data_3b6s_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 ? -52.311 60.037 64.507 1.0 9.73 1 C 1 ATOM 2 C CA . ARG A ? 1 ? -51.458 60.795 63.556 1.0 10.08 1 C 1 ATOM 3 C C . ARG A ? 1 ? -50.017 60.889 64.052 1.0 9.61 1 C 1 ATOM 4 O O . ARG A ? 1 ? -49.741 60.715 65.246 1.0 9.75 1 C 1 ATOM 5 C CB . ARG A ? 1 ? -52.044 62.187 63.242 1.0 9.95 1 C 1 ATOM 6 C CG . ARG A ? 1 ? -51.877 63.229 64.324 1.0 11.3 1 C 1 ATOM 7 C CD . ARG A ? 1 ? -52.356 64.593 63.818 1.0 10.92 1 C 1 ATOM 8 N NE . ARG A ? 1 ? -51.987 65.669 64.733 1.0 13.31 1 C 1 ATOM 9 C CZ . ARG A ? 1 ? -52.247 66.954 64.517 1.0 14.3 1 C 1 ATOM 10 N NH1 . ARG A ? 1 ? -52.885 67.331 63.416 1.0 14.23 1 C 1 ATOM 11 N NH2 . ARG A ? 1 ? -51.864 67.865 65.405 1.0 15.29 1 C 1 ATOM 12 N N . ARG A ? 2 ? -49.114 61.174 63.118 1.0 9.72 2 C 1 ATOM 13 C CA . ARG A ? 2 ? -47.680 61.113 63.355 1.0 9.64 2 C 1 ATOM 14 C C . ARG A ? 2 ? -47.164 62.318 64.139 1.0 10.72 2 C 1 ATOM 15 O O . ARG A ? 2 ? -47.811 63.369 64.177 1.0 10.32 2 C 1 ATOM 16 C CB . ARG A ? 2 ? -46.938 61.021 62.020 1.0 9.39 2 C 1 ATOM 17 C CG . ARG A ? 2 ? -47.209 59.741 61.246 1.0 8.2 2 C 1 ATOM 18 C CD . ARG A ? 2 ? -46.674 59.836 59.832 1.0 7.53 2 C 1 ATOM 19 N NE . ARG A ? 2 ? -47.027 58.660 59.042 1.0 6.17 2 C 1 ATOM 20 C CZ . ARG A ? 2 ? -46.295 57.543 58.978 1.0 6.6 2 C 1 ATOM 21 N NH1 . ARG A ? 2 ? -45.149 57.439 59.645 1.0 5.18 2 C 1 ATOM 22 N NH2 . ARG A ? 2 ? -46.707 56.530 58.228 1.0 6.7 2 C 1 ATOM 23 N N . LYS A ? 3 ? -45.985 62.154 64.743 1.0 11.53 3 C 1 ATOM 24 C CA . LYS A ? 3 ? -45.327 63.238 65.464 1.0 12.87 3 C 1 ATOM 25 C C . LYS A ? 3 ? -44.707 64.231 64.482 1.0 13.9 3 C 1 ATOM 26 O O . LYS A ? 3 ? -44.195 63.837 63.432 1.0 13.6 3 C 1 ATOM 27 C CB . LYS A ? 3 ? -44.275 62.689 66.437 1.0 12.49 3 C 1 ATOM 28 C CG . LYS A ? 3 ? -43.092 62.002 65.777 1.0 13.01 3 C 1 ATOM 29 C CD . LYS A ? 3 ? -42.055 61.564 66.804 1.0 13.0 3 C 1 ATOM 30 C CE . LYS A ? 3 ? -40.823 60.989 66.125 1.0 13.15 3 C 1 ATOM 31 N NZ . LYS A ? 3 ? -40.080 61.983 65.283 1.0 13.32 3 C 1 ATOM 32 N N . TRP A ? 4 ? -44.755 65.513 64.830 1.0 15.52 4 C 1 ATOM 33 C CA . TRP A ? 4 ? -44.318 66.569 63.925 1.0 17.09 4 C 1 ATOM 34 C C . TRP A ? 4 ? -42.810 66.785 64.019 1.0 17.8 4 C 1 ATOM 35 O O . TRP A ? 4 ? -42.120 66.863 63.002 1.0 17.92 4 C 1 ATOM 36 C CB . TRP A ? 4 ? -45.056 67.875 64.230 1.0 17.86 4 C 1 ATOM 37 C CG . TRP A ? 4 ? -44.618 69.024 63.375 1.0 18.99 4 C 1 ATOM 38 C CD1 . TRP A ? 4 ? -43.777 70.037 63.733 1.0 20.18 4 C 1 ATOM 39 C CD2 . TRP A ? 4 ? -45.000 69.279 62.018 1.0 20.15 4 C 1 ATOM 40 C CE2 . TRP A ? 4 ? -44.351 70.465 61.617 1.0 20.47 4 C 1 ATOM 41 C CE3 . TRP A ? 4 ? -45.827 68.621 61.103 1.0 20.22 4 C 1 ATOM 42 N NE1 . TRP A ? 4 ? -43.610 70.908 62.682 1.0 20.53 4 C 1 ATOM 43 C CZ2 . TRP A ? 4 ? -44.504 71.006 60.342 1.0 20.28 4 C 1 ATOM 44 C CZ3 . TRP A ? 4 ? -45.977 69.159 59.837 1.0 20.22 4 C 1 ATOM 45 C CH2 . TRP A ? 4 ? -45.318 70.339 59.470 1.0 20.07 4 C 1 ATOM 46 N N . ARG A ? 5 ? -38.783 66.246 64.769 1.0 19.6 6 C 1 ATOM 47 C CA . ARG A ? 5 ? -37.834 65.146 64.652 1.0 19.77 6 C 1 ATOM 48 C C . ARG A ? 5 ? -36.399 65.634 64.820 1.0 18.9 6 C 1 ATOM 49 O O . ARG A ? 5 ? -36.150 66.836 64.910 1.0 18.73 6 C 1 ATOM 50 C CB . ARG A ? 5 ? -37.995 64.440 63.304 1.0 20.4 6 C 1 ATOM 51 C CG . ARG A ? 5 ? -37.626 65.300 62.105 1.0 22.18 6 C 1 ATOM 52 C CD . ARG A ? 5 ? -38.263 64.772 60.831 1.0 24.71 6 C 1 ATOM 53 N NE . ARG A ? 5 ? -39.720 64.846 60.875 1.0 26.4 6 C 1 ATOM 54 C CZ . ARG A ? 5 ? -40.512 63.815 61.152 1.0 27.3 6 C 1 ATOM 55 N NH1 . ARG A ? 5 ? -39.988 62.625 61.409 1.0 27.71 6 C 1 ATOM 56 N NH2 . ARG A ? 5 ? -41.829 63.974 61.171 1.0 28.2 6 C 1 ATOM 57 N N . TRP A ? 6 ? -35.461 64.695 64.862 1.0 17.93 7 C 1 ATOM 58 C CA . TRP A ? 6 ? -34.098 64.993 65.285 1.0 16.92 7 C 1 ATOM 59 C C . TRP A ? 6 ? -33.103 64.021 64.659 1.0 15.94 7 C 1 ATOM 60 O O . TRP A ? 6 ? -33.390 62.832 64.513 1.0 16.04 7 C 1 ATOM 61 C CB . TRP A ? 6 ? -33.988 64.947 66.810 1.0 17.33 7 C 1 ATOM 62 C CG . TRP A ? 6 ? -35.232 65.395 67.515 1.0 18.11 7 C 1 ATOM 63 C CD1 . TRP A ? 6 ? -35.485 66.636 68.021 1.0 18.77 7 C 1 ATOM 64 C CD2 . TRP A ? 6 ? -36.394 64.604 67.791 1.0 17.61 7 C 1 ATOM 65 C CE2 . TRP A ? 6 ? -37.311 65.432 68.468 1.0 18.33 7 C 1 ATOM 66 C CE3 . TRP A ? 6 ? -36.748 63.276 67.532 1.0 18.31 7 C 1 ATOM 67 N NE1 . TRP A ? 6 ? -36.733 66.667 68.596 1.0 18.46 7 C 1 ATOM 68 C CZ2 . TRP A ? 6 ? -38.559 64.976 68.888 1.0 17.68 7 C 1 ATOM 69 C CZ3 . TRP A ? 6 ? -37.987 62.826 67.950 1.0 17.86 7 C 1 ATOM 70 C CH2 . TRP A ? 6 ? -38.878 63.673 68.620 1.0 18.22 7 C 1 ATOM 71 N N . HIS A ? 7 ? -31.933 64.533 64.292 1.0 14.44 8 C 1 ATOM 72 C CA . HIS A ? 7 ? -30.906 63.717 63.661 1.0 12.84 8 C 1 ATOM 73 C C . HIS A ? 7 ? -30.160 62.826 64.653 1.0 12.22 8 C 1 ATOM 74 O O . HIS A ? 7 ? -29.929 63.210 65.804 1.0 11.65 8 C 1 ATOM 75 C CB . HIS A ? 7 ? -29.910 64.606 62.906 1.0 13.28 8 C 1 ATOM 76 C CG . HIS A ? 7 ? -30.442 65.145 61.615 1.0 13.08 8 C 1 ATOM 77 C CD2 . HIS A ? 7 ? -30.659 64.544 60.421 1.0 13.98 8 C 1 ATOM 78 N ND1 . HIS A ? 7 ? -30.812 66.463 61.454 1.0 14.67 8 C 1 ATOM 79 C CE1 . HIS A ? 7 ? -31.234 66.650 60.216 1.0 14.59 8 C 1 ATOM 80 N NE2 . HIS A ? 7 ? -31.155 65.502 59.570 1.0 14.07 8 C 1 ATOM 81 N N . LEU A ? 8 ? -29.774 61.635 64.191 1.0 11.01 9 C 1 ATOM 82 C CA . LEU A ? 8 ? -28.917 60.742 64.972 1.0 10.4 9 C 1 ATOM 83 C C . LEU A ? 8 ? -27.516 61.332 65.109 1.0 10.12 9 C 1 ATOM 84 O O . LEU A ? 8 ? -27.112 62.221 64.343 1.0 9.78 9 C 1 ATOM 85 C CB . LEU A ? 8 ? -28.845 59.348 64.332 1.0 10.28 9 C 1 ATOM 86 C CG . LEU A ? 8 ? -30.113 58.494 64.221 1.0 10.29 9 C 1 ATOM 87 C CD1 . LEU A ? 8 ? -29.807 57.189 63.491 1.0 9.59 9 C 1 ATOM 88 C CD2 . LEU A ? 8 ? -30.726 58.196 65.588 1.0 10.01 9 C 1 ATOM 89 O OXT . LEU A ? 8 ? -26.759 60.938 65.997 1.0 9.44 9 C 1 #