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\SNMIEGVFAKGFKKASH.pdb REMARK YASARA Written on: Wed May 14 20:16:17 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 264 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 17 SER ASN MET ILE GLU GLY VAL PHE ALA LYS GLY PHE LYS SEQRES 2 17 LYS ALA SER HIS ATOM 1 N SER 1 -8.408 -9.919 33.248 1.00 -0.42 N ATOM 2 1H SER 1 -7.629 -9.282 33.344 1.00 -0.42 H ATOM 3 2H SER 1 -9.176 -9.450 32.788 1.00 -0.42 H ATOM 4 3H SER 1 -8.707 -10.224 34.164 1.00 0.27 H ATOM 5 CA SER 1 -7.989 -11.099 32.444 1.00 -0.03 C ATOM 6 HA SER 1 -7.710 -10.770 31.443 1.00 0.08 H ATOM 7 C SER 1 -9.131 -12.090 32.355 1.00 0.60 C ATOM 8 O SER 1 -10.138 -11.852 33.001 1.00 -0.57 O ATOM 9 CB SER 1 -6.781 -11.739 33.120 1.00 0.21 C ATOM 10 1HB SER 1 -7.088 -12.191 34.064 1.00 0.04 H ATOM 11 2HB SER 1 -6.350 -12.501 32.470 1.00 0.04 H ATOM 12 OG SER 1 -5.830 -10.722 33.374 1.00 -0.65 O ATOM 13 HG SER 1 -5.016 -11.122 33.715 1.00 0.43 H ATOM 14 N ASN 2 -8.985 -13.171 31.594 1.00 -0.42 N ATOM 15 H ASN 2 -8.153 -13.273 31.029 1.00 0.27 H ATOM 16 CA ASN 2 -9.978 -14.257 31.490 1.00 0.01 C ATOM 17 HA ASN 2 -9.686 -14.862 30.629 1.00 0.10 H ATOM 18 C ASN 2 -11.436 -13.851 31.213 1.00 0.60 C ATOM 19 O ASN 2 -11.799 -13.649 30.059 1.00 -0.57 O ATOM 20 CB ASN 2 -9.881 -15.195 32.707 1.00 -0.20 C ATOM 21 1HB ASN 2 -8.842 -15.490 32.843 1.00 0.08 H ATOM 22 2HB ASN 2 -10.207 -14.677 33.608 1.00 0.08 H ATOM 23 CG ASN 2 -10.708 -16.453 32.531 1.00 0.71 C ATOM 24 OD1 ASN 2 -11.137 -16.770 31.438 1.00 -0.59 O ATOM 25 ND2 ASN 2 -10.944 -17.162 33.598 1.00 -0.92 N ATOM 26 1HD2 ASN 2 -11.502 -17.996 33.500 1.00 0.42 H ATOM 27 2HD2 ASN 2 -10.567 -16.896 34.491 1.00 0.42 H ATOM 28 N MET 3 -12.259 -13.710 32.244 1.00 -0.42 N ATOM 29 H MET 3 -11.892 -13.772 33.184 1.00 0.27 H ATOM 30 CA MET 3 -13.699 -13.476 32.109 1.00 -0.02 C ATOM 31 HA MET 3 -14.097 -14.224 31.423 1.00 0.09 H ATOM 32 C MET 3 -14.082 -12.114 31.534 1.00 0.60 C ATOM 33 O MET 3 -15.212 -11.924 31.119 1.00 -0.57 O ATOM 34 CB MET 3 -14.403 -13.673 33.461 1.00 0.03 C ATOM 35 1HB MET 3 -15.476 -13.579 33.291 1.00 0.02 H ATOM 36 2HB MET 3 -14.211 -14.687 33.808 1.00 0.02 H ATOM 37 CG MET 3 -14.011 -12.690 34.575 1.00 0.00 C ATOM 38 1HG MET 3 -14.069 -11.675 34.181 1.00 0.04 H ATOM 39 2HG MET 3 -14.745 -12.777 35.377 1.00 0.04 H ATOM 40 SD MET 3 -12.363 -12.950 35.299 1.00 -0.27 S ATOM 41 CE MET 3 -12.621 -14.426 36.320 1.00 -0.05 C ATOM 42 1HE MET 3 -11.700 -14.672 36.849 1.00 0.07 H ATOM 43 2HE MET 3 -13.406 -14.229 37.053 1.00 0.07 H ATOM 44 3HE MET 3 -12.919 -15.269 35.697 1.00 0.07 H ATOM 45 N ILE 4 -13.131 -11.197 31.420 1.00 -0.42 N ATOM 46 H ILE 4 -12.222 -11.378 31.813 1.00 0.27 H ATOM 47 CA ILE 4 -13.369 -9.932 30.709 1.00 -0.06 C ATOM 48 HA ILE 4 -14.321 -9.524 31.052 1.00 0.09 H ATOM 49 C ILE 4 -13.490 -10.160 29.195 1.00 0.60 C ATOM 50 O ILE 4 -13.812 -9.257 28.417 1.00 -0.57 O ATOM 51 CB ILE 4 -12.262 -8.879 31.009 1.00 0.13 C ATOM 52 HB ILE 4 -12.555 -7.946 30.527 1.00 0.02 H ATOM 53 CG1 ILE 4 -10.898 -9.307 30.426 1.00 -0.04 C ATOM 54 1HG1 ILE 4 -10.526 -10.156 30.989 1.00 0.02 H ATOM 55 2HG1 ILE 4 -11.038 -9.626 29.397 1.00 0.02 H ATOM 56 CG2 ILE 4 -12.177 -8.630 32.541 1.00 -0.32 C ATOM 57 1HG2 ILE 4 -11.797 -9.507 33.063 1.00 0.09 H ATOM 58 2HG2 ILE 4 -11.537 -7.771 32.745 1.00 0.09 H ATOM 59 3HG2 ILE 4 -13.174 -8.398 32.926 1.00 0.09 H ATOM 60 CD1 ILE 4 -9.826 -8.209 30.409 1.00 -0.07 C ATOM 61 1HD1 ILE 4 -8.918 -8.594 29.944 1.00 0.02 H ATOM 62 2HD1 ILE 4 -10.183 -7.359 29.823 1.00 0.02 H ATOM 63 3HD1 ILE 4 -9.601 -7.872 31.419 1.00 0.02 H ATOM 64 N GLU 5 -13.199 -11.383 28.778 1.00 -0.52 N ATOM 65 H GLU 5 -12.916 -12.075 29.457 1.00 0.29 H ATOM 66 CA GLU 5 -13.298 -11.796 27.385 1.00 0.04 C ATOM 67 HA GLU 5 -13.812 -11.034 26.808 1.00 0.11 H ATOM 68 C GLU 5 -14.054 -13.107 27.204 1.00 0.54 C ATOM 69 O GLU 5 -14.910 -13.211 26.337 1.00 -0.58 O ATOM 70 CB GLU 5 -11.896 -12.001 26.814 1.00 0.06 C ATOM 71 1HB GLU 5 -11.362 -12.672 27.483 1.00 -0.02 H ATOM 72 2HB GLU 5 -11.987 -12.494 25.847 1.00 -0.02 H ATOM 73 CG GLU 5 -11.056 -10.752 26.640 1.00 0.01 C ATOM 74 1HG GLU 5 -11.608 -9.883 26.995 1.00 -0.04 H ATOM 75 2HG GLU 5 -10.147 -10.854 27.234 1.00 -0.04 H ATOM 76 CD GLU 5 -10.683 -10.537 25.191 1.00 0.81 C ATOM 77 OE1 GLU 5 -9.488 -10.603 24.853 1.00 -0.57 O ATOM 78 OE2 GLU 5 -11.598 -10.309 24.369 1.00 -0.57 O ATOM 79 N GLY 6 -13.692 -14.137 27.957 1.00 -0.42 N ATOM 80 H GLY 6 -13.054 -14.012 28.736 1.00 0.27 H ATOM 81 CA GLY 6 -14.119 -15.475 27.581 1.00 -0.03 C ATOM 82 1HA GLY 6 -13.884 -16.188 28.370 1.00 0.07 H ATOM 83 2HA GLY 6 -15.190 -15.479 27.376 1.00 0.07 H ATOM 84 C GLY 6 -13.356 -15.824 26.316 1.00 0.60 C ATOM 85 O GLY 6 -13.938 -16.149 25.281 1.00 -0.57 O ATOM 86 N VAL 7 -12.031 -15.724 26.398 1.00 -0.42 N ATOM 87 H VAL 7 -11.616 -15.534 27.295 1.00 0.27 H ATOM 88 CA VAL 7 -11.128 -15.827 25.238 1.00 -0.09 C ATOM 89 HA VAL 7 -11.357 -15.005 24.565 1.00 0.10 H ATOM 90 C VAL 7 -11.258 -17.106 24.419 1.00 0.60 C ATOM 91 O VAL 7 -10.867 -17.166 23.258 1.00 -0.57 O ATOM 92 CB VAL 7 -9.626 -15.730 25.666 1.00 0.30 C ATOM 93 HB VAL 7 -9.011 -15.866 24.779 1.00 -0.03 H ATOM 94 CG1 VAL 7 -9.298 -14.361 26.253 1.00 -0.32 C ATOM 95 1HG1 VAL 7 -9.588 -13.581 25.546 1.00 0.08 H ATOM 96 2HG1 VAL 7 -9.804 -14.212 27.204 1.00 0.08 H ATOM 97 3HG1 VAL 7 -8.220 -14.286 26.404 1.00 0.08 H ATOM 98 CG2 VAL 7 -9.240 -16.818 26.694 1.00 -0.32 C ATOM 99 1HG2 VAL 7 -9.391 -17.809 26.265 1.00 0.08 H ATOM 100 2HG2 VAL 7 -8.181 -16.724 26.938 1.00 0.08 H ATOM 101 3HG2 VAL 7 -9.825 -16.727 27.609 1.00 0.08 H ATOM 102 N PHE 8 -11.848 -18.124 25.021 1.00 -0.42 N ATOM 103 H PHE 8 -12.196 -17.987 25.956 1.00 0.27 H ATOM 104 CA PHE 8 -12.015 -19.437 24.422 1.00 -0.00 C ATOM 105 HA PHE 8 -11.033 -19.831 24.161 1.00 0.10 H ATOM 106 C PHE 8 -12.872 -19.378 23.165 1.00 0.60 C ATOM 107 O PHE 8 -12.716 -20.197 22.270 1.00 -0.57 O ATOM 108 CB PHE 8 -12.655 -20.336 25.479 1.00 -0.03 C ATOM 109 1HB PHE 8 -13.725 -20.126 25.508 1.00 0.03 H ATOM 110 2HB PHE 8 -12.518 -21.379 25.195 1.00 0.03 H ATOM 111 CG PHE 8 -12.101 -20.099 26.860 1.00 0.01 C ATOM 112 CD1 PHE 8 -12.840 -19.359 27.805 1.00 -0.13 C ATOM 113 HD1 PHE 8 -13.841 -19.025 27.566 1.00 0.13 H ATOM 114 CD2 PHE 8 -10.814 -20.553 27.201 1.00 -0.13 C ATOM 115 HD2 PHE 8 -10.241 -21.135 26.492 1.00 0.13 H ATOM 116 CE1 PHE 8 -12.283 -19.032 29.065 1.00 -0.17 C ATOM 117 HE1 PHE 8 -12.851 -18.453 29.780 1.00 0.14 H ATOM 118 CE2 PHE 8 -10.246 -20.240 28.461 1.00 -0.17 C ATOM 119 HE2 PHE 8 -9.254 -20.589 28.710 1.00 0.14 H ATOM 120 CZ PHE 8 -10.980 -19.469 29.391 1.00 -0.11 C ATOM 121 HZ PHE 8 -10.548 -19.218 30.349 1.00 0.13 H ATOM 122 N ALA 9 -13.713 -18.355 23.068 1.00 -0.42 N ATOM 123 H ALA 9 -13.756 -17.674 23.821 1.00 0.27 H ATOM 124 CA ALA 9 -14.579 -18.152 21.910 1.00 0.03 C ATOM 125 HA ALA 9 -15.223 -19.027 21.808 1.00 0.08 H ATOM 126 C ALA 9 -13.827 -17.987 20.581 1.00 0.60 C ATOM 127 O ALA 9 -14.354 -18.333 19.527 1.00 -0.57 O ATOM 128 CB ALA 9 -15.458 -16.935 22.173 1.00 -0.18 C ATOM 129 1HB ALA 9 -14.831 -16.049 22.287 1.00 0.06 H ATOM 130 2HB ALA 9 -16.135 -16.799 21.330 1.00 0.06 H ATOM 131 3HB ALA 9 -16.040 -17.089 23.083 1.00 0.06 H ATOM 132 N LYS 10 -12.603 -17.473 20.625 1.00 -0.35 N ATOM 133 H LYS 10 -12.255 -17.110 21.510 1.00 0.28 H ATOM 134 CA LYS 10 -11.744 -17.401 19.432 1.00 -0.24 C ATOM 135 HA LYS 10 -12.208 -17.958 18.619 1.00 0.14 H ATOM 136 C LYS 10 -10.390 -18.048 19.691 1.00 0.73 C ATOM 137 O LYS 10 -9.449 -17.844 18.941 1.00 -0.59 O ATOM 138 CB LYS 10 -11.548 -15.941 18.994 1.00 -0.01 C ATOM 139 1HB LYS 10 -11.083 -15.404 19.815 1.00 0.04 H ATOM 140 2HB LYS 10 -10.864 -15.913 18.146 1.00 0.04 H ATOM 141 CG LYS 10 -12.819 -15.195 18.598 1.00 0.02 C ATOM 142 1HG LYS 10 -13.560 -15.286 19.391 1.00 0.01 H ATOM 143 2HG LYS 10 -12.569 -14.144 18.480 1.00 0.01 H ATOM 144 CD LYS 10 -13.410 -15.715 17.287 1.00 -0.05 C ATOM 145 1HD LYS 10 -12.678 -15.599 16.487 1.00 0.06 H ATOM 146 2HD LYS 10 -13.650 -16.772 17.395 1.00 0.06 H ATOM 147 CE LYS 10 -14.685 -14.975 16.922 1.00 -0.01 C ATOM 148 1HE LYS 10 -15.161 -15.486 16.084 1.00 0.11 H ATOM 149 2HE LYS 10 -15.364 -15.013 17.774 1.00 0.11 H ATOM 150 NZ LYS 10 -14.446 -13.545 16.548 1.00 -0.38 N ATOM 151 1HZ LYS 10 -13.976 -13.479 15.657 1.00 0.17 H ATOM 152 2HZ LYS 10 -15.327 -13.044 16.515 1.00 0.17 H ATOM 153 3HZ LYS 10 -13.864 -13.086 17.249 1.00 0.17 H ATOM 154 N GLY 11 -10.278 -18.746 20.812 1.00 -0.42 N ATOM 155 H GLY 11 -11.099 -18.917 21.375 1.00 0.27 H ATOM 156 CA GLY 11 -8.994 -19.266 21.268 1.00 -0.03 C ATOM 157 1HA GLY 11 -9.159 -19.907 22.133 1.00 0.07 H ATOM 158 2HA GLY 11 -8.554 -19.867 20.471 1.00 0.07 H ATOM 159 C GLY 11 -7.992 -18.184 21.645 1.00 0.60 C ATOM 160 O GLY 11 -6.803 -18.449 21.777 1.00 -0.57 O ATOM 161 N PHE 12 -8.469 -16.952 21.768 1.00 -0.42 N ATOM 162 H PHE 12 -9.472 -16.837 21.788 1.00 0.27 H ATOM 163 CA PHE 12 -7.616 -15.767 21.863 1.00 -0.00 C ATOM 164 HA PHE 12 -6.795 -15.981 22.546 1.00 0.10 H ATOM 165 C PHE 12 -8.368 -14.533 22.368 1.00 0.60 C ATOM 166 O PHE 12 -7.850 -13.780 23.193 1.00 -0.57 O ATOM 167 CB PHE 12 -7.044 -15.479 20.463 1.00 -0.03 C ATOM 168 1HB PHE 12 -6.530 -16.372 20.110 1.00 0.03 H ATOM 169 2HB PHE 12 -7.868 -15.275 19.779 1.00 0.03 H ATOM 170 CG PHE 12 -6.065 -14.330 20.405 1.00 0.01 C ATOM 171 CD1 PHE 12 -5.084 -14.145 21.401 1.00 -0.13 C ATOM 172 HD1 PHE 12 -5.015 -14.830 22.233 1.00 0.13 H ATOM 173 CD2 PHE 12 -6.100 -13.444 19.313 1.00 -0.13 C ATOM 174 HD2 PHE 12 -6.833 -13.585 18.530 1.00 0.13 H ATOM 175 CE1 PHE 12 -4.162 -13.069 21.322 1.00 -0.17 C ATOM 176 HE1 PHE 12 -3.417 -12.938 22.094 1.00 0.14 H ATOM 177 CE2 PHE 12 -5.180 -12.368 19.216 1.00 -0.17 C ATOM 178 HE2 PHE 12 -5.215 -11.702 18.365 1.00 0.14 H ATOM 179 CZ PHE 12 -4.211 -12.179 20.226 1.00 -0.11 C ATOM 180 HZ PHE 12 -3.505 -11.364 20.156 1.00 0.13 H ATOM 181 N LYS 13 -9.581 -14.315 21.870 1.00 -0.35 N ATOM 182 H LYS 13 -9.974 -14.981 21.224 1.00 0.28 H ATOM 183 CA LYS 13 -10.402 -13.136 22.187 1.00 -0.24 C ATOM 184 HA LYS 13 -10.038 -12.649 23.092 1.00 0.14 H ATOM 185 C LYS 13 -11.851 -13.542 22.409 1.00 0.73 C ATOM 186 O LYS 13 -12.229 -14.674 22.102 1.00 -0.59 O ATOM 187 CB LYS 13 -10.367 -12.135 21.018 1.00 -0.01 C ATOM 188 1HB LYS 13 -10.003 -12.638 20.121 1.00 0.04 H ATOM 189 2HB LYS 13 -11.383 -11.805 20.810 1.00 0.04 H ATOM 190 CG LYS 13 -9.528 -10.889 21.279 1.00 0.02 C ATOM 191 1HG LYS 13 -9.881 -10.081 20.641 1.00 0.01 H ATOM 192 2HG LYS 13 -9.664 -10.584 22.312 1.00 0.01 H ATOM 193 CD LYS 13 -8.055 -11.116 20.988 1.00 -0.05 C ATOM 194 1HD LYS 13 -7.841 -12.178 21.046 1.00 0.06 H ATOM 195 2HD LYS 13 -7.850 -10.787 19.969 1.00 0.06 H ATOM 196 CE LYS 13 -7.126 -10.391 21.950 1.00 -0.01 C ATOM 197 1HE LYS 13 -6.106 -10.470 21.569 1.00 0.11 H ATOM 198 2HE LYS 13 -7.407 -9.338 22.006 1.00 0.11 H ATOM 199 NZ LYS 13 -7.181 -11.006 23.316 1.00 -0.38 N ATOM 200 1HZ LYS 13 -6.447 -10.640 23.904 1.00 0.17 H ATOM 201 2HZ LYS 13 -8.080 -10.810 23.753 1.00 0.17 H ATOM 202 3HZ LYS 13 -7.093 -12.017 23.247 1.00 0.17 H ATOM 203 N LYS 14 -12.661 -12.613 22.902 1.00 -0.35 N ATOM 204 H LYS 14 -12.267 -11.720 23.197 1.00 0.28 H ATOM 205 CA LYS 14 -14.114 -12.802 22.968 1.00 -0.24 C ATOM 206 HA LYS 14 -14.325 -13.700 23.553 1.00 0.14 H ATOM 207 C LYS 14 -14.693 -12.988 21.573 1.00 0.73 C ATOM 208 O LYS 14 -14.080 -12.609 20.585 1.00 -0.59 O ATOM 209 CB LYS 14 -14.785 -11.601 23.645 1.00 -0.01 C ATOM 210 1HB LYS 14 -15.847 -11.821 23.759 1.00 0.04 H ATOM 211 2HB LYS 14 -14.349 -11.518 24.633 1.00 0.04 H ATOM 212 CG LYS 14 -14.641 -10.238 22.959 1.00 0.02 C ATOM 213 1HG LYS 14 -13.591 -9.961 22.926 1.00 0.01 H ATOM 214 2HG LYS 14 -15.005 -10.305 21.937 1.00 0.01 H ATOM 215 CD LYS 14 -15.430 -9.131 23.680 1.00 -0.05 C ATOM 216 1HD LYS 14 -15.273 -8.195 23.145 1.00 0.06 H ATOM 217 2HD LYS 14 -16.491 -9.378 23.625 1.00 0.06 H ATOM 218 CE LYS 14 -15.075 -8.926 25.166 1.00 -0.01 C ATOM 219 1HE LYS 14 -15.732 -8.156 25.575 1.00 0.11 H ATOM 220 2HE LYS 14 -15.288 -9.850 25.706 1.00 0.11 H ATOM 221 NZ LYS 14 -13.651 -8.538 25.439 1.00 -0.38 N ATOM 222 1HZ LYS 14 -13.458 -7.621 25.067 1.00 0.17 H ATOM 223 2HZ LYS 14 -13.492 -8.539 26.443 1.00 0.17 H ATOM 224 3HZ LYS 14 -13.018 -9.210 25.008 1.00 0.17 H ATOM 225 N ALA 15 -15.915 -13.501 21.499 1.00 -0.42 N ATOM 226 H ALA 15 -16.393 -13.750 22.350 1.00 0.27 H ATOM 227 CA ALA 15 -16.577 -13.747 20.215 1.00 0.03 C ATOM 228 HA ALA 15 -15.969 -14.452 19.650 1.00 0.08 H ATOM 229 C ALA 15 -16.720 -12.476 19.367 1.00 0.60 C ATOM 230 O ALA 15 -16.688 -12.521 18.141 1.00 -0.57 O ATOM 231 CB ALA 15 -17.958 -14.372 20.464 1.00 -0.18 C ATOM 232 1HB ALA 15 -18.434 -14.589 19.506 1.00 0.06 H ATOM 233 2HB ALA 15 -17.856 -15.303 21.022 1.00 0.06 H ATOM 234 3HB ALA 15 -18.590 -13.681 21.023 1.00 0.06 H ATOM 235 N SER 16 -16.860 -11.348 20.043 1.00 -0.42 N ATOM 236 H SER 16 -16.907 -11.376 21.048 1.00 0.27 H ATOM 237 CA SER 16 -16.983 -10.038 19.415 1.00 -0.03 C ATOM 238 HA SER 16 -17.661 -10.119 18.564 1.00 0.08 H ATOM 239 C SER 16 -15.687 -9.381 18.935 1.00 0.60 C ATOM 240 O SER 16 -15.720 -8.217 18.545 1.00 -0.57 O ATOM 241 CB SER 16 -17.606 -9.114 20.455 1.00 0.21 C ATOM 242 1HB SER 16 -16.811 -8.574 20.971 1.00 0.04 H ATOM 243 2HB SER 16 -18.271 -8.399 19.969 1.00 0.04 H ATOM 244 OG SER 16 -18.318 -9.896 21.405 1.00 -0.65 O ATOM 245 HG SER 16 -19.212 -10.031 21.072 1.00 0.43 H ATOM 246 N HIS 17 -14.549 -10.059 19.014 1.00 -0.35 N ATOM 247 H HIS 17 -14.532 -11.037 19.301 1.00 0.28 H ATOM 248 CA HIS 17 -13.269 -9.469 18.620 1.00 -0.14 C ATOM 249 HA HIS 17 -13.433 -8.814 17.765 1.00 0.12 H ATOM 250 C HIS 17 -12.353 -10.613 18.187 1.00 0.73 C ATOM 251 O HIS 17 -11.109 -10.486 18.186 1.00 -0.59 O ATOM 252 OXT HIS 17 -12.939 -11.655 17.855 1.00 -0.59 O ATOM 253 CB HIS 17 -12.673 -8.655 19.778 1.00 -0.04 C ATOM 254 1HB HIS 17 -13.486 -8.179 20.324 1.00 0.08 H ATOM 255 2HB HIS 17 -12.157 -9.337 20.453 1.00 0.08 H ATOM 256 CG HIS 17 -11.728 -7.585 19.325 1.00 -0.00 C ATOM 257 ND1 HIS 17 -10.567 -7.856 18.620 1.00 -0.15 N ATOM 258 HD1 HIS 17 -10.299 -8.812 18.335 1.00 0.14 H ATOM 259 CD2 HIS 17 -11.764 -6.232 19.428 1.00 -0.11 C ATOM 260 HD2 HIS 17 -12.551 -5.660 19.904 1.00 0.23 H ATOM 261 CE1 HIS 17 -9.944 -6.723 18.338 1.00 -0.02 C ATOM 262 HE1 HIS 17 -9.015 -6.639 17.785 1.00 0.27 H ATOM 263 NE2 HIS 17 -10.651 -5.724 18.815 1.00 -0.17 N ATOM 264 HE2 HIS 17 -10.421 -4.740 18.731 1.00 0.14 H TER 265 HIS 17 END