data_2a83_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 ? -52.325 60.017 64.471 1.0 9.48 1 C 1 ATOM 2 C CA . ARG A ? 1 ? -51.522 60.830 63.531 1.0 9.6 1 C 1 ATOM 3 C C . ARG A ? 1 ? -50.065 60.876 63.952 1.0 8.01 1 C 1 ATOM 4 O O . ARG A ? 1 ? -49.726 60.706 65.127 1.0 9.75 1 C 1 ATOM 5 C CB . ARG A ? 1 ? -52.093 62.243 63.338 1.0 10.75 1 C 1 ATOM 6 C CG . ARG A ? 1 ? -51.771 63.281 64.372 1.0 11.74 1 C 1 ATOM 7 C CD . ARG A ? 1 ? -52.280 64.635 63.948 1.0 13.33 1 C 1 ATOM 8 N NE . ARG A ? 1 ? -51.829 65.670 64.844 1.0 14.2 1 C 1 ATOM 9 C CZ . ARG A ? 1 ? -51.955 66.958 64.597 1.0 14.0 1 C 1 ATOM 10 N NH1 . ARG A ? 1 ? -52.551 67.355 63.490 1.0 16.46 1 C 1 ATOM 11 N NH2 . ARG A ? 1 ? -51.449 67.826 65.461 1.0 18.06 1 C 1 ATOM 12 N N . ARG A ? 2 ? -49.213 61.132 62.956 1.0 8.14 2 C 1 ATOM 13 C CA . ARG A ? 2 ? -47.773 61.156 63.136 1.0 8.0 2 C 1 ATOM 14 C C . ARG A ? 2 ? -47.281 62.411 63.837 1.0 8.7 2 C 1 ATOM 15 O O . ARG A ? 2 ? -48.004 63.399 63.967 1.0 9.81 2 C 1 ATOM 16 C CB . ARG A ? 2 ? -47.092 61.027 61.775 1.0 8.63 2 C 1 ATOM 17 C CG . ARG A ? 2 ? -47.327 59.709 61.083 1.0 7.89 2 C 1 ATOM 18 C CD . ARG A ? 2 ? -46.842 59.713 59.647 1.0 7.93 2 C 1 ATOM 19 N NE . ARG A ? 2 ? -47.138 58.490 58.921 1.0 7.48 2 C 1 ATOM 20 C CZ . ARG A ? 2 ? -46.362 57.403 58.922 1.0 7.44 2 C 1 ATOM 21 N NH1 . ARG A ? 2 ? -45.219 57.394 59.594 1.0 8.19 2 C 1 ATOM 22 N NH2 . ARG A ? 2 ? -46.740 56.331 58.245 1.0 8.02 2 C 1 ATOM 23 N N . ARG A ? 3 ? -45.977 62.361 64.179 1.0 9.99 3 C 1 ATOM 24 C CA . ARG A ? 3 ? -45.262 63.522 64.681 1.0 10.79 3 C 1 ATOM 25 C C . ARG A ? 3 ? -44.115 63.814 63.730 1.0 11.36 3 C 1 ATOM 26 O O . ARG A ? 3 ? -43.465 62.912 63.191 1.0 10.54 3 C 1 ATOM 27 C CB . ARG A ? 3 ? -44.716 63.288 66.082 1.0 11.67 3 C 1 ATOM 28 C CG A ARG A ? 3 ? -44.150 61.864 66.205 0.5 10.53 3 C 1 ATOM 29 C CG B ARG A ? 3 ? -43.808 62.156 66.386 0.5 14.23 3 C 1 ATOM 30 C CD A ARG A ? 3 ? -43.283 61.637 67.422 0.5 9.11 3 C 1 ATOM 31 C CD B ARG A ? 3 ? -43.148 62.268 67.794 0.5 17.5 3 C 1 ATOM 32 N NE A ARG A ? 3 ? -41.961 62.216 67.290 0.5 11.24 3 C 1 ATOM 33 N NE B ARG A ? 3 ? -41.893 63.054 67.866 0.5 20.02 3 C 1 ATOM 34 C CZ A ARG A ? 3 ? -40.944 61.688 66.619 0.5 10.29 3 C 1 ATOM 35 C CZ B ARG A ? 3 ? -41.616 64.072 68.704 0.5 20.58 3 C 1 ATOM 36 N NH1 A ARG A ? 3 ? -41.084 60.541 65.980 0.5 10.63 3 C 1 ATOM 37 N NH1 B ARG A ? 3 ? -42.500 64.508 69.573 0.5 18.47 3 C 1 ATOM 38 N NH2 A ARG A ? 3 ? -39.770 62.310 66.586 0.5 11.47 3 C 1 ATOM 39 N NH2 B ARG A ? 3 ? -40.419 64.663 68.679 0.5 15.95 3 C 1 ATOM 40 N N A TRP A ? 4 ? -43.876 65.065 63.541 0.5 11.8 4 C 1 ATOM 41 N N B TRP A ? 4 ? -43.559 65.013 63.702 0.5 13.78 4 C 1 ATOM 42 C CA A TRP A ? 4 ? -42.718 65.521 62.862 0.5 10.89 4 C 1 ATOM 43 C CA B TRP A ? 4 ? -42.201 65.257 63.098 0.5 14.29 4 C 1 ATOM 44 C C A TRP A ? 4 ? -41.511 65.031 63.611 0.5 10.56 4 C 1 ATOM 45 C C B TRP A ? 4 ? -41.083 64.921 64.111 0.5 14.38 4 C 1 ATOM 46 O O A TRP A ? 4 ? -41.443 65.114 64.841 0.5 11.08 4 C 1 ATOM 47 O O B TRP A ? 4 ? -41.342 64.746 65.295 0.5 14.73 4 C 1 ATOM 48 C CB A TRP A ? 4 ? -42.679 67.050 62.870 0.5 11.12 4 C 1 ATOM 49 C CB B TRP A ? 4 ? -41.993 66.728 62.633 0.5 15.41 4 C 1 ATOM 50 C CG A TRP A ? 4 ? -43.704 67.631 62.090 0.5 11.13 4 C 1 ATOM 51 C CG B TRP A ? 4 ? -42.427 67.110 61.211 0.5 16.37 4 C 1 ATOM 52 C CD1 A TRP A ? 4 ? -44.924 68.060 62.523 0.5 11.7 4 C 1 ATOM 53 C CD1 B TRP A ? 4 ? -41.675 67.045 60.063 0.5 16.48 4 C 1 ATOM 54 C CD2 A TRP A ? 4 ? -43.673 67.834 60.685 0.5 10.8 4 C 1 ATOM 55 C CD2 B TRP A ? 4 ? -43.669 67.704 60.829 0.5 16.19 4 C 1 ATOM 56 C CE2 A TRP A ? 4 ? -44.899 68.420 60.318 0.5 10.51 4 C 1 ATOM 57 C CE2 B TRP A ? 4 ? -43.627 67.924 59.434 0.5 16.92 4 C 1 ATOM 58 C CE3 A TRP A ? 4 ? -42.719 67.600 59.690 0.5 11.68 4 C 1 ATOM 59 C CE3 B TRP A ? 4 ? -44.833 68.051 61.519 0.5 15.23 4 C 1 ATOM 60 N NE1 A TRP A ? 4 ? -45.642 68.549 61.463 0.5 12.1 4 C 1 ATOM 61 N NE1 B TRP A ? 4 ? -42.398 67.514 58.990 0.5 17.27 4 C 1 ATOM 62 C CZ2 A TRP A ? 4 ? -45.197 68.774 58.997 0.5 11.95 4 C 1 ATOM 63 C CZ2 B TRP A ? 4 ? -44.698 68.479 58.732 0.5 16.51 4 C 1 ATOM 64 C CZ3 A TRP A ? 4 ? -43.021 67.953 58.376 0.5 10.51 4 C 1 ATOM 65 C CZ3 B TRP A ? 4 ? -45.891 68.589 60.816 0.5 17.13 4 C 1 ATOM 66 C CH2 A TRP A ? 4 ? -44.250 68.534 58.050 0.5 12.27 4 C 1 ATOM 67 C CH2 B TRP A ? 4 ? -45.816 68.803 59.447 0.5 17.45 4 C 1 ATOM 68 N N A HIS A ? 5 ? -40.534 64.538 62.879 0.5 11.2 5 C 1 ATOM 69 N N B HIS A ? 5 ? -39.832 64.873 63.647 0.5 13.71 5 C 1 ATOM 70 C CA A HIS A ? 5 ? -39.281 64.163 63.488 0.5 10.9 5 C 1 ATOM 71 C CA B HIS A ? 5 ? -38.674 64.636 64.531 0.5 13.78 5 C 1 ATOM 72 C C A HIS A ? 5 ? -38.227 65.249 63.186 0.5 11.1 5 C 1 ATOM 73 C C B HIS A ? 5 ? -37.433 65.348 63.975 0.5 13.97 5 C 1 ATOM 74 O O A HIS A ? 5 ? -37.740 65.358 62.074 0.5 10.91 5 C 1 ATOM 75 O O B HIS A ? 5 ? -36.768 64.857 63.070 0.5 14.41 5 C 1 ATOM 76 C CB A HIS A ? 5 ? -38.846 62.804 62.945 0.5 10.67 5 C 1 ATOM 77 C CB B HIS A ? 5 ? -38.404 63.136 64.702 0.5 13.77 5 C 1 ATOM 78 C CG A HIS A ? 5 ? -37.593 62.280 63.565 0.5 10.37 5 C 1 ATOM 79 C CG B HIS A ? 5 ? -37.355 62.814 65.725 0.5 14.44 5 C 1 ATOM 80 C CD2 A HIS A ? 5 ? -36.324 62.208 63.094 0.5 10.41 5 C 1 ATOM 81 C CD2 B HIS A ? 5 ? -36.009 62.686 65.614 0.5 14.51 5 C 1 ATOM 82 N ND1 A HIS A ? 5 ? -37.558 61.766 64.842 0.5 11.52 5 C 1 ATOM 83 N ND1 B HIS A ? 5 ? -37.655 62.573 67.049 0.5 15.0 5 C 1 ATOM 84 C CE1 A HIS A ? 5 ? -36.326 61.380 65.127 0.5 10.99 5 C 1 ATOM 85 C CE1 B HIS A ? 5 ? -36.541 62.299 67.706 0.5 15.48 5 C 1 ATOM 86 N NE2 A HIS A ? 5 ? -35.556 61.649 64.087 0.5 11.29 5 C 1 ATOM 87 N NE2 B HIS A ? 5 ? -35.530 62.373 66.862 0.5 15.44 5 C 1 ATOM 88 N N A ARG A ? 6 ? -37.868 66.029 64.193 0.5 12.87 6 C 1 ATOM 89 N N B ARG A ? 6 ? -37.111 66.502 64.537 0.5 13.57 6 C 1 ATOM 90 C CA A ARG A ? 6 ? -36.952 67.148 64.025 0.5 14.76 6 C 1 ATOM 91 C CA B ARG A ? 6 ? -36.066 67.341 63.976 0.5 14.47 6 C 1 ATOM 92 C C A ARG A ? 6 ? -35.496 66.725 64.180 0.5 14.6 6 C 1 ATOM 93 C C B ARG A ? 6 ? -34.671 67.048 64.527 0.5 14.79 6 C 1 ATOM 94 O O A ARG A ? 6 ? -34.571 67.449 63.809 0.5 16.56 6 C 1 ATOM 95 O O B ARG A ? 6 ? -33.703 67.723 64.161 0.5 16.19 6 C 1 ATOM 96 C CB A ARG A ? 6 ? -37.304 68.233 65.057 0.5 16.04 6 C 1 ATOM 97 C CB B ARG A ? 6 ? -36.398 68.804 64.223 0.5 14.49 6 C 1 ATOM 98 C CG A ARG A ? 6 ? -36.354 69.399 65.108 0.5 19.58 6 C 1 ATOM 99 C CG B ARG A ? 6 ? -36.377 69.223 65.701 0.5 16.53 6 C 1 ATOM 100 C CD A ARG A ? 6 ? -36.847 70.527 65.999 0.5 23.16 6 C 1 ATOM 101 C CD B ARG A ? 6 ? -36.681 70.713 65.839 0.5 19.24 6 C 1 ATOM 102 N NE A ARG A ? 6 ? -35.772 71.455 66.351 0.5 26.01 6 C 1 ATOM 103 N NE B ARG A ? 6 ? -36.781 71.207 67.216 0.5 20.94 6 C 1 ATOM 104 C CZ A ARG A ? 6 ? -35.818 72.321 67.371 0.5 28.28 6 C 1 ATOM 105 C CZ B ARG A ? 6 ? -37.877 71.181 67.975 0.5 23.0 6 C 1 ATOM 106 N NH1 A ARG A ? 6 ? -36.890 72.395 68.157 0.5 28.53 6 C 1 ATOM 107 N NH1 B ARG A ? 6 ? -39.007 70.642 67.535 0.5 24.94 6 C 1 ATOM 108 N NH2 A ARG A ? 6 ? -34.781 73.114 67.611 0.5 30.59 6 C 1 ATOM 109 N NH2 B ARG A ? 6 ? -37.839 71.692 69.203 0.5 23.51 6 C 1 ATOM 110 N N A TRP A ? 7 ? -35.290 65.539 64.728 0.5 13.41 7 C 1 ATOM 111 N N B TRP A ? 7 ? -34.545 66.017 65.357 0.5 13.94 7 C 1 ATOM 112 C CA A TRP A ? 7 ? -34.000 65.209 65.300 0.5 13.29 7 C 1 ATOM 113 C CA B TRP A ? 7 ? -33.267 65.737 66.007 0.5 13.83 7 C 1 ATOM 114 C C A TRP A ? 7 ? -33.105 64.525 64.293 0.5 12.77 7 C 1 ATOM 115 C C B TRP A ? 7 ? -32.531 64.558 65.361 0.5 13.4 7 C 1 ATOM 116 O O A TRP A ? 7 ? -33.573 64.082 63.253 0.5 13.21 7 C 1 ATOM 117 O O B TRP A ? 7 ? -32.960 63.417 65.444 0.5 14.01 7 C 1 ATOM 118 C CB A TRP A ? 7 ? -34.190 64.349 66.547 0.5 13.33 7 C 1 ATOM 119 C CB B TRP A ? 7 ? -33.468 65.505 67.502 0.5 13.89 7 C 1 ATOM 120 C CG A TRP A ? 7 ? -35.261 64.913 67.433 0.5 13.77 7 C 1 ATOM 121 C CG B TRP A ? 7 ? -34.162 66.644 68.167 0.5 14.15 7 C 1 ATOM 122 C CD1 A TRP A ? 7 ? -36.481 64.354 67.728 0.5 13.6 7 C 1 ATOM 123 C CD1 B TRP A ? 7 ? -33.603 67.787 68.646 0.5 14.65 7 C 1 ATOM 124 C CD2 A TRP A ? 7 ? -35.233 66.177 68.083 0.5 12.97 7 C 1 ATOM 125 C CD2 B TRP A ? 7 ? -35.555 66.736 68.432 0.5 13.34 7 C 1 ATOM 126 C CE2 A TRP A ? 7 ? -36.455 66.319 68.781 0.5 14.08 7 C 1 ATOM 127 C CE2 B TRP A ? 7 ? -35.781 67.965 69.068 0.5 14.49 7 C 1 ATOM 128 C CE3 A TRP A ? 7 ? -34.285 67.209 68.170 0.5 12.68 7 C 1 ATOM 129 C CE3 B TRP A ? 7 ? -36.645 65.896 68.191 0.5 14.21 7 C 1 ATOM 130 N NE1 A TRP A ? 7 ? -37.201 65.191 68.544 0.5 15.12 7 C 1 ATOM 131 N NE1 B TRP A ? 7 ? -34.572 68.592 69.194 0.5 15.15 7 C 1 ATOM 132 C CZ2 A TRP A ? 7 ? -36.758 67.444 69.543 0.5 14.62 7 C 1 ATOM 133 C CZ2 B TRP A ? 7 ? -37.056 68.382 69.463 0.5 15.24 7 C 1 ATOM 134 C CZ3 A TRP A ? 7 ? -34.595 68.335 68.938 0.5 14.45 7 C 1 ATOM 135 C CZ3 B TRP A ? 7 ? -37.912 66.306 68.588 0.5 15.21 7 C 1 ATOM 136 C CH2 A TRP A ? 7 ? -35.812 68.436 69.617 0.5 14.53 7 C 1 ATOM 137 C CH2 B TRP A ? 7 ? -38.103 67.534 69.213 0.5 15.09 7 C 1 ATOM 138 N N A ARG A ? 8 ? -31.818 64.469 64.628 0.5 12.1 8 C 1 ATOM 139 N N B ARG A ? 8 ? -31.418 64.856 64.704 0.5 12.72 8 C 1 ATOM 140 C CA A ARG A ? 8 ? -30.807 63.761 63.857 0.5 11.74 8 C 1 ATOM 141 C CA B ARG A ? 8 ? -30.717 63.844 63.933 0.5 12.53 8 C 1 ATOM 142 C C A ARG A ? 8 ? -29.958 62.900 64.793 0.5 11.01 8 C 1 ATOM 143 C C B ARG A ? 8 ? -29.887 62.921 64.818 0.5 11.5 8 C 1 ATOM 144 O O A ARG A ? 8 ? -29.613 63.307 65.904 0.5 11.18 8 C 1 ATOM 145 O O B ARG A ? 8 ? -29.499 63.293 65.931 0.5 11.45 8 C 1 ATOM 146 C CB A ARG A ? 8 ? -29.862 64.737 63.167 0.5 11.59 8 C 1 ATOM 147 C CB B ARG A ? 8 ? -29.813 64.517 62.912 0.5 12.8 8 C 1 ATOM 148 C CG A ARG A ? 8 ? -30.528 65.731 62.242 0.5 13.57 8 C 1 ATOM 149 C CG B ARG A ? 8 ? -30.553 65.397 61.923 0.5 14.63 8 C 1 ATOM 150 C CD A ARG A ? 8 ? -31.211 65.121 61.029 0.5 15.22 8 C 1 ATOM 151 C CD B ARG A ? 8 ? -31.349 64.642 60.866 0.5 16.68 8 C 1 ATOM 152 N NE A ARG A ? 8 ? -31.665 66.172 60.105 0.5 15.9 8 C 1 ATOM 153 N NE B ARG A ? 8 ? -32.224 63.590 61.383 0.5 18.59 8 C 1 ATOM 154 C CZ A ARG A ? 8 ? -32.771 66.895 60.263 0.5 17.19 8 C 1 ATOM 155 C CZ B ARG A ? 8 ? -33.470 63.759 61.860 0.5 20.33 8 C 1 ATOM 156 N NH1 A ARG A ? 8 ? -33.570 66.697 61.306 0.5 17.64 8 C 1 ATOM 157 N NH1 B ARG A ? 8 ? -34.042 64.946 61.886 0.5 20.32 8 C 1 ATOM 158 N NH2 A ARG A ? 8 ? -33.074 67.827 59.362 0.5 19.01 8 C 1 ATOM 159 N NH2 B ARG A ? 8 ? -34.156 62.706 62.292 0.5 22.5 8 C 1 ATOM 160 N N . LEU A ? 9 ? -29.573 61.728 64.313 1.0 10.8 9 C 1 ATOM 161 C CA . LEU A ? 9 ? -28.657 60.837 65.043 1.0 11.01 9 C 1 ATOM 162 C C . LEU A ? 9 ? -27.272 61.460 65.182 1.0 10.96 9 C 1 ATOM 163 O O . LEU A ? 9 ? -26.905 62.320 64.353 1.0 11.27 9 C 1 ATOM 164 C CB . LEU A ? 9 ? -28.539 59.503 64.320 1.0 11.78 9 C 1 ATOM 165 C CG . LEU A ? 9 ? -29.804 58.684 64.127 1.0 11.98 9 C 1 ATOM 166 C CD1 . LEU A ? 9 ? -29.451 57.371 63.492 1.0 12.1 9 C 1 ATOM 167 C CD2 . LEU A ? 9 ? -30.564 58.476 65.419 1.0 12.1 9 C 1 ATOM 168 O OXT . LEU A ? 9 ? -26.545 61.050 66.117 1.0 10.56 9 C 1 #