REMARK YASARA ************************************************************* REMARK YASARA * * REMARK YASARA * Y A S A R A * REMARK YASARA * * REMARK YASARA * Yet Another Scientific Artificial Reality Application * REMARK YASARA * * REMARK YASARA * MOLECULE STRUCTURE FILE, PDB FORMAT * REMARK YASARA * * REMARK YASARA * Just use YASARA every day to make your questions go away! * REMARK YASARA * * REMARK YASARA * www.YASARA.org * REMARK YASARA * * REMARK YASARA ************************************************************* REMARK YASARA REMARK YASARA Original filename: C:\Users\federica\Favorites\Dropbox\lab13\Lucia\pdb_yadamp\risultati_grimd_abalone\pdb_final\RCVCTRGFCRCICLLGIC.pdb REMARK YASARA Written on: Mon May 19 17:41:21 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 281 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 18 ARG CYS VAL CYS THR ARG GLY PHE CYS ARG CYS ILE CYS SEQRES 2 18 LEU LEU GLY ILE CYS ATOM 1 N ARG 1 -8.588 -7.208 36.724 1.00 -0.35 N ATOM 2 1H ARG 1 -8.345 -6.236 36.854 1.00 -0.35 H ATOM 3 2H ARG 1 -9.321 -7.456 37.374 1.00 -0.35 H ATOM 4 3H ARG 1 -7.775 -7.781 36.907 1.00 0.28 H ATOM 5 CA ARG 1 -9.055 -7.428 35.317 1.00 -0.26 C ATOM 6 HA ARG 1 -9.931 -6.803 35.140 1.00 0.16 H ATOM 7 C ARG 1 -9.479 -8.887 35.102 1.00 0.73 C ATOM 8 O ARG 1 -8.944 -9.569 34.247 1.00 -0.59 O ATOM 9 CB ARG 1 -7.956 -6.994 34.315 1.00 -0.00 C ATOM 10 1HB ARG 1 -8.326 -7.177 33.309 1.00 0.03 H ATOM 11 2HB ARG 1 -7.819 -5.917 34.412 1.00 0.03 H ATOM 12 CG ARG 1 -6.557 -7.655 34.458 1.00 0.04 C ATOM 13 1HG ARG 1 -5.864 -6.940 34.902 1.00 0.03 H ATOM 14 2HG ARG 1 -6.635 -8.516 35.123 1.00 0.03 H ATOM 15 CD ARG 1 -5.989 -8.150 33.116 1.00 0.05 C ATOM 16 1HD ARG 1 -5.101 -8.750 33.318 1.00 0.07 H ATOM 17 2HD ARG 1 -6.727 -8.796 32.644 1.00 0.07 H ATOM 18 NE ARG 1 -5.617 -7.072 32.184 1.00 -0.53 N ATOM 19 HE ARG 1 -5.575 -6.140 32.558 1.00 0.35 H ATOM 20 CZ ARG 1 -5.281 -7.222 30.906 1.00 0.81 C ATOM 21 NH1 ARG 1 -4.838 -6.184 30.255 1.00 -0.86 N ATOM 22 1HH1 ARG 1 -4.733 -5.295 30.712 1.00 0.32 H ATOM 23 2HH1 ARG 1 -4.590 -6.270 29.284 1.00 0.32 H ATOM 24 NH2 ARG 1 -5.377 -8.345 30.244 1.00 -0.86 N ATOM 25 1HH2 ARG 1 -5.791 -9.167 30.675 1.00 0.32 H ATOM 26 2HH2 ARG 1 -5.055 -8.406 29.294 1.00 0.32 H ATOM 27 N CYS 2 -10.410 -9.407 35.892 1.00 -0.42 N ATOM 28 H CYS 2 -10.991 -8.832 36.488 1.00 0.27 H ATOM 29 CA CYS 2 -10.556 -10.860 36.026 1.00 0.02 C ATOM 30 HA CYS 2 -9.595 -11.245 36.374 1.00 0.11 H ATOM 31 C CYS 2 -10.907 -11.662 34.767 1.00 0.60 C ATOM 32 O CYS 2 -10.168 -12.570 34.392 1.00 -0.57 O ATOM 33 CB CYS 2 -11.581 -11.112 37.129 1.00 -0.12 C ATOM 34 1HB CYS 2 -12.589 -10.939 36.748 1.00 0.11 H ATOM 35 2HB CYS 2 -11.506 -12.149 37.467 1.00 0.11 H ATOM 36 SG CYS 2 -11.278 -9.983 38.512 1.00 -0.31 S ATOM 37 HG CYS 2 -12.151 -10.538 39.369 1.00 0.19 H ATOM 38 N VAL 3 -11.976 -11.311 34.064 1.00 -0.42 N ATOM 39 H VAL 3 -12.572 -10.556 34.366 1.00 0.27 H ATOM 40 CA VAL 3 -12.335 -12.048 32.846 1.00 -0.09 C ATOM 41 HA VAL 3 -12.290 -13.114 33.072 1.00 0.10 H ATOM 42 C VAL 3 -11.323 -11.785 31.734 1.00 0.60 C ATOM 43 O VAL 3 -11.096 -12.621 30.862 1.00 -0.57 O ATOM 44 CB VAL 3 -13.780 -11.730 32.361 1.00 0.30 C ATOM 45 HB VAL 3 -13.967 -12.305 31.454 1.00 -0.03 H ATOM 46 CG1 VAL 3 -14.800 -12.166 33.421 1.00 -0.32 C ATOM 47 1HG1 VAL 3 -14.701 -11.578 34.333 1.00 0.08 H ATOM 48 2HG1 VAL 3 -15.811 -12.033 33.030 1.00 0.08 H ATOM 49 3HG1 VAL 3 -14.665 -13.223 33.660 1.00 0.08 H ATOM 50 CG2 VAL 3 -13.978 -10.236 32.042 1.00 -0.32 C ATOM 51 1HG2 VAL 3 -13.825 -9.617 32.924 1.00 0.08 H ATOM 52 2HG2 VAL 3 -13.298 -9.925 31.249 1.00 0.08 H ATOM 53 3HG2 VAL 3 -14.998 -10.078 31.683 1.00 0.08 H ATOM 54 N CYS 4 -10.615 -10.670 31.836 1.00 -0.42 N ATOM 55 H CYS 4 -10.802 -10.037 32.595 1.00 0.27 H ATOM 56 CA CYS 4 -9.562 -10.298 30.900 1.00 0.02 C ATOM 57 HA CYS 4 -9.898 -10.537 29.891 1.00 0.11 H ATOM 58 C CYS 4 -8.241 -11.034 31.156 1.00 0.60 C ATOM 59 O CYS 4 -7.184 -10.568 30.745 1.00 -0.57 O ATOM 60 CB CYS 4 -9.346 -8.790 30.994 1.00 -0.12 C ATOM 61 1HB CYS 4 -8.538 -8.609 31.695 1.00 0.11 H ATOM 62 2HB CYS 4 -9.042 -8.408 30.017 1.00 0.11 H ATOM 63 SG CYS 4 -10.817 -7.904 31.580 1.00 -0.31 S ATOM 64 HG CYS 4 -11.517 -7.987 30.438 1.00 0.19 H ATOM 65 N THR 5 -8.298 -12.163 31.851 1.00 -0.42 N ATOM 66 H THR 5 -9.156 -12.410 32.323 1.00 0.27 H ATOM 67 CA THR 5 -7.161 -13.083 31.940 1.00 -0.04 C ATOM 68 HA THR 5 -6.305 -12.645 31.427 1.00 0.10 H ATOM 69 C THR 5 -7.446 -14.431 31.279 1.00 0.60 C ATOM 70 O THR 5 -6.535 -15.237 31.138 1.00 -0.57 O ATOM 71 CB THR 5 -6.747 -13.366 33.403 1.00 0.37 C ATOM 72 HB THR 5 -5.882 -14.029 33.401 1.00 0.00 H ATOM 73 OG1 THR 5 -7.820 -14.003 34.105 1.00 -0.68 O ATOM 74 HG1 THR 5 -8.525 -13.356 34.255 1.00 0.41 H ATOM 75 CG2 THR 5 -6.390 -12.096 34.155 1.00 -0.24 C ATOM 76 1HG2 THR 5 -5.604 -11.561 33.620 1.00 0.06 H ATOM 77 2HG2 THR 5 -7.264 -11.459 34.257 1.00 0.06 H ATOM 78 3HG2 THR 5 -6.023 -12.361 35.147 1.00 0.06 H ATOM 79 N ARG 6 -8.699 -14.678 30.895 1.00 -0.35 N ATOM 80 H ARG 6 -9.394 -13.957 31.014 1.00 0.28 H ATOM 81 CA ARG 6 -9.103 -15.960 30.278 1.00 -0.26 C ATOM 82 HA ARG 6 -8.359 -16.205 29.515 1.00 0.16 H ATOM 83 C ARG 6 -10.454 -15.996 29.569 1.00 0.73 C ATOM 84 O ARG 6 -10.574 -16.557 28.490 1.00 -0.59 O ATOM 85 CB ARG 6 -9.062 -17.097 31.316 1.00 -0.00 C ATOM 86 1HB ARG 6 -9.431 -18.012 30.853 1.00 0.03 H ATOM 87 2HB ARG 6 -8.015 -17.265 31.549 1.00 0.03 H ATOM 88 CG ARG 6 -9.821 -16.865 32.636 1.00 0.04 C ATOM 89 1HG ARG 6 -9.840 -15.805 32.879 1.00 0.03 H ATOM 90 2HG ARG 6 -10.847 -17.214 32.523 1.00 0.03 H ATOM 91 CD ARG 6 -9.157 -17.594 33.803 1.00 0.05 C ATOM 92 1HD ARG 6 -9.806 -17.520 34.677 1.00 0.07 H ATOM 93 2HD ARG 6 -9.035 -18.647 33.549 1.00 0.07 H ATOM 94 NE ARG 6 -7.856 -16.981 34.123 1.00 -0.53 N ATOM 95 HE ARG 6 -7.886 -16.037 34.485 1.00 0.35 H ATOM 96 CZ ARG 6 -6.652 -17.507 33.932 1.00 0.81 C ATOM 97 NH1 ARG 6 -5.608 -16.778 34.205 1.00 -0.86 N ATOM 98 1HH1 ARG 6 -5.728 -15.839 34.542 1.00 0.32 H ATOM 99 2HH1 ARG 6 -4.684 -17.142 34.054 1.00 0.32 H ATOM 100 NH2 ARG 6 -6.443 -18.719 33.483 1.00 -0.86 N ATOM 101 1HH2 ARG 6 -7.225 -19.315 33.276 1.00 0.32 H ATOM 102 2HH2 ARG 6 -5.505 -19.050 33.340 1.00 0.32 H ATOM 103 N GLY 7 -11.477 -15.371 30.134 1.00 -0.42 N ATOM 104 H GLY 7 -11.354 -14.875 31.001 1.00 0.27 H ATOM 105 CA GLY 7 -12.788 -15.377 29.501 1.00 -0.03 C ATOM 106 1HA GLY 7 -13.080 -16.407 29.294 1.00 0.07 H ATOM 107 2HA GLY 7 -13.519 -14.927 30.173 1.00 0.07 H ATOM 108 C GLY 7 -12.775 -14.606 28.197 1.00 0.60 C ATOM 109 O GLY 7 -13.466 -14.951 27.238 1.00 -0.57 O ATOM 110 N PHE 8 -11.939 -13.582 28.128 1.00 -0.42 N ATOM 111 H PHE 8 -11.405 -13.312 28.944 1.00 0.27 H ATOM 112 CA PHE 8 -11.796 -12.813 26.897 1.00 -0.00 C ATOM 113 HA PHE 8 -12.790 -12.485 26.593 1.00 0.10 H ATOM 114 C PHE 8 -11.202 -13.635 25.753 1.00 0.60 C ATOM 115 O PHE 8 -11.455 -13.325 24.597 1.00 -0.57 O ATOM 116 CB PHE 8 -10.940 -11.562 27.132 1.00 -0.03 C ATOM 117 1HB PHE 8 -11.197 -10.828 26.369 1.00 0.03 H ATOM 118 2HB PHE 8 -11.188 -11.142 28.105 1.00 0.03 H ATOM 119 CG PHE 8 -9.456 -11.811 27.050 1.00 0.01 C ATOM 120 CD1 PHE 8 -8.760 -12.411 28.114 1.00 -0.13 C ATOM 121 HD1 PHE 8 -9.290 -12.707 29.002 1.00 0.13 H ATOM 122 CD2 PHE 8 -8.746 -11.451 25.888 1.00 -0.13 C ATOM 123 HD2 PHE 8 -9.266 -10.998 25.056 1.00 0.13 H ATOM 124 CE1 PHE 8 -7.365 -12.641 28.032 1.00 -0.17 C ATOM 125 HE1 PHE 8 -6.838 -13.105 28.852 1.00 0.14 H ATOM 126 CE2 PHE 8 -7.353 -11.687 25.786 1.00 -0.17 C ATOM 127 HE2 PHE 8 -6.821 -11.411 24.887 1.00 0.14 H ATOM 128 CZ PHE 8 -6.661 -12.277 26.865 1.00 -0.11 C ATOM 129 HZ PHE 8 -5.598 -12.459 26.794 1.00 0.13 H ATOM 130 N CYS 9 -10.456 -14.696 26.043 1.00 -0.42 N ATOM 131 H CYS 9 -10.308 -14.974 27.005 1.00 0.27 H ATOM 132 CA CYS 9 -9.793 -15.466 24.994 1.00 0.02 C ATOM 133 HA CYS 9 -9.188 -14.787 24.393 1.00 0.11 H ATOM 134 C CYS 9 -10.803 -16.143 24.075 1.00 0.60 C ATOM 135 O CYS 9 -10.680 -16.087 22.855 1.00 -0.57 O ATOM 136 CB CYS 9 -8.877 -16.522 25.615 1.00 -0.12 C ATOM 137 1HB CYS 9 -9.481 -17.224 26.191 1.00 0.11 H ATOM 138 2HB CYS 9 -8.382 -17.075 24.814 1.00 0.11 H ATOM 139 SG CYS 9 -7.625 -15.818 26.708 1.00 -0.31 S ATOM 140 HG CYS 9 -6.979 -15.106 25.777 1.00 0.19 H ATOM 141 N ARG 10 -11.847 -16.738 24.642 1.00 -0.35 N ATOM 142 H ARG 10 -11.929 -16.757 25.649 1.00 0.28 H ATOM 143 CA ARG 10 -12.867 -17.368 23.795 1.00 -0.26 C ATOM 144 HA ARG 10 -12.351 -17.977 23.049 1.00 0.16 H ATOM 145 C ARG 10 -13.653 -16.312 23.030 1.00 0.73 C ATOM 146 O ARG 10 -14.137 -16.568 21.939 1.00 -0.59 O ATOM 147 CB ARG 10 -13.804 -18.301 24.582 1.00 -0.00 C ATOM 148 1HB ARG 10 -14.394 -18.860 23.855 1.00 0.03 H ATOM 149 2HB ARG 10 -13.195 -19.013 25.139 1.00 0.03 H ATOM 150 CG ARG 10 -14.775 -17.629 25.549 1.00 0.04 C ATOM 151 1HG ARG 10 -14.212 -17.122 26.326 1.00 0.03 H ATOM 152 2HG ARG 10 -15.378 -16.901 25.007 1.00 0.03 H ATOM 153 CD ARG 10 -15.712 -18.634 26.199 1.00 0.05 C ATOM 154 1HD ARG 10 -16.202 -19.216 25.417 1.00 0.07 H ATOM 155 2HD ARG 10 -15.130 -19.306 26.833 1.00 0.07 H ATOM 156 NE ARG 10 -16.738 -17.953 27.006 1.00 -0.53 N ATOM 157 HE ARG 10 -16.698 -16.946 27.017 1.00 0.35 H ATOM 158 CZ ARG 10 -17.711 -18.534 27.697 1.00 0.81 C ATOM 159 NH1 ARG 10 -18.564 -17.779 28.333 1.00 -0.86 N ATOM 160 1HH1 ARG 10 -18.495 -16.777 28.283 1.00 0.32 H ATOM 161 2HH1 ARG 10 -19.304 -18.198 28.869 1.00 0.32 H ATOM 162 NH2 ARG 10 -17.868 -19.831 27.780 1.00 -0.86 N ATOM 163 1HH2 ARG 10 -17.233 -20.441 27.294 1.00 0.32 H ATOM 164 2HH2 ARG 10 -18.619 -20.219 28.323 1.00 0.32 H ATOM 165 N CYS 11 -13.751 -15.112 23.583 1.00 -0.42 N ATOM 166 H CYS 11 -13.302 -14.926 24.463 1.00 0.27 H ATOM 167 CA CYS 11 -14.493 -14.046 22.925 1.00 0.02 C ATOM 168 HA CYS 11 -15.445 -14.446 22.572 1.00 0.11 H ATOM 169 C CYS 11 -13.722 -13.529 21.714 1.00 0.60 C ATOM 170 O CYS 11 -14.289 -13.385 20.642 1.00 -0.57 O ATOM 171 CB CYS 11 -14.774 -12.914 23.916 1.00 -0.12 C ATOM 172 1HB CYS 11 -13.831 -12.465 24.228 1.00 0.11 H ATOM 173 2HB CYS 11 -15.363 -12.148 23.406 1.00 0.11 H ATOM 174 SG CYS 11 -15.678 -13.477 25.388 1.00 -0.31 S ATOM 175 HG CYS 11 -14.653 -14.089 26.001 1.00 0.19 H ATOM 176 N ILE 12 -12.424 -13.296 21.847 1.00 -0.42 N ATOM 177 H ILE 12 -11.966 -13.404 22.749 1.00 0.27 H ATOM 178 CA ILE 12 -11.641 -12.845 20.695 1.00 -0.06 C ATOM 179 HA ILE 12 -12.222 -12.075 20.190 1.00 0.09 H ATOM 180 C ILE 12 -11.458 -13.973 19.680 1.00 0.60 C ATOM 181 O ILE 12 -11.325 -13.708 18.497 1.00 -0.57 O ATOM 182 CB ILE 12 -10.284 -12.188 21.093 1.00 0.13 C ATOM 183 HB ILE 12 -9.823 -11.806 20.181 1.00 0.02 H ATOM 184 CG1 ILE 12 -9.315 -13.204 21.728 1.00 -0.04 C ATOM 185 1HG1 ILE 12 -9.729 -13.526 22.678 1.00 0.02 H ATOM 186 2HG1 ILE 12 -9.241 -14.074 21.079 1.00 0.02 H ATOM 187 CG2 ILE 12 -10.551 -10.982 22.033 1.00 -0.32 C ATOM 188 1HG2 ILE 12 -9.636 -10.404 22.164 1.00 0.09 H ATOM 189 2HG2 ILE 12 -11.303 -10.326 21.591 1.00 0.09 H ATOM 190 3HG2 ILE 12 -10.900 -11.321 23.008 1.00 0.09 H ATOM 191 CD1 ILE 12 -7.891 -12.697 21.978 1.00 -0.07 C ATOM 192 1HD1 ILE 12 -7.280 -13.516 22.355 1.00 0.02 H ATOM 193 2HD1 ILE 12 -7.459 -12.331 21.045 1.00 0.02 H ATOM 194 3HD1 ILE 12 -7.899 -11.895 22.716 1.00 0.02 H ATOM 195 N CYS 13 -11.533 -15.226 20.110 1.00 -0.42 N ATOM 196 H CYS 13 -11.570 -15.417 21.103 1.00 0.27 H ATOM 197 CA CYS 13 -11.536 -16.347 19.171 1.00 0.02 C ATOM 198 HA CYS 13 -10.679 -16.259 18.501 1.00 0.11 H ATOM 199 C CYS 13 -12.809 -16.335 18.327 1.00 0.60 C ATOM 200 O CYS 13 -12.761 -16.546 17.125 1.00 -0.57 O ATOM 201 CB CYS 13 -11.444 -17.673 19.929 1.00 -0.12 C ATOM 202 1HB CYS 13 -10.614 -17.621 20.635 1.00 0.11 H ATOM 203 2HB CYS 13 -12.368 -17.827 20.486 1.00 0.11 H ATOM 204 SG CYS 13 -11.181 -19.089 18.832 1.00 -0.31 S ATOM 205 HG CYS 13 -11.960 -18.654 17.826 1.00 0.19 H ATOM 206 N LEU 14 -13.945 -16.066 18.959 1.00 -0.42 N ATOM 207 H LEU 14 -13.939 -15.924 19.962 1.00 0.27 H ATOM 208 CA LEU 14 -15.223 -15.976 18.251 1.00 -0.05 C ATOM 209 HA LEU 14 -15.374 -16.891 17.680 1.00 0.09 H ATOM 210 C LEU 14 -15.250 -14.803 17.272 1.00 0.60 C ATOM 211 O LEU 14 -15.858 -14.887 16.214 1.00 -0.57 O ATOM 212 CB LEU 14 -16.357 -15.830 19.273 1.00 -0.11 C ATOM 213 1HB LEU 14 -16.271 -16.652 19.983 1.00 0.05 H ATOM 214 2HB LEU 14 -16.195 -14.904 19.820 1.00 0.05 H ATOM 215 CG LEU 14 -17.804 -15.804 18.752 1.00 0.35 C ATOM 216 HG LEU 14 -17.918 -14.952 18.084 1.00 -0.04 H ATOM 217 CD1 LEU 14 -18.184 -17.071 17.984 1.00 -0.41 C ATOM 218 1HD1 LEU 14 -19.234 -17.025 17.695 1.00 0.10 H ATOM 219 2HD1 LEU 14 -17.585 -17.139 17.074 1.00 0.10 H ATOM 220 3HD1 LEU 14 -18.014 -17.954 18.599 1.00 0.10 H ATOM 221 CD2 LEU 14 -18.759 -15.612 19.930 1.00 -0.41 C ATOM 222 1HD2 LEU 14 -18.680 -16.450 20.622 1.00 0.10 H ATOM 223 2HD2 LEU 14 -18.517 -14.685 20.451 1.00 0.10 H ATOM 224 3HD2 LEU 14 -19.783 -15.543 19.561 1.00 0.10 H ATOM 225 N LEU 15 -14.576 -13.714 17.610 1.00 -0.42 N ATOM 226 H LEU 15 -14.142 -13.660 18.522 1.00 0.27 H ATOM 227 CA LEU 15 -14.460 -12.583 16.687 1.00 -0.05 C ATOM 228 HA LEU 15 -15.436 -12.382 16.247 1.00 0.09 H ATOM 229 C LEU 15 -13.492 -12.868 15.537 1.00 0.60 C ATOM 230 O LEU 15 -13.688 -12.385 14.431 1.00 -0.57 O ATOM 231 CB LEU 15 -13.978 -11.336 17.437 1.00 -0.11 C ATOM 232 1HB LEU 15 -13.036 -11.586 17.924 1.00 0.05 H ATOM 233 2HB LEU 15 -13.769 -10.564 16.696 1.00 0.05 H ATOM 234 CG LEU 15 -14.919 -10.730 18.490 1.00 0.35 C ATOM 235 HG LEU 15 -15.216 -11.507 19.188 1.00 -0.04 H ATOM 236 CD1 LEU 15 -14.186 -9.642 19.275 1.00 -0.41 C ATOM 237 1HD1 LEU 15 -14.846 -9.238 20.043 1.00 0.10 H ATOM 238 2HD1 LEU 15 -13.309 -10.069 19.759 1.00 0.10 H ATOM 239 3HD1 LEU 15 -13.875 -8.839 18.605 1.00 0.10 H ATOM 240 CD2 LEU 15 -16.188 -10.144 17.865 1.00 -0.41 C ATOM 241 1HD2 LEU 15 -16.808 -9.696 18.641 1.00 0.10 H ATOM 242 2HD2 LEU 15 -15.929 -9.387 17.124 1.00 0.10 H ATOM 243 3HD2 LEU 15 -16.761 -10.937 17.382 1.00 0.10 H ATOM 244 N GLY 16 -12.462 -13.658 15.800 1.00 -0.42 N ATOM 245 H GLY 16 -12.372 -14.065 16.721 1.00 0.27 H ATOM 246 CA GLY 16 -11.405 -13.942 14.836 1.00 -0.03 C ATOM 247 1HA GLY 16 -11.193 -13.035 14.268 1.00 0.07 H ATOM 248 2HA GLY 16 -10.508 -14.216 15.389 1.00 0.07 H ATOM 249 C GLY 16 -11.695 -15.050 13.843 1.00 0.60 C ATOM 250 O GLY 16 -10.813 -15.830 13.489 1.00 -0.57 O ATOM 251 N ILE 17 -12.941 -15.128 13.404 1.00 -0.42 N ATOM 252 H ILE 17 -13.609 -14.441 13.732 1.00 0.27 H ATOM 253 CA ILE 17 -13.386 -16.132 12.434 1.00 -0.06 C ATOM 254 HA ILE 17 -12.676 -16.957 12.421 1.00 0.09 H ATOM 255 C ILE 17 -13.413 -15.530 11.029 1.00 0.60 C ATOM 256 O ILE 17 -13.812 -16.187 10.062 1.00 -0.57 O ATOM 257 CB ILE 17 -14.782 -16.700 12.819 1.00 0.13 C ATOM 258 HB ILE 17 -15.062 -17.445 12.074 1.00 0.02 H ATOM 259 CG1 ILE 17 -15.849 -15.582 12.812 1.00 -0.04 C ATOM 260 1HG1 ILE 17 -15.615 -14.864 13.597 1.00 0.02 H ATOM 261 2HG1 ILE 17 -15.803 -15.059 11.859 1.00 0.02 H ATOM 262 CG2 ILE 17 -14.685 -17.416 14.193 1.00 -0.32 C ATOM 263 1HG2 ILE 17 -13.880 -18.151 14.170 1.00 0.09 H ATOM 264 2HG2 ILE 17 -14.473 -16.694 14.982 1.00 0.09 H ATOM 265 3HG2 ILE 17 -15.619 -17.926 14.419 1.00 0.09 H ATOM 266 CD1 ILE 17 -17.296 -16.052 13.012 1.00 -0.07 C ATOM 267 1HD1 ILE 17 -17.423 -16.454 14.017 1.00 0.02 H ATOM 268 2HD1 ILE 17 -17.966 -15.200 12.888 1.00 0.02 H ATOM 269 3HD1 ILE 17 -17.545 -16.814 12.273 1.00 0.02 H ATOM 270 N CYS 18 -12.999 -14.274 10.936 1.00 -0.42 N ATOM 271 H CYS 18 -12.620 -13.802 11.753 1.00 0.27 H ATOM 272 CA CYS 18 -12.924 -13.491 9.709 1.00 0.02 C ATOM 273 HA CYS 18 -12.651 -14.109 8.856 1.00 0.11 H ATOM 274 C CYS 18 -11.797 -12.522 10.037 1.00 0.60 C ATOM 275 O CYS 18 -11.325 -11.779 9.153 1.00 -0.57 O ATOM 276 OXT CYS 18 -11.430 -12.528 11.236 1.00 -0.57 O ATOM 277 CB CYS 18 -14.224 -12.719 9.455 1.00 -0.12 C ATOM 278 1HB CYS 18 -14.480 -12.178 10.366 1.00 0.11 H ATOM 279 2HB CYS 18 -14.036 -11.988 8.667 1.00 0.11 H ATOM 280 SG CYS 18 -15.618 -13.773 8.967 1.00 -0.31 S ATOM 281 HG CYS 18 -15.064 -14.917 9.410 1.00 0.19 H TER 282 CYS 18 END