ATOM 87 N VAL A 8 -6.821 -3.528 -0.777 1.00 0.63 N ATOM 88 CA VAL A 8 -7.054 -4.959 -0.920 1.00 0.60 C ATOM 89 C VAL A 8 -6.099 -5.749 -0.026 1.00 0.39 C ATOM 90 O VAL A 8 -5.056 -5.235 0.391 1.00 0.36 O ATOM 91 CB VAL A 8 -6.887 -5.405 -2.397 1.00 0.85 C ATOM 92 CG1 VAL A 8 -7.333 -6.843 -2.596 1.00 1.46 C ATOM 93 CG2 VAL A 8 -7.667 -4.492 -3.325 1.00 1.26 C ATOM 94 H VAL A 8 -6.397 -3.042 -1.512 1.00 0.74 H ATOM 95 HA VAL A 8 -8.071 -5.163 -0.613 1.00 0.76 H ATOM 96 HB VAL A 8 -5.841 -5.339 -2.657 1.00 1.42 H ATOM 97 HG11 VAL A 8 -8.374 -6.935 -2.330 1.00 1.98 H ATOM 98 HG12 VAL A 8 -6.744 -7.496 -1.972 1.00 1.75 H ATOM 99 HG13 VAL A 8 -7.202 -7.118 -3.630 1.00 2.12 H ATOM 100 HG21 VAL A 8 -7.537 -4.820 -4.347 1.00 1.50 H ATOM 101 HG22 VAL A 8 -7.303 -3.479 -3.225 1.00 1.76 H ATOM 102 HG23 VAL A 8 -8.716 -4.526 -3.064 1.00 2.00 H ATOM 103 N ALA A 9 -6.471 -6.986 0.286 1.00 0.42 N ATOM 104 CA ALA A 9 -5.633 -7.855 1.097 1.00 0.42 C ATOM 105 C ALA A 9 -4.262 -8.036 0.462 1.00 0.38 C ATOM 106 O ALA A 9 -4.153 -8.425 -0.704 1.00 0.84 O ATOM 107 CB ALA A 9 -6.307 -9.201 1.291 1.00 0.66 C ATOM 108 H ALA A 9 -7.329 -7.322 -0.044 1.00 0.56 H ATOM 109 HA ALA A 9 -5.513 -7.394 2.063 1.00 0.54 H ATOM 110 HB1 ALA A 9 -6.430 -9.685 0.331 1.00 1.29 H ATOM 111 HB2 ALA A 9 -7.273 -9.054 1.747 1.00 1.25 H ATOM 112 HB3 ALA A 9 -5.698 -9.821 1.931 1.00 1.19 H ATOM 113 N GLY A 10 -3.220 -7.761 1.231 1.00 0.32 N ATOM 114 CA GLY A 10 -1.873 -7.833 0.707 1.00 0.28 C ATOM 115 C GLY A 10 -1.304 -6.460 0.415 1.00 0.22 C ATOM 116 O GLY A 10 -0.196 -6.340 -0.111 1.00 0.32 O ATOM 117 H GLY A 10 -3.366 -7.515 2.174 1.00 0.67 H ATOM 118 HA2 GLY A 10 -1.238 -8.330 1.426 1.00 0.38 H ATOM 119 HA3 GLY A 10 -1.884 -8.409 -0.207 1.00 0.40 H ATOM 120 N TYR A 11 -2.070 -5.421 0.741 1.00 0.14 N ATOM 121 CA TYR A 11 -1.627 -4.052 0.529 1.00 0.14 C ATOM 122 C TYR A 11 -1.529 -3.284 1.824 1.00 0.21 C ATOM 123 O TYR A 11 -2.515 -3.107 2.538 1.00 0.35 O ATOM 124 CB TYR A 11 -2.552 -3.325 -0.431 1.00 0.20 C ATOM 125 CG TYR A 11 -2.524 -3.903 -1.826 1.00 0.22 C ATOM 126 CD1 TYR A 11 -1.551 -3.515 -2.733 1.00 0.22 C ATOM 127 CD2 TYR A 11 -3.456 -4.844 -2.226 1.00 0.38 C ATOM 128 CE1 TYR A 11 -1.508 -4.053 -4.001 1.00 0.28 C ATOM 129 CE2 TYR A 11 -3.423 -5.389 -3.492 1.00 0.47 C ATOM 130 CZ TYR A 11 -2.449 -4.991 -4.377 1.00 0.38 C ATOM 131 OH TYR A 11 -2.418 -5.530 -5.642 1.00 0.49 O ATOM 132 H TYR A 11 -2.963 -5.581 1.120 1.00 0.19 H ATOM 133 HA TYR A 11 -0.654 -4.080 0.092 1.00 0.16 H ATOM 134 HB2 TYR A 11 -3.560 -3.384 -0.060 1.00 0.26 H ATOM 135 HB3 TYR A 11 -2.246 -2.290 -0.490 1.00 0.24 H ATOM 136 HD1 TYR A 11 -0.815 -2.782 -2.435 1.00 0.27 H ATOM 137 HD2 TYR A 11 -4.216 -5.159 -1.529 1.00 0.48 H ATOM 138 HE1 TYR A 11 -0.740 -3.739 -4.691 1.00 0.33 H ATOM 139 HE2 TYR A 11 -4.164 -6.117 -3.783 1.00 0.62 H ATOM 140 HH TYR A 11 -1.527 -5.830 -5.843 1.00 0.87 H ATOM 141 N MET A 12 -0.325 -2.825 2.110 1.00 0.28 N ATOM 142 CA MET A 12 -0.098 -1.949 3.236 1.00 0.40 C ATOM 143 C MET A 12 -0.002 -0.534 2.688 1.00 0.34 C ATOM 144 O MET A 12 0.256 -0.349 1.493 1.00 0.41 O ATOM 145 CB MET A 12 1.162 -2.354 4.021 1.00 0.57 C ATOM 146 CG MET A 12 2.473 -2.050 3.309 1.00 1.09 C ATOM 147 SD MET A 12 3.059 -0.373 3.620 1.00 2.12 S ATOM 148 CE MET A 12 3.260 -0.414 5.399 1.00 2.36 C ATOM 149 H MET A 12 0.423 -3.043 1.511 1.00 0.35 H ATOM 150 HA MET A 12 -0.964 -2.015 3.879 1.00 0.49 H ATOM 151 HB2 MET A 12 1.161 -1.828 4.964 1.00 1.14 H ATOM 152 HB3 MET A 12 1.124 -3.417 4.217 1.00 1.13 H ATOM 153 HG2 MET A 12 3.225 -2.748 3.649 1.00 1.35 H ATOM 154 HG3 MET A 12 2.325 -2.172 2.247 1.00 1.59 H ATOM 155 HE1 MET A 12 3.941 -1.209 5.665 1.00 2.61 H ATOM 156 HE2 MET A 12 2.300 -0.595 5.861 1.00 2.80 H ATOM 157 HE3 MET A 12 3.656 0.533 5.743 1.00 2.67 H ATOM 158 N ARG A 13 -0.220 0.463 3.520 1.00 0.39 N ATOM 159 CA ARG A 13 -0.475 1.789 2.996 1.00 0.33 C ATOM 160 C ARG A 13 0.486 2.843 3.510 1.00 0.26 C ATOM 161 O ARG A 13 1.026 2.749 4.614 1.00 0.34 O ATOM 162 CB ARG A 13 -1.926 2.140 3.284 1.00 0.41 C ATOM 163 CG ARG A 13 -2.846 1.125 2.640 1.00 0.56 C ATOM 164 CD ARG A 13 -4.295 1.265 3.056 1.00 0.78 C ATOM 165 NE ARG A 13 -4.518 1.146 4.499 1.00 1.46 N ATOM 166 CZ ARG A 13 -4.948 0.035 5.092 1.00 2.35 C ATOM 167 NH1 ARG A 13 -5.006 -1.106 4.416 1.00 2.82 N ATOM 168 NH2 ARG A 13 -5.297 0.057 6.373 1.00 3.00 N ATOM 169 H ARG A 13 -0.222 0.309 4.491 1.00 0.52 H ATOM 170 HA ARG A 13 -0.355 1.732 1.924 1.00 0.33 H ATOM 171 HB2 ARG A 13 -2.089 2.135 4.352 1.00 0.47 H ATOM 172 HB3 ARG A 13 -2.148 3.117 2.882 1.00 0.44 H ATOM 173 HG2 ARG A 13 -2.782 1.246 1.567 1.00 1.03 H ATOM 174 HG3 ARG A 13 -2.501 0.133 2.902 1.00 0.96 H ATOM 175 HD2 ARG A 13 -4.657 2.221 2.727 1.00 1.08 H ATOM 176 HD3 ARG A 13 -4.851 0.479 2.556 1.00 1.17 H ATOM 177 HE ARG A 13 -4.411 1.959 5.038 1.00 1.54 H ATOM 178 HH11 ARG A 13 -4.719 -1.139 3.460 1.00 2.53 H ATOM 179 HH12 ARG A 13 -5.356 -1.940 4.862 1.00 3.61 H ATOM 180 HH21 ARG A 13 -5.246 0.915 6.900 1.00 2.91 H ATOM 181 HH22 ARG A 13 -5.626 -0.776 6.818 1.00 3.72 H ATOM 182 N THR A 14 0.705 3.838 2.668 1.00 0.20 N ATOM 183 CA THR A 14 1.650 4.900 2.957 1.00 0.24 C ATOM 184 C THR A 14 0.973 6.058 3.694 1.00 0.20 C ATOM 185 O THR A 14 -0.255 6.099 3.794 1.00 0.20 O ATOM 186 CB THR A 14 2.274 5.424 1.649 1.00 0.34 C ATOM 187 OG1 THR A 14 1.242 5.729 0.699 1.00 0.39 O ATOM 188 CG2 THR A 14 3.233 4.406 1.056 1.00 0.50 C ATOM 189 H THR A 14 0.204 3.863 1.817 1.00 0.23 H ATOM 190 HA THR A 14 2.437 4.493 3.573 1.00 0.33 H ATOM 191 HB THR A 14 2.823 6.326 1.870 1.00 0.42 H ATOM 192 HG1 THR A 14 1.534 5.470 -0.184 1.00 0.64 H ATOM 193 HG21 THR A 14 2.705 3.486 0.853 1.00 1.22 H ATOM 194 HG22 THR A 14 4.031 4.216 1.758 1.00 1.18 H ATOM 195 HG23 THR A 14 3.645 4.794 0.137 1.00 1.05 H ATOM 196 N PRO A 15 1.769 7.023 4.204 1.00 0.30 N ATOM 197 CA PRO A 15 1.245 8.251 4.820 1.00 0.35 C ATOM 198 C PRO A 15 0.548 9.124 3.786 1.00 0.32 C ATOM 199 O PRO A 15 -0.173 10.064 4.114 1.00 0.44 O ATOM 200 CB PRO A 15 2.491 8.965 5.361 1.00 0.50 C ATOM 201 CG PRO A 15 3.588 7.956 5.320 1.00 0.79 C ATOM 202 CD PRO A 15 3.236 6.985 4.229 1.00 0.44 C ATOM 203 HA PRO A 15 0.562 8.034 5.628 1.00 0.41 H ATOM 204 HB2 PRO A 15 2.722 9.819 4.738 1.00 0.58 H ATOM 205 HB3 PRO A 15 2.303 9.298 6.370 1.00 0.69 H ATOM 206 HG2 PRO A 15 4.524 8.444 5.100 1.00 1.17 H ATOM 207 HG3 PRO A 15 3.646 7.445 6.272 1.00 1.23 H ATOM 208 HD2 PRO A 15 3.639 7.306 3.278 1.00 0.53 H ATOM 209 HD3 PRO A 15 3.591 5.995 4.476 1.00 0.53 H ATOM 210 N ASP A 16 0.786 8.785 2.529 1.00 0.30 N ATOM 211 CA ASP A 16 0.170 9.463 1.401 1.00 0.39 C ATOM 212 C ASP A 16 -1.256 8.961 1.202 1.00 0.38 C ATOM 213 O ASP A 16 -2.113 9.669 0.678 1.00 0.58 O ATOM 214 CB ASP A 16 1.007 9.211 0.145 1.00 0.55 C ATOM 215 CG ASP A 16 0.379 9.765 -1.114 1.00 1.26 C ATOM 216 OD1 ASP A 16 0.608 10.950 -1.424 1.00 1.82 O ATOM 217 OD2 ASP A 16 -0.314 9.007 -1.811 1.00 1.95 O ATOM 218 H ASP A 16 1.406 8.048 2.355 1.00 0.33 H ATOM 219 HA ASP A 16 0.152 10.520 1.614 1.00 0.49 H ATOM 220 HB2 ASP A 16 1.975 9.676 0.267 1.00 1.27 H ATOM 221 HB3 ASP A 16 1.141 8.147 0.020 1.00 1.24 H ATOM 222 N GLY A 17 -1.504 7.740 1.661 1.00 0.28 N ATOM 223 CA GLY A 17 -2.813 7.136 1.514 1.00 0.35 C ATOM 224 C GLY A 17 -2.886 6.223 0.310 1.00 0.27 C ATOM 225 O GLY A 17 -3.971 5.894 -0.167 1.00 0.38 O ATOM 226 H GLY A 17 -0.791 7.248 2.116 1.00 0.29 H ATOM 227 HA2 GLY A 17 -3.034 6.561 2.401 1.00 0.42 H ATOM 228 HA3 GLY A 17 -3.553 7.915 1.408 1.00 0.48 H ATOM 229 N ARG A 18 -1.728 5.803 -0.181 1.00 0.20 N ATOM 230 CA ARG A 18 -1.668 4.956 -1.365 1.00 0.23 C ATOM 231 C ARG A 18 -1.581 3.479 -1.010 1.00 0.24 C ATOM 232 O ARG A 18 -0.935 3.095 -0.029 1.00 0.33 O ATOM 233 CB ARG A 18 -0.479 5.338 -2.240 1.00 0.37 C ATOM 234 CG ARG A 18 -0.844 6.279 -3.377 1.00 0.93 C ATOM 235 CD ARG A 18 0.365 6.648 -4.227 1.00 1.57 C ATOM 236 NE ARG A 18 1.146 7.730 -3.631 1.00 2.09 N ATOM 237 CZ ARG A 18 2.397 8.026 -3.974 1.00 3.01 C ATOM 238 NH1 ARG A 18 3.058 7.261 -4.832 1.00 3.52 N ATOM 239 NH2 ARG A 18 2.989 9.092 -3.453 1.00 3.79 N ATOM 240 H ARG A 18 -0.894 6.074 0.257 1.00 0.25 H ATOM 241 HA ARG A 18 -2.576 5.118 -1.925 1.00 0.26 H ATOM 242 HB2 ARG A 18 0.269 5.817 -1.619 1.00 0.78 H ATOM 243 HB3 ARG A 18 -0.061 4.436 -2.666 1.00 0.82 H ATOM 244 HG2 ARG A 18 -1.577 5.796 -4.007 1.00 1.46 H ATOM 245 HG3 ARG A 18 -1.264 7.181 -2.959 1.00 1.63 H ATOM 246 HD2 ARG A 18 0.994 5.777 -4.331 1.00 2.16 H ATOM 247 HD3 ARG A 18 0.021 6.962 -5.201 1.00 2.09 H ATOM 248 HE ARG A 18 0.684 8.297 -2.959 1.00 2.18 H ATOM 249 HH11 ARG A 18 2.623 6.445 -5.227 1.00 3.38 H ATOM 250 HH12 ARG A 18 3.999 7.504 -5.109 1.00 4.29 H ATOM 251 HH21 ARG A 18 2.498 9.676 -2.805 1.00 3.88 H ATOM 252 HH22 ARG A 18 3.941 9.322 -3.709 1.00 4.49 H ATOM 253 N CYS A 19 -2.245 2.664 -1.828 1.00 0.31 N ATOM 254 CA CYS A 19 -2.159 1.216 -1.733 1.00 0.36 C ATOM 255 C CYS A 19 -0.889 0.725 -2.417 1.00 0.36 C ATOM 256 O CYS A 19 -0.706 0.936 -3.616 1.00 0.58 O ATOM 257 CB CYS A 19 -3.361 0.559 -2.423 1.00 0.50 C ATOM 258 SG CYS A 19 -4.999 1.131 -1.857 1.00 0.70 S ATOM 259 H CYS A 19 -2.814 3.055 -2.524 1.00 0.40 H ATOM 260 HA CYS A 19 -2.139 0.933 -0.694 1.00 0.39 H ATOM 261 HB2 CYS A 19 -3.303 0.762 -3.481 1.00 0.80 H ATOM 262 HB3 CYS A 19 -3.314 -0.509 -2.269 1.00 0.68 H ATOM 263 N LYS A 20 -0.010 0.096 -1.662 1.00 0.32 N ATOM 264 CA LYS A 20 1.121 -0.593 -2.253 1.00 0.37 C ATOM 265 C LYS A 20 1.227 -1.973 -1.636 1.00 0.28 C ATOM 266 O LYS A 20 0.648 -2.214 -0.573 1.00 0.33 O ATOM 267 CB LYS A 20 2.424 0.196 -2.062 1.00 0.57 C ATOM 268 CG LYS A 20 2.903 0.285 -0.622 1.00 0.95 C ATOM 269 CD LYS A 20 4.243 0.996 -0.541 1.00 1.22 C ATOM 270 CE LYS A 20 4.718 1.134 0.895 1.00 1.60 C ATOM 271 NZ LYS A 20 5.088 -0.175 1.487 1.00 2.50 N ATOM 272 H LYS A 20 -0.121 0.086 -0.680 1.00 0.44 H ATOM 273 HA LYS A 20 0.923 -0.700 -3.309 1.00 0.48 H ATOM 274 HB2 LYS A 20 3.202 -0.273 -2.647 1.00 1.18 H ATOM 275 HB3 LYS A 20 2.273 1.200 -2.428 1.00 1.31 H ATOM 276 HG2 LYS A 20 2.176 0.839 -0.046 1.00 1.57 H ATOM 277 HG3 LYS A 20 3.003 -0.712 -0.219 1.00 1.62 H ATOM 278 HD2 LYS A 20 4.975 0.429 -1.096 1.00 1.67 H ATOM 279 HD3 LYS A 20 4.145 1.980 -0.972 1.00 1.55 H ATOM 280 HE2 LYS A 20 5.580 1.783 0.912 1.00 1.75 H ATOM 281 HE3 LYS A 20 3.925 1.575 1.483 1.00 1.77 H ATOM 282 HZ1 LYS A 20 4.322 -0.864 1.355 1.00 2.98 H ATOM 283 HZ2 LYS A 20 5.268 -0.064 2.510 1.00 2.92 H ATOM 284 HZ3 LYS A 20 5.950 -0.539 1.041 1.00 2.83 H ATOM 285 N PRO A 21 1.917 -2.913 -2.305 1.00 0.28 N ATOM 286 CA PRO A 21 2.118 -4.262 -1.771 1.00 0.33 C ATOM 287 C PRO A 21 2.644 -4.238 -0.338 1.00 0.37 C ATOM 288 O PRO A 21 3.155 -3.216 0.133 1.00 0.50 O ATOM 289 CB PRO A 21 3.169 -4.850 -2.714 1.00 0.54 C ATOM 290 CG PRO A 21 2.949 -4.142 -4.006 1.00 0.60 C ATOM 291 CD PRO A 21 2.542 -2.746 -3.636 1.00 0.37 C ATOM 292 HA PRO A 21 1.214 -4.854 -1.815 1.00 0.36 H ATOM 293 HB2 PRO A 21 4.154 -4.654 -2.318 1.00 0.68 H ATOM 294 HB3 PRO A 21 3.019 -5.914 -2.814 1.00 0.65 H ATOM 295 HG2 PRO A 21 3.866 -4.124 -4.577 1.00 0.91 H ATOM 296 HG3 PRO A 21 2.163 -4.624 -4.566 1.00 0.91 H ATOM 297 HD2 PRO A 21 3.407 -2.104 -3.578 1.00 0.64 H ATOM 298 HD3 PRO A 21 1.831 -2.358 -4.351 1.00 0.63 H ATOM 299 N THR A 22 2.480 -5.346 0.363 1.00 0.39 N ATOM 300 CA THR A 22 3.068 -5.502 1.681 1.00 0.50 C ATOM 301 C THR A 22 4.566 -5.184 1.651 1.00 0.71 C ATOM 302 O THR A 22 5.111 -4.584 2.575 1.00 0.94 O ATOM 303 CB THR A 22 2.872 -6.934 2.199 1.00 0.59 C ATOM 304 OG1 THR A 22 3.296 -7.866 1.193 1.00 1.00 O ATOM 305 CG2 THR A 22 1.419 -7.184 2.566 1.00 0.67 C ATOM 306 H THR A 22 1.916 -6.066 0.000 1.00 0.41 H ATOM 307 HA THR A 22 2.566 -4.819 2.350 1.00 0.48 H ATOM 308 HB THR A 22 3.480 -7.065 3.079 1.00 0.88 H ATOM 309 HG1 THR A 22 2.636 -8.569 1.101 1.00 1.13 H ATOM 310 HG21 THR A 22 1.101 -6.458 3.298 1.00 1.35 H ATOM 311 HG22 THR A 22 1.318 -8.179 2.974 1.00 1.33 H ATOM 312 HG23 THR A 22 0.802 -7.095 1.680 1.00 1.14 H