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\FFPLLFGALSSHLPKLF.pdb REMARK YASARA Written on: Mon May 19 15:39:36 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 285 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 17 PHE PHE PRO LEU LEU PHE GLY ALA LEU SER SER HIS LEU SEQRES 2 17 PRO LYS LEU PHE ATOM 1 N PHE 1 -6.314 -8.368 25.192 1.00 -0.42 N ATOM 2 1H PHE 1 -6.378 -8.120 26.169 1.00 -0.42 H ATOM 3 2H PHE 1 -5.392 -8.146 24.843 1.00 -0.42 H ATOM 4 3H PHE 1 -6.998 -7.844 24.664 1.00 0.27 H ATOM 5 CA PHE 1 -6.571 -9.826 25.022 1.00 -0.00 C ATOM 6 HA PHE 1 -5.820 -10.392 25.570 1.00 0.10 H ATOM 7 C PHE 1 -6.496 -10.166 23.554 1.00 0.60 C ATOM 8 O PHE 1 -6.202 -9.277 22.771 1.00 -0.57 O ATOM 9 CB PHE 1 -7.970 -10.193 25.529 1.00 -0.03 C ATOM 10 1HB PHE 1 -8.701 -9.778 24.839 1.00 0.03 H ATOM 11 2HB PHE 1 -8.078 -11.278 25.535 1.00 0.03 H ATOM 12 CG PHE 1 -8.275 -9.674 26.902 1.00 0.01 C ATOM 13 CD1 PHE 1 -7.583 -10.166 28.025 1.00 -0.13 C ATOM 14 HD1 PHE 1 -6.833 -10.937 27.912 1.00 0.13 H ATOM 15 CD2 PHE 1 -9.265 -8.690 27.082 1.00 -0.13 C ATOM 16 HD2 PHE 1 -9.817 -8.308 26.234 1.00 0.13 H ATOM 17 CE1 PHE 1 -7.857 -9.661 29.319 1.00 -0.17 C ATOM 18 HE1 PHE 1 -7.316 -10.036 30.178 1.00 0.14 H ATOM 19 CE2 PHE 1 -9.554 -8.183 28.369 1.00 -0.17 C ATOM 20 HE2 PHE 1 -10.320 -7.430 28.499 1.00 0.14 H ATOM 21 CZ PHE 1 -8.841 -8.662 29.489 1.00 -0.11 C ATOM 22 HZ PHE 1 -9.054 -8.271 30.475 1.00 0.13 H ATOM 23 N PHE 2 -6.837 -11.390 23.172 1.00 -0.42 N ATOM 24 H PHE 2 -7.020 -12.113 23.849 1.00 0.27 H ATOM 25 CA PHE 2 -7.055 -11.716 21.765 1.00 -0.00 C ATOM 26 HA PHE 2 -6.141 -11.535 21.199 1.00 0.10 H ATOM 27 C PHE 2 -8.197 -10.837 21.250 1.00 0.60 C ATOM 28 O PHE 2 -9.104 -10.526 22.028 1.00 -0.57 O ATOM 29 CB PHE 2 -7.477 -13.180 21.646 1.00 -0.03 C ATOM 30 1HB PHE 2 -8.428 -13.311 22.162 1.00 0.03 H ATOM 31 2HB PHE 2 -7.621 -13.416 20.597 1.00 0.03 H ATOM 32 CG PHE 2 -6.486 -14.142 22.229 1.00 0.01 C ATOM 33 CD1 PHE 2 -6.693 -14.692 23.509 1.00 -0.13 C ATOM 34 HD1 PHE 2 -7.575 -14.428 24.075 1.00 0.13 H ATOM 35 CD2 PHE 2 -5.345 -14.515 21.498 1.00 -0.13 C ATOM 36 HD2 PHE 2 -5.179 -14.113 20.508 1.00 0.13 H ATOM 37 CE1 PHE 2 -5.761 -15.602 24.065 1.00 -0.17 C ATOM 38 HE1 PHE 2 -5.923 -16.017 25.049 1.00 0.14 H ATOM 39 CE2 PHE 2 -4.408 -15.428 22.037 1.00 -0.17 C ATOM 40 HE2 PHE 2 -3.538 -15.715 21.461 1.00 0.14 H ATOM 41 CZ PHE 2 -4.613 -15.969 23.326 1.00 -0.11 C ATOM 42 HZ PHE 2 -3.900 -16.668 23.739 1.00 0.13 H ATOM 43 N PRO 3 -8.175 -10.419 19.973 1.00 -0.25 N ATOM 44 CA PRO 3 -9.317 -9.619 19.513 1.00 -0.03 C ATOM 45 HA PRO 3 -9.535 -8.814 20.214 1.00 0.06 H ATOM 46 C PRO 3 -10.570 -10.470 19.300 1.00 0.59 C ATOM 47 O PRO 3 -10.510 -11.699 19.298 1.00 -0.57 O ATOM 48 CB PRO 3 -8.801 -9.037 18.195 1.00 -0.01 C ATOM 49 1HB PRO 3 -9.618 -8.833 17.503 1.00 0.03 H ATOM 50 2HB PRO 3 -8.227 -8.130 18.384 1.00 0.03 H ATOM 51 CG PRO 3 -7.914 -10.098 17.673 1.00 0.02 C ATOM 52 1HG PRO 3 -8.513 -10.892 17.230 1.00 0.02 H ATOM 53 2HG PRO 3 -7.213 -9.696 16.941 1.00 0.02 H ATOM 54 CD PRO 3 -7.188 -10.607 18.892 1.00 0.02 C ATOM 55 1HD PRO 3 -6.926 -11.658 18.772 1.00 0.04 H ATOM 56 2HD PRO 3 -6.299 -10.004 19.086 1.00 0.04 H ATOM 57 N LEU 4 -11.709 -9.822 19.078 1.00 -0.42 N ATOM 58 H LEU 4 -11.715 -8.814 19.067 1.00 0.27 H ATOM 59 CA LEU 4 -12.974 -10.534 18.865 1.00 -0.05 C ATOM 60 HA LEU 4 -13.187 -11.136 19.747 1.00 0.09 H ATOM 61 C LEU 4 -12.916 -11.477 17.666 1.00 0.60 C ATOM 62 O LEU 4 -13.441 -12.581 17.719 1.00 -0.57 O ATOM 63 CB LEU 4 -14.111 -9.523 18.661 1.00 -0.11 C ATOM 64 1HB LEU 4 -14.115 -8.842 19.511 1.00 0.05 H ATOM 65 2HB LEU 4 -13.879 -8.937 17.772 1.00 0.05 H ATOM 66 CG LEU 4 -15.539 -10.075 18.489 1.00 0.35 C ATOM 67 HG LEU 4 -15.556 -10.722 17.614 1.00 -0.04 H ATOM 68 CD1 LEU 4 -16.033 -10.886 19.692 1.00 -0.41 C ATOM 69 1HD1 LEU 4 -15.393 -11.756 19.840 1.00 0.10 H ATOM 70 2HD1 LEU 4 -16.039 -10.268 20.588 1.00 0.10 H ATOM 71 3HD1 LEU 4 -17.046 -11.240 19.496 1.00 0.10 H ATOM 72 CD2 LEU 4 -16.499 -8.917 18.237 1.00 -0.41 C ATOM 73 1HD2 LEU 4 -16.189 -8.364 17.349 1.00 0.10 H ATOM 74 2HD2 LEU 4 -17.504 -9.304 18.062 1.00 0.10 H ATOM 75 3HD2 LEU 4 -16.521 -8.241 19.093 1.00 0.10 H ATOM 76 N LEU 5 -12.223 -11.064 16.613 1.00 -0.42 N ATOM 77 H LEU 5 -11.792 -10.156 16.636 1.00 0.27 H ATOM 78 CA LEU 5 -12.076 -11.876 15.401 1.00 -0.05 C ATOM 79 HA LEU 5 -13.073 -12.193 15.091 1.00 0.09 H ATOM 80 C LEU 5 -11.254 -13.153 15.590 1.00 0.60 C ATOM 81 O LEU 5 -11.259 -14.027 14.738 1.00 -0.57 O ATOM 82 CB LEU 5 -11.499 -11.008 14.270 1.00 -0.11 C ATOM 83 1HB LEU 5 -11.527 -11.599 13.353 1.00 0.05 H ATOM 84 2HB LEU 5 -12.206 -10.191 14.134 1.00 0.05 H ATOM 85 CG LEU 5 -10.099 -10.370 14.366 1.00 0.35 C ATOM 86 HG LEU 5 -9.989 -9.937 15.358 1.00 -0.04 H ATOM 87 CD1 LEU 5 -8.930 -11.329 14.122 1.00 -0.41 C ATOM 88 1HD1 LEU 5 -9.039 -11.812 13.148 1.00 0.10 H ATOM 89 2HD1 LEU 5 -7.985 -10.785 14.147 1.00 0.10 H ATOM 90 3HD1 LEU 5 -8.902 -12.097 14.891 1.00 0.10 H ATOM 91 CD2 LEU 5 -10.005 -9.230 13.353 1.00 -0.41 C ATOM 92 1HD2 LEU 5 -10.784 -8.491 13.543 1.00 0.10 H ATOM 93 2HD2 LEU 5 -9.036 -8.737 13.436 1.00 0.10 H ATOM 94 3HD2 LEU 5 -10.120 -9.617 12.338 1.00 0.10 H ATOM 95 N PHE 6 -10.566 -13.275 16.717 1.00 -0.42 N ATOM 96 H PHE 6 -10.599 -12.538 17.410 1.00 0.27 H ATOM 97 CA PHE 6 -9.777 -14.467 17.027 1.00 -0.00 C ATOM 98 HA PHE 6 -9.493 -14.977 16.105 1.00 0.10 H ATOM 99 C PHE 6 -10.627 -15.410 17.881 1.00 0.60 C ATOM 100 O PHE 6 -10.191 -16.476 18.305 1.00 -0.57 O ATOM 101 CB PHE 6 -8.516 -14.021 17.770 1.00 -0.03 C ATOM 102 1HB PHE 6 -8.126 -13.140 17.266 1.00 0.03 H ATOM 103 2HB PHE 6 -8.788 -13.749 18.787 1.00 0.03 H ATOM 104 CG PHE 6 -7.417 -15.048 17.803 1.00 0.01 C ATOM 105 CD1 PHE 6 -6.541 -15.182 16.711 1.00 -0.13 C ATOM 106 HD1 PHE 6 -6.675 -14.566 15.834 1.00 0.13 H ATOM 107 CD2 PHE 6 -7.231 -15.866 18.931 1.00 -0.13 C ATOM 108 HD2 PHE 6 -7.905 -15.784 19.767 1.00 0.13 H ATOM 109 CE1 PHE 6 -5.478 -16.121 16.745 1.00 -0.17 C ATOM 110 HE1 PHE 6 -4.814 -16.219 15.898 1.00 0.14 H ATOM 111 CE2 PHE 6 -6.175 -16.808 18.983 1.00 -0.17 C ATOM 112 HE2 PHE 6 -6.047 -17.432 19.856 1.00 0.14 H ATOM 113 CZ PHE 6 -5.295 -16.934 17.887 1.00 -0.11 C ATOM 114 HZ PHE 6 -4.490 -17.656 17.916 1.00 0.13 H ATOM 115 N GLY 7 -11.844 -14.984 18.192 1.00 -0.42 N ATOM 116 H GLY 7 -12.171 -14.093 17.831 1.00 0.27 H ATOM 117 CA GLY 7 -12.763 -15.754 19.017 1.00 -0.03 C ATOM 118 1HA GLY 7 -13.774 -15.388 18.840 1.00 0.07 H ATOM 119 2HA GLY 7 -12.714 -16.798 18.706 1.00 0.07 H ATOM 120 C GLY 7 -12.479 -15.689 20.506 1.00 0.60 C ATOM 121 O GLY 7 -13.365 -15.375 21.302 1.00 -0.57 O ATOM 122 N ALA 8 -11.238 -15.957 20.885 1.00 -0.42 N ATOM 123 H ALA 8 -10.567 -16.159 20.144 1.00 0.27 H ATOM 124 CA ALA 8 -10.789 -16.090 22.272 1.00 0.03 C ATOM 125 HA ALA 8 -11.478 -16.782 22.753 1.00 0.08 H ATOM 126 C ALA 8 -10.760 -14.824 23.153 1.00 0.60 C ATOM 127 O ALA 8 -10.179 -14.855 24.246 1.00 -0.57 O ATOM 128 CB ALA 8 -9.404 -16.760 22.252 1.00 -0.18 C ATOM 129 1HB ALA 8 -9.447 -17.685 21.672 1.00 0.06 H ATOM 130 2HB ALA 8 -8.676 -16.091 21.794 1.00 0.06 H ATOM 131 3HB ALA 8 -9.080 -16.993 23.263 1.00 0.06 H ATOM 132 N LEU 9 -11.382 -13.739 22.710 1.00 -0.42 N ATOM 133 H LEU 9 -11.847 -13.788 21.815 1.00 0.27 H ATOM 134 CA LEU 9 -11.481 -12.501 23.487 1.00 -0.05 C ATOM 135 HA LEU 9 -10.478 -12.113 23.661 1.00 0.09 H ATOM 136 C LEU 9 -12.139 -12.749 24.844 1.00 0.60 C ATOM 137 O LEU 9 -13.259 -13.244 24.938 1.00 -0.57 O ATOM 138 CB LEU 9 -12.304 -11.465 22.708 1.00 -0.11 C ATOM 139 1HB LEU 9 -11.754 -11.208 21.805 1.00 0.05 H ATOM 140 2HB LEU 9 -13.222 -11.957 22.396 1.00 0.05 H ATOM 141 CG LEU 9 -12.717 -10.164 23.422 1.00 0.35 C ATOM 142 HG LEU 9 -13.289 -10.433 24.306 1.00 -0.04 H ATOM 143 CD1 LEU 9 -11.549 -9.300 23.871 1.00 -0.41 C ATOM 144 1HD1 LEU 9 -10.935 -9.844 24.578 1.00 0.10 H ATOM 145 2HD1 LEU 9 -10.942 -9.015 23.010 1.00 0.10 H ATOM 146 3HD1 LEU 9 -11.922 -8.396 24.356 1.00 0.10 H ATOM 147 CD2 LEU 9 -13.629 -9.341 22.535 1.00 -0.41 C ATOM 148 1HD2 LEU 9 -13.979 -8.461 23.078 1.00 0.10 H ATOM 149 2HD2 LEU 9 -13.094 -9.016 21.643 1.00 0.10 H ATOM 150 3HD2 LEU 9 -14.497 -9.930 22.245 1.00 0.10 H ATOM 151 N SER 10 -11.437 -12.379 25.904 1.00 -0.42 N ATOM 152 H SER 10 -10.527 -11.965 25.786 1.00 0.27 H ATOM 153 CA SER 10 -11.891 -12.634 27.267 1.00 -0.03 C ATOM 154 HA SER 10 -12.092 -13.697 27.360 1.00 0.08 H ATOM 155 C SER 10 -13.157 -11.903 27.685 1.00 0.60 C ATOM 156 O SER 10 -13.888 -12.374 28.535 1.00 -0.57 O ATOM 157 CB SER 10 -10.764 -12.258 28.223 1.00 0.21 C ATOM 158 1HB SER 10 -10.669 -11.172 28.258 1.00 0.04 H ATOM 159 2HB SER 10 -10.994 -12.628 29.221 1.00 0.04 H ATOM 160 OG SER 10 -9.539 -12.814 27.769 1.00 -0.65 O ATOM 161 HG SER 10 -8.904 -12.757 28.493 1.00 0.43 H ATOM 162 N SER 11 -13.445 -10.777 27.053 1.00 -0.42 N ATOM 163 H SER 11 -12.835 -10.427 26.333 1.00 0.27 H ATOM 164 CA SER 11 -14.604 -9.965 27.408 1.00 -0.03 C ATOM 165 HA SER 11 -14.570 -9.787 28.482 1.00 0.08 H ATOM 166 C SER 11 -15.982 -10.548 27.098 1.00 0.60 C ATOM 167 O SER 11 -16.985 -9.951 27.462 1.00 -0.57 O ATOM 168 CB SER 11 -14.470 -8.619 26.704 1.00 0.21 C ATOM 169 1HB SER 11 -14.742 -8.732 25.654 1.00 0.04 H ATOM 170 2HB SER 11 -15.136 -7.893 27.173 1.00 0.04 H ATOM 171 OG SER 11 -13.122 -8.179 26.787 1.00 -0.65 O ATOM 172 HG SER 11 -13.124 -7.216 26.766 1.00 0.43 H ATOM 173 N HIS 12 -16.051 -11.692 26.425 1.00 -0.35 N ATOM 174 H HIS 12 -15.198 -12.154 26.140 1.00 0.28 H ATOM 175 CA HIS 12 -17.344 -12.312 26.106 1.00 -0.14 C ATOM 176 HA HIS 12 -18.112 -11.845 26.724 1.00 0.12 H ATOM 177 C HIS 12 -17.363 -13.806 26.422 1.00 0.73 C ATOM 178 O HIS 12 -18.232 -14.542 25.958 1.00 -0.59 O ATOM 179 CB HIS 12 -17.714 -12.054 24.637 1.00 -0.04 C ATOM 180 1HB HIS 12 -18.787 -12.219 24.524 1.00 0.08 H ATOM 181 2HB HIS 12 -17.509 -11.010 24.399 1.00 0.08 H ATOM 182 CG HIS 12 -17.009 -12.945 23.661 1.00 -0.00 C ATOM 183 ND1 HIS 12 -17.613 -14.056 23.084 1.00 -0.15 N ATOM 184 HD1 HIS 12 -18.555 -14.373 23.291 1.00 0.14 H ATOM 185 CD2 HIS 12 -15.751 -12.934 23.156 1.00 -0.11 C ATOM 186 HD2 HIS 12 -14.983 -12.214 23.399 1.00 0.23 H ATOM 187 CE1 HIS 12 -16.750 -14.655 22.278 1.00 -0.02 C ATOM 188 HE1 HIS 12 -16.945 -15.548 21.693 1.00 0.27 H ATOM 189 NE2 HIS 12 -15.611 -14.009 22.323 1.00 -0.17 N ATOM 190 HE2 HIS 12 -14.749 -14.301 21.849 1.00 0.14 H ATOM 191 N LEU 13 -16.374 -14.258 27.180 1.00 -0.42 N ATOM 192 H LEU 13 -15.732 -13.610 27.625 1.00 0.27 H ATOM 193 CA LEU 13 -16.198 -15.675 27.489 1.00 -0.05 C ATOM 194 HA LEU 13 -17.085 -16.249 27.222 1.00 0.09 H ATOM 195 C LEU 13 -15.974 -15.725 28.989 1.00 0.60 C ATOM 196 O LEU 13 -15.490 -14.731 29.524 1.00 -0.57 O ATOM 197 CB LEU 13 -14.956 -16.222 26.774 1.00 -0.11 C ATOM 198 1HB LEU 13 -14.114 -15.582 27.041 1.00 0.05 H ATOM 199 2HB LEU 13 -14.752 -17.218 27.167 1.00 0.05 H ATOM 200 CG LEU 13 -15.008 -16.328 25.244 1.00 0.35 C ATOM 201 HG LEU 13 -15.251 -15.351 24.836 1.00 -0.04 H ATOM 202 CD1 LEU 13 -13.643 -16.741 24.713 1.00 -0.41 C ATOM 203 1HD1 LEU 13 -12.901 -16.001 25.014 1.00 0.10 H ATOM 204 2HD1 LEU 13 -13.373 -17.727 25.090 1.00 0.10 H ATOM 205 3HD1 LEU 13 -13.678 -16.770 23.623 1.00 0.10 H ATOM 206 CD2 LEU 13 -16.061 -17.330 24.770 1.00 -0.41 C ATOM 207 1HD2 LEU 13 -15.888 -18.309 25.221 1.00 0.10 H ATOM 208 2HD2 LEU 13 -17.057 -16.980 25.046 1.00 0.10 H ATOM 209 3HD2 LEU 13 -16.020 -17.427 23.686 1.00 0.10 H ATOM 210 N PRO 14 -16.276 -16.852 29.661 1.00 -0.25 N ATOM 211 CA PRO 14 -15.969 -16.898 31.097 1.00 -0.03 C ATOM 212 HA PRO 14 -16.359 -16.004 31.585 1.00 0.06 H ATOM 213 C PRO 14 -14.464 -16.993 31.387 1.00 0.59 C ATOM 214 O PRO 14 -13.849 -18.064 31.419 1.00 -0.57 O ATOM 215 CB PRO 14 -16.755 -18.119 31.576 1.00 -0.01 C ATOM 216 1HB PRO 14 -16.286 -18.577 32.447 1.00 0.03 H ATOM 217 2HB PRO 14 -17.781 -17.830 31.804 1.00 0.03 H ATOM 218 CG PRO 14 -16.737 -19.032 30.402 1.00 0.02 C ATOM 219 1HG PRO 14 -15.778 -19.548 30.346 1.00 0.02 H ATOM 220 2HG PRO 14 -17.553 -19.752 30.455 1.00 0.02 H ATOM 221 CD PRO 14 -16.901 -18.114 29.214 1.00 0.02 C ATOM 222 1HD PRO 14 -16.389 -18.523 28.344 1.00 0.04 H ATOM 223 2HD PRO 14 -17.960 -17.952 29.003 1.00 0.04 H ATOM 224 N LYS 15 -13.863 -15.815 31.468 1.00 -0.35 N ATOM 225 H LYS 15 -14.462 -15.015 31.321 1.00 0.28 H ATOM 226 CA LYS 15 -12.435 -15.610 31.717 1.00 -0.24 C ATOM 227 HA LYS 15 -12.028 -16.490 32.219 1.00 0.14 H ATOM 228 C LYS 15 -12.210 -14.400 32.614 1.00 0.73 C ATOM 229 O LYS 15 -11.188 -14.307 33.282 1.00 -0.59 O ATOM 230 CB LYS 15 -11.679 -15.373 30.406 1.00 -0.01 C ATOM 231 1HB LYS 15 -12.115 -14.512 29.902 1.00 0.04 H ATOM 232 2HB LYS 15 -10.645 -15.138 30.662 1.00 0.04 H ATOM 233 CG LYS 15 -11.670 -16.558 29.444 1.00 0.02 C ATOM 234 1HG LYS 15 -11.325 -17.444 29.978 1.00 0.01 H ATOM 235 2HG LYS 15 -12.681 -16.735 29.075 1.00 0.01 H ATOM 236 CD LYS 15 -10.740 -16.305 28.269 1.00 -0.05 C ATOM 237 1HD LYS 15 -11.041 -15.394 27.765 1.00 0.06 H ATOM 238 2HD LYS 15 -9.722 -16.184 28.642 1.00 0.06 H ATOM 239 CE LYS 15 -10.782 -17.452 27.276 1.00 -0.01 C ATOM 240 1HE LYS 15 -10.476 -18.371 27.781 1.00 0.11 H ATOM 241 2HE LYS 15 -11.806 -17.572 26.919 1.00 0.11 H ATOM 242 NZ LYS 15 -9.869 -17.183 26.111 1.00 -0.38 N ATOM 243 1HZ LYS 15 -10.139 -16.320 25.644 1.00 0.17 H ATOM 244 2HZ LYS 15 -8.917 -17.093 26.436 1.00 0.17 H ATOM 245 3HZ LYS 15 -9.923 -17.945 25.449 1.00 0.17 H ATOM 246 N LEU 16 -13.142 -13.454 32.580 1.00 -0.42 N ATOM 247 H LEU 16 -13.919 -13.542 31.949 1.00 0.27 H ATOM 248 CA LEU 16 -13.085 -12.253 33.422 1.00 -0.05 C ATOM 249 HA LEU 16 -12.154 -12.234 33.987 1.00 0.09 H ATOM 250 C LEU 16 -14.252 -12.254 34.403 1.00 0.60 C ATOM 251 O LEU 16 -14.431 -11.325 35.187 1.00 -0.57 O ATOM 252 CB LEU 16 -13.173 -10.994 32.551 1.00 -0.11 C ATOM 253 1HB LEU 16 -14.148 -10.997 32.065 1.00 0.05 H ATOM 254 2HB LEU 16 -13.135 -10.128 33.212 1.00 0.05 H ATOM 255 CG LEU 16 -12.112 -10.802 31.459 1.00 0.35 C ATOM 256 HG LEU 16 -12.181 -11.638 30.768 1.00 -0.04 H ATOM 257 CD1 LEU 16 -12.410 -9.522 30.681 1.00 -0.41 C ATOM 258 1HD1 LEU 16 -13.430 -9.558 30.301 1.00 0.10 H ATOM 259 2HD1 LEU 16 -12.307 -8.653 31.335 1.00 0.10 H ATOM 260 3HD1 LEU 16 -11.725 -9.428 29.842 1.00 0.10 H ATOM 261 CD2 LEU 16 -10.682 -10.749 31.998 1.00 -0.41 C ATOM 262 1HD2 LEU 16 -10.582 -9.935 32.718 1.00 0.10 H ATOM 263 2HD2 LEU 16 -10.441 -11.690 32.497 1.00 0.10 H ATOM 264 3HD2 LEU 16 -9.981 -10.603 31.182 1.00 0.10 H ATOM 265 N PHE 17 -15.066 -13.289 34.275 1.00 -0.42 N ATOM 266 H PHE 17 -14.824 -14.052 33.656 1.00 0.27 H ATOM 267 CA PHE 17 -16.315 -13.502 34.991 1.00 -0.00 C ATOM 268 HA PHE 17 -16.205 -13.306 36.056 1.00 0.10 H ATOM 269 C PHE 17 -16.520 -14.990 34.737 1.00 0.60 C ATOM 270 O PHE 17 -17.466 -15.619 35.244 1.00 -0.57 O ATOM 271 OXT PHE 17 -15.683 -15.485 33.941 1.00 -0.57 O ATOM 272 CB PHE 17 -17.459 -12.672 34.390 1.00 -0.03 C ATOM 273 1HB PHE 17 -18.387 -12.954 34.886 1.00 0.03 H ATOM 274 2HB PHE 17 -17.268 -11.620 34.597 1.00 0.03 H ATOM 275 CG PHE 17 -17.632 -12.842 32.897 1.00 0.01 C ATOM 276 CD1 PHE 17 -18.388 -13.909 32.377 1.00 -0.13 C ATOM 277 HD1 PHE 17 -18.808 -14.644 33.051 1.00 0.13 H ATOM 278 CD2 PHE 17 -17.069 -11.909 32.007 1.00 -0.13 C ATOM 279 HD2 PHE 17 -16.481 -11.090 32.396 1.00 0.13 H ATOM 280 CE1 PHE 17 -18.613 -14.029 30.981 1.00 -0.17 C ATOM 281 HE1 PHE 17 -19.201 -14.850 30.598 1.00 0.14 H ATOM 282 CE2 PHE 17 -17.280 -12.015 30.607 1.00 -0.17 C ATOM 283 HE2 PHE 17 -16.847 -11.288 29.936 1.00 0.14 H ATOM 284 CZ PHE 17 -18.072 -13.069 30.097 1.00 -0.11 C ATOM 285 HZ PHE 17 -18.255 -13.146 29.038 1.00 0.13 H TER 286 PHE 17 END