ATOM 89 N ALA A 8 -2.116 -3.496 -2.743 1.00 0.38 N ATOM 90 CA ALA A 8 -2.564 -4.724 -3.376 1.00 0.26 C ATOM 91 C ALA A 8 -2.571 -5.870 -2.379 1.00 0.32 C ATOM 92 O ALA A 8 -2.244 -5.679 -1.210 1.00 0.44 O ATOM 93 CB ALA A 8 -1.662 -5.057 -4.547 1.00 0.28 C ATOM 94 H ALA A 8 -1.162 -3.295 -2.722 1.00 0.62 H ATOM 95 HA ALA A 8 -3.566 -4.568 -3.749 1.00 0.33 H ATOM 96 HB1 ALA A 8 -1.664 -4.236 -5.246 1.00 1.05 H ATOM 97 HB2 ALA A 8 -2.020 -5.950 -5.034 1.00 1.03 H ATOM 98 HB3 ALA A 8 -0.656 -5.218 -4.185 1.00 1.02 H ATOM 99 N THR A 9 -2.923 -7.062 -2.836 1.00 0.43 N ATOM 100 CA THR A 9 -2.884 -8.236 -1.981 1.00 0.60 C ATOM 101 C THR A 9 -1.437 -8.638 -1.674 1.00 0.52 C ATOM 102 O THR A 9 -1.155 -9.299 -0.672 1.00 0.95 O ATOM 103 CB THR A 9 -3.627 -9.414 -2.629 1.00 0.85 C ATOM 104 OG1 THR A 9 -4.016 -9.067 -3.967 1.00 1.36 O ATOM 105 CG2 THR A 9 -4.855 -9.787 -1.816 1.00 1.67 C ATOM 106 H THR A 9 -3.227 -7.157 -3.766 1.00 0.50 H ATOM 107 HA THR A 9 -3.381 -7.988 -1.055 1.00 0.73 H ATOM 108 HB THR A 9 -2.963 -10.261 -2.663 1.00 1.26 H ATOM 109 HG1 THR A 9 -3.767 -9.788 -4.572 1.00 1.73 H ATOM 110 HG21 THR A 9 -4.550 -10.063 -0.819 1.00 2.28 H ATOM 111 HG22 THR A 9 -5.357 -10.620 -2.284 1.00 2.19 H ATOM 112 HG23 THR A 9 -5.528 -8.945 -1.763 1.00 2.02 H ATOM 113 N GLY A 10 -0.525 -8.221 -2.546 1.00 0.26 N ATOM 114 CA GLY A 10 0.887 -8.441 -2.318 1.00 0.25 C ATOM 115 C GLY A 10 1.610 -7.136 -2.053 1.00 0.22 C ATOM 116 O GLY A 10 2.837 -7.060 -2.138 1.00 0.34 O ATOM 117 H GLY A 10 -0.817 -7.757 -3.355 1.00 0.54 H ATOM 118 HA2 GLY A 10 1.015 -9.097 -1.471 1.00 0.31 H ATOM 119 HA3 GLY A 10 1.314 -8.905 -3.193 1.00 0.41 H ATOM 120 N TYR A 11 0.840 -6.102 -1.730 1.00 0.14 N ATOM 121 CA TYR A 11 1.399 -4.782 -1.484 1.00 0.14 C ATOM 122 C TYR A 11 0.773 -4.147 -0.256 1.00 0.19 C ATOM 123 O TYR A 11 -0.175 -4.669 0.321 1.00 0.39 O ATOM 124 CB TYR A 11 1.186 -3.862 -2.684 1.00 0.17 C ATOM 125 CG TYR A 11 2.103 -4.134 -3.857 1.00 0.17 C ATOM 126 CD1 TYR A 11 1.744 -5.050 -4.831 1.00 0.33 C ATOM 127 CD2 TYR A 11 3.325 -3.487 -3.986 1.00 0.27 C ATOM 128 CE1 TYR A 11 2.570 -5.319 -5.900 1.00 0.39 C ATOM 129 CE2 TYR A 11 4.163 -3.750 -5.056 1.00 0.31 C ATOM 130 CZ TYR A 11 3.794 -4.593 -6.014 1.00 0.31 C ATOM 131 OH TYR A 11 4.599 -4.936 -7.084 1.00 0.41 O ATOM 132 H TYR A 11 -0.131 -6.239 -1.628 1.00 0.20 H ATOM 133 HA TYR A 11 2.459 -4.900 -1.313 1.00 0.17 H ATOM 134 HB2 TYR A 11 0.171 -3.968 -3.027 1.00 0.22 H ATOM 135 HB3 TYR A 11 1.345 -2.841 -2.371 1.00 0.23 H ATOM 136 HD1 TYR A 11 0.794 -5.558 -4.747 1.00 0.47 H ATOM 137 HD2 TYR A 11 3.621 -2.769 -3.235 1.00 0.41 H ATOM 138 HE1 TYR A 11 2.265 -6.040 -6.644 1.00 0.56 H ATOM 139 HE2 TYR A 11 5.108 -3.239 -5.140 1.00 0.44 H ATOM 140 HH TYR A 11 4.158 -4.669 -7.906 1.00 0.98 H ATOM 141 N GLN A 12 1.310 -3.010 0.129 1.00 0.15 N ATOM 142 CA GLN A 12 0.833 -2.279 1.279 1.00 0.21 C ATOM 143 C GLN A 12 1.039 -0.793 1.037 1.00 0.19 C ATOM 144 O GLN A 12 1.670 -0.417 0.052 1.00 0.23 O ATOM 145 CB GLN A 12 1.592 -2.736 2.524 1.00 0.34 C ATOM 146 CG GLN A 12 3.042 -2.268 2.566 1.00 1.14 C ATOM 147 CD GLN A 12 3.841 -2.909 3.686 1.00 1.18 C ATOM 148 OE1 GLN A 12 3.867 -2.408 4.807 1.00 1.35 O ATOM 149 NE2 GLN A 12 4.526 -3.998 3.378 1.00 1.89 N ATOM 150 H GLN A 12 2.074 -2.648 -0.373 1.00 0.22 H ATOM 151 HA GLN A 12 -0.219 -2.480 1.399 1.00 0.26 H ATOM 152 HB2 GLN A 12 1.083 -2.359 3.395 1.00 0.90 H ATOM 153 HB3 GLN A 12 1.583 -3.815 2.547 1.00 1.02 H ATOM 154 HG2 GLN A 12 3.510 -2.512 1.626 1.00 1.75 H ATOM 155 HG3 GLN A 12 3.055 -1.197 2.703 1.00 1.67 H ATOM 156 HE21 GLN A 12 4.486 -4.330 2.453 1.00 2.54 H ATOM 157 HE22 GLN A 12 5.050 -4.427 4.085 1.00 1.96 H ATOM 158 N ARG A 13 0.515 0.045 1.910 1.00 0.29 N ATOM 159 CA ARG A 13 0.682 1.478 1.753 1.00 0.28 C ATOM 160 C ARG A 13 1.708 2.000 2.734 1.00 0.28 C ATOM 161 O ARG A 13 1.762 1.586 3.894 1.00 0.54 O ATOM 162 CB ARG A 13 -0.639 2.240 1.916 1.00 0.47 C ATOM 163 CG ARG A 13 -1.333 2.019 3.247 1.00 1.48 C ATOM 164 CD ARG A 13 -2.559 2.908 3.372 1.00 1.60 C ATOM 165 NE ARG A 13 -3.495 2.720 2.262 1.00 1.99 N ATOM 166 CZ ARG A 13 -4.085 3.721 1.606 1.00 2.42 C ATOM 167 NH1 ARG A 13 -3.868 4.984 1.969 1.00 2.41 N ATOM 168 NH2 ARG A 13 -4.892 3.458 0.592 1.00 3.36 N ATOM 169 H ARG A 13 0.030 -0.300 2.685 1.00 0.43 H ATOM 170 HA ARG A 13 1.057 1.650 0.752 1.00 0.26 H ATOM 171 HB2 ARG A 13 -0.442 3.302 1.821 1.00 0.97 H ATOM 172 HB3 ARG A 13 -1.312 1.937 1.127 1.00 1.02 H ATOM 173 HG2 ARG A 13 -1.639 0.982 3.318 1.00 2.05 H ATOM 174 HG3 ARG A 13 -0.645 2.252 4.044 1.00 2.05 H ATOM 175 HD2 ARG A 13 -3.065 2.677 4.296 1.00 2.04 H ATOM 176 HD3 ARG A 13 -2.236 3.937 3.384 1.00 1.90 H ATOM 177 HE ARG A 13 -3.687 1.794 1.984 1.00 2.44 H ATOM 178 HH11 ARG A 13 -3.260 5.192 2.733 1.00 2.32 H ATOM 179 HH12 ARG A 13 -4.318 5.740 1.471 1.00 2.90 H ATOM 180 HH21 ARG A 13 -5.064 2.510 0.317 1.00 3.83 H ATOM 181 HH22 ARG A 13 -5.331 4.210 0.081 1.00 3.79 H ATOM 182 N THR A 14 2.527 2.897 2.244 1.00 0.17 N ATOM 183 CA THR A 14 3.484 3.589 3.064 1.00 0.31 C ATOM 184 C THR A 14 2.777 4.710 3.822 1.00 0.20 C ATOM 185 O THR A 14 1.547 4.816 3.768 1.00 0.18 O ATOM 186 CB THR A 14 4.590 4.176 2.176 1.00 0.50 C ATOM 187 OG1 THR A 14 4.001 5.071 1.224 1.00 0.51 O ATOM 188 CG2 THR A 14 5.321 3.057 1.442 1.00 0.70 C ATOM 189 H THR A 14 2.502 3.092 1.281 1.00 0.22 H ATOM 190 HA THR A 14 3.921 2.891 3.760 1.00 0.46 H ATOM 191 HB THR A 14 5.295 4.713 2.792 1.00 0.59 H ATOM 192 HG1 THR A 14 4.538 5.883 1.156 1.00 0.97 H ATOM 193 HG21 THR A 14 5.780 2.396 2.160 1.00 1.06 H ATOM 194 HG22 THR A 14 6.080 3.481 0.802 1.00 1.35 H ATOM 195 HG23 THR A 14 4.612 2.497 0.843 1.00 1.28 H ATOM 196 N ALA A 15 3.539 5.552 4.512 1.00 0.32 N ATOM 197 CA ALA A 15 2.966 6.679 5.242 1.00 0.33 C ATOM 198 C ALA A 15 2.181 7.592 4.301 1.00 0.35 C ATOM 199 O ALA A 15 1.179 8.191 4.686 1.00 0.73 O ATOM 200 CB ALA A 15 4.066 7.459 5.954 1.00 0.56 C ATOM 201 H ALA A 15 4.509 5.413 4.537 1.00 0.45 H ATOM 202 HA ALA A 15 2.292 6.286 5.990 1.00 0.39 H ATOM 203 HB1 ALA A 15 4.773 7.836 5.229 1.00 1.09 H ATOM 204 HB2 ALA A 15 4.577 6.810 6.650 1.00 1.19 H ATOM 205 HB3 ALA A 15 3.630 8.289 6.495 1.00 1.10 H ATOM 206 N ASP A 16 2.625 7.666 3.055 1.00 0.39 N ATOM 207 CA ASP A 16 1.999 8.537 2.071 1.00 0.54 C ATOM 208 C ASP A 16 1.024 7.776 1.173 1.00 0.52 C ATOM 209 O ASP A 16 0.205 8.381 0.485 1.00 0.85 O ATOM 210 CB ASP A 16 3.068 9.224 1.224 1.00 0.79 C ATOM 211 CG ASP A 16 3.834 8.246 0.360 1.00 1.57 C ATOM 212 OD1 ASP A 16 4.679 7.502 0.905 1.00 2.45 O ATOM 213 OD2 ASP A 16 3.583 8.210 -0.864 1.00 2.08 O ATOM 214 H ASP A 16 3.400 7.126 2.787 1.00 0.62 H ATOM 215 HA ASP A 16 1.444 9.286 2.608 1.00 0.63 H ATOM 216 HB2 ASP A 16 2.594 9.952 0.579 1.00 1.33 H ATOM 217 HB3 ASP A 16 3.767 9.726 1.875 1.00 1.34 H ATOM 218 N GLY A 17 1.091 6.453 1.194 1.00 0.25 N ATOM 219 CA GLY A 17 0.170 5.674 0.391 1.00 0.33 C ATOM 220 C GLY A 17 0.811 5.066 -0.837 1.00 0.29 C ATOM 221 O GLY A 17 0.115 4.668 -1.775 1.00 0.41 O ATOM 222 H GLY A 17 1.754 6.006 1.763 1.00 0.27 H ATOM 223 HA2 GLY A 17 -0.235 4.878 1.000 1.00 0.38 H ATOM 224 HA3 GLY A 17 -0.638 6.316 0.077 1.00 0.47 H ATOM 225 N ARG A 18 2.133 4.986 -0.840 1.00 0.25 N ATOM 226 CA ARG A 18 2.854 4.342 -1.928 1.00 0.29 C ATOM 227 C ARG A 18 2.812 2.833 -1.731 1.00 0.24 C ATOM 228 O ARG A 18 2.899 2.348 -0.600 1.00 0.40 O ATOM 229 CB ARG A 18 4.300 4.841 -1.980 1.00 0.41 C ATOM 230 CG ARG A 18 5.068 4.406 -3.220 1.00 1.25 C ATOM 231 CD ARG A 18 6.469 4.993 -3.224 1.00 1.66 C ATOM 232 NE ARG A 18 7.195 4.683 -4.457 1.00 2.09 N ATOM 233 CZ ARG A 18 8.203 5.411 -4.937 1.00 2.82 C ATOM 234 NH1 ARG A 18 8.627 6.482 -4.267 1.00 3.23 N ATOM 235 NH2 ARG A 18 8.790 5.066 -6.080 1.00 3.63 N ATOM 236 H ARG A 18 2.638 5.369 -0.092 1.00 0.29 H ATOM 237 HA ARG A 18 2.354 4.586 -2.854 1.00 0.36 H ATOM 238 HB2 ARG A 18 4.295 5.919 -1.951 1.00 0.78 H ATOM 239 HB3 ARG A 18 4.827 4.470 -1.112 1.00 1.06 H ATOM 240 HG2 ARG A 18 5.140 3.329 -3.230 1.00 2.01 H ATOM 241 HG3 ARG A 18 4.540 4.744 -4.101 1.00 1.76 H ATOM 242 HD2 ARG A 18 6.393 6.065 -3.121 1.00 2.12 H ATOM 243 HD3 ARG A 18 7.013 4.590 -2.385 1.00 2.22 H ATOM 244 HE ARG A 18 6.912 3.877 -4.959 1.00 2.38 H ATOM 245 HH11 ARG A 18 8.195 6.734 -3.400 1.00 3.16 H ATOM 246 HH12 ARG A 18 9.374 7.050 -4.634 1.00 3.93 H ATOM 247 HH21 ARG A 18 8.475 4.253 -6.585 1.00 3.87 H ATOM 248 HH22 ARG A 18 9.551 5.607 -6.441 1.00 4.23 H ATOM 249 N CYS A 19 2.665 2.093 -2.814 1.00 0.15 N ATOM 250 CA CYS A 19 2.500 0.653 -2.723 1.00 0.19 C ATOM 251 C CYS A 19 3.841 -0.061 -2.568 1.00 0.21 C ATOM 252 O CYS A 19 4.649 -0.110 -3.495 1.00 0.37 O ATOM 253 CB CYS A 19 1.748 0.132 -3.946 1.00 0.27 C ATOM 254 SG CYS A 19 0.113 0.914 -4.173 1.00 0.32 S ATOM 255 H CYS A 19 2.663 2.525 -3.695 1.00 0.23 H ATOM 256 HA CYS A 19 1.906 0.452 -1.846 1.00 0.20 H ATOM 257 HB2 CYS A 19 2.335 0.323 -4.833 1.00 0.30 H ATOM 258 HB3 CYS A 19 1.596 -0.931 -3.841 1.00 0.32 H ATOM 259 N LYS A 20 4.066 -0.602 -1.380 1.00 0.17 N ATOM 260 CA LYS A 20 5.290 -1.332 -1.075 1.00 0.23 C ATOM 261 C LYS A 20 4.968 -2.815 -0.918 1.00 0.15 C ATOM 262 O LYS A 20 3.956 -3.161 -0.319 1.00 0.14 O ATOM 263 CB LYS A 20 5.904 -0.777 0.215 1.00 0.38 C ATOM 264 CG LYS A 20 7.413 -0.927 0.311 1.00 0.90 C ATOM 265 CD LYS A 20 8.121 -0.131 -0.775 1.00 1.14 C ATOM 266 CE LYS A 20 9.614 0.003 -0.497 1.00 1.79 C ATOM 267 NZ LYS A 20 10.283 -1.315 -0.336 1.00 2.61 N ATOM 268 H LYS A 20 3.384 -0.506 -0.679 1.00 0.22 H ATOM 269 HA LYS A 20 5.982 -1.202 -1.892 1.00 0.32 H ATOM 270 HB2 LYS A 20 5.669 0.274 0.283 1.00 0.61 H ATOM 271 HB3 LYS A 20 5.459 -1.290 1.058 1.00 0.85 H ATOM 272 HG2 LYS A 20 7.739 -0.567 1.274 1.00 1.46 H ATOM 273 HG3 LYS A 20 7.669 -1.971 0.208 1.00 1.29 H ATOM 274 HD2 LYS A 20 7.985 -0.630 -1.723 1.00 1.51 H ATOM 275 HD3 LYS A 20 7.685 0.858 -0.822 1.00 1.55 H ATOM 276 HE2 LYS A 20 10.073 0.531 -1.317 1.00 2.17 H ATOM 277 HE3 LYS A 20 9.743 0.572 0.410 1.00 2.24 H ATOM 278 HZ1 LYS A 20 9.953 -1.782 0.538 1.00 2.97 H ATOM 279 HZ2 LYS A 20 11.317 -1.185 -0.277 1.00 3.02 H ATOM 280 HZ3 LYS A 20 10.074 -1.931 -1.149 1.00 3.14 H ATOM 281 N PRO A 21 5.799 -3.706 -1.487 1.00 0.17 N ATOM 282 CA PRO A 21 5.596 -5.158 -1.387 1.00 0.19 C ATOM 283 C PRO A 21 5.478 -5.629 0.060 1.00 0.27 C ATOM 284 O PRO A 21 6.159 -5.111 0.949 1.00 0.42 O ATOM 285 CB PRO A 21 6.850 -5.750 -2.038 1.00 0.33 C ATOM 286 CG PRO A 21 7.350 -4.683 -2.941 1.00 0.41 C ATOM 287 CD PRO A 21 6.988 -3.374 -2.289 1.00 0.29 C ATOM 288 HA PRO A 21 4.722 -5.472 -1.938 1.00 0.22 H ATOM 289 HB2 PRO A 21 7.576 -5.997 -1.280 1.00 0.39 H ATOM 290 HB3 PRO A 21 6.587 -6.637 -2.595 1.00 0.47 H ATOM 291 HG2 PRO A 21 8.421 -4.766 -3.052 1.00 0.56 H ATOM 292 HG3 PRO A 21 6.864 -4.772 -3.900 1.00 0.57 H ATOM 293 HD2 PRO A 21 7.796 -3.030 -1.657 1.00 0.36 H ATOM 294 HD3 PRO A 21 6.750 -2.635 -3.038 1.00 0.37 H ATOM 295 N THR A 22 4.598 -6.592 0.301 1.00 0.37 N ATOM 296 CA THR A 22 4.422 -7.137 1.637 1.00 0.53 C ATOM 297 C THR A 22 5.335 -8.332 1.859 1.00 0.70 C ATOM 298 O THR A 22 5.367 -9.265 1.053 1.00 1.32 O ATOM 299 CB THR A 22 2.957 -7.544 1.897 1.00 0.67 C ATOM 300 OG1 THR A 22 2.453 -8.319 0.800 1.00 0.84 O ATOM 301 CG2 THR A 22 2.091 -6.312 2.098 1.00 0.81 C ATOM 302 H THR A 22 4.056 -6.945 -0.441 1.00 0.43 H ATOM 303 HA THR A 22 4.684 -6.363 2.345 1.00 0.62 H ATOM 304 HB THR A 22 2.919 -8.141 2.799 1.00 0.78 H ATOM 305 HG1 THR A 22 1.493 -8.341 0.847 1.00 1.36 H ATOM 306 HG21 THR A 22 2.167 -5.672 1.231 1.00 1.39 H ATOM 307 HG22 THR A 22 2.429 -5.772 2.973 1.00 1.22 H ATOM 308 HG23 THR A 22 1.064 -6.611 2.235 1.00 1.30 H