP A ? 9 ? -26.578 60.928 65.826 1.0 33.53 9 C 1 ATOM 73 C CB . TRP A ? 9 ? -28.395 59.315 63.980 1.0 28.26 9 C 1 ATOM 74 C CG . TRP A ? 9 ? -29.488 58.300 64.057 1.0 29.23 9 C 1 ATOM 75 C CD1 . TRP A ? 9 ? -30.773 58.505 64.463 1.0 28.34 9 C 1 ATOM 76 C CD2 . TRP A ? 9 ? -29.386 56.912 63.730 1.0 31.8 9 C 1 ATOM 77 C CE2 . TRP A ? 9 ? -30.651 56.334 63.954 1.0 32.6 9 C 1 ATOM 78 C CE3 . TRP A ? 9 ? -28.347 56.098 63.265 1.0 29.88 9 C 1 ATOM 79 N NE1 . TRP A ? 9 ? -31.482 57.329 64.403 1.0 25.92 9 C 1 ATOM 80 C CZ2 . TRP A ? 9 ? -30.906 54.983 63.732 1.0 29.19 9 C 1 ATOM 81 C CZ3 . TRP A ? 9 ? -28.601 54.760 63.044 1.0 34.46 9 C 1 ATOM 82 C CH2 . TRP A ? 9 ? -29.870 54.215 63.277 1.0 31.63 9 C 1 ATOM 83 O OXT . TRP A ? 9 ? -27.134 62.395 64.411 1.0 31.9 9 C 1 #