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\FLFSLIPSAISGLISAFK.pdb REMARK YASARA Written on: Mon May 19 15:47:43 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 284 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 18 PHE LEU PHE SER LEU ILE PRO SER ALA ILE SER GLY LEU SEQRES 2 18 ILE SER ALA PHE LYS ATOM 1 N PHE 1 -17.020 -17.070 37.129 1.00 -0.42 N ATOM 2 1H PHE 1 -16.990 -17.075 38.138 1.00 -0.42 H ATOM 3 2H PHE 1 -17.732 -17.711 36.807 1.00 -0.42 H ATOM 4 3H PHE 1 -16.126 -17.366 36.760 1.00 0.27 H ATOM 5 CA PHE 1 -17.333 -15.697 36.636 1.00 -0.00 C ATOM 6 HA PHE 1 -18.311 -15.416 37.027 1.00 0.10 H ATOM 7 C PHE 1 -17.426 -15.731 35.123 1.00 0.60 C ATOM 8 O PHE 1 -17.404 -16.827 34.595 1.00 -0.57 O ATOM 9 CB PHE 1 -16.305 -14.676 37.148 1.00 -0.03 C ATOM 10 1HB PHE 1 -16.695 -13.673 36.978 1.00 0.03 H ATOM 11 2HB PHE 1 -16.187 -14.814 38.223 1.00 0.03 H ATOM 12 CG PHE 1 -14.947 -14.773 36.497 1.00 0.01 C ATOM 13 CD1 PHE 1 -14.548 -13.806 35.553 1.00 -0.13 C ATOM 14 HD1 PHE 1 -15.215 -12.998 35.285 1.00 0.13 H ATOM 15 CD2 PHE 1 -14.038 -15.788 36.857 1.00 -0.13 C ATOM 16 HD2 PHE 1 -14.302 -16.522 37.603 1.00 0.13 H ATOM 17 CE1 PHE 1 -13.264 -13.853 34.964 1.00 -0.17 C ATOM 18 HE1 PHE 1 -12.961 -13.096 34.253 1.00 0.14 H ATOM 19 CE2 PHE 1 -12.756 -15.857 36.260 1.00 -0.17 C ATOM 20 HE2 PHE 1 -12.067 -16.644 36.538 1.00 0.14 H ATOM 21 CZ PHE 1 -12.368 -14.885 35.316 1.00 -0.11 C ATOM 22 HZ PHE 1 -11.383 -14.926 34.869 1.00 0.13 H ATOM 23 N LEU 2 -17.545 -14.608 34.420 1.00 -0.42 N ATOM 24 H LEU 2 -17.495 -13.707 34.873 1.00 0.27 H ATOM 25 CA LEU 2 -17.802 -14.634 32.974 1.00 -0.05 C ATOM 26 HA LEU 2 -18.778 -15.099 32.820 1.00 0.09 H ATOM 27 C LEU 2 -16.804 -15.456 32.159 1.00 0.60 C ATOM 28 O LEU 2 -17.219 -16.274 31.357 1.00 -0.57 O ATOM 29 CB LEU 2 -17.875 -13.190 32.450 1.00 -0.11 C ATOM 30 1HB LEU 2 -18.568 -12.665 33.107 1.00 0.05 H ATOM 31 2HB LEU 2 -16.898 -12.724 32.574 1.00 0.05 H ATOM 32 CG LEU 2 -18.346 -12.923 31.005 1.00 0.35 C ATOM 33 HG LEU 2 -19.183 -13.585 30.787 1.00 -0.04 H ATOM 34 CD1 LEU 2 -18.851 -11.482 30.922 1.00 -0.41 C ATOM 35 1HD1 LEU 2 -19.675 -11.331 31.621 1.00 0.10 H ATOM 36 2HD1 LEU 2 -18.049 -10.779 31.150 1.00 0.10 H ATOM 37 3HD1 LEU 2 -19.223 -11.280 29.916 1.00 0.10 H ATOM 38 CD2 LEU 2 -17.271 -13.113 29.926 1.00 -0.41 C ATOM 39 1HD2 LEU 2 -16.957 -14.153 29.880 1.00 0.10 H ATOM 40 2HD2 LEU 2 -17.680 -12.849 28.950 1.00 0.10 H ATOM 41 3HD2 LEU 2 -16.406 -12.481 30.131 1.00 0.10 H ATOM 42 N PHE 3 -15.505 -15.299 32.376 1.00 -0.42 N ATOM 43 H PHE 3 -15.175 -14.643 33.064 1.00 0.27 H ATOM 44 CA PHE 3 -14.524 -16.035 31.571 1.00 -0.00 C ATOM 45 HA PHE 3 -14.747 -15.863 30.516 1.00 0.10 H ATOM 46 C PHE 3 -14.561 -17.544 31.819 1.00 0.60 C ATOM 47 O PHE 3 -14.188 -18.335 30.972 1.00 -0.57 O ATOM 48 CB PHE 3 -13.121 -15.504 31.857 1.00 -0.03 C ATOM 49 1HB PHE 3 -13.174 -14.419 31.936 1.00 0.03 H ATOM 50 2HB PHE 3 -12.779 -15.908 32.807 1.00 0.03 H ATOM 51 CG PHE 3 -12.115 -15.841 30.793 1.00 0.01 C ATOM 52 CD1 PHE 3 -11.934 -14.974 29.704 1.00 -0.13 C ATOM 53 HD1 PHE 3 -12.524 -14.072 29.632 1.00 0.13 H ATOM 54 CD2 PHE 3 -11.335 -17.010 30.877 1.00 -0.13 C ATOM 55 HD2 PHE 3 -11.468 -17.691 31.705 1.00 0.13 H ATOM 56 CE1 PHE 3 -10.980 -15.258 28.703 1.00 -0.17 C ATOM 57 HE1 PHE 3 -10.843 -14.572 27.883 1.00 0.14 H ATOM 58 CE2 PHE 3 -10.380 -17.315 29.875 1.00 -0.17 C ATOM 59 HE2 PHE 3 -9.794 -18.220 29.942 1.00 0.14 H ATOM 60 CZ PHE 3 -10.202 -16.435 28.786 1.00 -0.11 C ATOM 61 HZ PHE 3 -9.480 -16.666 28.016 1.00 0.13 H ATOM 62 N SER 4 -15.064 -17.950 32.977 1.00 -0.42 N ATOM 63 H SER 4 -15.390 -17.277 33.649 1.00 0.27 H ATOM 64 CA SER 4 -15.196 -19.370 33.296 1.00 -0.03 C ATOM 65 HA SER 4 -14.245 -19.870 33.109 1.00 0.08 H ATOM 66 C SER 4 -16.280 -20.040 32.458 1.00 0.60 C ATOM 67 O SER 4 -16.311 -21.255 32.336 1.00 -0.57 O ATOM 68 CB SER 4 -15.577 -19.530 34.766 1.00 0.21 C ATOM 69 1HB SER 4 -16.639 -19.312 34.877 1.00 0.04 H ATOM 70 2HB SER 4 -15.393 -20.558 35.081 1.00 0.04 H ATOM 71 OG SER 4 -14.838 -18.621 35.573 1.00 -0.65 O ATOM 72 HG SER 4 -13.905 -18.858 35.494 1.00 0.43 H ATOM 73 N LEU 5 -17.187 -19.231 31.928 1.00 -0.42 N ATOM 74 H LEU 5 -17.115 -18.237 32.088 1.00 0.27 H ATOM 75 CA LEU 5 -18.289 -19.717 31.101 1.00 -0.05 C ATOM 76 HA LEU 5 -18.421 -20.789 31.246 1.00 0.09 H ATOM 77 C LEU 5 -17.986 -19.455 29.631 1.00 0.60 C ATOM 78 O LEU 5 -18.292 -20.265 28.764 1.00 -0.57 O ATOM 79 CB LEU 5 -19.580 -18.984 31.487 1.00 -0.11 C ATOM 80 1HB LEU 5 -19.438 -17.925 31.272 1.00 0.05 H ATOM 81 2HB LEU 5 -20.377 -19.349 30.839 1.00 0.05 H ATOM 82 CG LEU 5 -20.053 -19.102 32.945 1.00 0.35 C ATOM 83 HG LEU 5 -19.252 -18.770 33.603 1.00 -0.04 H ATOM 84 CD1 LEU 5 -21.251 -18.180 33.168 1.00 -0.41 C ATOM 85 1HD1 LEU 5 -20.974 -17.151 32.939 1.00 0.10 H ATOM 86 2HD1 LEU 5 -22.078 -18.479 32.520 1.00 0.10 H ATOM 87 3HD1 LEU 5 -21.574 -18.238 34.207 1.00 0.10 H ATOM 88 CD2 LEU 5 -20.425 -20.533 33.330 1.00 -0.41 C ATOM 89 1HD2 LEU 5 -21.201 -20.913 32.663 1.00 0.10 H ATOM 90 2HD2 LEU 5 -19.549 -21.179 33.255 1.00 0.10 H ATOM 91 3HD2 LEU 5 -20.790 -20.563 34.356 1.00 0.10 H ATOM 92 N ILE 6 -17.385 -18.301 29.368 1.00 -0.42 N ATOM 93 H ILE 6 -17.170 -17.674 30.133 1.00 0.27 H ATOM 94 CA ILE 6 -17.051 -17.856 28.016 1.00 -0.06 C ATOM 95 HA ILE 6 -17.303 -18.652 27.318 1.00 0.09 H ATOM 96 C ILE 6 -15.535 -17.607 27.946 1.00 0.60 C ATOM 97 O ILE 6 -15.074 -16.457 27.963 1.00 -0.57 O ATOM 98 CB ILE 6 -17.859 -16.567 27.610 1.00 0.13 C ATOM 99 HB ILE 6 -17.500 -15.740 28.221 1.00 0.02 H ATOM 100 CG1 ILE 6 -19.372 -16.703 27.900 1.00 -0.04 C ATOM 101 1HG1 ILE 6 -19.512 -16.896 28.962 1.00 0.02 H ATOM 102 2HG1 ILE 6 -19.832 -15.737 27.694 1.00 0.02 H ATOM 103 CG2 ILE 6 -17.646 -16.198 26.112 1.00 -0.32 C ATOM 104 1HG2 ILE 6 -16.611 -15.913 25.947 1.00 0.09 H ATOM 105 2HG2 ILE 6 -17.890 -17.047 25.473 1.00 0.09 H ATOM 106 3HG2 ILE 6 -18.281 -15.352 25.846 1.00 0.09 H ATOM 107 CD1 ILE 6 -20.163 -17.769 27.105 1.00 -0.07 C ATOM 108 1HD1 ILE 6 -20.178 -17.519 26.045 1.00 0.02 H ATOM 109 2HD1 ILE 6 -19.718 -18.754 27.240 1.00 0.02 H ATOM 110 3HD1 ILE 6 -21.189 -17.798 27.472 1.00 0.02 H ATOM 111 N PRO 7 -14.721 -18.677 27.848 1.00 -0.25 N ATOM 112 CA PRO 7 -13.286 -18.389 27.710 1.00 -0.03 C ATOM 113 HA PRO 7 -12.955 -17.691 28.480 1.00 0.06 H ATOM 114 C PRO 7 -12.966 -17.818 26.330 1.00 0.59 C ATOM 115 O PRO 7 -11.945 -17.171 26.109 1.00 -0.57 O ATOM 116 CB PRO 7 -12.642 -19.757 27.938 1.00 -0.01 C ATOM 117 1HB PRO 7 -11.700 -19.842 27.398 1.00 0.03 H ATOM 118 2HB PRO 7 -12.488 -19.920 29.005 1.00 0.03 H ATOM 119 CG PRO 7 -13.653 -20.717 27.420 1.00 0.02 C ATOM 120 1HG PRO 7 -13.604 -20.758 26.332 1.00 0.02 H ATOM 121 2HG PRO 7 -13.503 -21.708 27.847 1.00 0.02 H ATOM 122 CD PRO 7 -14.972 -20.133 27.862 1.00 0.02 C ATOM 123 1HD PRO 7 -15.767 -20.406 27.167 1.00 0.04 H ATOM 124 2HD PRO 7 -15.214 -20.459 28.876 1.00 0.04 H ATOM 125 N SER 8 -13.914 -17.971 25.414 1.00 -0.42 N ATOM 126 H SER 8 -14.731 -18.523 25.642 1.00 0.27 H ATOM 127 CA SER 8 -13.895 -17.382 24.082 1.00 -0.03 C ATOM 128 HA SER 8 -13.023 -17.745 23.539 1.00 0.08 H ATOM 129 C SER 8 -13.868 -15.855 24.079 1.00 0.60 C ATOM 130 O SER 8 -13.666 -15.237 23.035 1.00 -0.57 O ATOM 131 CB SER 8 -15.161 -17.861 23.379 1.00 0.21 C ATOM 132 1HB SER 8 -15.762 -17.001 23.077 1.00 0.04 H ATOM 133 2HB SER 8 -14.891 -18.446 22.499 1.00 0.04 H ATOM 134 OG SER 8 -15.901 -18.669 24.289 1.00 -0.65 O ATOM 135 HG SER 8 -16.671 -19.024 23.831 1.00 0.43 H ATOM 136 N ALA 9 -14.006 -15.238 25.245 1.00 -0.42 N ATOM 137 H ALA 9 -14.203 -15.777 26.081 1.00 0.27 H ATOM 138 CA ALA 9 -13.816 -13.802 25.378 1.00 0.03 C ATOM 139 HA ALA 9 -14.520 -13.289 24.721 1.00 0.08 H ATOM 140 C ALA 9 -12.395 -13.406 24.952 1.00 0.60 C ATOM 141 O ALA 9 -12.214 -12.345 24.363 1.00 -0.57 O ATOM 142 CB ALA 9 -14.095 -13.383 26.825 1.00 -0.18 C ATOM 143 1HB ALA 9 -15.127 -13.624 27.087 1.00 0.06 H ATOM 144 2HB ALA 9 -13.424 -13.910 27.501 1.00 0.06 H ATOM 145 3HB ALA 9 -13.942 -12.307 26.928 1.00 0.06 H ATOM 146 N ILE 10 -11.395 -14.253 25.180 1.00 -0.42 N ATOM 147 H ILE 10 -11.566 -15.141 25.646 1.00 0.27 H ATOM 148 CA ILE 10 -10.033 -13.912 24.751 1.00 -0.06 C ATOM 149 HA ILE 10 -9.846 -12.886 25.064 1.00 0.09 H ATOM 150 C ILE 10 -9.946 -13.934 23.224 1.00 0.60 C ATOM 151 O ILE 10 -9.248 -13.125 22.620 1.00 -0.57 O ATOM 152 CB ILE 10 -8.945 -14.824 25.420 1.00 0.13 C ATOM 153 HB ILE 10 -9.192 -14.918 26.473 1.00 0.02 H ATOM 154 CG1 ILE 10 -7.545 -14.188 25.330 1.00 -0.04 C ATOM 155 1HG1 ILE 10 -6.811 -14.945 25.607 1.00 0.02 H ATOM 156 2HG1 ILE 10 -7.350 -13.899 24.298 1.00 0.02 H ATOM 157 CG2 ILE 10 -8.890 -16.250 24.820 1.00 -0.32 C ATOM 158 1HG2 ILE 10 -9.876 -16.708 24.837 1.00 0.09 H ATOM 159 2HG2 ILE 10 -8.525 -16.223 23.791 1.00 0.09 H ATOM 160 3HG2 ILE 10 -8.218 -16.871 25.415 1.00 0.09 H ATOM 161 CD1 ILE 10 -7.324 -12.971 26.233 1.00 -0.07 C ATOM 162 1HD1 ILE 10 -7.503 -13.243 27.274 1.00 0.02 H ATOM 163 2HD1 ILE 10 -6.294 -12.628 26.128 1.00 0.02 H ATOM 164 3HD1 ILE 10 -7.995 -12.161 25.948 1.00 0.02 H ATOM 165 N SER 11 -10.718 -14.803 22.586 1.00 -0.42 N ATOM 166 H SER 11 -11.309 -15.433 23.106 1.00 0.27 H ATOM 167 CA SER 11 -10.726 -14.885 21.132 1.00 -0.03 C ATOM 168 HA SER 11 -9.697 -14.939 20.782 1.00 0.08 H ATOM 169 C SER 11 -11.386 -13.642 20.555 1.00 0.60 C ATOM 170 O SER 11 -10.963 -13.118 19.531 1.00 -0.57 O ATOM 171 CB SER 11 -11.472 -16.137 20.680 1.00 0.21 C ATOM 172 1HB SER 11 -12.542 -15.996 20.836 1.00 0.04 H ATOM 173 2HB SER 11 -11.284 -16.309 19.620 1.00 0.04 H ATOM 174 OG SER 11 -11.040 -17.250 21.447 1.00 -0.65 O ATOM 175 HG SER 11 -11.207 -18.051 20.943 1.00 0.43 H ATOM 176 N GLY 12 -12.393 -13.129 21.248 1.00 -0.42 N ATOM 177 H GLY 12 -12.728 -13.605 22.079 1.00 0.27 H ATOM 178 CA GLY 12 -13.017 -11.883 20.836 1.00 -0.03 C ATOM 179 1HA GLY 12 -13.291 -11.949 19.783 1.00 0.07 H ATOM 180 2HA GLY 12 -13.915 -11.711 21.429 1.00 0.07 H ATOM 181 C GLY 12 -12.072 -10.714 21.022 1.00 0.60 C ATOM 182 O GLY 12 -12.002 -9.822 20.179 1.00 -0.57 O ATOM 183 N LEU 13 -11.298 -10.730 22.098 1.00 -0.42 N ATOM 184 H LEU 13 -11.388 -11.484 22.774 1.00 0.27 H ATOM 185 CA LEU 13 -10.340 -9.661 22.359 1.00 -0.05 C ATOM 186 HA LEU 13 -10.884 -8.717 22.361 1.00 0.09 H ATOM 187 C LEU 13 -9.277 -9.591 21.267 1.00 0.60 C ATOM 188 O LEU 13 -9.004 -8.514 20.753 1.00 -0.57 O ATOM 189 CB LEU 13 -9.670 -9.862 23.724 1.00 -0.11 C ATOM 190 1HB LEU 13 -10.445 -10.065 24.463 1.00 0.05 H ATOM 191 2HB LEU 13 -9.033 -10.742 23.659 1.00 0.05 H ATOM 192 CG LEU 13 -8.814 -8.693 24.237 1.00 0.35 C ATOM 193 HG LEU 13 -8.134 -8.380 23.447 1.00 -0.04 H ATOM 194 CD1 LEU 13 -9.675 -7.496 24.650 1.00 -0.41 C ATOM 195 1HD1 LEU 13 -10.355 -7.777 25.455 1.00 0.10 H ATOM 196 2HD1 LEU 13 -9.033 -6.682 24.988 1.00 0.10 H ATOM 197 3HD1 LEU 13 -10.256 -7.141 23.799 1.00 0.10 H ATOM 198 CD2 LEU 13 -7.976 -9.141 25.428 1.00 -0.41 C ATOM 199 1HD2 LEU 13 -7.366 -8.309 25.780 1.00 0.10 H ATOM 200 2HD2 LEU 13 -8.619 -9.486 26.238 1.00 0.10 H ATOM 201 3HD2 LEU 13 -7.311 -9.949 25.122 1.00 0.10 H ATOM 202 N ILE 14 -8.713 -10.724 20.868 1.00 -0.42 N ATOM 203 H ILE 14 -8.956 -11.601 21.322 1.00 0.27 H ATOM 204 CA ILE 14 -7.695 -10.723 19.809 1.00 -0.06 C ATOM 205 HA ILE 14 -7.060 -9.855 19.978 1.00 0.09 H ATOM 206 C ILE 14 -8.297 -10.558 18.412 1.00 0.60 C ATOM 207 O ILE 14 -7.600 -10.266 17.437 1.00 -0.57 O ATOM 208 CB ILE 14 -6.763 -11.966 19.867 1.00 0.13 C ATOM 209 HB ILE 14 -5.976 -11.825 19.125 1.00 0.02 H ATOM 210 CG1 ILE 14 -7.526 -13.257 19.512 1.00 -0.04 C ATOM 211 1HG1 ILE 14 -8.268 -13.438 20.280 1.00 0.02 H ATOM 212 2HG1 ILE 14 -8.048 -13.111 18.568 1.00 0.02 H ATOM 213 CG2 ILE 14 -6.092 -12.045 21.265 1.00 -0.32 C ATOM 214 1HG2 ILE 14 -5.302 -12.795 21.256 1.00 0.09 H ATOM 215 2HG2 ILE 14 -5.644 -11.081 21.512 1.00 0.09 H ATOM 216 3HG2 ILE 14 -6.823 -12.309 22.031 1.00 0.09 H ATOM 217 CD1 ILE 14 -6.667 -14.518 19.373 1.00 -0.07 C ATOM 218 1HD1 ILE 14 -7.294 -15.342 19.033 1.00 0.02 H ATOM 219 2HD1 ILE 14 -5.874 -14.349 18.644 1.00 0.02 H ATOM 220 3HD1 ILE 14 -6.229 -14.784 20.335 1.00 0.02 H ATOM 221 N SER 15 -9.611 -10.695 18.298 1.00 -0.42 N ATOM 222 H SER 15 -10.160 -10.998 19.092 1.00 0.27 H ATOM 223 CA SER 15 -10.281 -10.371 17.043 1.00 -0.03 C ATOM 224 HA SER 15 -9.703 -10.772 16.211 1.00 0.08 H ATOM 225 C SER 15 -10.340 -8.854 16.913 1.00 0.60 C ATOM 226 O SER 15 -10.177 -8.322 15.817 1.00 -0.57 O ATOM 227 CB SER 15 -11.694 -10.952 16.979 1.00 0.21 C ATOM 228 1HB SER 15 -12.283 -10.577 17.814 1.00 0.04 H ATOM 229 2HB SER 15 -12.164 -10.639 16.047 1.00 0.04 H ATOM 230 OG SER 15 -11.651 -12.368 17.025 1.00 -0.65 O ATOM 231 HG SER 15 -11.338 -12.644 17.903 1.00 0.43 H ATOM 232 N ALA 16 -10.525 -8.155 18.024 1.00 -0.42 N ATOM 233 H ALA 16 -10.666 -8.635 18.907 1.00 0.27 H ATOM 234 CA ALA 16 -10.578 -6.697 18.004 1.00 0.03 C ATOM 235 HA ALA 16 -11.072 -6.392 17.081 1.00 0.08 H ATOM 236 C ALA 16 -9.200 -6.016 18.033 1.00 0.60 C ATOM 237 O ALA 16 -9.007 -5.001 17.369 1.00 -0.57 O ATOM 238 CB ALA 16 -11.428 -6.218 19.187 1.00 -0.18 C ATOM 239 1HB ALA 16 -12.436 -6.627 19.107 1.00 0.06 H ATOM 240 2HB ALA 16 -10.979 -6.549 20.125 1.00 0.06 H ATOM 241 3HB ALA 16 -11.478 -5.128 19.181 1.00 0.06 H ATOM 242 N PHE 17 -8.261 -6.541 18.808 1.00 -0.42 N ATOM 243 H PHE 17 -8.448 -7.395 19.329 1.00 0.27 H ATOM 244 CA PHE 17 -6.980 -5.870 19.045 1.00 -0.00 C ATOM 245 HA PHE 17 -6.898 -5.002 18.393 1.00 0.10 H ATOM 246 C PHE 17 -5.782 -6.776 18.806 1.00 0.60 C ATOM 247 O PHE 17 -5.837 -7.967 19.100 1.00 -0.57 O ATOM 248 CB PHE 17 -6.926 -5.392 20.498 1.00 -0.03 C ATOM 249 1HB PHE 17 -6.867 -6.265 21.148 1.00 0.03 H ATOM 250 2HB PHE 17 -6.025 -4.796 20.638 1.00 0.03 H ATOM 251 CG PHE 17 -8.123 -4.580 20.908 1.00 0.01 C ATOM 252 CD1 PHE 17 -9.063 -5.118 21.803 1.00 -0.13 C ATOM 253 HD1 PHE 17 -8.916 -6.114 22.193 1.00 0.13 H ATOM 254 CD2 PHE 17 -8.329 -3.289 20.392 1.00 -0.13 C ATOM 255 HD2 PHE 17 -7.616 -2.866 19.698 1.00 0.13 H ATOM 256 CE1 PHE 17 -10.209 -4.377 22.188 1.00 -0.17 C ATOM 257 HE1 PHE 17 -10.924 -4.803 22.876 1.00 0.14 H ATOM 258 CE2 PHE 17 -9.475 -2.537 20.757 1.00 -0.17 C ATOM 259 HE2 PHE 17 -9.629 -1.551 20.344 1.00 0.14 H ATOM 260 CZ PHE 17 -10.417 -3.084 21.659 1.00 -0.11 C ATOM 261 HZ PHE 17 -11.292 -2.516 21.940 1.00 0.13 H ATOM 262 N LYS 18 -4.718 -6.206 18.258 1.00 -0.35 N ATOM 263 H LYS 18 -4.722 -5.216 18.012 1.00 0.28 H ATOM 264 CA LYS 18 -3.439 -6.868 18.004 1.00 -0.24 C ATOM 265 HA LYS 18 -3.081 -7.389 18.890 1.00 0.14 H ATOM 266 C LYS 18 -2.553 -5.669 17.719 1.00 0.73 C ATOM 267 O LYS 18 -3.191 -4.599 17.560 1.00 -0.59 O ATOM 268 OXT LYS 18 -1.319 -5.779 17.647 1.00 -0.59 O ATOM 269 CB LYS 18 -3.489 -7.826 16.805 1.00 -0.01 C ATOM 270 1HB LYS 18 -2.494 -8.252 16.672 1.00 0.04 H ATOM 271 2HB LYS 18 -4.162 -8.643 17.059 1.00 0.04 H ATOM 272 CG LYS 18 -3.925 -7.209 15.469 1.00 0.02 C ATOM 273 1HG LYS 18 -4.253 -6.180 15.612 1.00 0.01 H ATOM 274 2HG LYS 18 -3.068 -7.207 14.795 1.00 0.01 H ATOM 275 CD LYS 18 -5.060 -8.000 14.826 1.00 -0.05 C ATOM 276 1HD LYS 18 -5.138 -7.715 13.777 1.00 0.06 H ATOM 277 2HD LYS 18 -4.828 -9.064 14.887 1.00 0.06 H ATOM 278 CE LYS 18 -6.395 -7.723 15.514 1.00 -0.01 C ATOM 279 1HE LYS 18 -6.290 -7.900 16.585 1.00 0.11 H ATOM 280 2HE LYS 18 -6.671 -6.678 15.360 1.00 0.11 H ATOM 281 NZ LYS 18 -7.471 -8.612 15.005 1.00 -0.38 N ATOM 282 1HZ LYS 18 -8.375 -8.272 15.321 1.00 0.17 H ATOM 283 2HZ LYS 18 -7.461 -8.642 13.998 1.00 0.17 H ATOM 284 3HZ LYS 18 -7.341 -9.542 15.390 1.00 0.17 H TER 285 LYS 18 END