ATOM 39 N CYS A 3 2.834 -1.219 -6.012 1.00 0.40 N ATOM 40 CA CYS A 3 2.035 -1.101 -7.263 1.00 0.27 C ATOM 41 C CYS A 3 1.353 -2.420 -7.611 1.00 0.29 C ATOM 42 O CYS A 3 0.430 -2.453 -8.400 1.00 0.59 O ATOM 43 CB CYS A 3 3.003 -0.743 -8.392 1.00 0.32 C ATOM 44 SG CYS A 3 4.133 0.642 -8.102 1.00 0.20 S ATOM 45 H CYS A 3 3.738 -0.843 -5.972 1.00 0.45 H ATOM 46 HA CYS A 3 1.275 -0.334 -7.142 1.00 0.56 H ATOM 47 HB2 CYS A 3 3.602 -1.614 -8.612 1.00 0.47 H ATOM 48 HB3 CYS A 3 2.423 -0.516 -9.269 1.00 0.64 H ATOM 49 N CYS A 4 1.832 -3.478 -7.025 1.00 0.13 N ATOM 50 CA CYS A 4 1.233 -4.810 -7.301 1.00 0.08 C ATOM 51 C CYS A 4 0.250 -5.202 -6.205 1.00 0.24 C ATOM 52 O CYS A 4 -0.659 -5.972 -6.437 1.00 0.69 O ATOM 53 CB CYS A 4 2.365 -5.839 -7.346 1.00 0.33 C ATOM 54 SG CYS A 4 3.716 -5.518 -8.505 1.00 0.60 S ATOM 55 H CYS A 4 2.590 -3.395 -6.410 1.00 0.35 H ATOM 56 HA CYS A 4 0.701 -4.774 -8.251 1.00 0.22 H ATOM 57 HB2 CYS A 4 2.793 -5.913 -6.357 1.00 0.42 H ATOM 58 HB3 CYS A 4 1.941 -6.800 -7.595 1.00 0.77 H ATOM 59 N THR A 5 0.450 -4.676 -5.028 1.00 0.09 N ATOM 60 CA THR A 5 -0.478 -5.021 -3.923 1.00 0.26 C ATOM 61 C THR A 5 -1.771 -4.205 -4.093 1.00 0.41 C ATOM 62 O THR A 5 -1.716 -3.058 -4.491 1.00 0.46 O ATOM 63 CB THR A 5 0.181 -4.614 -2.594 1.00 0.30 C ATOM 64 OG1 THR A 5 1.572 -4.774 -2.802 1.00 0.34 O ATOM 65 CG2 THR A 5 -0.143 -5.582 -1.442 1.00 0.57 C ATOM 66 H THR A 5 1.204 -4.073 -4.877 1.00 0.42 H ATOM 67 HA THR A 5 -0.677 -6.081 -3.970 1.00 0.41 H ATOM 68 HB THR A 5 -0.052 -3.589 -2.345 1.00 0.23 H ATOM 69 HG1 THR A 5 1.739 -5.703 -2.975 1.00 0.95 H ATOM 70 HG21 THR A 5 -1.098 -5.321 -1.000 1.00 0.66 H ATOM 71 HG22 THR A 5 -0.181 -6.597 -1.803 1.00 0.68 H ATOM 72 HG23 THR A 5 0.621 -5.508 -0.683 1.00 0.62 H ATOM 103 N LYS A 8 -3.519 -2.413 -6.796 1.00 0.71 N ATOM 104 CA LYS A 8 -2.293 -2.429 -7.637 1.00 0.65 C ATOM 105 C LYS A 8 -2.175 -1.090 -8.364 1.00 0.72 C ATOM 106 O LYS A 8 -2.878 -0.839 -9.325 1.00 1.74 O ATOM 107 CB LYS A 8 -2.380 -3.570 -8.666 1.00 0.59 C ATOM 108 CG LYS A 8 -3.143 -4.752 -8.052 1.00 0.77 C ATOM 109 CD LYS A 8 -3.074 -5.969 -8.988 1.00 0.77 C ATOM 110 CE LYS A 8 -2.921 -7.242 -8.151 1.00 0.65 C ATOM 111 NZ LYS A 8 -3.360 -8.435 -8.925 1.00 1.31 N ATOM 112 H LYS A 8 -4.213 -3.094 -6.893 1.00 0.58 H ATOM 113 HA LYS A 8 -1.431 -2.554 -6.989 1.00 0.62 H ATOM 114 HB2 LYS A 8 -2.887 -3.228 -9.549 1.00 0.91 H ATOM 115 HB3 LYS A 8 -1.381 -3.881 -8.932 1.00 0.42 H ATOM 116 HG2 LYS A 8 -2.709 -5.002 -7.095 1.00 0.81 H ATOM 117 HG3 LYS A 8 -4.177 -4.478 -7.909 1.00 1.12 H ATOM 118 HD2 LYS A 8 -3.981 -6.027 -9.571 1.00 0.75 H ATOM 119 HD3 LYS A 8 -2.232 -5.876 -9.659 1.00 0.91 H ATOM 120 HE2 LYS A 8 -1.887 -7.365 -7.867 1.00 0.86 H ATOM 121 HE3 LYS A 8 -3.525 -7.163 -7.258 1.00 1.47 H ATOM 122 HZ1 LYS A 8 -4.396 -8.439 -8.995 1.00 1.66 H ATOM 123 HZ2 LYS A 8 -2.948 -8.401 -9.880 1.00 1.64 H ATOM 124 HZ3 LYS A 8 -3.041 -9.299 -8.440 1.00 1.83 H ATOM 125 N LYS A 9 -1.285 -0.252 -7.897 1.00 0.70 N ATOM 126 CA LYS A 9 -1.120 1.073 -8.552 1.00 0.73 C ATOM 127 C LYS A 9 -0.339 0.976 -9.858 1.00 0.68 C ATOM 128 O LYS A 9 0.688 1.600 -10.009 1.00 1.49 O ATOM 129 CB LYS A 9 -0.367 2.005 -7.591 1.00 0.69 C ATOM 130 CG LYS A 9 -0.838 1.737 -6.158 1.00 2.06 C ATOM 131 CD LYS A 9 -0.542 2.963 -5.292 1.00 2.06 C ATOM 132 CE LYS A 9 -0.930 2.658 -3.844 1.00 3.97 C ATOM 133 NZ LYS A 9 -0.365 3.686 -2.924 1.00 3.89 N ATOM 134 H LYS A 9 -0.730 -0.496 -7.127 1.00 1.48 H ATOM 135 HA LYS A 9 -2.100 1.468 -8.764 1.00 0.85 H ATOM 136 HB2 LYS A 9 0.694 1.827 -7.664 1.00 1.62 H ATOM 137 HB3 LYS A 9 -0.571 3.033 -7.851 1.00 1.63 H ATOM 138 HG2 LYS A 9 -1.899 1.541 -6.158 1.00 1.03 H ATOM 139 HG3 LYS A 9 -0.320 0.878 -5.761 1.00 3.36 H ATOM 140 HD2 LYS A 9 0.510 3.200 -5.344 1.00 1.74 H ATOM 141 HD3 LYS A 9 -1.115 3.806 -5.649 1.00 1.88 H ATOM 142 HE2 LYS A 9 -2.007 2.653 -3.751 1.00 4.72 H ATOM 143 HE3 LYS A 9 -0.549 1.686 -3.564 1.00 5.01 H ATOM 144 HZ1 LYS A 9 -0.803 3.592 -1.985 1.00 3.73 H ATOM 145 HZ2 LYS A 9 0.663 3.548 -2.842 1.00 4.66 H ATOM 146 HZ3 LYS A 9 -0.557 4.635 -3.303 1.00 3.93 H ATOM 147 N CYS A 10 -0.852 0.213 -10.784 1.00 0.64 N ATOM 148 CA CYS A 10 -0.147 0.069 -12.087 1.00 0.64 C ATOM 149 C CYS A 10 -0.648 1.096 -13.102 1.00 0.71 C ATOM 150 O CYS A 10 -1.043 0.753 -14.201 1.00 1.18 O ATOM 151 CB CYS A 10 -0.409 -1.345 -12.616 1.00 0.80 C ATOM 152 SG CYS A 10 0.536 -2.686 -11.853 1.00 0.74 S ATOM 153 H CYS A 10 -1.693 -0.264 -10.622 1.00 1.28 H ATOM 154 HA CYS A 10 0.917 0.226 -11.931 1.00 0.51 H ATOM 155 HB2 CYS A 10 -1.458 -1.567 -12.488 1.00 1.01 H ATOM 156 HB3 CYS A 10 -0.193 -1.357 -13.676 1.00 0.83 H ATOM 157 N LYS A 11 -0.620 2.341 -12.706 1.00 0.51 N ATOM 158 CA LYS A 11 -1.083 3.424 -13.616 1.00 0.52 C ATOM 159 C LYS A 11 -0.108 4.596 -13.565 1.00 0.40 C ATOM 160 O LYS A 11 0.141 5.245 -14.561 1.00 0.40 O ATOM 161 CB LYS A 11 -2.462 3.915 -13.156 1.00 0.60 C ATOM 162 CG LYS A 11 -3.541 3.004 -13.751 1.00 0.69 C ATOM 163 CD LYS A 11 -4.883 3.279 -13.061 1.00 0.58 C ATOM 164 CE LYS A 11 -5.256 4.756 -13.226 1.00 1.75 C ATOM 165 NZ LYS A 11 -4.976 5.217 -14.615 1.00 2.16 N ATOM 166 H LYS A 11 -0.291 2.562 -11.810 1.00 0.69 H ATOM 167 HA LYS A 11 -1.124 3.046 -14.632 1.00 0.60 H ATOM 168 HB2 LYS A 11 -2.519 3.892 -12.079 1.00 0.61 H ATOM 169 HB3 LYS A 11 -2.614 4.928 -13.500 1.00 0.60 H ATOM 170 HG2 LYS A 11 -3.632 3.194 -14.812 1.00 1.05 H ATOM 171 HG3 LYS A 11 -3.263 1.971 -13.601 1.00 0.78 H ATOM 172 HD2 LYS A 11 -5.650 2.664 -13.505 1.00 2.03 H ATOM 173 HD3 LYS A 11 -4.804 3.041 -12.010 1.00 1.62 H ATOM 174 HE2 LYS A 11 -6.307 4.888 -13.018 1.00 2.63 H ATOM 175 HE3 LYS A 11 -4.686 5.355 -12.532 1.00 3.29 H ATOM 176 HZ1 LYS A 11 -5.384 4.542 -15.293 1.00 2.21 H ATOM 177 HZ2 LYS A 11 -5.401 6.155 -14.760 1.00 2.89 H ATOM 178 HZ3 LYS A 11 -3.948 5.275 -14.760 1.00 2.25 H ATOM 179 N ASP A 12 0.425 4.840 -12.400 1.00 0.32 N ATOM 180 CA ASP A 12 1.386 5.962 -12.262 1.00 0.28 C ATOM 181 C ASP A 12 2.714 5.602 -12.922 1.00 0.33 C ATOM 182 O ASP A 12 3.085 4.445 -12.982 1.00 0.99 O ATOM 183 CB ASP A 12 1.624 6.213 -10.766 1.00 0.36 C ATOM 184 CG ASP A 12 0.547 5.491 -9.952 1.00 1.74 C ATOM 185 OD1 ASP A 12 -0.610 5.737 -10.247 1.00 3.16 O ATOM 186 OD2 ASP A 12 0.945 4.736 -9.079 1.00 2.12 O ATOM 187 H ASP A 12 0.196 4.286 -11.624 1.00 0.32 H ATOM 188 HA ASP A 12 0.975 6.842 -12.743 1.00 0.33 H ATOM 189 HB2 ASP A 12 2.597 5.837 -10.483 1.00 0.96 H ATOM 190 HB3 ASP A 12 1.576 7.273 -10.562 1.00 1.58 H ATOM 191 N ALA A 13 3.403 6.596 -13.408 1.00 0.50 N ATOM 192 CA ALA A 13 4.710 6.328 -14.070 1.00 0.42 C ATOM 193 C ALA A 13 5.579 5.412 -13.231 1.00 0.43 C ATOM 194 O ALA A 13 5.879 4.300 -13.608 1.00 0.38 O ATOM 195 CB ALA A 13 5.470 7.648 -14.198 1.00 0.45 C ATOM 196 H ALA A 13 3.061 7.511 -13.341 1.00 1.05 H ATOM 197 HA ALA A 13 4.541 5.880 -15.041 1.00 0.35 H ATOM 198 HB1 ALA A 13 5.172 8.163 -15.099 1.00 0.93 H ATOM 199 HB2 ALA A 13 5.260 8.271 -13.340 1.00 0.24 H ATOM 200 HB3 ALA A 13 6.534 7.443 -14.231 1.00 0.72 H ATOM 201 N GLN A 14 5.973 5.920 -12.106 1.00 0.51 N ATOM 202 CA GLN A 14 6.833 5.135 -11.193 1.00 0.56 C ATOM 203 C GLN A 14 6.378 3.681 -11.035 1.00 0.42 C ATOM 204 O GLN A 14 7.151 2.844 -10.612 1.00 0.46 O ATOM 205 CB GLN A 14 6.784 5.803 -9.816 1.00 0.78 C ATOM 206 CG GLN A 14 8.151 6.406 -9.496 1.00 0.75 C ATOM 207 CD GLN A 14 8.070 7.154 -8.165 1.00 0.98 C ATOM 208 OE1 GLN A 14 8.614 6.727 -7.164 1.00 1.54 O ATOM 209 NE2 GLN A 14 7.398 8.270 -8.109 1.00 1.27 N ATOM 210 H GLN A 14 5.700 6.830 -11.859 1.00 0.57 H ATOM 211 HA GLN A 14 7.841 5.152 -11.590 1.00 0.63 H ATOM 212 HB2 GLN A 14 6.036 6.583 -9.819 1.00 1.46 H ATOM 213 HB3 GLN A 14 6.527 5.070 -9.068 1.00 1.74 H ATOM 214 HG2 GLN A 14 8.889 5.622 -9.423 1.00 2.08 H ATOM 215 HG3 GLN A 14 8.437 7.095 -10.277 1.00 1.53 H ATOM 216 HE21 GLN A 14 6.957 8.617 -8.913 1.00 1.11 H ATOM 217 HE22 GLN A 14 7.335 8.763 -7.264 1.00 1.87 H ATOM 218 N CYS A 15 5.145 3.398 -11.378 1.00 0.38 N ATOM 219 CA CYS A 15 4.651 1.994 -11.238 1.00 0.21 C ATOM 220 C CYS A 15 4.538 1.255 -12.569 1.00 0.17 C ATOM 221 O CYS A 15 4.340 0.061 -12.586 1.00 0.17 O ATOM 222 CB CYS A 15 3.256 2.048 -10.622 1.00 0.12 C ATOM 223 SG CYS A 15 3.145 2.245 -8.828 1.00 0.11 S ATOM 224 H CYS A 15 4.554 4.100 -11.719 1.00 0.53 H ATOM 225 HA CYS A 15 5.322 1.438 -10.590 1.00 0.24 H ATOM 226 HB2 CYS A 15 2.713 2.862 -11.077 1.00 0.26 H ATOM 227 HB3 CYS A 15 2.754 1.133 -10.884 1.00 0.12 H ATOM 228 N LYS A 16 4.646 1.955 -13.656 1.00 0.27 N ATOM 229 CA LYS A 16 4.538 1.253 -14.960 1.00 0.21 C ATOM 230 C LYS A 16 5.662 0.224 -15.170 1.00 0.22 C ATOM 231 O LYS A 16 5.401 -0.875 -15.618 1.00 0.21 O ATOM 232 CB LYS A 16 4.548 2.295 -16.092 1.00 0.20 C ATOM 233 CG LYS A 16 3.182 2.302 -16.787 1.00 0.26 C ATOM 234 CD LYS A 16 3.081 3.531 -17.691 1.00 0.43 C ATOM 235 CE LYS A 16 2.282 4.614 -16.964 1.00 0.78 C ATOM 236 NZ LYS A 16 2.310 5.889 -17.734 1.00 1.17 N ATOM 237 H LYS A 16 4.786 2.921 -13.617 1.00 0.40 H ATOM 238 HA LYS A 16 3.601 0.708 -14.956 1.00 0.19 H ATOM 239 HB2 LYS A 16 4.743 3.276 -15.682 1.00 0.16 H ATOM 240 HB3 LYS A 16 5.318 2.051 -16.808 1.00 0.22 H ATOM 241 HG2 LYS A 16 3.071 1.406 -17.380 1.00 0.29 H ATOM 242 HG3 LYS A 16 2.396 2.337 -16.045 1.00 0.22 H ATOM 243 HD2 LYS A 16 4.071 3.900 -17.916 1.00 0.24 H ATOM 244 HD3 LYS A 16 2.580 3.268 -18.610 1.00 0.86 H ATOM 245 HE2 LYS A 16 1.257 4.293 -16.851 1.00 1.01 H ATOM 246 HE3 LYS A 16 2.706 4.783 -15.985 1.00 0.80 H ATOM 247 HZ1 LYS A 16 2.541 6.676 -17.095 1.00 1.64 H ATOM 248 HZ2 LYS A 16 3.030 5.827 -18.482 1.00 1.75 H ATOM 249 HZ3 LYS A 16 1.377 6.053 -18.163 1.00 0.61 H ATOM 265 N GLN A 18 6.951 -2.277 -14.056 1.00 0.12 N ATOM 266 CA GLN A 18 6.781 -3.370 -13.074 1.00 0.15 C ATOM 267 C GLN A 18 6.309 -4.642 -13.768 1.00 0.12 C ATOM 268 O GLN A 18 5.441 -4.611 -14.615 1.00 0.56 O ATOM 269 CB GLN A 18 5.690 -2.949 -12.084 1.00 0.41 C ATOM 270 CG GLN A 18 6.306 -2.603 -10.726 1.00 0.62 C ATOM 271 CD GLN A 18 7.403 -1.555 -10.905 1.00 0.71 C ATOM 272 OE1 GLN A 18 7.149 -0.435 -11.306 1.00 0.80 O ATOM 273 NE2 GLN A 18 8.637 -1.873 -10.621 1.00 0.72 N ATOM 274 H GLN A 18 6.325 -2.198 -14.795 1.00 0.12 H ATOM 275 HA GLN A 18 7.724 -3.559 -12.570 1.00 0.27 H ATOM 276 HB2 GLN A 18 5.169 -2.091 -12.472 1.00 0.55 H ATOM 277 HB3 GLN A 18 4.986 -3.760 -11.964 1.00 0.42 H ATOM 278 HG2 GLN A 18 5.541 -2.201 -10.076 1.00 0.80 H ATOM 279 HG3 GLN A 18 6.726 -3.490 -10.277 1.00 0.59 H ATOM 280 HE21 GLN A 18 8.848 -2.773 -10.297 1.00 0.65 H ATOM 281 HE22 GLN A 18 9.352 -1.213 -10.736 1.00 0.80 H ATOM 282 N ARG A 19 6.899 -5.729 -13.395 1.00 0.27 N ATOM 283 CA ARG A 19 6.511 -7.030 -14.006 1.00 0.33 C ATOM 284 C ARG A 19 5.009 -7.269 -13.844 1.00 0.30 C ATOM 285 O ARG A 19 4.386 -7.905 -14.672 1.00 0.38 O ATOM 286 CB ARG A 19 7.269 -8.144 -13.271 1.00 0.47 C ATOM 287 CG ARG A 19 6.969 -9.494 -13.932 1.00 2.45 C ATOM 288 CD ARG A 19 7.749 -10.595 -13.210 1.00 2.24 C ATOM 289 NE ARG A 19 7.111 -10.858 -11.887 1.00 2.65 N ATOM 290 CZ ARG A 19 7.267 -12.024 -11.317 1.00 2.85 C ATOM 291 NH1 ARG A 19 6.707 -13.071 -11.860 1.00 3.21 N ATOM 292 NH2 ARG A 19 7.979 -12.103 -10.225 1.00 2.70 N ATOM 293 H ARG A 19 7.605 -5.686 -12.726 1.00 0.58 H ATOM 294 HA ARG A 19 6.759 -7.016 -15.062 1.00 0.45 H ATOM 295 HB2 ARG A 19 8.331 -7.949 -13.314 1.00 2.24 H ATOM 296 HB3 ARG A 19 6.957 -8.171 -12.237 1.00 2.35 H ATOM 297 HG2 ARG A 19 5.911 -9.703 -13.873 1.00 3.94 H ATOM 298 HG3 ARG A 19 7.265 -9.463 -14.971 1.00 3.92 H ATOM 299 HD2 ARG A 19 7.736 -11.501 -13.799 1.00 4.20 H ATOM 300 HD3 ARG A 19 8.771 -10.282 -13.059 1.00 2.01 H ATOM 301 HE ARG A 19 6.579 -10.162 -11.450 1.00 3.87 H ATOM 302 HH11 ARG A 19 6.169 -12.973 -12.695 1.00 3.31 H ATOM 303 HH12 ARG A 19 6.822 -13.974 -11.443 1.00 3.38 H ATOM 304 HH21 ARG A 19 8.395 -11.280 -9.840 1.00 2.43 H ATOM 305 HH22 ARG A 19 8.104 -12.985 -9.773 1.00 2.89 H ATOM 306 N CYS A 20 4.456 -6.747 -12.781 1.00 0.36 N ATOM 307 CA CYS A 20 2.999 -6.935 -12.543 1.00 0.49 C ATOM 308 C CYS A 20 2.162 -5.848 -13.223 1.00 0.53 C ATOM 309 O CYS A 20 0.951 -5.857 -13.116 1.00 1.10 O ATOM 310 CB CYS A 20 2.755 -6.861 -11.032 1.00 0.63 C ATOM 311 SG CYS A 20 2.777 -5.222 -10.269 1.00 0.78 S ATOM 312 H CYS A 20 4.999 -6.239 -12.142 1.00 0.41 H ATOM 313 HA CYS A 20 2.701 -7.903 -12.932 1.00 0.54 H ATOM 314 HB2 CYS A 20 1.795 -7.309 -10.824 1.00 0.81 H ATOM 315 HB3 CYS A 20 3.508 -7.461 -10.541 1.00 0.53 H ATOM 316 N CYS A 21 2.815 -4.937 -13.905 1.00 0.38 N ATOM 317 CA CYS A 21 2.062 -3.846 -14.594 1.00 0.41 C ATOM 318 C CYS A 21 2.272 -3.901 -16.102 1.00 0.39 C ATOM 319 O CYS A 21 1.331 -4.061 -16.855 1.00 0.45 O ATOM 320 CB CYS A 21 2.560 -2.492 -14.070 1.00 0.40 C ATOM 321 SG CYS A 21 2.455 -2.225 -12.286 1.00 0.46 S ATOM 322 H CYS A 21 3.792 -4.975 -13.965 1.00 0.77 H ATOM 323 HA CYS A 21 1.002 -3.962 -14.392 1.00 0.44 H ATOM 324 HB2 CYS A 21 3.591 -2.358 -14.369 1.00 0.31 H ATOM 325 HB3 CYS A 21 1.982 -1.714 -14.549 1.00 0.48 H ATOM 326 N ALA A 22 3.500 -3.769 -16.519 1.00 0.34 N ATOM 327 CA ALA A 22 3.776 -3.812 -17.978 1.00 0.36 C ATOM 328 C ALA A 22 3.684 -5.240 -18.510 1.00 0.35 C ATOM 329 O ALA A 22 4.276 -5.588 -19.514 1.00 1.63 O ATOM 330 CB ALA A 22 5.195 -3.285 -18.217 1.00 0.45 C ATOM 331 H ALA A 22 4.230 -3.643 -15.879 1.00 0.33 H ATOM 332 HA ALA A 22 3.044 -3.197 -18.491 1.00 0.43 H ATOM 333 HB1 ALA A 22 5.905 -4.094 -18.123 1.00 0.57 H ATOM 334 HB2 ALA A 22 5.263 -2.864 -19.209 1.00 0.41 H ATOM 335 HB3 ALA A 22 5.428 -2.521 -17.490 1.00 0.60 H