data_3vcl_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 . ARG A ? 1 ? -52.023 59.421 63.934 1.0 32.02 1 C 1 ATOM 2 C CA . ARG A ? 1 ? -51.248 60.293 63.030 1.0 30.75 1 C 1 ATOM 3 C C . ARG A ? 1 ? -49.763 60.304 63.483 1.0 35.06 1 C 1 ATOM 4 O O . ARG A ? 1 ? -49.465 60.209 64.691 1.0 35.66 1 C 1 ATOM 5 C CB . ARG A ? 1 ? -51.836 61.710 62.860 1.0 36.61 1 C 1 ATOM 6 C CG . ARG A ? 1 ? -51.617 62.642 63.983 1.0 45.47 1 C 1 ATOM 7 C CD . ARG A ? 1 ? -52.103 64.028 63.549 1.0 52.29 1 C 1 ATOM 8 N NE . ARG A ? 1 ? -51.705 65.000 64.520 1.0 58.31 1 C 1 ATOM 9 C CZ . ARG A ? 1 ? -52.032 66.274 64.438 1.0 58.98 1 C 1 ATOM 10 N NH1 . ARG A ? 1 ? -52.767 66.688 63.409 1.0 55.06 1 C 1 ATOM 11 N NH2 . ARG A ? 1 ? -51.621 67.107 65.376 1.0 61.06 1 C 1 ATOM 12 N N . PRO A ? 2 ? -48.827 60.398 62.519 1.0 33.34 2 C 1 ATOM 13 C CA . PRO A ? 2 ? -47.396 60.288 62.889 1.0 31.06 2 C 1 ATOM 14 C C . PRO A ? 2 ? -46.841 61.522 63.581 1.0 30.57 2 C 1 ATOM 15 O O . PRO A ? 2 ? -47.416 62.610 63.575 1.0 34.88 2 C 1 ATOM 16 C CB . PRO A ? 2 ? -46.687 60.138 61.526 1.0 32.07 2 C 1 ATOM 17 C CG . PRO A ? 2 ? -47.701 60.750 60.473 1.0 30.98 2 C 1 ATOM 18 C CD . PRO A ? 2 ? -49.036 60.334 61.057 1.0 30.62 2 C 1 ATOM 19 N N . HIS A ? 3 ? -45.661 61.358 64.162 1.0 30.48 3 C 1 ATOM 20 C CA . HIS A ? 3 ? -44.997 62.464 64.810 1.0 31.82 3 C 1 ATOM 21 C C . HIS A ? 3 ? -44.303 63.378 63.783 1.0 33.59 3 C 1 ATOM 22 O O . HIS A ? 3 ? -43.807 62.895 62.758 1.0 39.26 3 C 1 ATOM 23 C CB . HIS A ? 3 ? -43.982 61.921 65.825 1.0 31.4 3 C 1 ATOM 24 C CG . HIS A ? 3 ? -42.757 61.294 65.205 1.0 41.77 3 C 1 ATOM 25 C CD2 . HIS A ? 3 ? -41.812 61.803 64.374 1.0 41.07 3 C 1 ATOM 26 N ND1 . HIS A ? 3 ? -42.391 59.981 65.438 1.0 45.0 3 C 1 ATOM 27 C CE1 . HIS A ? 3 ? -41.287 59.705 64.764 1.0 42.95 3 C 1 ATOM 28 N NE2 . HIS A ? 3 ? -40.906 60.795 64.118 1.0 45.93 3 C 1 ATOM 29 N N . GLU A ? 4 ? -44.243 64.668 64.077 1.0 37.85 4 C 1 ATOM 30 C CA . GLU A ? 4 ? -43.584 65.669 63.204 1.0 48.59 4 C 1 ATOM 31 C C . GLU A ? 4 ? -42.167 65.986 63.670 1.0 52.57 4 C 1 ATOM 32 O O . GLU A ? 4 ? -41.829 65.680 64.799 1.0 56.23 4 C 1 ATOM 33 C CB . GLU A ? 4 ? -44.379 66.986 63.212 1.0 52.21 4 C 1 ATOM 34 N N . ARG A ? 5 ? -41.352 66.607 62.806 1.0 55.06 5 C 1 ATOM 35 C CA . ARG A ? 5 ? -40.083 67.247 63.216 1.0 65.66 5 C 1 ATOM 36 C C . ARG A ? 5 ? -40.383 68.768 63.219 1.0 82.35 5 C 1 ATOM 37 O O . ARG A ? 5 ? -41.050 69.237 62.285 1.0 88.92 5 C 1 ATOM 38 C CB . ARG A ? 5 ? -38.936 66.924 62.235 1.0 59.12 5 C 1 ATOM 39 C CG . ARG A ? 5 ? -37.493 67.169 62.781 1.0 65.65 5 C 1 ATOM 40 C CD . ARG A ? 5 ? -36.405 66.996 61.704 1.0 65.73 5 C 1 ATOM 41 N NE . ARG A ? 5 ? -35.038 67.040 62.246 1.0 67.21 5 C 1 ATOM 42 C CZ . ARG A ? 5 ? -33.913 66.804 61.540 1.0 58.48 5 C 1 ATOM 43 N NH1 . ARG A ? 5 ? -33.996 66.482 60.237 1.0 51.31 5 C 1 ATOM 44 N NH2 . ARG A ? 5 ? -32.706 66.876 62.143 1.0 46.9 5 C 1 ATOM 45 N N . ASN A ? 6 ? -39.915 69.562 64.196 1.0 92.61 6 C 1 ATOM 46 C CA . ASN A ? 6 ? -38.849 69.247 65.163 1.0 95.54 6 C 1 ATOM 47 C C . ASN A ? 6 ? -39.230 68.363 66.351 1.0 92.79 6 C 1 ATOM 48 O O . ASN A ? 6 ? -40.375 67.927 66.478 1.0 96.35 6 C 1 ATOM 49 C CB . ASN A ? 6 ? -38.163 70.529 65.655 1.0 96.94 6 C 1 ATOM 50 N N . GLY A ? 7 ? -38.248 68.089 67.210 1.0 83.75 7 C 1 ATOM 51 C CA . GLY A ? 7 ? -38.264 66.859 67.987 1.0 70.89 7 C 1 ATOM 52 C C . GLY A ? 7 ? -37.984 65.739 66.980 1.0 57.25 7 C 1 ATOM 53 O O . GLY A ? 7 ? -38.170 65.935 65.778 1.0 54.1 7 C 1 ATOM 54 N N . PHE A ? 8 ? -37.511 64.581 67.432 1.0 48.92 8 C 1 ATOM 55 C CA . PHE A ? 8 ? -37.252 63.464 66.499 1.0 47.04 8 C 1 ATOM 56 C C . PHE A ? 8 ? -36.184 63.817 65.454 1.0 44.74 8 C 1 ATOM 57 O O . PHE A ? 8 ? -36.360 63.586 64.247 1.0 45.34 8 C 1 ATOM 58 C CB . PHE A ? 8 ? -38.539 62.972 65.811 1.0 44.25 8 C 1 ATOM 59 C CG . PHE A ? 8 ? -39.546 62.406 66.762 1.0 43.97 8 C 1 ATOM 60 C CD1 . PHE A ? 8 ? -39.510 61.055 67.108 1.0 42.54 8 C 1 ATOM 61 C CD2 . PHE A ? 8 ? -40.540 63.221 67.309 1.0 45.26 8 C 1 ATOM 62 C CE1 . PHE A ? 8 ? -40.438 60.530 67.987 1.0 48.02 8 C 1 ATOM 63 C CE2 . PHE A ? 8 ? -41.499 62.705 68.186 1.0 45.44 8 C 1 ATOM 64 C CZ . PHE A ? 8 ? -41.438 61.370 68.539 1.0 48.75 8 C 1 ATOM 65 N N . THR A ? 9 ? -35.058 64.320 65.932 1.0 43.63 9 C 1 ATOM 66 C CA . THR A ? 9 ? -34.009 64.807 65.045 1.0 37.29 9 C 1 ATOM 67 C C . THR A ? 9 ? -33.054 63.675 64.612 1.0 37.59 9 C 1 ATOM 68 O O . THR A ? 9 ? -33.189 62.516 65.021 1.0 40.49 9 C 1 ATOM 69 C CB . THR A ? 9 ? -33.197 66.002 65.638 1.0 57.04 9 C 1 ATOM 70 C CG2 . THR A ? 9 ? -34.056 67.259 65.757 1.0 61.33 9 C 1 ATOM 71 O OG1 . THR A ? 9 ? -32.683 65.656 66.925 1.0 55.51 9 C 1 ATOM 72 N N . VAL A ? 10 ? -32.087 64.056 63.797 1.0 33.76 10 C 1 ATOM 73 C CA A VAL A ? 10 ? -31.161 63.120 63.193 0.5 33.5 10 C 1 ATOM 74 C CA B VAL A ? 10 ? -31.166 63.094 63.187 0.5 33.48 10 C 1 ATOM 75 C C . VAL A ? 10 ? -30.372 62.319 64.243 1.0 33.8 10 C 1 ATOM 76 O O . VAL A ? 10 ? -30.053 62.862 65.350 1.0 34.53 10 C 1 ATOM 77 C CB A VAL A ? 10 ? -30.230 63.877 62.206 0.5 33.93 10 C 1 ATOM 78 C CB B VAL A ? 10 ? -30.198 63.789 62.177 0.5 33.9 10 C 1 ATOM 79 C CG1 A VAL A ? 10 ? -29.172 64.793 62.948 0.5 35.09 10 C 1 ATOM 80 C CG1 B VAL A ? 10 ? -29.092 62.873 61.703 0.5 35.09 10 C 1 ATOM 81 C CG2 A VAL A ? 10 ? -29.584 62.935 61.249 0.5 33.49 10 C 1 ATOM 82 C CG2 B VAL A ? 10 ? -30.934 64.306 60.978 0.5 33.49 10 C 1 ATOM 83 N N . LEU A ? 11 ? -30.073 61.048 63.923 1.0 33.32 11 C 1 ATOM 84 C CA . LEU A ? 11 ? -29.185 60.237 64.762 1.0 33.69 11 C 1 ATOM 85 C C . LEU A ? 11 ? -27.747 60.764 64.755 1.0 35.08 11 C 1 ATOM 86 O O . LEU A ? 11 ? -27.361 61.593 63.914 1.0 34.87 11 C 1 ATOM 87 C CB . LEU A ? 11 ? -29.228 58.777 64.335 1.0 33.06 11 C 1 ATOM 88 C CG . LEU A ? 11 ? -30.481 57.978 64.779 1.0 32.37 11 C 1 ATOM 89 C CD1 . LEU A ? 11 ? -31.892 58.442 64.230 1.0 31.76 11 C 1 ATOM 90 C CD2 . LEU A ? 11 ? -30.242 56.485 64.401 1.0 34.14 11 C 1 ATOM 91 O OXT . LEU A ? 11 ? -26.898 60.374 65.600 1.0 35.22 11 C 1 #