ATOM 27 N PRO A 2 11.380 -1.860 1.638 1.00 0.48 N ATOM 28 CA PRO A 2 10.328 -1.629 0.656 1.00 0.37 C ATOM 29 C PRO A 2 8.947 -1.803 1.278 1.00 0.31 C ATOM 30 O PRO A 2 8.693 -2.775 1.988 1.00 0.43 O ATOM 31 CB PRO A 2 10.589 -2.699 -0.400 1.00 0.45 C ATOM 32 CG PRO A 2 11.226 -3.822 0.348 1.00 0.58 C ATOM 33 CD PRO A 2 11.989 -3.199 1.493 1.00 0.63 C ATOM 34 HA PRO A 2 10.406 -0.647 0.213 1.00 0.40 H ATOM 35 HB2 PRO A 2 9.651 -3.001 -0.846 1.00 0.46 H ATOM 36 HB3 PRO A 2 11.248 -2.307 -1.161 1.00 0.51 H ATOM 37 HG2 PRO A 2 10.462 -4.488 0.726 1.00 0.60 H ATOM 38 HG3 PRO A 2 11.899 -4.359 -0.304 1.00 0.69 H ATOM 39 HD2 PRO A 2 11.856 -3.781 2.394 1.00 0.74 H ATOM 40 HD3 PRO A 2 13.038 -3.119 1.248 1.00 0.73 H ATOM 41 N PHE A 3 8.061 -0.863 1.013 1.00 0.19 N ATOM 42 CA PHE A 3 6.733 -0.889 1.602 1.00 0.16 C ATOM 43 C PHE A 3 5.818 -1.795 0.794 1.00 0.15 C ATOM 44 O PHE A 3 5.227 -1.383 -0.199 1.00 0.18 O ATOM 45 CB PHE A 3 6.178 0.531 1.700 1.00 0.14 C ATOM 46 CG PHE A 3 7.007 1.406 2.591 1.00 0.15 C ATOM 47 CD1 PHE A 3 7.969 2.250 2.063 1.00 0.14 C ATOM 48 CD2 PHE A 3 6.836 1.365 3.961 1.00 0.22 C ATOM 49 CE1 PHE A 3 8.744 3.041 2.889 1.00 0.17 C ATOM 50 CE2 PHE A 3 7.606 2.155 4.792 1.00 0.25 C ATOM 51 CZ PHE A 3 8.561 2.993 4.255 1.00 0.21 C ATOM 52 H PHE A 3 8.297 -0.138 0.395 1.00 0.19 H ATOM 53 HA PHE A 3 6.824 -1.295 2.599 1.00 0.22 H ATOM 54 HB2 PHE A 3 6.155 0.976 0.717 1.00 0.13 H ATOM 55 HB3 PHE A 3 5.178 0.499 2.101 1.00 0.19 H ATOM 56 HD1 PHE A 3 8.112 2.290 0.993 1.00 0.16 H ATOM 57 HD2 PHE A 3 6.086 0.711 4.382 1.00 0.26 H ATOM 58 HE1 PHE A 3 9.490 3.696 2.466 1.00 0.19 H ATOM 59 HE2 PHE A 3 7.459 2.116 5.861 1.00 0.31 H ATOM 60 HZ PHE A 3 9.166 3.610 4.903 1.00 0.24 H ATOM 80 N CYS A 5 2.637 -4.257 0.085 1.00 0.13 N ATOM 81 CA CYS A 5 1.248 -4.503 0.426 1.00 0.18 C ATOM 82 C CYS A 5 1.096 -5.900 1.013 1.00 0.29 C ATOM 83 O CYS A 5 1.767 -6.842 0.587 1.00 0.33 O ATOM 84 CB CYS A 5 0.351 -4.336 -0.804 1.00 0.13 C ATOM 85 SG CYS A 5 -1.379 -4.778 -0.516 1.00 0.20 S ATOM 86 H CYS A 5 2.883 -4.118 -0.856 1.00 0.11 H ATOM 87 HA CYS A 5 0.957 -3.781 1.172 1.00 0.26 H ATOM 88 HB2 CYS A 5 0.376 -3.303 -1.121 1.00 0.17 H ATOM 89 HB3 CYS A 5 0.724 -4.959 -1.600 1.00 0.13 H ATOM 90 N THR A 6 0.230 -6.024 2.002 1.00 0.42 N ATOM 91 CA THR A 6 0.035 -7.282 2.693 1.00 0.57 C ATOM 92 C THR A 6 -1.394 -7.785 2.537 1.00 0.46 C ATOM 93 O THR A 6 -1.929 -8.464 3.417 1.00 0.49 O ATOM 94 CB THR A 6 0.372 -7.126 4.182 1.00 0.85 C ATOM 95 OG1 THR A 6 -0.196 -5.903 4.677 1.00 1.31 O ATOM 96 CG2 THR A 6 1.878 -7.120 4.400 1.00 1.22 C ATOM 97 H THR A 6 -0.290 -5.244 2.282 1.00 0.45 H ATOM 98 HA THR A 6 0.711 -8.006 2.266 1.00 0.64 H ATOM 99 HB THR A 6 -0.053 -7.958 4.724 1.00 0.76 H ATOM 100 HG1 THR A 6 -0.685 -6.082 5.491 1.00 1.76 H ATOM 101 HG21 THR A 6 2.293 -8.062 4.072 1.00 1.66 H ATOM 102 HG22 THR A 6 2.089 -6.978 5.448 1.00 1.79 H ATOM 103 HG23 THR A 6 2.320 -6.315 3.831 1.00 1.53 H ATOM 104 N TRP A 7 -2.009 -7.458 1.414 1.00 0.44 N ATOM 105 CA TRP A 7 -3.369 -7.878 1.151 1.00 0.38 C ATOM 106 C TRP A 7 -3.359 -9.053 0.183 1.00 0.51 C ATOM 107 O TRP A 7 -3.706 -8.915 -0.990 1.00 0.61 O ATOM 108 CB TRP A 7 -4.183 -6.717 0.581 1.00 0.39 C ATOM 109 CG TRP A 7 -5.647 -6.826 0.859 1.00 0.42 C ATOM 110 CD1 TRP A 7 -6.548 -7.633 0.231 1.00 0.49 C ATOM 111 CD2 TRP A 7 -6.379 -6.086 1.836 1.00 0.51 C ATOM 112 NE1 TRP A 7 -7.799 -7.446 0.768 1.00 0.57 N ATOM 113 CE2 TRP A 7 -7.720 -6.497 1.754 1.00 0.59 C ATOM 114 CE3 TRP A 7 -6.026 -5.116 2.775 1.00 0.62 C ATOM 115 CZ2 TRP A 7 -8.711 -5.970 2.578 1.00 0.73 C ATOM 116 CZ3 TRP A 7 -7.008 -4.591 3.592 1.00 0.78 C ATOM 117 CH2 TRP A 7 -8.337 -5.019 3.488 1.00 0.82 C ATOM 118 H TRP A 7 -1.530 -6.932 0.735 1.00 0.52 H ATOM 119 HA TRP A 7 -3.809 -8.195 2.083 1.00 0.36 H ATOM 120 HB2 TRP A 7 -3.832 -5.794 1.012 1.00 0.42 H ATOM 121 HB3 TRP A 7 -4.049 -6.682 -0.487 1.00 0.45 H ATOM 122 HD1 TRP A 7 -6.299 -8.316 -0.564 1.00 0.55 H ATOM 123 HE1 TRP A 7 -8.617 -7.913 0.488 1.00 0.66 H ATOM 124 HE3 TRP A 7 -5.004 -4.776 2.866 1.00 0.64 H ATOM 125 HZ2 TRP A 7 -9.740 -6.291 2.512 1.00 0.80 H ATOM 126 HZ3 TRP A 7 -6.755 -3.838 4.323 1.00 0.91 H ATOM 127 HH2 TRP A 7 -9.073 -4.581 4.145 1.00 0.95 H ATOM 146 N CYS A 9 -2.078 -9.734 -3.187 1.00 0.41 N ATOM 147 CA CYS A 9 -1.582 -8.430 -3.584 1.00 0.30 C ATOM 148 C CYS A 9 -0.404 -8.021 -2.705 1.00 0.26 C ATOM 149 O CYS A 9 -0.542 -7.885 -1.487 1.00 0.34 O ATOM 150 CB CYS A 9 -2.700 -7.395 -3.490 1.00 0.29 C ATOM 151 SG CYS A 9 -2.232 -5.746 -4.058 1.00 0.23 S ATOM 152 H CYS A 9 -2.911 -9.788 -2.666 1.00 0.39 H ATOM 153 HA CYS A 9 -1.249 -8.498 -4.609 1.00 0.32 H ATOM 154 HB2 CYS A 9 -3.537 -7.721 -4.087 1.00 0.33 H ATOM 155 HB3 CYS A 9 -3.013 -7.310 -2.459 1.00 0.30 H ATOM 156 N GLY A 10 0.750 -7.829 -3.329 1.00 0.25 N ATOM 157 CA GLY A 10 1.941 -7.476 -2.595 1.00 0.27 C ATOM 158 C GLY A 10 2.846 -6.544 -3.375 1.00 0.21 C ATOM 159 O GLY A 10 4.033 -6.824 -3.547 1.00 0.30 O ATOM 160 H GLY A 10 0.792 -7.927 -4.303 1.00 0.32 H ATOM 161 HA2 GLY A 10 1.653 -6.995 -1.672 1.00 0.31 H ATOM 162 HA3 GLY A 10 2.484 -8.377 -2.363 1.00 0.34 H ATOM 163 N LYS A 11 2.286 -5.449 -3.873 1.00 0.17 N ATOM 164 CA LYS A 11 3.081 -4.425 -4.543 1.00 0.16 C ATOM 165 C LYS A 11 4.002 -3.728 -3.548 1.00 0.16 C ATOM 166 O LYS A 11 3.630 -3.508 -2.397 1.00 0.21 O ATOM 167 CB LYS A 11 2.185 -3.396 -5.238 1.00 0.24 C ATOM 168 CG LYS A 11 1.624 -3.873 -6.568 1.00 0.75 C ATOM 169 CD LYS A 11 0.879 -2.758 -7.286 1.00 0.58 C ATOM 170 CE LYS A 11 0.510 -3.148 -8.711 1.00 1.49 C ATOM 171 NZ LYS A 11 -0.428 -4.300 -8.758 1.00 2.05 N1+ ATOM 172 H LYS A 11 1.316 -5.332 -3.796 1.00 0.24 H ATOM 173 HA LYS A 11 3.691 -4.917 -5.287 1.00 0.18 H ATOM 174 HB2 LYS A 11 1.354 -3.161 -4.588 1.00 0.71 H ATOM 175 HB3 LYS A 11 2.757 -2.497 -5.415 1.00 0.81 H ATOM 176 HG2 LYS A 11 2.440 -4.209 -7.191 1.00 1.30 H ATOM 177 HG3 LYS A 11 0.944 -4.690 -6.388 1.00 1.24 H ATOM 178 HD2 LYS A 11 -0.026 -2.536 -6.739 1.00 0.70 H ATOM 179 HD3 LYS A 11 1.508 -1.880 -7.313 1.00 0.86 H ATOM 180 HE2 LYS A 11 0.047 -2.302 -9.193 1.00 2.21 H ATOM 181 HE3 LYS A 11 1.413 -3.411 -9.241 1.00 1.86 H ATOM 182 HZ1 LYS A 11 -1.293 -4.083 -8.224 1.00 2.40 H ATOM 183 HZ2 LYS A 11 0.014 -5.147 -8.349 1.00 2.57 H ATOM 184 HZ3 LYS A 11 -0.689 -4.506 -9.744 1.00 2.43 H ATOM 185 N ARG A 12 5.204 -3.397 -3.994 1.00 0.14 N ATOM 186 CA ARG A 12 6.186 -2.757 -3.134 1.00 0.17 C ATOM 187 C ARG A 12 6.379 -1.299 -3.524 1.00 0.15 C ATOM 188 O ARG A 12 6.570 -0.978 -4.699 1.00 0.24 O ATOM 189 CB ARG A 12 7.522 -3.502 -3.190 1.00 0.26 C ATOM 190 CG ARG A 12 7.432 -4.935 -2.693 1.00 0.83 C ATOM 191 CD ARG A 12 8.787 -5.626 -2.698 1.00 0.78 C ATOM 192 NE ARG A 12 8.698 -6.986 -2.171 1.00 1.85 N ATOM 193 CZ ARG A 12 9.681 -7.602 -1.516 1.00 2.32 C ATOM 194 NH1 ARG A 12 10.861 -7.011 -1.369 1.00 2.15 N1+ ATOM 195 NH2 ARG A 12 9.488 -8.823 -1.030 1.00 3.36 N ATOM 196 H ARG A 12 5.433 -3.576 -4.930 1.00 0.14 H ATOM 197 HA ARG A 12 5.807 -2.792 -2.122 1.00 0.21 H ATOM 198 HB2 ARG A 12 7.867 -3.521 -4.212 1.00 0.90 H ATOM 199 HB3 ARG A 12 8.243 -2.976 -2.583 1.00 0.85 H ATOM 200 HG2 ARG A 12 7.050 -4.929 -1.683 1.00 1.33 H ATOM 201 HG3 ARG A 12 6.755 -5.484 -3.330 1.00 1.38 H ATOM 202 HD2 ARG A 12 9.155 -5.665 -3.712 1.00 0.99 H ATOM 203 HD3 ARG A 12 9.472 -5.057 -2.086 1.00 0.93 H ATOM 204 HE ARG A 12 7.845 -7.462 -2.305 1.00 2.49 H ATOM 205 HH11 ARG A 12 11.019 -6.098 -1.752 1.00 1.82 H ATOM 206 HH12 ARG A 12 11.599 -7.475 -0.876 1.00 2.73 H ATOM 207 HH21 ARG A 12 10.224 -9.292 -0.534 1.00 3.75 H ATOM 208 HH22 ARG A 12 8.609 -9.284 -1.161 1.00 3.87 H ATOM 209 N PHE A 13 6.321 -0.431 -2.530 1.00 0.10 N ATOM 210 CA PHE A 13 6.415 1.003 -2.737 1.00 0.10 C ATOM 211 C PHE A 13 7.645 1.558 -2.027 1.00 0.12 C ATOM 212 O PHE A 13 8.282 0.860 -1.232 1.00 0.18 O ATOM 213 CB PHE A 13 5.146 1.670 -2.209 1.00 0.12 C ATOM 214 CG PHE A 13 3.894 1.124 -2.830 1.00 0.14 C ATOM 215 CD1 PHE A 13 3.426 1.628 -4.032 1.00 0.19 C ATOM 216 CD2 PHE A 13 3.183 0.112 -2.210 1.00 0.16 C ATOM 217 CE1 PHE A 13 2.271 1.134 -4.602 1.00 0.22 C ATOM 218 CE2 PHE A 13 2.027 -0.386 -2.774 1.00 0.20 C ATOM 219 CZ PHE A 13 1.587 0.103 -3.985 1.00 0.21 C ATOM 220 H PHE A 13 6.198 -0.767 -1.615 1.00 0.14 H ATOM 221 HA PHE A 13 6.500 1.189 -3.796 1.00 0.13 H ATOM 222 HB2 PHE A 13 5.081 1.519 -1.140 1.00 0.12 H ATOM 223 HB3 PHE A 13 5.189 2.728 -2.418 1.00 0.14 H ATOM 224 HD1 PHE A 13 3.972 2.419 -4.522 1.00 0.21 H ATOM 225 HD2 PHE A 13 3.540 -0.287 -1.272 1.00 0.16 H ATOM 226 HE1 PHE A 13 1.915 1.536 -5.540 1.00 0.27 H ATOM 227 HE2 PHE A 13 1.481 -1.174 -2.280 1.00 0.22 H ATOM 228 HZ PHE A 13 0.690 -0.294 -4.434 1.00 0.25 H ATOM 229 N THR A 14 7.988 2.801 -2.330 1.00 0.15 N ATOM 230 CA THR A 14 9.164 3.432 -1.750 1.00 0.17 C ATOM 231 C THR A 14 8.806 4.352 -0.586 1.00 0.13 C ATOM 232 O THR A 14 9.668 4.738 0.200 1.00 0.24 O ATOM 233 CB THR A 14 9.945 4.233 -2.809 1.00 0.28 C ATOM 234 OG1 THR A 14 9.038 4.949 -3.666 1.00 0.85 O ATOM 235 CG2 THR A 14 10.829 3.319 -3.644 1.00 0.95 C ATOM 236 H THR A 14 7.436 3.313 -2.965 1.00 0.20 H ATOM 237 HA THR A 14 9.809 2.647 -1.381 1.00 0.23 H ATOM 238 HB THR A 14 10.575 4.948 -2.297 1.00 0.82 H ATOM 239 HG1 THR A 14 8.136 4.903 -3.301 1.00 1.26 H ATOM 240 HG21 THR A 14 10.217 2.587 -4.145 1.00 1.58 H ATOM 241 HG22 THR A 14 11.539 2.817 -3.004 1.00 1.36 H ATOM 242 HG23 THR A 14 11.361 3.905 -4.378 1.00 1.65 H ATOM 243 N ARG A 15 7.535 4.714 -0.487 1.00 0.13 N ATOM 244 CA ARG A 15 7.075 5.591 0.580 1.00 0.18 C ATOM 245 C ARG A 15 5.811 5.026 1.221 1.00 0.14 C ATOM 246 O ARG A 15 4.961 4.436 0.543 1.00 0.13 O ATOM 247 CB ARG A 15 6.807 7.001 0.034 1.00 0.31 C ATOM 248 CG ARG A 15 7.976 7.593 -0.741 1.00 0.38 C ATOM 249 CD ARG A 15 7.687 9.011 -1.209 1.00 0.91 C ATOM 250 NE ARG A 15 7.580 9.948 -0.092 1.00 1.61 N ATOM 251 CZ ARG A 15 7.376 11.259 -0.231 1.00 2.07 C ATOM 252 NH1 ARG A 15 7.225 11.793 -1.439 1.00 1.87 N1+ ATOM 253 NH2 ARG A 15 7.314 12.035 0.843 1.00 3.12 N ATOM 254 H ARG A 15 6.888 4.391 -1.155 1.00 0.20 H ATOM 255 HA ARG A 15 7.855 5.641 1.325 1.00 0.22 H ATOM 256 HB2 ARG A 15 5.953 6.964 -0.621 1.00 0.37 H ATOM 257 HB3 ARG A 15 6.586 7.660 0.862 1.00 0.40 H ATOM 258 HG2 ARG A 15 8.846 7.608 -0.102 1.00 0.69 H ATOM 259 HG3 ARG A 15 8.174 6.972 -1.603 1.00 0.59 H ATOM 260 HD2 ARG A 15 8.488 9.332 -1.858 1.00 1.32 H ATOM 261 HD3 ARG A 15 6.759 9.012 -1.758 1.00 1.67 H ATOM 262 HE ARG A 15 7.673 9.578 0.816 1.00 2.18 H ATOM 263 HH11 ARG A 15 7.260 11.211 -2.257 1.00 1.78 H ATOM 264 HH12 ARG A 15 7.073 12.779 -1.541 1.00 2.28 H ATOM 265 HH21 ARG A 15 7.417 11.638 1.758 1.00 3.70 H ATOM 266 HH22 ARG A 15 7.159 13.022 0.747 1.00 3.46 H ATOM 267 N SER A 16 5.703 5.204 2.535 1.00 0.15 N ATOM 268 CA SER A 16 4.560 4.714 3.298 1.00 0.14 C ATOM 269 C SER A 16 3.249 5.292 2.770 1.00 0.12 C ATOM 270 O SER A 16 2.217 4.626 2.800 1.00 0.15 O ATOM 271 CB SER A 16 4.724 5.074 4.776 1.00 0.22 C ATOM 272 OG SER A 16 5.986 4.657 5.266 1.00 1.22 O ATOM 273 H SER A 16 6.425 5.670 3.012 1.00 0.19 H ATOM 274 HA SER A 16 4.534 3.639 3.200 1.00 0.16 H ATOM 275 HB2 SER A 16 4.639 6.143 4.899 1.00 0.90 H ATOM 276 HB3 SER A 16 3.951 4.583 5.348 1.00 1.04 H ATOM 277 HG SER A 16 6.618 5.384 5.188 1.00 1.52 H ATOM 278 N ASP A 17 3.302 6.526 2.277 1.00 0.14 N ATOM 279 CA ASP A 17 2.117 7.193 1.743 1.00 0.19 C ATOM 280 C ASP A 17 1.632 6.497 0.480 1.00 0.16 C ATOM 281 O ASP A 17 0.429 6.388 0.248 1.00 0.18 O ATOM 282 CB ASP A 17 2.404 8.665 1.452 1.00 0.28 C ATOM 283 CG ASP A 17 1.169 9.421 1.003 1.00 1.40 C ATOM 284 OD1 ASP A 17 0.927 9.505 -0.219 1.00 2.04 O ATOM 285 OD2 ASP A 17 0.435 9.938 1.872 1.00 2.15 O1- ATOM 286 H ASP A 17 4.158 7.003 2.281 1.00 0.15 H ATOM 287 HA ASP A 17 1.342 7.129 2.491 1.00 0.24 H ATOM 288 HB2 ASP A 17 2.782 9.135 2.348 1.00 1.06 H ATOM 289 HB3 ASP A 17 3.149 8.735 0.676 1.00 0.95 H ATOM 290 N GLU A 18 2.574 6.011 -0.325 1.00 0.15 N ATOM 291 CA GLU A 18 2.241 5.260 -1.530 1.00 0.16 C ATOM 292 C GLU A 18 1.466 4.011 -1.151 1.00 0.11 C ATOM 293 O GLU A 18 0.431 3.695 -1.741 1.00 0.13 O ATOM 294 CB GLU A 18 3.504 4.846 -2.288 1.00 0.25 C ATOM 295 CG GLU A 18 4.337 5.996 -2.824 1.00 0.40 C ATOM 296 CD GLU A 18 5.539 5.509 -3.612 1.00 1.31 C ATOM 297 OE1 GLU A 18 6.497 5.002 -2.995 1.00 2.28 O ATOM 298 OE2 GLU A 18 5.537 5.641 -4.852 1.00 1.61 O1- ATOM 299 H GLU A 18 3.512 6.150 -0.096 1.00 0.16 H ATOM 300 HA GLU A 18 1.626 5.882 -2.162 1.00 0.24 H ATOM 301 HB2 GLU A 18 4.127 4.275 -1.621 1.00 0.27 H ATOM 302 HB3 GLU A 18 3.217 4.221 -3.121 1.00 0.28 H ATOM 303 HG2 GLU A 18 3.720 6.604 -3.470 1.00 0.80 H ATOM 304 HG3 GLU A 18 4.685 6.587 -1.994 1.00 0.93 H ATOM 305 N LEU A 19 1.979 3.316 -0.143 1.00 0.11 N ATOM 306 CA LEU A 19 1.360 2.092 0.340 1.00 0.12 C ATOM 307 C LEU A 19 0.001 2.376 0.977 1.00 0.12 C ATOM 308 O LEU A 19 -0.959 1.650 0.742 1.00 0.14 O ATOM 309 CB LEU A 19 2.284 1.392 1.339 1.00 0.14 C ATOM 310 CG LEU A 19 1.697 0.145 2.004 1.00 0.15 C ATOM 311 CD1 LEU A 19 1.315 -0.897 0.962 1.00 0.17 C ATOM 312 CD2 LEU A 19 2.687 -0.437 2.998 1.00 0.17 C ATOM 313 H LEU A 19 2.806 3.636 0.285 1.00 0.12 H ATOM 314 HA LEU A 19 1.211 1.445 -0.510 1.00 0.14 H ATOM 315 HB2 LEU A 19 3.189 1.108 0.821 1.00 0.15 H ATOM 316 HB3 LEU A 19 2.540 2.097 2.112 1.00 0.15 H ATOM 317 HG LEU A 19 0.801 0.422 2.544 1.00 0.15 H ATOM 318 HD11 LEU A 19 0.898 -1.760 1.455 1.00 0.93 H ATOM 319 HD12 LEU A 19 2.193 -1.190 0.405 1.00 0.92 H ATOM 320 HD13 LEU A 19 0.582 -0.480 0.286 1.00 0.94 H ATOM 321 HD21 LEU A 19 2.992 0.332 3.693 1.00 0.94 H ATOM 322 HD22 LEU A 19 3.553 -0.810 2.470 1.00 1.07 H ATOM 323 HD23 LEU A 19 2.219 -1.246 3.539 1.00 1.03 H ATOM 324 N GLN A 20 -0.074 3.431 1.776 1.00 0.15 N ATOM 325 CA GLN A 20 -1.324 3.809 2.430 1.00 0.19 C ATOM 326 C GLN A 20 -2.383 4.193 1.404 1.00 0.15 C ATOM 327 O GLN A 20 -3.534 3.751 1.487 1.00 0.16 O ATOM 328 CB GLN A 20 -1.086 4.957 3.408 1.00 0.27 C ATOM 329 CG GLN A 20 -0.406 4.523 4.694 1.00 1.15 C ATOM 330 CD GLN A 20 -1.262 3.564 5.496 1.00 1.67 C ATOM 331 OE1 GLN A 20 -2.069 3.981 6.325 1.00 2.11 O ATOM 332 NE2 GLN A 20 -1.093 2.273 5.254 1.00 2.50 N ATOM 333 H GLN A 20 0.732 3.972 1.932 1.00 0.17 H ATOM 334 HA GLN A 20 -1.674 2.950 2.981 1.00 0.23 H ATOM 335 HB2 GLN A 20 -0.466 5.700 2.930 1.00 0.82 H ATOM 336 HB3 GLN A 20 -2.037 5.401 3.661 1.00 0.82 H ATOM 337 HG2 GLN A 20 0.526 4.035 4.449 1.00 1.84 H ATOM 338 HG3 GLN A 20 -0.208 5.397 5.297 1.00 1.71 H ATOM 339 HE21 GLN A 20 -0.430 2.011 4.583 1.00 2.87 H ATOM 340 HE22 GLN A 20 -1.647 1.631 5.751 1.00 3.01 H ATOM 341 N ARG A 21 -1.981 5.003 0.435 1.00 0.15 N ATOM 342 CA ARG A 21 -2.858 5.378 -0.665 1.00 0.19 C ATOM 343 C ARG A 21 -3.324 4.129 -1.400 1.00 0.14 C ATOM 344 O ARG A 21 -4.509 3.973 -1.694 1.00 0.16 O ATOM 345 CB ARG A 21 -2.129 6.327 -1.620 1.00 0.28 C ATOM 346 CG ARG A 21 -2.867 6.575 -2.921 1.00 0.90 C ATOM 347 CD ARG A 21 -2.083 7.496 -3.838 1.00 0.92 C ATOM 348 NE ARG A 21 -2.631 7.501 -5.192 1.00 1.52 N ATOM 349 CZ ARG A 21 -2.326 8.404 -6.124 1.00 1.91 C ATOM 350 NH1 ARG A 21 -1.520 9.423 -5.838 1.00 1.87 N1+ ATOM 351 NH2 ARG A 21 -2.831 8.286 -7.345 1.00 2.78 N ATOM 352 H ARG A 21 -1.063 5.358 0.458 1.00 0.17 H ATOM 353 HA ARG A 21 -3.718 5.882 -0.251 1.00 0.24 H ATOM 354 HB2 ARG A 21 -1.990 7.277 -1.126 1.00 0.71 H ATOM 355 HB3 ARG A 21 -1.163 5.910 -1.854 1.00 0.85 H ATOM 356 HG2 ARG A 21 -3.023 5.631 -3.421 1.00 1.39 H ATOM 357 HG3 ARG A 21 -3.821 7.028 -2.699 1.00 1.31 H ATOM 358 HD2 ARG A 21 -2.119 8.498 -3.439 1.00 1.26 H ATOM 359 HD3 ARG A 21 -1.057 7.161 -3.875 1.00 1.23 H ATOM 360 HE ARG A 21 -3.247 6.769 -5.428 1.00 2.02 H ATOM 361 HH11 ARG A 21 -1.136 9.522 -4.914 1.00 1.76 H ATOM 362 HH12 ARG A 21 -1.287 10.094 -6.544 1.00 2.33 H ATOM 363 HH21 ARG A 21 -3.441 7.520 -7.570 1.00 3.23 H ATOM 364 HH22 ARG A 21 -2.608 8.963 -8.051 1.00 3.13 H ATOM 365 N HIS A 22 -2.384 3.228 -1.662 1.00 0.11 N ATOM 366 CA HIS A 22 -2.688 1.962 -2.307 1.00 0.09 C ATOM 367 C HIS A 22 -3.723 1.180 -1.494 1.00 0.11 C ATOM 368 O HIS A 22 -4.712 0.694 -2.038 1.00 0.15 O ATOM 369 CB HIS A 22 -1.401 1.143 -2.485 1.00 0.11 C ATOM 370 CG HIS A 22 -1.642 -0.271 -2.901 1.00 0.11 C ATOM 371 ND1 HIS A 22 -1.698 -0.705 -4.222 1.00 0.18 N ATOM 372 CD2 HIS A 22 -1.905 -1.354 -2.136 1.00 0.11 C ATOM 373 CE1 HIS A 22 -2.006 -2.013 -4.207 1.00 0.21 C ATOM 374 NE2 HIS A 22 -2.137 -2.417 -2.969 1.00 0.15 N ATOM 375 H HIS A 22 -1.454 3.419 -1.410 1.00 0.13 H ATOM 376 HA HIS A 22 -3.103 2.180 -3.279 1.00 0.11 H ATOM 377 HB2 HIS A 22 -0.785 1.609 -3.239 1.00 0.14 H ATOM 378 HB3 HIS A 22 -0.862 1.126 -1.550 1.00 0.12 H ATOM 379 HD1 HIS A 22 -1.543 -0.153 -5.023 1.00 0.24 H ATOM 380 HD2 HIS A 22 -1.904 -1.392 -1.058 1.00 0.14 H ATOM 381 HE1 HIS A 22 -2.118 -2.636 -5.080 1.00 0.28 H ATOM 382 N LYS A 23 -3.496 1.085 -0.190 1.00 0.13 N ATOM 383 CA LYS A 23 -4.384 0.342 0.704 1.00 0.18 C ATOM 384 C LYS A 23 -5.814 0.870 0.651 1.00 0.17 C ATOM 385 O LYS A 23 -6.767 0.127 0.914 1.00 0.21 O ATOM 386 CB LYS A 23 -3.869 0.403 2.144 1.00 0.26 C ATOM 387 CG LYS A 23 -2.633 -0.442 2.409 1.00 0.57 C ATOM 388 CD LYS A 23 -2.940 -1.929 2.339 1.00 0.99 C ATOM 389 CE LYS A 23 -1.765 -2.763 2.822 1.00 1.50 C ATOM 390 NZ LYS A 23 -1.420 -2.475 4.242 1.00 1.93 N1+ ATOM 391 H LYS A 23 -2.701 1.522 0.187 1.00 0.13 H ATOM 392 HA LYS A 23 -4.387 -0.685 0.380 1.00 0.24 H ATOM 393 HB2 LYS A 23 -3.630 1.428 2.379 1.00 0.56 H ATOM 394 HB3 LYS A 23 -4.654 0.068 2.805 1.00 0.66 H ATOM 395 HG2 LYS A 23 -1.884 -0.208 1.668 1.00 1.21 H ATOM 396 HG3 LYS A 23 -2.252 -0.208 3.392 1.00 1.27 H ATOM 397 HD2 LYS A 23 -3.797 -2.139 2.960 1.00 1.75 H ATOM 398 HD3 LYS A 23 -3.160 -2.195 1.317 1.00 1.44 H ATOM 399 HE2 LYS A 23 -2.021 -3.808 2.728 1.00 1.79 H ATOM 400 HE3 LYS A 23 -0.909 -2.546 2.200 1.00 2.05 H ATOM 401 HZ1 LYS A 23 -1.135 -1.481 4.350 1.00 2.29 H ATOM 402 HZ2 LYS A 23 -0.634 -3.083 4.550 1.00 2.36 H ATOM 403 HZ3 LYS A 23 -2.241 -2.656 4.854 1.00 2.11 H ATOM 404 N ARG A 24 -5.971 2.141 0.296 1.00 0.17 N ATOM 405 CA ARG A 24 -7.299 2.735 0.214 1.00 0.23 C ATOM 406 C ARG A 24 -8.144 2.035 -0.848 1.00 0.22 C ATOM 407 O ARG A 24 -9.368 1.987 -0.739 1.00 0.33 O ATOM 408 CB ARG A 24 -7.226 4.237 -0.068 1.00 0.34 C ATOM 409 CG ARG A 24 -6.526 5.023 1.028 1.00 0.92 C ATOM 410 CD ARG A 24 -6.747 6.521 0.883 1.00 0.92 C ATOM 411 NE ARG A 24 -6.282 7.041 -0.403 1.00 1.57 N ATOM 412 CZ ARG A 24 -5.872 8.296 -0.587 1.00 1.89 C ATOM 413 NH1 ARG A 24 -5.792 9.129 0.447 1.00 1.57 N1+ ATOM 414 NH2 ARG A 24 -5.528 8.714 -1.800 1.00 2.84 N ATOM 415 H ARG A 24 -5.178 2.688 0.085 1.00 0.18 H ATOM 416 HA ARG A 24 -7.774 2.587 1.173 1.00 0.28 H ATOM 417 HB2 ARG A 24 -6.692 4.394 -0.993 1.00 0.81 H ATOM 418 HB3 ARG A 24 -8.230 4.622 -0.172 1.00 0.82 H ATOM 419 HG2 ARG A 24 -6.912 4.705 1.985 1.00 1.39 H ATOM 420 HG3 ARG A 24 -5.467 4.819 0.982 1.00 1.39 H ATOM 421 HD2 ARG A 24 -7.803 6.723 0.977 1.00 1.14 H ATOM 422 HD3 ARG A 24 -6.215 7.026 1.677 1.00 1.40 H ATOM 423 HE ARG A 24 -6.302 6.428 -1.174 1.00 2.11 H ATOM 424 HH11 ARG A 24 -5.486 10.075 0.312 1.00 1.94 H ATOM 425 HH12 ARG A 24 -6.032 8.816 1.370 1.00 1.49 H ATOM 426 HH21 ARG A 24 -5.577 8.084 -2.583 1.00 3.18 H ATOM 427 HH22 ARG A 24 -5.216 9.658 -1.942 1.00 3.39 H ATOM 428 N THR A 25 -7.488 1.456 -1.850 1.00 0.21 N ATOM 429 CA THR A 25 -8.203 0.761 -2.912 1.00 0.27 C ATOM 430 C THR A 25 -8.760 -0.570 -2.411 1.00 0.26 C ATOM 431 O THR A 25 -9.750 -1.080 -2.937 1.00 0.34 O ATOM 432 CB THR A 25 -7.316 0.523 -4.155 1.00 0.37 C ATOM 433 OG1 THR A 25 -6.219 -0.346 -3.842 1.00 1.28 O ATOM 434 CG2 THR A 25 -6.779 1.842 -4.693 1.00 1.04 C ATOM 435 H THR A 25 -6.507 1.497 -1.874 1.00 0.23 H ATOM 436 HA THR A 25 -9.032 1.389 -3.208 1.00 0.29 H ATOM 437 HB THR A 25 -7.919 0.062 -4.921 1.00 0.93 H ATOM 438 HG1 THR A 25 -5.631 0.091 -3.206 1.00 1.45 H ATOM 439 HG21 THR A 25 -7.604 2.475 -4.984 1.00 1.50 H ATOM 440 HG22 THR A 25 -6.151 1.652 -5.549 1.00 1.73 H ATOM 441 HG23 THR A 25 -6.201 2.336 -3.925 1.00 1.63 H ATOM 442 N HIS A 26 -8.124 -1.130 -1.385 1.00 0.22 N ATOM 443 CA HIS A 26 -8.628 -2.345 -0.756 1.00 0.25 C ATOM 444 C HIS A 26 -9.714 -1.991 0.245 1.00 0.32 C ATOM 445 O HIS A 26 -10.705 -2.707 0.390 1.00 0.40 O ATOM 446 CB HIS A 26 -7.520 -3.104 -0.022 1.00 0.27 C ATOM 447 CG HIS A 26 -6.461 -3.686 -0.898 1.00 0.23 C ATOM 448 ND1 HIS A 26 -6.674 -4.712 -1.814 1.00 0.26 N ATOM 449 CD2 HIS A 26 -5.137 -3.399 -0.954 1.00 0.20 C ATOM 450 CE1 HIS A 26 -5.489 -5.007 -2.380 1.00 0.26 C ATOM 451 NE2 HIS A 26 -4.560 -4.235 -1.883 1.00 0.21 N ATOM 452 H HIS A 26 -7.302 -0.715 -1.044 1.00 0.22 H ATOM 453 HA HIS A 26 -9.046 -2.974 -1.525 1.00 0.30 H ATOM 454 HB2 HIS A 26 -7.034 -2.430 0.667 1.00 0.30 H ATOM 455 HB3 HIS A 26 -7.965 -3.914 0.537 1.00 0.34 H ATOM 456 HD1 HIS A 26 -7.535 -5.148 -2.009 1.00 0.30 H ATOM 457 HD2 HIS A 26 -4.615 -2.659 -0.369 1.00 0.20 H ATOM 458 HE1 HIS A 26 -5.329 -5.769 -3.127 1.00 0.32 H