ATOM 1 N MET A 1 1.483 0.174 -0.015 1.00 61.14 N ATOM 2 CA MET A 1 2.142 0.060 -1.310 1.00 54.30 C ATOM 3 C MET A 1 3.239 -0.999 -1.272 1.00 10.41 C ATOM 4 O MET A 1 3.969 -1.115 -0.287 1.00 3.43 O ATOM 5 CB MET A 1 2.734 1.409 -1.726 1.00 20.22 C ATOM 6 CG MET A 1 3.703 1.987 -0.708 1.00 1.40 C ATOM 7 SD MET A 1 5.006 2.971 -1.471 1.00 51.55 S ATOM 8 CE MET A 1 6.135 3.165 -0.094 1.00 35.22 C ATOM 9 H MET A 1 1.914 0.693 0.697 1.00 74.14 H ATOM 10 HA MET A 1 1.398 -0.235 -2.036 1.00 15.40 H ATOM 11 HB2 MET A 1 3.259 1.285 -2.662 1.00 4.54 H ATOM 12 HB3 MET A 1 1.928 2.114 -1.865 1.00 14.14 H ATOM 13 HG2 MET A 1 3.153 2.614 -0.023 1.00 54.45 H ATOM 14 HG3 MET A 1 4.157 1.173 -0.162 1.00 12.20 H ATOM 15 HE1 MET A 1 6.647 2.231 0.086 1.00 22.11 H ATOM 16 HE2 MET A 1 6.857 3.933 -0.326 1.00 11.55 H ATOM 17 HE3 MET A 1 5.580 3.447 0.790 1.00 61.33 H ATOM 18 N CYS A 2 3.349 -1.770 -2.349 1.00 65.22 N ATOM 19 CA CYS A 2 4.357 -2.820 -2.437 1.00 20.05 C ATOM 20 C CYS A 2 5.731 -2.232 -2.744 1.00 4.54 C ATOM 21 O CYS A 2 6.750 -2.720 -2.255 1.00 4.35 O ATOM 22 CB CYS A 2 3.972 -3.834 -3.517 1.00 63.23 C ATOM 23 SG CYS A 2 4.977 -5.353 -3.502 1.00 13.21 S ATOM 24 H CYS A 2 2.738 -1.630 -3.103 1.00 75.25 H ATOM 25 HA CYS A 2 4.398 -3.322 -1.483 1.00 54.14 H ATOM 26 HB2 CYS A 2 2.940 -4.123 -3.378 1.00 13.22 H ATOM 27 HB3 CYS A 2 4.085 -3.374 -4.488 1.00 71.35 H ATOM 28 N MET A 3 5.751 -1.179 -3.555 1.00 45.01 N ATOM 29 CA MET A 3 6.999 -0.523 -3.926 1.00 52.23 C ATOM 30 C MET A 3 6.738 0.884 -4.453 1.00 23.10 C ATOM 31 O MET A 3 5.658 1.194 -4.955 1.00 20.11 O ATOM 32 CB MET A 3 7.739 -1.347 -4.980 1.00 74.12 C ATOM 33 CG MET A 3 7.201 -1.157 -6.389 1.00 63.41 C ATOM 34 SD MET A 3 8.096 -2.132 -7.613 1.00 2.44 S ATOM 35 CE MET A 3 9.775 -1.585 -7.319 1.00 45.55 C ATOM 36 H MET A 3 4.906 -0.835 -3.914 1.00 0.44 H ATOM 37 HA MET A 3 7.612 -0.454 -3.039 1.00 70.35 H ATOM 38 HB2 MET A 3 8.781 -1.063 -4.976 1.00 63.13 H ATOM 39 HB3 MET A 3 7.659 -2.393 -4.726 1.00 23.14 H ATOM 40 HG2 MET A 3 6.162 -1.452 -6.405 1.00 53.32 H ATOM 41 HG3 MET A 3 7.280 -0.112 -6.651 1.00 1.24 H ATOM 42 HE1 MET A 3 10.254 -1.370 -8.263 1.00 21.34 H ATOM 43 HE2 MET A 3 9.761 -0.691 -6.712 1.00 61.54 H ATOM 44 HE3 MET A 3 10.322 -2.362 -6.806 1.00 63.45 H ATOM 45 N PRO A 4 7.749 1.757 -4.338 1.00 22.41 N ATOM 46 CA PRO A 4 7.652 3.146 -4.799 1.00 23.31 C ATOM 47 C PRO A 4 7.606 3.251 -6.319 1.00 1.05 C ATOM 48 O PRO A 4 8.455 2.695 -7.016 1.00 42.21 O ATOM 49 CB PRO A 4 8.932 3.788 -4.257 1.00 25.11 C ATOM 50 CG PRO A 4 9.892 2.659 -4.114 1.00 51.45 C ATOM 51 CD PRO A 4 9.065 1.456 -3.751 1.00 11.41 C ATOM 52 HA PRO A 4 6.792 3.644 -4.377 1.00 24.43 H ATOM 53 HB2 PRO A 4 9.292 4.527 -4.960 1.00 61.33 H ATOM 54 HB3 PRO A 4 8.729 4.258 -3.306 1.00 71.44 H ATOM 55 HG2 PRO A 4 10.406 2.492 -5.048 1.00 72.30 H ATOM 56 HG3 PRO A 4 10.600 2.877 -3.328 1.00 34.11 H ATOM 57 HD2 PRO A 4 9.488 0.563 -4.186 1.00 15.24 H ATOM 58 HD3 PRO A 4 8.994 1.358 -2.677 1.00 72.12 H ATOM 59 N CYS A 5 6.609 3.967 -6.827 1.00 4.23 N ATOM 60 CA CYS A 5 6.450 4.144 -8.266 1.00 74.20 C ATOM 61 C CYS A 5 6.911 5.535 -8.696 1.00 64.10 C ATOM 62 O CYS A 5 7.194 6.392 -7.860 1.00 15.51 O ATOM 63 CB CYS A 5 4.990 3.932 -8.670 1.00 42.42 C ATOM 64 SG CYS A 5 4.777 3.082 -10.267 1.00 30.21 S ATOM 65 H CYS A 5 5.962 4.386 -6.221 1.00 1.03 H ATOM 66 HA CYS A 5 7.063 3.407 -8.761 1.00 23.14 H ATOM 67 HB2 CYS A 5 4.499 3.337 -7.914 1.00 54.03 H ATOM 68 HB3 CYS A 5 4.500 4.891 -8.739 1.00 14.14 H ATOM 69 N PHE A 6 6.983 5.749 -10.006 1.00 61.31 N ATOM 70 CA PHE A 6 7.410 7.034 -10.548 1.00 11.13 C ATOM 71 C PHE A 6 6.665 7.353 -11.840 1.00 22.31 C ATOM 72 O PHE A 6 6.642 6.549 -12.773 1.00 51.14 O ATOM 73 CB PHE A 6 8.919 7.028 -10.803 1.00 13.01 C ATOM 74 CG PHE A 6 9.739 7.073 -9.546 1.00 63.40 C ATOM 75 CD1 PHE A 6 10.270 8.269 -9.091 1.00 51.33 C ATOM 76 CD2 PHE A 6 9.982 5.919 -8.819 1.00 31.31 C ATOM 77 CE1 PHE A 6 11.025 8.314 -7.936 1.00 4.43 C ATOM 78 CE2 PHE A 6 10.737 5.956 -7.662 1.00 22.35 C ATOM 79 CZ PHE A 6 11.259 7.156 -7.220 1.00 34.35 C ATOM 80 H PHE A 6 6.745 5.025 -10.622 1.00 73.13 H ATOM 81 HA PHE A 6 7.180 7.793 -9.816 1.00 73.55 H ATOM 82 HB2 PHE A 6 9.182 6.129 -11.339 1.00 11.14 H ATOM 83 HB3 PHE A 6 9.178 7.888 -11.401 1.00 15.01 H ATOM 84 HD1 PHE A 6 10.087 9.176 -9.649 1.00 4.32 H ATOM 85 HD2 PHE A 6 9.573 4.979 -9.164 1.00 2.12 H ATOM 86 HE1 PHE A 6 11.432 9.253 -7.591 1.00 62.43 H ATOM 87 HE2 PHE A 6 10.917 5.049 -7.105 1.00 62.21 H ATOM 88 HZ PHE A 6 11.850 7.187 -6.316 1.00 51.43 H ATOM 89 N THR A 7 6.056 8.534 -11.888 1.00 52.30 N ATOM 90 CA THR A 7 5.308 8.960 -13.065 1.00 12.52 C ATOM 91 C THR A 7 6.246 9.328 -14.209 1.00 73.14 C ATOM 92 O THR A 7 5.942 9.087 -15.378 1.00 53.32 O ATOM 93 CB THR A 7 4.404 10.167 -12.749 1.00 60.31 C ATOM 94 OG1 THR A 7 5.202 11.278 -12.326 1.00 62.32 O ATOM 95 CG2 THR A 7 3.394 9.818 -11.666 1.00 21.32 C ATOM 96 H THR A 7 6.111 9.131 -11.114 1.00 2.23 H ATOM 97 HA THR A 7 4.680 8.138 -13.377 1.00 25.02 H ATOM 98 HB THR A 7 3.868 10.440 -13.647 1.00 13.03 H ATOM 99 HG1 THR A 7 5.050 12.023 -12.913 1.00 50.10 H ATOM 100 HG21 THR A 7 3.776 10.130 -10.705 1.00 33.24 H ATOM 101 HG22 THR A 7 3.228 8.751 -11.659 1.00 1.34 H ATOM 102 HG23 THR A 7 2.464 10.326 -11.866 1.00 63.31 H ATOM 103 N THR A 8 7.390 9.913 -13.866 1.00 1.00 N ATOM 104 CA THR A 8 8.373 10.313 -14.864 1.00 60.33 C ATOM 105 C THR A 8 9.130 9.106 -15.407 1.00 53.42 C ATOM 106 O THR A 8 9.675 9.149 -16.510 1.00 64.45 O ATOM 107 CB THR A 8 9.383 11.322 -14.285 1.00 54.50 C ATOM 108 OG1 THR A 8 10.366 11.653 -15.273 1.00 44.03 O ATOM 109 CG2 THR A 8 10.068 10.753 -13.052 1.00 4.11 C ATOM 110 H THR A 8 7.575 10.078 -12.918 1.00 15.32 H ATOM 111 HA THR A 8 7.846 10.791 -15.678 1.00 2.23 H ATOM 112 HB THR A 8 8.851 12.219 -14.002 1.00 41.13 H ATOM 113 HG1 THR A 8 10.591 12.584 -15.200 1.00 42.43 H ATOM 114 HG21 THR A 8 10.358 9.730 -13.240 1.00 54.43 H ATOM 115 HG22 THR A 8 9.386 10.785 -12.215 1.00 2.14 H ATOM 116 HG23 THR A 8 10.945 11.339 -12.825 1.00 74.13 H ATOM 117 N ASP A 9 9.159 8.033 -14.626 1.00 21.34 N ATOM 118 CA ASP A 9 9.848 6.813 -15.029 1.00 12.04 C ATOM 119 C ASP A 9 8.908 5.884 -15.790 1.00 61.42 C ATOM 120 O ASP A 9 7.795 5.608 -15.343 1.00 12.44 O ATOM 121 CB ASP A 9 10.416 6.094 -13.803 1.00 52.22 C ATOM 122 CG ASP A 9 11.460 5.058 -14.172 1.00 4.24 C ATOM 123 OD1 ASP A 9 12.171 4.583 -13.262 1.00 2.11 O ATOM 124 OD2 ASP A 9 11.568 4.724 -15.370 1.00 44.10 O1- ATOM 125 H ASP A 9 8.705 8.061 -13.757 1.00 2.15 H ATOM 126 HA ASP A 9 10.664 7.092 -15.679 1.00 55.21 H ATOM 127 HB2 ASP A 9 10.871 6.820 -13.146 1.00 2.03 H ATOM 128 HB3 ASP A 9 9.611 5.597 -13.282 1.00 52.11 H ATOM 129 N HIS A 10 9.365 5.405 -16.944 1.00 43.01 N ATOM 130 CA HIS A 10 8.564 4.506 -17.768 1.00 62.24 C ATOM 131 C HIS A 10 8.896 3.049 -17.463 1.00 53.43 C ATOM 132 O HIS A 10 8.032 2.175 -17.548 1.00 31.54 O ATOM 133 CB HIS A 10 8.798 4.796 -19.251 1.00 31.21 C ATOM 134 CG HIS A 10 10.243 4.772 -19.645 1.00 13.22 C ATOM 135 ND1 HIS A 10 11.125 5.783 -19.329 1.00 61.15 N ATOM 136 CD2 HIS A 10 10.958 3.850 -20.331 1.00 41.34 C ATOM 137 CE1 HIS A 10 12.321 5.485 -19.806 1.00 72.53 C ATOM 138 NE2 HIS A 10 12.246 4.317 -20.418 1.00 64.11 N ATOM 139 H HIS A 10 10.260 5.660 -17.246 1.00 40.51 H ATOM 140 HA HIS A 10 7.524 4.682 -17.535 1.00 21.14 H ATOM 141 HB2 HIS A 10 8.281 4.055 -19.841 1.00 15.41 H ATOM 142 HB3 HIS A 10 8.405 5.775 -19.486 1.00 4.24 H ATOM 143 HD1 HIS A 10 10.907 6.598 -18.832 1.00 3.22 H ATOM 144 HD2 HIS A 10 10.584 2.920 -20.736 1.00 74.25 H ATOM 145 HE1 HIS A 10 13.208 6.092 -19.712 1.00 61.01 H ATOM 146 N GLN A 11 10.151 2.794 -17.110 1.00 53.33 N ATOM 147 CA GLN A 11 10.596 1.442 -16.794 1.00 74.14 C ATOM 148 C GLN A 11 10.214 1.061 -15.368 1.00 32.21 C ATOM 149 O GLN A 11 10.247 -0.112 -14.999 1.00 21.34 O ATOM 150 CB GLN A 11 12.111 1.326 -16.977 1.00 43.54 C ATOM 151 CG GLN A 11 12.906 2.249 -16.069 1.00 43.54 C ATOM 152 CD GLN A 11 14.276 1.696 -15.729 1.00 64.12 C ATOM 153 OE1 GLN A 11 14.395 0.598 -15.183 1.00 53.20 O ATOM 154 NE2 GLN A 11 15.317 2.454 -16.048 1.00 34.11 N ATOM 155 H GLN A 11 10.793 3.533 -17.060 1.00 21.03 H ATOM 156 HA GLN A 11 10.108 0.765 -17.478 1.00 15.23 H ATOM 157 HB2 GLN A 11 12.409 0.308 -16.771 1.00 73.33 H ATOM 158 HB3 GLN A 11 12.357 1.563 -18.002 1.00 24.02 H ATOM 159 HG2 GLN A 11 13.033 3.200 -16.567 1.00 63.04 H ATOM 160 HG3 GLN A 11 12.354 2.395 -15.153 1.00 63.33 H ATOM 161 HE21 GLN A 11 15.145 3.318 -16.479 1.00 15.12 H ATOM 162 HE22 GLN A 11 16.214 2.122 -15.838 1.00 62.42 H ATOM 163 N MET A 12 9.852 2.061 -14.571 1.00 45.43 N ATOM 164 CA MET A 12 9.461 1.830 -13.185 1.00 41.10 C ATOM 165 C MET A 12 8.186 0.998 -13.110 1.00 14.12 C ATOM 166 O MET A 12 8.075 0.086 -12.291 1.00 20.41 O ATOM 167 CB MET A 12 9.258 3.162 -12.462 1.00 13.42 C ATOM 168 CG MET A 12 8.849 3.007 -11.005 1.00 3.42 C ATOM 169 SD MET A 12 10.184 2.372 -9.974 1.00 34.23 S ATOM 170 CE MET A 12 9.369 0.987 -9.181 1.00 44.15 C ATOM 171 H MET A 12 9.844 2.976 -14.923 1.00 23.24 H ATOM 172 HA MET A 12 10.260 1.287 -12.702 1.00 24.11 H ATOM 173 HB2 MET A 12 10.181 3.722 -12.496 1.00 10.25 H ATOM 174 HB3 MET A 12 8.487 3.722 -12.971 1.00 64.23 H ATOM 175 HG2 MET A 12 8.547 3.971 -10.625 1.00 14.24 H ATOM 176 HG3 MET A 12 8.014 2.324 -10.952 1.00 32.30 H ATOM 177 HE1 MET A 12 9.744 0.063 -9.596 1.00 33.32 H ATOM 178 HE2 MET A 12 9.568 1.012 -8.120 1.00 73.40 H ATOM 179 HE3 MET A 12 8.304 1.051 -9.351 1.00 50.41 H ATOM 180 N ALA A 13 7.225 1.317 -13.972 1.00 20.32 N ATOM 181 CA ALA A 13 5.958 0.596 -14.004 1.00 61.02 C ATOM 182 C ALA A 13 6.184 -0.909 -14.098 1.00 65.44 C ATOM 183 O ALA A 13 5.431 -1.696 -13.524 1.00 61.00 O ATOM 184 CB ALA A 13 5.107 1.079 -15.170 1.00 41.50 C ATOM 185 H ALA A 13 7.373 2.052 -14.601 1.00 54.24 H ATOM 186 HA ALA A 13 5.427 0.814 -13.089 1.00 40.02 H ATOM 187 HB1 ALA A 13 5.728 1.184 -16.048 1.00 4.12 H ATOM 188 HB2 ALA A 13 4.325 0.360 -15.366 1.00 21.51 H ATOM 189 HB3 ALA A 13 4.665 2.033 -14.923 1.00 41.25 H ATOM 190 N ARG A 14 7.224 -1.302 -14.825 1.00 61.42 N ATOM 191 CA ARG A 14 7.548 -2.713 -14.995 1.00 4.12 C ATOM 192 C ARG A 14 7.635 -3.417 -13.644 1.00 73.12 C ATOM 193 O ARG A 14 7.034 -4.473 -13.442 1.00 51.32 O ATOM 194 CB ARG A 14 8.870 -2.868 -15.749 1.00 70.30 C ATOM 195 CG ARG A 14 9.020 -4.210 -16.445 1.00 3.53 C ATOM 196 CD ARG A 14 8.254 -4.245 -17.759 1.00 31.05 C ATOM 197 NE ARG A 14 8.885 -3.417 -18.782 1.00 71.02 N ATOM 198 CZ ARG A 14 8.480 -3.375 -20.047 1.00 73.14 C ATOM 199 NH1 ARG A 14 7.451 -4.111 -20.442 1.00 12.21 N1+ ATOM 200 NH2 ARG A 14 9.106 -2.596 -20.920 1.00 43.21 N ATOM 201 H ARG A 14 7.788 -0.627 -15.258 1.00 11.41 H ATOM 202 HA ARG A 14 6.758 -3.168 -15.574 1.00 53.42 H ATOM 203 HB2 ARG A 14 8.938 -2.091 -16.496 1.00 62.34 H ATOM 204 HB3 ARG A 14 9.684 -2.757 -15.049 1.00 32.32 H ATOM 205 HG2 ARG A 14 10.066 -4.386 -16.647 1.00 14.32 H ATOM 206 HG3 ARG A 14 8.640 -4.986 -15.797 1.00 64.15 H ATOM 207 HD2 ARG A 14 8.214 -5.266 -18.110 1.00 2.11 H ATOM 208 HD3 ARG A 14 7.251 -3.886 -17.585 1.00 61.05 H ATOM 209 HE ARG A 14 9.648 -2.865 -18.513 1.00 12.31 H ATOM 210 HH11 ARG A 14 6.977 -4.698 -19.786 1.00 13.11 H ATOM 211 HH12 ARG A 14 7.147 -4.078 -21.394 1.00 54.33 H ATOM 212 HH21 ARG A 14 9.883 -2.040 -20.626 1.00 3.13 H ATOM 213 HH22 ARG A 14 8.802 -2.565 -21.871 1.00 22.33 H ATOM 214 N LYS A 15 8.387 -2.826 -12.722 1.00 53.05 N ATOM 215 CA LYS A 15 8.553 -3.395 -11.389 1.00 32.42 C ATOM 216 C LYS A 15 7.267 -3.271 -10.580 1.00 33.31 C ATOM 217 O LYS A 15 6.891 -4.186 -9.848 1.00 53.12 O ATOM 218 CB LYS A 15 9.700 -2.698 -10.655 1.00 1.14 C ATOM 219 CG LYS A 15 11.054 -2.894 -11.315 1.00 62.52 C ATOM 220 CD LYS A 15 12.022 -1.784 -10.941 1.00 62.43 C ATOM 221 CE LYS A 15 11.860 -0.573 -11.847 1.00 42.23 C ATOM 222 NZ LYS A 15 13.175 -0.008 -12.259 1.00 31.31 N1+ ATOM 223 H LYS A 15 8.841 -1.985 -12.942 1.00 5.22 H ATOM 224 HA LYS A 15 8.792 -4.442 -11.503 1.00 12.41 H ATOM 225 HB2 LYS A 15 9.493 -1.639 -10.611 1.00 65.25 H ATOM 226 HB3 LYS A 15 9.755 -3.087 -9.648 1.00 61.53 H ATOM 227 HG2 LYS A 15 11.466 -3.839 -10.998 1.00 44.42 H ATOM 228 HG3 LYS A 15 10.923 -2.898 -12.389 1.00 63.13 H ATOM 229 HD2 LYS A 15 11.836 -1.484 -9.921 1.00 35.34 H ATOM 230 HD3 LYS A 15 13.034 -2.156 -11.029 1.00 43.40 H ATOM 231 HE2 LYS A 15 11.312 -0.870 -12.728 1.00 42.01 H ATOM 232 HE3 LYS A 15 11.303 0.185 -11.314 1.00 31.51 H ATOM 233 HZ1 LYS A 15 13.927 -0.362 -11.634 1.00 32.11 H ATOM 234 HZ2 LYS A 15 13.152 1.029 -12.203 1.00 43.32 H ATOM 235 HZ3 LYS A 15 13.392 -0.287 -13.237 1.00 5.34 H ATOM 236 N CYS A 16 6.595 -2.133 -10.719 1.00 3.31 N ATOM 237 CA CYS A 16 5.349 -1.887 -10.001 1.00 42.35 C ATOM 238 C CYS A 16 4.378 -3.052 -10.184 1.00 44.12 C ATOM 239 O CYS A 16 3.684 -3.447 -9.247 1.00 25.33 O ATOM 240 CB CYS A 16 4.703 -0.589 -10.487 1.00 33.01 C ATOM 241 SG CYS A 16 2.966 -0.385 -9.975 1.00 23.31 S ATOM 242 H CYS A 16 6.944 -1.439 -11.317 1.00 60.30 H ATOM 243 HA CYS A 16 5.583 -1.792 -8.952 1.00 65.44 H ATOM 244 HB2 CYS A 16 5.260 0.250 -10.097 1.00 64.11 H ATOM 245 HB3 CYS A 16 4.732 -0.564 -11.566 1.00 1.13 H ATOM 246 N ASP A 17 4.337 -3.595 -11.395 1.00 30.21 N ATOM 247 CA ASP A 17 3.453 -4.714 -11.701 1.00 74.33 C ATOM 248 C ASP A 17 3.996 -6.012 -11.112 1.00 20.44 C ATOM 249 O ASP A 17 3.235 -6.860 -10.644 1.00 54.11 O ATOM 250 CB ASP A 17 3.282 -4.858 -13.214 1.00 61.34 C ATOM 251 CG ASP A 17 2.953 -3.540 -13.887 1.00 41.41 C ATOM 252 OD1 ASP A 17 3.494 -3.281 -14.983 1.00 23.12 O ATOM 253 OD2 ASP A 17 2.153 -2.767 -13.319 1.00 73.12 O1- ATOM 254 H ASP A 17 4.914 -3.235 -12.101 1.00 20.24 H ATOM 255 HA ASP A 17 2.490 -4.507 -11.258 1.00 70.12 H ATOM 256 HB2 ASP A 17 4.200 -5.238 -13.639 1.00 60.14 H ATOM 257 HB3 ASP A 17 2.481 -5.554 -13.415 1.00 43.02 H ATOM 258 N ASP A 18 5.315 -6.162 -11.140 1.00 1.53 N ATOM 259 CA ASP A 18 5.961 -7.356 -10.609 1.00 43.23 C ATOM 260 C ASP A 18 5.715 -7.487 -9.109 1.00 73.15 C ATOM 261 O ASP A 18 5.309 -8.543 -8.625 1.00 70.42 O ATOM 262 CB ASP A 18 7.464 -7.317 -10.890 1.00 12.25 C ATOM 263 CG ASP A 18 8.153 -8.622 -10.538 1.00 72.42 C ATOM 264 OD1 ASP A 18 9.339 -8.580 -10.152 1.00 72.02 O ATOM 265 OD2 ASP A 18 7.505 -9.684 -10.650 1.00 1.52 O1- ATOM 266 H ASP A 18 5.869 -5.450 -11.526 1.00 42.55 H ATOM 267 HA ASP A 18 5.534 -8.213 -11.107 1.00 30.43 H ATOM 268 HB2 ASP A 18 7.622 -7.120 -11.940 1.00 71.53 H ATOM 269 HB3 ASP A 18 7.912 -6.526 -10.308 1.00 23.01 H ATOM 270 N CYS A 19 5.964 -6.405 -8.377 1.00 74.32 N ATOM 271 CA CYS A 19 5.771 -6.398 -6.933 1.00 61.35 C ATOM 272 C CYS A 19 4.359 -6.848 -6.570 1.00 64.12 C ATOM 273 O CYS A 19 4.148 -7.513 -5.556 1.00 71.41 O ATOM 274 CB CYS A 19 6.032 -4.999 -6.370 1.00 12.25 C ATOM 275 SG CYS A 19 6.593 -4.988 -4.636 1.00 61.50 S ATOM 276 H CYS A 19 6.285 -5.592 -8.822 1.00 52.24 H ATOM 277 HA CYS A 19 6.478 -7.089 -6.500 1.00 12.02 H ATOM 278 HB2 CYS A 19 6.795 -4.517 -6.964 1.00 43.44 H ATOM 279 HB3 CYS A 19 5.121 -4.421 -6.425 1.00 44.30 H ATOM 280 N CYS A 20 3.393 -6.481 -7.407 1.00 43.21 N ATOM 281 CA CYS A 20 2.001 -6.847 -7.177 1.00 13.54 C ATOM 282 C CYS A 20 1.783 -8.338 -7.416 1.00 3.21 C ATOM 283 O CYS A 20 0.887 -8.947 -6.832 1.00 31.20 O ATOM 284 CB CYS A 20 1.081 -6.033 -8.088 1.00 71.44 C ATOM 285 SG CYS A 20 1.093 -4.243 -7.751 1.00 62.14 S ATOM 286 H CYS A 20 3.623 -5.952 -8.200 1.00 13.34 H ATOM 287 HA CYS A 20 1.765 -6.621 -6.148 1.00 50.45 H ATOM 288 HB2 CYS A 20 1.387 -6.175 -9.114 1.00 1.51 H ATOM 289 HB3 CYS A 20 0.066 -6.384 -7.968 1.00 54.53 H ATOM 290 N GLY A 21 2.610 -8.921 -8.278 1.00 71.21 N ATOM 291 CA GLY A 21 2.492 -10.336 -8.580 1.00 63.31 C ATOM 292 C GLY A 21 3.263 -10.729 -9.824 1.00 31.25 C ATOM 293 O GLY A 21 4.297 -11.392 -9.739 1.00 4.44 O ATOM 294 H GLY A 21 3.307 -8.386 -8.713 1.00 15.03 H ATOM 295 HA2 GLY A 21 2.867 -10.903 -7.741 1.00 21.32 H ATOM 296 HA3 GLY A 21 1.449 -10.574 -8.726 1.00 45.10 H ATOM 297 N GLY A 22 2.758 -10.323 -10.984 1.00 45.41 N ATOM 298 CA GLY A 22 3.418 -10.649 -12.236 1.00 34.14 C ATOM 299 C GLY A 22 3.178 -9.604 -13.307 1.00 73.32 C ATOM 300 O GLY A 22 2.380 -8.685 -13.121 1.00 61.24 O ATOM 301 H GLY A 22 1.930 -9.798 -10.992 1.00 60.10 H ATOM 302 HA2 GLY A 22 4.479 -10.731 -12.059 1.00 2.10 H ATOM 303 HA3 GLY A 22 3.047 -11.600 -12.588 1.00 24.21 H ATOM 304 N LYS A 23 3.870 -9.743 -14.432 1.00 3.23 N ATOM 305 CA LYS A 23 3.729 -8.804 -15.539 1.00 20.35 C ATOM 306 C LYS A 23 2.263 -8.624 -15.917 1.00 22.43 C ATOM 307 O LYS A 23 1.592 -9.578 -16.311 1.00 2.32 O ATOM 308 CB LYS A 23 4.524 -9.291 -16.753 1.00 72.33 C ATOM 309 CG LYS A 23 4.580 -8.283 -17.887 1.00 64.12 C ATOM 310 CD LYS A 23 5.846 -8.443 -18.713 1.00 52.32 C ATOM 311 CE LYS A 23 5.648 -9.435 -19.849 1.00 45.02 C ATOM 312 NZ LYS A 23 5.930 -10.833 -19.421 1.00 51.44 N1+ ATOM 313 H LYS A 23 4.491 -10.497 -14.521 1.00 3.22 H ATOM 314 HA LYS A 23 4.125 -7.852 -15.218 1.00 40.43 H ATOM 315 HB2 LYS A 23 5.536 -9.509 -16.442 1.00 34.30 H ATOM 316 HB3 LYS A 23 4.068 -10.197 -17.127 1.00 10.51 H ATOM 317 HG2 LYS A 23 3.725 -8.428 -18.529 1.00 33.44 H ATOM 318 HG3 LYS A 23 4.557 -7.285 -17.471 1.00 3.51 H ATOM 319 HD2 LYS A 23 6.118 -7.484 -19.130 1.00 62.25 H ATOM 320 HD3 LYS A 23 6.642 -8.797 -18.072 1.00 13.45 H ATOM 321 HE2 LYS A 23 4.626 -9.371 -20.192 1.00 23.11 H ATOM 322 HE3 LYS A 23 6.316 -9.174 -20.657 1.00 53.04 H ATOM 323 HZ1 LYS A 23 5.637 -11.500 -20.163 1.00 22.05 H ATOM 324 HZ2 LYS A 23 5.407 -11.051 -18.549 1.00 23.14 H ATOM 325 HZ3 LYS A 23 6.948 -10.954 -19.242 1.00 40.52 H ATOM 326 N GLY A 24 1.771 -7.394 -15.796 1.00 4.40 N ATOM 327 CA GLY A 24 0.388 -7.112 -16.130 1.00 75.05 C ATOM 328 C GLY A 24 -0.486 -6.955 -14.902 1.00 42.01 C ATOM 329 O GLY A 24 -1.563 -6.362 -14.969 1.00 52.53 O ATOM 330 H GLY A 24 2.353 -6.673 -15.477 1.00 25.55 H ATOM 331 HA2 GLY A 24 0.346 -6.201 -16.708 1.00 12.33 H ATOM 332 HA3 GLY A 24 0.002 -7.924 -16.731 1.00 2.34 H ATOM 333 N ARG A 25 -0.022 -7.489 -13.776 1.00 15.22 N ATOM 334 CA ARG A 25 -0.770 -7.407 -12.527 1.00 10.45 C ATOM 335 C ARG A 25 -0.339 -6.190 -11.715 1.00 52.41 C ATOM 336 O ARG A 25 0.824 -6.063 -11.335 1.00 73.24 O ATOM 337 CB ARG A 25 -0.568 -8.680 -11.703 1.00 71.43 C ATOM 338 CG ARG A 25 -0.603 -9.954 -12.532 1.00 22.35 C ATOM 339 CD ARG A 25 -1.206 -11.111 -11.751 1.00 4.34 C ATOM 340 NE ARG A 25 -0.758 -12.406 -12.256 1.00 25.31 N ATOM 341 CZ ARG A 25 -1.150 -13.569 -11.748 1.00 43.12 C ATOM 342 NH1 ARG A 25 -1.994 -13.599 -10.726 1.00 62.53 N1+ ATOM 343 NH2 ARG A 25 -0.697 -14.705 -12.263 1.00 50.14 N ATOM 344 H ARG A 25 0.844 -7.949 -13.785 1.00 43.44 H ATOM 345 HA ARG A 25 -1.817 -7.310 -12.773 1.00 53.35 H ATOM 346 HB2 ARG A 25 0.390 -8.626 -11.207 1.00 52.51 H ATOM 347 HB3 ARG A 25 -1.348 -8.739 -10.959 1.00 44.52 H ATOM 348 HG2 ARG A 25 -1.200 -9.781 -13.416 1.00 71.44 H ATOM 349 HG3 ARG A 25 0.405 -10.212 -12.820 1.00 42.22 H ATOM 350 HD2 ARG A 25 -0.915 -11.019 -10.715 1.00 43.41 H ATOM 351 HD3 ARG A 25 -2.283 -11.057 -11.829 1.00 72.52 H ATOM 352 HE ARG A 25 -0.133 -12.407 -13.011 1.00 71.42 H ATOM 353 HH11 ARG A 25 -2.338 -12.744 -10.338 1.00 14.34 H ATOM 354 HH12 ARG A 25 -2.290 -14.476 -10.346 1.00 2.50 H ATOM 355 HH21 ARG A 25 -0.061 -14.686 -13.033 1.00 12.23 H ATOM 356 HH22 ARG A 25 -0.994 -15.580 -11.880 1.00 22.24 H ATOM 357 N GLY A 26 -1.287 -5.294 -11.451 1.00 12.23 N ATOM 358 CA GLY A 26 -0.987 -4.099 -10.687 1.00 3.25 C ATOM 359 C GLY A 26 -1.164 -2.831 -11.499 1.00 24.32 C ATOM 360 O GLY A 26 -1.522 -2.883 -12.676 1.00 11.13 O ATOM 361 H GLY A 26 -2.198 -5.447 -11.781 1.00 43.32 H ATOM 362 HA2 GLY A 26 -1.642 -4.059 -9.829 1.00 32.44 H ATOM 363 HA3 GLY A 26 0.036 -4.152 -10.344 1.00 64.11 H ATOM 364 N LYS A 27 -0.913 -1.687 -10.870 1.00 24.11 N ATOM 365 CA LYS A 27 -1.047 -0.400 -11.541 1.00 32.04 C ATOM 366 C LYS A 27 -0.206 0.666 -10.846 1.00 61.25 C ATOM 367 O LYS A 27 0.052 0.582 -9.644 1.00 41.23 O ATOM 368 CB LYS A 27 -2.514 0.033 -11.572 1.00 32.44 C ATOM 369 CG LYS A 27 -2.927 0.696 -12.875 1.00 22.41 C ATOM 370 CD LYS A 27 -4.363 0.364 -13.240 1.00 55.25 C ATOM 371 CE LYS A 27 -4.449 -0.915 -14.059 1.00 3.41 C ATOM 372 NZ LYS A 27 -4.630 -2.115 -13.196 1.00 54.24 N1+ ATOM 373 H LYS A 27 -0.631 -1.710 -9.932 1.00 41.42 H ATOM 374 HA LYS A 27 -0.694 -0.516 -12.555 1.00 61.03 H ATOM 375 HB2 LYS A 27 -3.137 -0.837 -11.423 1.00 64.22 H ATOM 376 HB3 LYS A 27 -2.687 0.732 -10.766 1.00 21.32 H ATOM 377 HG2 LYS A 27 -2.831 1.767 -12.769 1.00 34.13 H ATOM 378 HG3 LYS A 27 -2.275 0.352 -13.666 1.00 32.04 H ATOM 379 HD2 LYS A 27 -4.935 0.237 -12.333 1.00 4.44 H ATOM 380 HD3 LYS A 27 -4.777 1.180 -13.817 1.00 42.23 H ATOM 381 HE2 LYS A 27 -5.287 -0.838 -14.734 1.00 23.42 H ATOM 382 HE3 LYS A 27 -3.537 -1.024 -14.627 1.00 60.13 H ATOM 383 HZ1 LYS A 27 -3.704 -2.478 -12.891 1.00 33.13 H ATOM 384 HZ2 LYS A 27 -5.127 -2.861 -13.722 1.00 74.00 H ATOM 385 HZ3 LYS A 27 -5.188 -1.869 -12.354 1.00 22.22 H ATOM 386 N CYS A 28 0.218 1.668 -11.608 1.00 33.30 N ATOM 387 CA CYS A 28 1.029 2.751 -11.065 1.00 64.20 C ATOM 388 C CYS A 28 0.199 4.020 -10.896 1.00 13.13 C ATOM 389 O CYS A 28 -0.175 4.666 -11.875 1.00 62.20 O ATOM 390 CB CYS A 28 2.224 3.030 -11.979 1.00 65.11 C ATOM 391 SG CYS A 28 3.436 4.198 -11.283 1.00 14.21 S ATOM 392 H CYS A 28 -0.020 1.680 -12.559 1.00 41.24 H ATOM 393 HA CYS A 28 1.392 2.442 -10.097 1.00 44.02 H ATOM 394 HB2 CYS A 28 2.740 2.101 -12.176 1.00 14.45 H ATOM 395 HB3 CYS A 28 1.867 3.442 -12.911 1.00 4.33 H ATOM 396 N TYR A 29 -0.086 4.372 -9.646 1.00 12.13 N ATOM 397 CA TYR A 29 -0.874 5.562 -9.347 1.00 54.10 C ATOM 398 C TYR A 29 -0.129 6.481 -8.384 1.00 74.01 C ATOM 399 O TYR A 29 -0.014 6.188 -7.194 1.00 21.41 O ATOM 400 CB TYR A 29 -2.227 5.168 -8.753 1.00 42.54 C ATOM 401 CG TYR A 29 -3.168 4.535 -9.753 1.00 45.23 C ATOM 402 CD1 TYR A 29 -3.583 3.217 -9.609 1.00 34.12 C ATOM 403 CD2 TYR A 29 -3.639 5.255 -10.844 1.00 62.43 C ATOM 404 CE1 TYR A 29 -4.442 2.635 -10.521 1.00 13.32 C ATOM 405 CE2 TYR A 29 -4.500 4.681 -11.760 1.00 31.12 C ATOM 406 CZ TYR A 29 -4.898 3.372 -11.595 1.00 13.41 C ATOM 407 OH TYR A 29 -5.754 2.796 -12.506 1.00 30.43 O ATOM 408 H TYR A 29 0.240 3.817 -8.908 1.00 31.15 H ATOM 409 HA TYR A 29 -1.040 6.091 -10.275 1.00 62.24 H ATOM 410 HB2 TYR A 29 -2.069 4.459 -7.955 1.00 4.12 H ATOM 411 HB3 TYR A 29 -2.708 6.049 -8.355 1.00 4.13 H ATOM 412 HD1 TYR A 29 -3.225 2.643 -8.767 1.00 34.10 H ATOM 413 HD2 TYR A 29 -3.326 6.281 -10.971 1.00 55.44 H ATOM 414 HE1 TYR A 29 -4.754 1.609 -10.392 1.00 64.52 H ATOM 415 HE2 TYR A 29 -4.857 5.258 -12.602 1.00 70.25 H ATOM 416 HH TYR A 29 -6.428 3.431 -12.756 1.00 34.11 H ATOM 417 N GLY A 30 0.373 7.595 -8.907 1.00 73.23 N ATOM 418 CA GLY A 30 1.100 8.540 -8.079 1.00 75.55 C ATOM 419 C GLY A 30 2.509 8.077 -7.771 1.00 55.41 C ATOM 420 O GLY A 30 3.090 7.263 -8.489 1.00 44.54 O ATOM 421 H GLY A 30 0.250 7.776 -9.862 1.00 55.31 H ATOM 422 HA2 GLY A 30 1.148 9.489 -8.594 1.00 23.51 H ATOM 423 HA3 GLY A 30 0.566 8.673 -7.150 1.00 4.20 H ATOM 424 N PRO A 31 3.083 8.602 -6.677 1.00 73.33 N ATOM 425 CA PRO A 31 4.441 8.253 -6.251 1.00 43.14 C ATOM 426 C PRO A 31 4.536 6.822 -5.733 1.00 12.34 C ATOM 427 O PRO A 31 5.619 6.241 -5.683 1.00 71.01 O ATOM 428 CB PRO A 31 4.727 9.249 -5.125 1.00 11.54 C ATOM 429 CG PRO A 31 3.384 9.619 -4.597 1.00 21.14 C ATOM 430 CD PRO A 31 2.450 9.577 -5.774 1.00 72.01 C ATOM 431 HA PRO A 31 5.156 8.393 -7.049 1.00 2.41 H ATOM 432 HB2 PRO A 31 5.334 8.775 -4.367 1.00 63.31 H ATOM 433 HB3 PRO A 31 5.245 10.109 -5.523 1.00 63.04 H ATOM 434 HG2 PRO A 31 3.075 8.906 -3.847 1.00 34.33 H ATOM 435 HG3 PRO A 31 3.416 10.615 -4.178 1.00 30.22 H ATOM 436 HD2 PRO A 31 1.471 9.241 -5.468 1.00 4.13 H ATOM 437 HD3 PRO A 31 2.388 10.550 -6.241 1.00 34.24 H ATOM 438 N GLN A 32 3.394 6.260 -5.348 1.00 24.42 N ATOM 439 CA GLN A 32 3.349 4.896 -4.833 1.00 72.22 C ATOM 440 C GLN A 32 2.641 3.967 -5.813 1.00 34.31 C ATOM 441 O GLN A 32 1.736 4.384 -6.538 1.00 54.23 O ATOM 442 CB GLN A 32 2.641 4.863 -3.478 1.00 24.33 C ATOM 443 CG GLN A 32 3.245 5.807 -2.451 1.00 54.33 C ATOM 444 CD GLN A 32 2.540 5.744 -1.111 1.00 11.12 C ATOM 445 OE1 GLN A 32 1.324 5.926 -1.028 1.00 63.11 O ATOM 446 NE2 GLN A 32 3.299 5.481 -0.055 1.00 54.22 N ATOM 447 H GLN A 32 2.563 6.774 -5.412 1.00 31.43 H ATOM 448 HA GLN A 32 4.367 4.557 -4.705 1.00 24.43 H ATOM 449 HB2 GLN A 32 1.605 5.135 -3.620 1.00 14.54 H ATOM 450 HB3 GLN A 32 2.690 3.859 -3.084 1.00 42.10 H ATOM 451 HG2 GLN A 32 4.283 5.545 -2.308 1.00 35.42 H ATOM 452 HG3 GLN A 32 3.180 6.818 -2.828 1.00 4.55 H ATOM 453 HE21 GLN A 32 4.260 5.348 -0.197 1.00 11.44 H ATOM 454 HE22 GLN A 32 2.869 5.435 0.824 1.00 14.22 H ATOM 455 N CYS A 33 3.059 2.706 -5.832 1.00 31.22 N ATOM 456 CA CYS A 33 2.466 1.716 -6.723 1.00 4.23 C ATOM 457 C CYS A 33 1.273 1.033 -6.061 1.00 42.43 C ATOM 458 O CYS A 33 1.410 0.400 -5.013 1.00 3.41 O ATOM 459 CB CYS A 33 3.508 0.671 -7.126 1.00 45.11 C ATOM 460 SG CYS A 33 2.822 -0.757 -8.023 1.00 44.02 S ATOM 461 H CYS A 33 3.784 2.433 -5.231 1.00 11.45 H ATOM 462 HA CYS A 33 2.125 2.230 -7.610 1.00 22.44 H ATOM 463 HB2 CYS A 33 4.246 1.136 -7.764 1.00 21.42 H ATOM 464 HB3 CYS A 33 3.995 0.298 -6.236 1.00 63.41 H ATOM 465 N LEU A 34 0.105 1.164 -6.680 1.00 13.22 N ATOM 466 CA LEU A 34 -1.112 0.559 -6.151 1.00 63.23 C ATOM 467 C LEU A 34 -1.541 -0.634 -7.001 1.00 51.42 C ATOM 468 O LEU A 34 -1.797 -0.498 -8.198 1.00 24.01 O ATOM 469 CB LEU A 34 -2.239 1.593 -6.100 1.00 32.10 C ATOM 470 CG LEU A 34 -1.856 2.975 -5.569 1.00 43.54 C ATOM 471 CD1 LEU A 34 -3.052 3.914 -5.614 1.00 14.04 C ATOM 472 CD2 LEU A 34 -1.311 2.870 -4.153 1.00 70.22 C ATOM 473 H LEU A 34 0.059 1.680 -7.512 1.00 45.35 H ATOM 474 HA LEU A 34 -0.904 0.215 -5.149 1.00 40.11 H ATOM 475 HB2 LEU A 34 -2.620 1.718 -7.102 1.00 35.14 H ATOM 476 HB3 LEU A 34 -3.020 1.199 -5.466 1.00 40.13 H ATOM 477 HG LEU A 34 -1.081 3.393 -6.196 1.00 15.14 H ATOM 478 HD11 LEU A 34 -3.618 3.734 -6.516 1.00 55.34 H ATOM 479 HD12 LEU A 34 -2.707 4.937 -5.603 1.00 25.24 H ATOM 480 HD13 LEU A 34 -3.680 3.737 -4.753 1.00 51.04 H ATOM 481 HD21 LEU A 34 -0.352 3.365 -4.099 1.00 53.03 H ATOM 482 HD22 LEU A 34 -1.194 1.829 -3.888 1.00 13.11 H ATOM 483 HD23 LEU A 34 -1.999 3.342 -3.466 1.00 72.45 H ATOM 484 N CYS A 35 -1.619 -1.802 -6.374 1.00 55.40 N ATOM 485 CA CYS A 35 -2.018 -3.019 -7.070 1.00 1.13 C ATOM 486 C CYS A 35 -3.534 -3.082 -7.231 1.00 11.13 C ATOM 487 O CYS A 35 -4.277 -2.525 -6.423 1.00 45.25 O ATOM 488 CB CYS A 35 -1.523 -4.252 -6.310 1.00 3.52 C ATOM 489 SG CYS A 35 0.247 -4.200 -5.881 1.00 24.35 S ATOM 490 H CYS A 35 -1.403 -1.848 -5.418 1.00 32.23 H ATOM 491 HA CYS A 35 -1.565 -3.005 -8.049 1.00 72.33 H ATOM 492 HB2 CYS A 35 -2.082 -4.345 -5.390 1.00 72.10 H ATOM 493 HB3 CYS A 35 -1.689 -5.130 -6.917 1.00 43.25 H ATOM 494 N ARG A 36 -3.985 -3.764 -8.278 1.00 44.14 N ATOM 495 CA ARG A 36 -5.411 -3.899 -8.546 1.00 13.02 C ATOM 496 C ARG A 36 -6.149 -4.417 -7.314 1.00 4.24 C ATOM 497 O ARG A 36 -5.589 -5.161 -6.510 1.00 54.12 O ATOM 498 CB ARG A 36 -5.644 -4.843 -9.727 1.00 3.14 C ATOM 499 CG ARG A 36 -5.626 -4.146 -11.077 1.00 65.30 C ATOM 500 CD ARG A 36 -6.401 -4.933 -12.122 1.00 44.00 C ATOM 501 NE ARG A 36 -5.585 -5.976 -12.738 1.00 13.52 N ATOM 502 CZ ARG A 36 -6.086 -6.965 -13.469 1.00 42.43 C ATOM 503 NH1 ARG A 36 -7.393 -7.045 -13.675 1.00 55.24 N1+ ATOM 504 NH2 ARG A 36 -5.279 -7.877 -13.996 1.00 4.52 N ATOM 505 H ARG A 36 -3.342 -4.186 -8.887 1.00 31.33 H ATOM 506 HA ARG A 36 -5.796 -2.922 -8.796 1.00 52.22 H ATOM 507 HB2 ARG A 36 -4.871 -5.598 -9.726 1.00 23.53 H ATOM 508 HB3 ARG A 36 -6.604 -5.321 -9.606 1.00 62.10 H ATOM 509 HG2 ARG A 36 -6.074 -3.168 -10.973 1.00 51.50 H ATOM 510 HG3 ARG A 36 -4.601 -4.041 -11.404 1.00 2.40 H ATOM 511 HD2 ARG A 36 -7.255 -5.391 -11.647 1.00 3.43 H ATOM 512 HD3 ARG A 36 -6.738 -4.252 -12.889 1.00 43.42 H ATOM 513 HE ARG A 36 -4.616 -5.936 -12.598 1.00 5.53 H ATOM 514 HH11 ARG A 36 -8.004 -6.359 -13.280 1.00 32.41 H ATOM 515 HH12 ARG A 36 -7.768 -7.790 -14.227 1.00 50.15 H ATOM 516 HH21 ARG A 36 -4.293 -7.820 -13.844 1.00 24.15 H ATOM 517 HH22 ARG A 36 -5.657 -8.621 -14.546 1.00 1.54 H TER 518 ARG A 36