data_5iek_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 ? -52.175 59.788 64.216 1.0 17.52 1 C 1 ATOM 2 C CA . ARG A ? 1 ? -51.372 60.721 63.407 1.0 17.28 1 C 1 ATOM 3 C C . ARG A ? 1 ? -49.956 60.772 63.954 1.0 15.35 1 C 1 ATOM 4 O O . ARG A ? 1 ? -49.723 60.511 65.130 1.0 14.71 1 C 1 ATOM 5 C CB . ARG A ? 1 ? -52.013 62.113 63.370 1.0 23.15 1 C 1 ATOM 6 C CG . ARG A ? 1 ? -51.521 63.127 64.349 1.0 19.48 1 C 1 ATOM 7 C CD . ARG A ? 1 ? -52.165 64.481 64.040 1.0 21.47 1 C 1 ATOM 8 N NE . ARG A ? 1 ? -51.701 65.521 64.947 1.0 24.61 1 C 1 ATOM 9 C CZ . ARG A ? 1 ? -51.923 66.821 64.769 1.0 28.31 1 C 1 ATOM 10 N NH1 . ARG A ? 1 ? -52.619 67.243 63.722 1.0 30.58 1 C 1 ATOM 11 N NH2 . ARG A ? 1 ? -51.439 67.693 65.645 1.0 29.58 1 C 1 ATOM 12 H HA . ARG A ? 1 ? -51.328 60.389 62.497 1.0 20.73 1 C 1 ATOM 13 H HB2 . ARG A ? 1 ? -51.873 62.483 62.484 1.0 27.78 1 C 1 ATOM 14 H HB3 . ARG A ? 1 ? -52.965 62.008 63.523 1.0 27.78 1 C 1 ATOM 15 H HG2 . ARG A ? 1 ? -51.770 62.862 65.249 1.0 23.37 1 C 1 ATOM 16 H HG3 . ARG A ? 1 ? -50.557 63.216 64.272 1.0 23.37 1 C 1 ATOM 17 H HD2 . ARG A ? 1 ? -51.937 64.743 63.134 1.0 25.77 1 C 1 ATOM 18 H HD3 . ARG A ? 1 ? -53.128 64.405 64.133 1.0 25.77 1 C 1 ATOM 19 H HE . ARG A ? 1 ? -51.228 65.283 65.625 1.0 29.53 1 C 1 ATOM 20 H HH11 . ARG A ? 1 ? -52.926 66.677 63.153 1.0 36.69 1 C 1 ATOM 21 H HH12 . ARG A ? 1 ? -52.762 68.084 63.611 1.0 36.69 1 C 1 ATOM 22 H HH21 . ARG A ? 1 ? -50.991 67.416 66.325 1.0 35.5 1 C 1 ATOM 23 H HH22 . ARG A ? 1 ? -51.585 68.533 65.540 1.0 35.5 1 C 1 ATOM 24 H H1 . ARG A ? 1 ? -53.016 59.793 63.925 1.0 21.03 1 C 1 ATOM 25 H H2 . ARG A ? 1 ? -51.839 58.968 64.143 1.0 21.03 1 C 1 ATOM 26 H H3 . ARG A ? 1 ? -52.155 60.042 65.068 1.0 21.03 1 C 1 ATOM 27 N N . GLU A ? 2 ? -49.017 61.113 63.076 1.0 13.27 2 C 1 ATOM 28 C CA . GLU A ? 2 ? -47.601 60.904 63.342 1.0 12.04 2 C 1 ATOM 29 C C . GLU A ? 2 ? -46.971 62.048 64.138 1.0 14.0 2 C 1 ATOM 30 O O . GLU A ? 2 ? -47.433 63.187 64.126 1.0 14.09 2 C 1 ATOM 31 C CB . GLU A ? 2 ? -46.836 60.745 62.021 1.0 18.04 2 C 1 ATOM 32 C CG . GLU A ? 2 ? -46.877 59.353 61.490 1.0 17.03 2 C 1 ATOM 33 C CD . GLU A ? 2 ? -45.576 58.944 60.840 1.0 16.46 2 C 1 ATOM 34 O OE1 . GLU A ? 2 ? -45.528 58.956 59.599 1.0 14.85 2 C 1 ATOM 35 O OE2 . GLU A ? 2 ? -44.623 58.585 61.570 1.0 15.36 2 C 1 ATOM 36 H H . GLU A ? 2 ? -49.178 61.471 62.310 1.0 15.93 2 C 1 ATOM 37 H HA . GLU A ? 2 ? -47.492 60.086 63.852 1.0 14.44 2 C 1 ATOM 38 H HB2 . GLU A ? 2 ? -47.232 61.331 61.356 1.0 21.64 2 C 1 ATOM 39 H HB3 . GLU A ? 2 ? -45.908 60.985 62.163 1.0 21.64 2 C 1 ATOM 40 H HG2 . GLU A ? 2 ? -47.053 58.740 62.220 1.0 20.43 2 C 1 ATOM 41 H HG3 . GLU A ? 2 ? -47.579 59.289 60.824 1.0 20.43 2 C 1 ATOM 42 N N . PHE A ? 3 ? -45.872 61.706 64.809 1.0 13.76 3 C 1 ATOM 43 C CA . PHE A ? 3 ? -44.968 62.660 65.421 1.0 13.31 3 C 1 ATOM 44 C C . PHE A ? 3 ? -44.237 63.439 64.344 1.0 14.4 3 C 1 ATOM 45 O O . PHE A ? 3 ? -43.764 62.864 63.356 1.0 17.01 3 C 1 ATOM 46 C CB . PHE A ? 3 ? -43.967 61.910 66.296 1.0 15.08 3 C 1 ATOM 47 C CG . PHE A ? 3 ? -42.967 62.786 67.019 1.0 16.18 3 C 1 ATOM 48 C CD1 . PHE A ? 3 ? -43.385 63.760 67.907 1.0 19.35 3 C 1 ATOM 49 C CD2 . PHE A ? 3 ? -41.608 62.587 66.850 1.0 21.46 3 C 1 ATOM 50 C CE1 . PHE A ? 3 ? -42.477 64.540 68.587 1.0 19.03 3 C 1 ATOM 51 C CE2 . PHE A ? 3 ? -40.685 63.379 67.540 1.0 19.26 3 C 1 ATOM 52 C CZ . PHE A ? 3 ? -41.125 64.342 68.407 1.0 23.15 3 C 1 ATOM 53 H H . PHE A ? 3 ? -45.625 60.890 64.923 1.0 16.51 3 C 1 ATOM 54 H HA . PHE A ? 3 ? -45.468 63.281 65.975 1.0 15.98 3 C 1 ATOM 55 H HB2 . PHE A ? 3 ? -44.457 61.409 66.967 1.0 18.1 3 C 1 ATOM 56 H HB3 . PHE A ? 3 ? -43.466 61.296 65.735 1.0 18.1 3 C 1 ATOM 57 H HD1 . PHE A ? 3 ? -44.296 63.898 68.040 1.0 23.22 3 C 1 ATOM 58 H HD2 . PHE A ? 3 ? -41.306 61.930 66.265 1.0 25.75 3 C 1 ATOM 59 H HE1 . PHE A ? 3 ? -42.777 65.197 69.174 1.0 22.84 3 C 1 ATOM 60 H HE2 . PHE A ? 3 ? -39.773 63.248 67.416 1.0 23.12 3 C 1 ATOM 61 H HZ . PHE A ? 3 ? -40.513 64.874 68.862 1.0 27.78 3 C 1 ATOM 62 N N . SER A ? 4 ? -44.122 64.753 64.537 1.0 16.3 4 C 1 ATOM 63 C CA . SER A ? 4 ? -43.676 65.617 63.450 1.0 18.94 4 C 1 ATOM 64 C C . SER A ? 4 ? -42.243 66.088 63.598 1.0 25.37 4 C 1 ATOM 65 O O . SER A ? 4 ? -41.795 66.892 62.781 1.0 22.0 4 C 1 ATOM 66 C CB . SER A ? 4 ? -44.583 66.836 63.320 1.0 24.31 4 C 1 ATOM 67 O OG . SER A ? 4 ? -44.452 67.701 64.436 1.0 24.0 4 C 1 ATOM 68 H H . SER A ? 4 ? -44.293 65.161 65.275 1.0 19.56 4 C 1 ATOM 69 H HA . SER A ? 4 ? -43.735 65.119 62.619 1.0 22.73 4 C 1 ATOM 70 H HB2 . SER A ? 4 ? -44.342 67.323 62.515 1.0 29.17 4 C 1 ATOM 71 H HB3 . SER A ? 4 ? -45.505 66.538 63.260 1.0 29.17 4 C 1 ATOM 72 H HG . SER A ? 4 ? -44.659 67.294 65.140 1.0 28.8 4 C 1 ATOM 73 N N . LYS A ? 5 ? -41.504 65.606 64.599 1.0 19.73 5 C 1 ATOM 74 C CA . LYS A ? 5 ? -40.181 66.152 64.880 1.0 19.12 5 C 1 ATOM 75 C C . LYS A ? 5 ? -39.145 65.050 65.007 1.0 18.0 5 C 1 ATOM 76 O O . LYS A ? 5 ? -38.264 65.117 65.856 1.0 18.53 5 C 1 ATOM 77 C CB . LYS A ? 5 ? -40.205 66.998 66.153 1.0 25.42 5 C 1 ATOM 78 C CG . LYS A ? 5 ? -41.213 68.143 66.173 1.0 32.32 5 C 1 ATOM 79 C CD . LYS A ? 5 ? -40.998 68.947 67.458 1.0 47.16 5 C 1 ATOM 80 C CE . LYS A ? 5 ? -42.017 70.042 67.730 1.0 46.21 5 C 1 ATOM 81 N NZ . LYS A ? 5 ? -41.885 70.474 69.166 1.0 57.67 5 C 1 ATOM 82 H H . LYS A ? 5 ? -41.745 64.969 65.124 1.0 23.68 5 C 1 ATOM 83 H HA . LYS A ? 5 ? -39.916 66.727 64.145 1.0 22.94 5 C 1 ATOM 84 H HB2 . LYS A ? 5 ? -40.412 66.417 66.902 1.0 30.51 5 C 1 ATOM 85 H HB3 . LYS A ? 5 ? -39.324 67.384 66.279 1.0 30.51 5 C 1 ATOM 86 H HG2 . LYS A ? 5 ? -41.067 68.725 65.410 1.0 38.79 5 C 1 ATOM 87 H HG3 . LYS A ? 5 ? -42.116 67.790 66.171 1.0 38.79 5 C 1 ATOM 88 H HD2 . LYS A ? 5 ? -41.023 68.334 68.210 1.0 56.59 5 C 1 ATOM 89 H HD3 . LYS A ? 5 ? -40.125 69.367 67.414 1.0 56.59 5 C 1 ATOM 90 H HE2 . LYS A ? 5 ? -41.841 70.805 67.155 1.0 55.46 5 C 1 ATOM 91 H HE3 . LYS A ? 5 ? -42.913 69.701 67.586 1.0 55.46 5 C 1 ATOM 92 H HZ1 . LYS A ? 5 ? -42.474 71.117 69.345 1.0 69.21 5 C 1 ATOM 93 H HZ2 . LYS A ? 5 ? -42.036 69.784 69.706 1.0 69.21 5 C 1 ATOM 94 H HZ3 . LYS A ? 5 ? -41.064 70.784 69.317 1.0 69.21 5 C 1 ATOM 95 N N . GLU A ? 6 ? -39.200 64.031 64.140 1.0 19.05 6 C 1 ATOM 96 C CA . GLU A ? 6 ? -38.196 62.969 64.178 1.0 20.58 6 C 1 ATOM 97 C C . GLU A ? 6 ? -36.798 63.573 64.013 1.0 16.87 6 C 1 ATOM 98 O O . GLU A ? 6 ? -36.549 64.273 63.022 1.0 16.12 6 C 1 ATOM 99 C CB . GLU A ? 6 ? -38.441 61.958 63.062 1.0 26.5 6 C 1 ATOM 100 C CG . GLU A ? 6 ? -39.499 60.957 63.354 1.0 28.05 6 C 1 ATOM 101 C CD . GLU A ? 6 ? -38.930 59.702 63.984 1.0 43.23 6 C 1 ATOM 102 O OE1 . GLU A ? 6 ? -37.716 59.678 64.338 1.0 34.43 6 C 1 ATOM 103 O OE2 . GLU A ? 6 ? -39.708 58.732 64.113 1.0 42.12 6 C 1 ATOM 104 H H . GLU A ? 6 ? -39.800 63.935 63.530 1.0 22.86 6 C 1 ATOM 105 H HA . GLU A ? 6 ? -38.238 62.508 65.031 1.0 24.69 6 C 1 ATOM 106 H HB2 . GLU A ? 6 ? -38.704 62.437 62.262 1.0 31.8 6 C 1 ATOM 107 H HB3 . GLU A ? 6 ? -37.617 61.473 62.896 1.0 31.8 6 C 1 ATOM 108 H HG2 . GLU A ? 6 ? -40.141 61.343 63.971 1.0 33.66 6 C 1 ATOM 109 H HG3 . GLU A ? 6 ? -39.940 60.708 62.526 1.0 33.66 6 C 1 ATOM 110 N N . PRO A ? 7 ? -35.856 63.283 64.900 1.0 13.65 7 C 1 ATOM 111 C CA . PRO A ? 7 ? -34.534 63.907 64.793 1.0 14.79 7 C 1 ATOM 112 C C . PRO A ? 7 ? -33.525 63.044 64.052 1.0 16.46 7 C 1 ATOM 113 O O . PRO A ? 7 ? -33.679 61.827 63.914 1.0 18.34 7 C 1 ATOM 114 C CB . PRO A ? 7 ? -34.116 64.056 66.257 1.0 17.26 7 C 1 ATOM 115 C CG . PRO A ? 7 ? -34.621 62.816 66.862 1.0 17.14 7 C 1 ATOM 116 C CD . PRO A ? 7 ? -35.983 62.566 66.187 1.0 15.84 7 C 1 ATOM 117 H HA . PRO A ? 7 ? -34.594 64.781 64.375 1.0 17.75 7 C 1 ATOM 118 H HB2 . PRO A ? 7 ? -33.149 64.109 66.325 1.0 20.71 7 C 1 ATOM 119 H HB3 . PRO A ? 7 ? -34.540 64.835 66.648 1.0 20.71 7 C 1 ATOM 120 H HG2 . PRO A ? 7 ? -34.008 62.089 66.677 1.0 20.57 7 C 1 ATOM 121 H HG3 . PRO A ? 7 ? -34.730 62.941 67.817 1.0 20.57 7 C 1 ATOM 122 H HD2 . PRO A ? 7 ? -36.116 61.617 66.035 1.0 19.01 7 C 1 ATOM 123 H HD3 . PRO A ? 7 ? -36.699 62.947 66.718 1.0 19.01 7 C 1 ATOM 124 N N . GLU A ? 8 ? -32.488 63.714 63.567 1.0 17.78 8 C 1 ATOM 125 C CA . GLU A ? 8 ? -31.336 63.038 62.989 1.0 18.25 8 C 1 ATOM 126 C C . GLU A ? 8 ? -30.581 62.291 64.072 1.0 15.2 8 C 1 ATOM 127 O O . GLU A ? 8 ? -30.361 62.828 65.165 1.0 16.06 8 C 1 ATOM 128 C CB . GLU A ? 8 ? -30.382 64.041 62.336 1.0 20.47 8 C 1 ATOM 129 C CG . GLU A ? 8 ? -30.938 64.751 61.148 1.0 37.09 8 C 1 ATOM 130 C CD . GLU A ? 8 ? -29.938 65.727 60.527 1.0 38.94 8 C 1 ATOM 131 O OE1 . GLU A ? 8 ? -28.751 65.705 60.910 1.0 32.99 8 C 1 ATOM 132 O OE2 . GLU A ? 8 ? -30.345 66.507 59.645 1.0 49.12 8 C 1 ATOM 133 H H . GLU A ? 8 ? -32.428 64.572 63.561 1.0 21.33 8 C 1 ATOM 134 H HA . GLU A ? 8 ? -31.630 62.403 62.317 1.0 21.9 8 C 1 ATOM 135 H HB2 . GLU A ? 8 ? -30.143 64.713 62.993 1.0 24.56 8 C 1 ATOM 136 H HB3 . GLU A ? 8 ? -29.586 63.569 62.049 1.0 24.56 8 C 1 ATOM 137 H HG2 . GLU A ? 8 ? -31.178 64.097 60.473 1.0 44.51 8 C 1 ATOM 138 H HG3 . GLU A ? 8 ? -31.722 65.254 61.419 1.0 44.51 8 C 1 ATOM 139 N N . LEU A ? 9 ? -30.191 61.050 63.767 1.0 14.86 9 C 1 ATOM 140 C CA . LEU A ? 9 ? -29.309 60.287 64.644 1.0 16.47 9 C 1 ATOM 141 C C . LEU A ? 9 ? -27.861 60.787 64.605 1.0 21.07 9 C 1 ATOM 142 O O . LEU A ? 9 ? -27.025 60.432 65.468 1.0 17.06 9 C 1 ATOM 143 C CB . LEU A ? 9 ? -29.337 58.803 64.278 1.0 16.73 9 C 1 ATOM 144 C CG . LEU A ? 9 ? -30.537 57.980 64.760 1.0 14.98 9 C 1 ATOM 145 C CD1 . LEU A ? 9 ? -31.841 58.438 64.088 1.0 14.92 9 C 1 ATOM 146 C CD2 . LEU A ? 9 ? -30.324 56.512 64.508 1.0 16.56 9 C 1 ATOM 147 O OXT . LEU A ? 9 ? -27.512 61.551 63.706 1.0 20.51 9 C 1 ATOM 148 H H . LEU A ? 9 ? -30.424 60.631 63.053 1.0 17.83 9 C 1 ATOM 149 H HA . LEU A ? 9 ? -29.627 60.373 65.556 1.0 19.76 9 C 1 ATOM 150 H HB2 . LEU A ? 9 ? -29.315 58.731 63.311 1.0 20.07 9 C 1 ATOM 151 H HB3 . LEU A ? 9 ? -28.542 58.388 64.646 1.0 20.07 9 C 1 ATOM 152 H HG . LEU A ? 9 ? -30.637 58.105 65.716 1.0 17.98 9 C 1 ATOM 153 H HD11 . LEU A ? 9 ? -32.573 57.894 64.420 1.0 17.9 9 C 1 ATOM 154 H HD12 . LEU A ? 9 ? -31.996 59.370 64.306 1.0 17.9 9 C 1 ATOM 155 H HD13 . LEU A ? 9 ? -31.755 58.330 63.129 1.0 17.9 9 C 1 ATOM 156 H HD21 . LEU A ? 9 ? -31.099 56.022 64.823 1.0 19.87 9 C 1 ATOM 157 H HD22 . LEU A ? 9 ? -30.207 56.370 63.556 1.0 19.87 9 C 1 ATOM 158 H HD23 . LEU A ? 9 ? -29.531 56.222 64.986 1.0 19.87 9 C 1 #