ATOM 39 N CYS A 3 2.254 -0.841 -6.120 1.00 0.31 N ATOM 40 CA CYS A 3 2.007 -0.966 -7.584 1.00 0.12 C ATOM 41 C CYS A 3 1.548 -2.375 -7.955 1.00 0.11 C ATOM 42 O CYS A 3 0.924 -2.564 -8.980 1.00 0.19 O ATOM 43 CB CYS A 3 3.315 -0.673 -8.329 1.00 0.16 C ATOM 44 SG CYS A 3 4.147 0.895 -7.972 1.00 0.33 S ATOM 45 H CYS A 3 3.107 -1.132 -5.735 1.00 0.38 H ATOM 46 HA CYS A 3 1.233 -0.264 -7.875 1.00 0.22 H ATOM 47 HB2 CYS A 3 4.011 -1.469 -8.113 1.00 0.29 H ATOM 48 HB3 CYS A 3 3.110 -0.697 -9.389 1.00 0.16 H ATOM 49 N CYS A 4 1.869 -3.333 -7.119 1.00 0.13 N ATOM 50 CA CYS A 4 1.457 -4.736 -7.415 1.00 0.27 C ATOM 51 C CYS A 4 0.756 -5.378 -6.222 1.00 0.33 C ATOM 52 O CYS A 4 0.278 -6.492 -6.315 1.00 0.44 O ATOM 53 CB CYS A 4 2.713 -5.550 -7.738 1.00 0.37 C ATOM 54 SG CYS A 4 3.673 -5.046 -9.186 1.00 0.81 S ATOM 55 H CYS A 4 2.380 -3.129 -6.308 1.00 0.11 H ATOM 56 HA CYS A 4 0.771 -4.738 -8.256 1.00 0.27 H ATOM 57 HB2 CYS A 4 3.368 -5.514 -6.881 1.00 0.93 H ATOM 58 HB3 CYS A 4 2.419 -6.580 -7.882 1.00 0.57 H ATOM 59 N THR A 5 0.720 -4.676 -5.120 1.00 0.27 N ATOM 60 CA THR A 5 0.050 -5.246 -3.921 1.00 0.34 C ATOM 61 C THR A 5 -1.351 -4.626 -3.796 1.00 0.34 C ATOM 62 O THR A 5 -1.521 -3.456 -4.073 1.00 0.33 O ATOM 63 CB THR A 5 0.854 -4.847 -2.673 1.00 0.44 C ATOM 64 OG1 THR A 5 2.189 -4.699 -3.116 1.00 0.42 O ATOM 65 CG2 THR A 5 0.921 -5.971 -1.618 1.00 0.59 C ATOM 66 H THR A 5 1.125 -3.784 -5.086 1.00 0.19 H ATOM 67 HA THR A 5 -0.008 -6.314 -4.041 1.00 0.33 H ATOM 68 HB THR A 5 0.485 -3.920 -2.259 1.00 0.43 H ATOM 69 HG1 THR A 5 2.702 -4.340 -2.389 1.00 0.99 H ATOM 70 HG21 THR A 5 0.055 -5.918 -0.969 1.00 0.65 H ATOM 71 HG22 THR A 5 0.954 -6.937 -2.094 1.00 0.57 H ATOM 72 HG23 THR A 5 1.810 -5.844 -1.018 1.00 0.69 H ATOM 103 N LYS A 8 -3.500 -2.813 -6.131 1.00 0.25 N ATOM 104 CA LYS A 8 -2.375 -2.689 -7.100 1.00 0.19 C ATOM 105 C LYS A 8 -2.522 -1.398 -7.901 1.00 0.28 C ATOM 106 O LYS A 8 -3.619 -0.904 -8.076 1.00 0.57 O ATOM 107 CB LYS A 8 -2.402 -3.866 -8.082 1.00 0.25 C ATOM 108 CG LYS A 8 -2.783 -5.151 -7.350 1.00 0.16 C ATOM 109 CD LYS A 8 -2.236 -6.342 -8.142 1.00 0.49 C ATOM 110 CE LYS A 8 -2.752 -6.268 -9.580 1.00 2.23 C ATOM 111 NZ LYS A 8 -2.612 -7.586 -10.257 1.00 2.85 N ATOM 112 H LYS A 8 -4.231 -3.450 -6.282 1.00 0.26 H ATOM 113 HA LYS A 8 -1.439 -2.660 -6.550 1.00 0.23 H ATOM 114 HB2 LYS A 8 -3.115 -3.669 -8.864 1.00 0.31 H ATOM 115 HB3 LYS A 8 -1.425 -3.982 -8.526 1.00 0.38 H ATOM 116 HG2 LYS A 8 -2.358 -5.146 -6.357 1.00 0.38 H ATOM 117 HG3 LYS A 8 -3.857 -5.225 -7.280 1.00 0.31 H ATOM 118 HD2 LYS A 8 -1.157 -6.312 -8.145 1.00 2.44 H ATOM 119 HD3 LYS A 8 -2.562 -7.265 -7.684 1.00 2.05 H ATOM 120 HE2 LYS A 8 -3.794 -5.980 -9.575 1.00 3.23 H ATOM 121 HE3 LYS A 8 -2.186 -5.528 -10.128 1.00 3.88 H ATOM 122 HZ1 LYS A 8 -3.557 -7.969 -10.467 1.00 3.00 H ATOM 123 HZ2 LYS A 8 -2.083 -7.467 -11.144 1.00 3.38 H ATOM 124 HZ3 LYS A 8 -2.103 -8.245 -9.634 1.00 3.31 H ATOM 125 N LYS A 9 -1.422 -0.875 -8.376 1.00 0.14 N ATOM 126 CA LYS A 9 -1.497 0.381 -9.165 1.00 0.36 C ATOM 127 C LYS A 9 -0.487 0.374 -10.304 1.00 0.23 C ATOM 128 O LYS A 9 0.698 0.250 -10.088 1.00 0.22 O ATOM 129 CB LYS A 9 -1.210 1.578 -8.247 1.00 0.67 C ATOM 130 CG LYS A 9 -0.989 2.821 -9.114 1.00 1.38 C ATOM 131 CD LYS A 9 -1.442 4.063 -8.345 1.00 1.45 C ATOM 132 CE LYS A 9 -0.634 4.176 -7.050 1.00 2.20 C ATOM 133 NZ LYS A 9 -0.563 5.597 -6.606 1.00 2.69 N ATOM 134 H LYS A 9 -0.560 -1.307 -8.225 1.00 0.15 H ATOM 135 HA LYS A 9 -2.486 0.460 -9.589 1.00 0.54 H ATOM 136 HB2 LYS A 9 -2.051 1.740 -7.588 1.00 1.80 H ATOM 137 HB3 LYS A 9 -0.330 1.389 -7.655 1.00 1.02 H ATOM 138 HG2 LYS A 9 0.059 2.910 -9.359 1.00 3.12 H ATOM 139 HG3 LYS A 9 -1.560 2.734 -10.028 1.00 2.10 H ATOM 140 HD2 LYS A 9 -1.283 4.942 -8.950 1.00 3.33 H ATOM 141 HD3 LYS A 9 -2.493 3.980 -8.110 1.00 2.07 H ATOM 142 HE2 LYS A 9 -1.104 3.588 -6.276 1.00 2.79 H ATOM 143 HE3 LYS A 9 0.367 3.807 -7.214 1.00 3.94 H ATOM 144 HZ1 LYS A 9 -1.451 6.083 -6.851 1.00 2.03 H ATOM 145 HZ2 LYS A 9 -0.423 5.632 -5.577 1.00 3.32 H ATOM 146 HZ3 LYS A 9 0.232 6.070 -7.081 1.00 4.05 H ATOM 147 N CYS A 10 -0.993 0.495 -11.501 1.00 0.23 N ATOM 148 CA CYS A 10 -0.103 0.503 -12.696 1.00 0.14 C ATOM 149 C CYS A 10 -0.486 1.645 -13.634 1.00 0.14 C ATOM 150 O CYS A 10 -0.432 1.507 -14.841 1.00 0.19 O ATOM 151 CB CYS A 10 -0.288 -0.824 -13.442 1.00 0.21 C ATOM 152 SG CYS A 10 0.382 -2.319 -12.674 1.00 0.22 S ATOM 153 H CYS A 10 -1.962 0.567 -11.610 1.00 0.33 H ATOM 154 HA CYS A 10 0.926 0.633 -12.379 1.00 0.12 H ATOM 155 HB2 CYS A 10 -1.347 -0.981 -13.589 1.00 0.29 H ATOM 156 HB3 CYS A 10 0.161 -0.727 -14.417 1.00 0.23 H ATOM 157 N LYS A 11 -0.865 2.753 -13.052 1.00 0.11 N ATOM 158 CA LYS A 11 -1.264 3.932 -13.873 1.00 0.11 C ATOM 159 C LYS A 11 -0.284 5.087 -13.697 1.00 0.22 C ATOM 160 O LYS A 11 -0.443 6.129 -14.303 1.00 0.90 O ATOM 161 CB LYS A 11 -2.645 4.391 -13.396 1.00 0.24 C ATOM 162 CG LYS A 11 -3.513 3.161 -13.122 1.00 0.81 C ATOM 163 CD LYS A 11 -4.985 3.578 -13.110 1.00 0.52 C ATOM 164 CE LYS A 11 -5.534 3.538 -14.537 1.00 1.44 C ATOM 165 NZ LYS A 11 -6.582 4.581 -14.721 1.00 0.92 N ATOM 166 H LYS A 11 -0.886 2.811 -12.074 1.00 0.12 H ATOM 167 HA LYS A 11 -1.293 3.650 -14.921 1.00 0.14 H ATOM 168 HB2 LYS A 11 -2.541 4.967 -12.489 1.00 0.59 H ATOM 169 HB3 LYS A 11 -3.109 5.003 -14.154 1.00 0.93 H ATOM 170 HG2 LYS A 11 -3.349 2.420 -13.892 1.00 2.00 H ATOM 171 HG3 LYS A 11 -3.249 2.738 -12.165 1.00 1.77 H ATOM 172 HD2 LYS A 11 -5.549 2.904 -12.485 1.00 1.23 H ATOM 173 HD3 LYS A 11 -5.072 4.581 -12.716 1.00 0.54 H ATOM 174 HE2 LYS A 11 -4.736 3.718 -15.242 1.00 2.09 H ATOM 175 HE3 LYS A 11 -5.966 2.567 -14.733 1.00 2.37 H ATOM 176 HZ1 LYS A 11 -6.567 4.917 -15.706 1.00 1.63 H ATOM 177 HZ2 LYS A 11 -7.516 4.176 -14.507 1.00 1.55 H ATOM 178 HZ3 LYS A 11 -6.396 5.378 -14.080 1.00 0.44 H ATOM 179 N ASP A 12 0.706 4.879 -12.870 1.00 0.44 N ATOM 180 CA ASP A 12 1.710 5.953 -12.637 1.00 0.31 C ATOM 181 C ASP A 12 3.049 5.589 -13.267 1.00 0.28 C ATOM 182 O ASP A 12 3.228 4.494 -13.763 1.00 0.49 O ATOM 183 CB ASP A 12 1.915 6.114 -11.128 1.00 0.21 C ATOM 184 CG ASP A 12 2.692 7.406 -10.867 1.00 1.84 C ATOM 185 OD1 ASP A 12 2.027 8.421 -10.736 1.00 0.91 O ATOM 186 OD2 ASP A 12 3.906 7.305 -10.818 1.00 4.05 O ATOM 187 H ASP A 12 0.787 4.019 -12.408 1.00 0.99 H ATOM 188 HA ASP A 12 1.356 6.879 -13.077 1.00 0.38 H ATOM 189 HB2 ASP A 12 0.958 6.163 -10.630 1.00 1.33 H ATOM 190 HB3 ASP A 12 2.477 5.276 -10.743 1.00 1.37 H ATOM 191 N ALA A 13 3.964 6.516 -13.230 1.00 0.18 N ATOM 192 CA ALA A 13 5.302 6.252 -13.820 1.00 0.25 C ATOM 193 C ALA A 13 6.113 5.307 -12.948 1.00 0.25 C ATOM 194 O ALA A 13 6.587 4.288 -13.398 1.00 0.43 O ATOM 195 CB ALA A 13 6.073 7.571 -13.878 1.00 0.28 C ATOM 196 H ALA A 13 3.771 7.384 -12.816 1.00 0.25 H ATOM 197 HA ALA A 13 5.188 5.824 -14.809 1.00 0.38 H ATOM 198 HB1 ALA A 13 6.346 7.794 -14.899 1.00 0.41 H ATOM 199 HB2 ALA A 13 5.461 8.369 -13.489 1.00 0.15 H ATOM 200 HB3 ALA A 13 6.973 7.482 -13.277 1.00 0.35 H ATOM 201 N GLN A 14 6.258 5.679 -11.712 1.00 0.27 N ATOM 202 CA GLN A 14 7.033 4.831 -10.780 1.00 0.43 C ATOM 203 C GLN A 14 6.444 3.423 -10.645 1.00 0.34 C ATOM 204 O GLN A 14 7.049 2.562 -10.036 1.00 0.32 O ATOM 205 CB GLN A 14 7.016 5.501 -9.401 1.00 0.60 C ATOM 206 CG GLN A 14 7.752 6.840 -9.486 1.00 0.53 C ATOM 207 CD GLN A 14 9.250 6.601 -9.300 1.00 1.00 C ATOM 208 OE1 GLN A 14 9.824 5.704 -9.886 1.00 1.79 O ATOM 209 NE2 GLN A 14 9.921 7.381 -8.497 1.00 1.76 N ATOM 210 H GLN A 14 5.855 6.514 -11.396 1.00 0.33 H ATOM 211 HA GLN A 14 8.045 4.760 -11.156 1.00 0.55 H ATOM 212 HB2 GLN A 14 5.995 5.666 -9.090 1.00 0.64 H ATOM 213 HB3 GLN A 14 7.507 4.863 -8.679 1.00 0.94 H ATOM 214 HG2 GLN A 14 7.577 7.293 -10.450 1.00 1.02 H ATOM 215 HG3 GLN A 14 7.397 7.502 -8.709 1.00 1.41 H ATOM 216 HE21 GLN A 14 9.464 8.106 -8.022 1.00 2.00 H ATOM 217 HE22 GLN A 14 10.883 7.242 -8.367 1.00 2.47 H ATOM 218 N CYS A 15 5.283 3.214 -11.217 1.00 0.27 N ATOM 219 CA CYS A 15 4.644 1.864 -11.125 1.00 0.18 C ATOM 220 C CYS A 15 4.572 1.156 -12.477 1.00 0.14 C ATOM 221 O CYS A 15 4.203 0.005 -12.546 1.00 0.11 O ATOM 222 CB CYS A 15 3.215 2.056 -10.618 1.00 0.16 C ATOM 223 SG CYS A 15 2.978 2.297 -8.839 1.00 0.28 S ATOM 224 H CYS A 15 4.834 3.939 -11.700 1.00 0.28 H ATOM 225 HA CYS A 15 5.209 1.239 -10.437 1.00 0.23 H ATOM 226 HB2 CYS A 15 2.793 2.912 -11.122 1.00 0.17 H ATOM 227 HB3 CYS A 15 2.643 1.192 -10.910 1.00 0.11 H ATOM 228 N LYS A 16 4.902 1.844 -13.534 1.00 0.16 N ATOM 229 CA LYS A 16 4.838 1.174 -14.859 1.00 0.20 C ATOM 230 C LYS A 16 5.908 0.079 -14.999 1.00 0.28 C ATOM 231 O LYS A 16 5.617 -0.992 -15.490 1.00 0.26 O ATOM 232 CB LYS A 16 5.005 2.228 -15.967 1.00 0.32 C ATOM 233 CG LYS A 16 3.740 2.261 -16.839 1.00 0.36 C ATOM 234 CD LYS A 16 3.733 3.535 -17.685 1.00 0.49 C ATOM 235 CE LYS A 16 2.660 4.482 -17.137 1.00 0.74 C ATOM 236 NZ LYS A 16 2.696 5.788 -17.851 1.00 1.17 N ATOM 237 H LYS A 16 5.182 2.780 -13.457 1.00 0.18 H ATOM 238 HA LYS A 16 3.875 0.693 -14.935 1.00 0.17 H ATOM 239 HB2 LYS A 16 5.160 3.197 -15.519 1.00 0.33 H ATOM 240 HB3 LYS A 16 5.859 1.980 -16.577 1.00 0.39 H ATOM 241 HG2 LYS A 16 3.722 1.394 -17.486 1.00 0.49 H ATOM 242 HG3 LYS A 16 2.859 2.251 -16.213 1.00 0.29 H ATOM 243 HD2 LYS A 16 4.700 4.012 -17.636 1.00 0.48 H ATOM 244 HD3 LYS A 16 3.510 3.288 -18.713 1.00 0.51 H ATOM 245 HE2 LYS A 16 1.683 4.035 -17.264 1.00 0.68 H ATOM 246 HE3 LYS A 16 2.832 4.652 -16.085 1.00 0.78 H ATOM 247 HZ1 LYS A 16 3.588 5.870 -18.380 1.00 0.79 H ATOM 248 HZ2 LYS A 16 1.895 5.846 -18.513 1.00 1.54 H ATOM 249 HZ3 LYS A 16 2.630 6.563 -17.160 1.00 2.25 H ATOM 265 N GLN A 18 6.929 -2.437 -13.755 1.00 0.35 N ATOM 266 CA GLN A 18 6.616 -3.523 -12.799 1.00 0.42 C ATOM 267 C GLN A 18 5.983 -4.694 -13.538 1.00 0.30 C ATOM 268 O GLN A 18 4.974 -4.536 -14.187 1.00 0.16 O ATOM 269 CB GLN A 18 5.594 -2.979 -11.793 1.00 0.49 C ATOM 270 CG GLN A 18 6.223 -2.873 -10.405 1.00 0.76 C ATOM 271 CD GLN A 18 7.488 -2.015 -10.469 1.00 0.82 C ATOM 272 OE1 GLN A 18 8.596 -2.516 -10.438 1.00 2.24 O ATOM 273 NE2 GLN A 18 7.369 -0.718 -10.557 1.00 2.40 N ATOM 274 H GLN A 18 6.325 -2.263 -14.499 1.00 0.22 H ATOM 275 HA GLN A 18 7.524 -3.852 -12.306 1.00 0.58 H ATOM 276 HB2 GLN A 18 5.265 -2.005 -12.113 1.00 0.37 H ATOM 277 HB3 GLN A 18 4.741 -3.641 -11.753 1.00 0.54 H ATOM 278 HG2 GLN A 18 5.521 -2.410 -9.725 1.00 0.82 H ATOM 279 HG3 GLN A 18 6.475 -3.859 -10.043 1.00 0.90 H ATOM 280 HE21 GLN A 18 6.479 -0.310 -10.583 1.00 4.03 H ATOM 281 HE22 GLN A 18 8.169 -0.154 -10.590 1.00 2.37 H ATOM 282 N ARG A 19 6.599 -5.835 -13.435 1.00 0.40 N ATOM 283 CA ARG A 19 6.054 -7.038 -14.126 1.00 0.30 C ATOM 284 C ARG A 19 4.527 -7.082 -14.056 1.00 0.33 C ATOM 285 O ARG A 19 3.881 -7.617 -14.936 1.00 0.39 O ATOM 286 CB ARG A 19 6.605 -8.285 -13.431 1.00 0.50 C ATOM 287 CG ARG A 19 8.131 -8.282 -13.532 1.00 1.16 C ATOM 288 CD ARG A 19 8.690 -9.384 -12.631 1.00 0.91 C ATOM 289 NE ARG A 19 10.179 -9.342 -12.686 1.00 0.94 N ATOM 290 CZ ARG A 19 10.841 -8.798 -11.699 1.00 2.66 C ATOM 291 NH1 ARG A 19 10.756 -9.335 -10.514 1.00 4.16 N ATOM 292 NH2 ARG A 19 11.566 -7.739 -11.936 1.00 3.84 N ATOM 293 H ARG A 19 7.426 -5.897 -12.917 1.00 0.54 H ATOM 294 HA ARG A 19 6.357 -7.013 -15.167 1.00 0.20 H ATOM 295 HB2 ARG A 19 6.312 -8.281 -12.392 1.00 1.09 H ATOM 296 HB3 ARG A 19 6.211 -9.171 -13.907 1.00 1.59 H ATOM 297 HG2 ARG A 19 8.428 -8.461 -14.554 1.00 2.12 H ATOM 298 HG3 ARG A 19 8.513 -7.324 -13.215 1.00 1.80 H ATOM 299 HD2 ARG A 19 8.364 -9.227 -11.613 1.00 1.10 H ATOM 300 HD3 ARG A 19 8.345 -10.350 -12.972 1.00 1.77 H ATOM 301 HE ARG A 19 10.657 -9.719 -13.454 1.00 1.06 H ATOM 302 HH11 ARG A 19 10.190 -10.147 -10.372 1.00 4.39 H ATOM 303 HH12 ARG A 19 11.256 -8.934 -9.746 1.00 5.57 H ATOM 304 HH21 ARG A 19 11.607 -7.357 -12.859 1.00 3.98 H ATOM 305 HH22 ARG A 19 12.081 -7.311 -11.192 1.00 5.21 H ATOM 306 N CYS A 20 3.977 -6.526 -13.012 1.00 0.49 N ATOM 307 CA CYS A 20 2.495 -6.533 -12.883 1.00 0.65 C ATOM 308 C CYS A 20 1.886 -5.342 -13.621 1.00 0.58 C ATOM 309 O CYS A 20 0.788 -4.917 -13.324 1.00 0.79 O ATOM 310 CB CYS A 20 2.141 -6.425 -11.396 1.00 0.90 C ATOM 311 SG CYS A 20 2.283 -4.792 -10.629 1.00 1.03 S ATOM 312 H CYS A 20 4.534 -6.106 -12.321 1.00 0.58 H ATOM 313 HA CYS A 20 2.107 -7.452 -13.310 1.00 0.72 H ATOM 314 HB2 CYS A 20 1.125 -6.763 -11.264 1.00 1.03 H ATOM 315 HB3 CYS A 20 2.785 -7.099 -10.848 1.00 0.90 H ATOM 316 N CYS A 21 2.612 -4.836 -14.580 1.00 0.33 N ATOM 317 CA CYS A 21 2.105 -3.675 -15.355 1.00 0.39 C ATOM 318 C CYS A 21 2.586 -3.741 -16.807 1.00 0.45 C ATOM 319 O CYS A 21 1.836 -4.094 -17.692 1.00 0.63 O ATOM 320 CB CYS A 21 2.636 -2.383 -14.708 1.00 0.27 C ATOM 321 SG CYS A 21 2.379 -2.166 -12.929 1.00 0.24 S ATOM 322 H CYS A 21 3.481 -5.231 -14.798 1.00 0.18 H ATOM 323 HA CYS A 21 1.019 -3.694 -15.346 1.00 0.56 H ATOM 324 HB2 CYS A 21 3.696 -2.324 -14.886 1.00 0.25 H ATOM 325 HB3 CYS A 21 2.176 -1.545 -15.210 1.00 0.24 H ATOM 326 N ALA A 22 3.829 -3.394 -17.024 1.00 0.57 N ATOM 327 CA ALA A 22 4.368 -3.433 -18.409 1.00 0.70 C ATOM 328 C ALA A 22 5.083 -4.757 -18.675 1.00 1.58 C ATOM 329 O ALA A 22 6.227 -4.950 -18.310 1.00 2.84 O ATOM 330 CB ALA A 22 5.371 -2.287 -18.569 1.00 1.35 C ATOM 331 H ALA A 22 4.403 -3.116 -16.281 1.00 0.69 H ATOM 332 HA ALA A 22 3.547 -3.330 -19.110 1.00 0.39 H ATOM 333 HB1 ALA A 22 6.273 -2.511 -18.017 1.00 2.11 H ATOM 334 HB2 ALA A 22 5.615 -2.160 -19.614 1.00 0.97 H ATOM 335 HB3 ALA A 22 4.942 -1.371 -18.189 1.00 1.92 H