ATOM 27 N PRO A 2 11.320 -2.410 1.797 1.00 0.48 N ATOM 28 CA PRO A 2 10.313 -1.616 1.095 1.00 0.37 C ATOM 29 C PRO A 2 8.936 -1.734 1.734 1.00 0.31 C ATOM 30 O PRO A 2 8.695 -2.607 2.569 1.00 0.43 O ATOM 31 CB PRO A 2 10.303 -2.224 -0.307 1.00 0.45 C ATOM 32 CG PRO A 2 10.696 -3.645 -0.101 1.00 0.58 C ATOM 33 CD PRO A 2 11.653 -3.650 1.063 1.00 0.63 C ATOM 34 HA PRO A 2 10.596 -0.574 1.039 1.00 0.40 H ATOM 35 HB2 PRO A 2 9.310 -2.143 -0.730 1.00 0.46 H ATOM 36 HB3 PRO A 2 11.013 -1.705 -0.932 1.00 0.51 H ATOM 37 HG2 PRO A 2 9.821 -4.236 0.130 1.00 0.60 H ATOM 38 HG3 PRO A 2 11.180 -4.024 -0.988 1.00 0.69 H ATOM 39 HD2 PRO A 2 11.489 -4.521 1.682 1.00 0.74 H ATOM 40 HD3 PRO A 2 12.675 -3.624 0.710 1.00 0.73 H ATOM 41 N PHE A 3 8.041 -0.847 1.341 1.00 0.19 N ATOM 42 CA PHE A 3 6.679 -0.856 1.840 1.00 0.16 C ATOM 43 C PHE A 3 5.829 -1.749 0.952 1.00 0.15 C ATOM 44 O PHE A 3 5.188 -1.278 0.016 1.00 0.18 O ATOM 45 CB PHE A 3 6.112 0.565 1.862 1.00 0.14 C ATOM 46 CG PHE A 3 6.856 1.501 2.770 1.00 0.15 C ATOM 47 CD1 PHE A 3 7.912 2.260 2.292 1.00 0.14 C ATOM 48 CD2 PHE A 3 6.494 1.623 4.098 1.00 0.22 C ATOM 49 CE1 PHE A 3 8.594 3.124 3.126 1.00 0.17 C ATOM 50 CE2 PHE A 3 7.171 2.485 4.937 1.00 0.25 C ATOM 51 CZ PHE A 3 8.223 3.237 4.451 1.00 0.21 C ATOM 52 H PHE A 3 8.300 -0.173 0.675 1.00 0.19 H ATOM 53 HA PHE A 3 6.687 -1.256 2.842 1.00 0.22 H ATOM 54 HB2 PHE A 3 6.149 0.975 0.866 1.00 0.13 H ATOM 55 HB3 PHE A 3 5.087 0.531 2.190 1.00 0.19 H ATOM 56 HD1 PHE A 3 8.203 2.171 1.255 1.00 0.16 H ATOM 57 HD2 PHE A 3 5.672 1.035 4.478 1.00 0.26 H ATOM 58 HE1 PHE A 3 9.414 3.711 2.740 1.00 0.19 H ATOM 59 HE2 PHE A 3 6.879 2.571 5.971 1.00 0.31 H ATOM 60 HZ PHE A 3 8.753 3.912 5.105 1.00 0.24 H ATOM 80 N CYS A 5 2.815 -4.311 -0.010 1.00 0.13 N ATOM 81 CA CYS A 5 1.460 -4.707 0.313 1.00 0.18 C ATOM 82 C CYS A 5 1.413 -6.214 0.558 1.00 0.29 C ATOM 83 O CYS A 5 2.111 -6.983 -0.107 1.00 0.33 O ATOM 84 CB CYS A 5 0.501 -4.313 -0.819 1.00 0.13 C ATOM 85 SG CYS A 5 -1.220 -4.789 -0.536 1.00 0.20 S ATOM 86 H CYS A 5 3.025 -4.032 -0.930 1.00 0.11 H ATOM 87 HA CYS A 5 1.171 -4.195 1.218 1.00 0.26 H ATOM 88 HB2 CYS A 5 0.526 -3.240 -0.944 1.00 0.17 H ATOM 89 HB3 CYS A 5 0.827 -4.782 -1.733 1.00 0.13 H ATOM 90 N THR A 6 0.613 -6.625 1.526 1.00 0.42 N ATOM 91 CA THR A 6 0.488 -8.031 1.868 1.00 0.57 C ATOM 92 C THR A 6 -0.977 -8.430 1.977 1.00 0.46 C ATOM 93 O THR A 6 -1.399 -9.033 2.962 1.00 0.49 O ATOM 94 CB THR A 6 1.210 -8.340 3.193 1.00 0.85 C ATOM 95 OG1 THR A 6 0.883 -7.342 4.173 1.00 1.31 O ATOM 96 CG2 THR A 6 2.715 -8.392 2.992 1.00 1.22 C ATOM 97 H THR A 6 0.092 -5.967 2.030 1.00 0.45 H ATOM 98 HA THR A 6 0.954 -8.608 1.082 1.00 0.64 H ATOM 99 HB THR A 6 0.876 -9.304 3.549 1.00 0.76 H ATOM 100 HG1 THR A 6 0.193 -7.684 4.755 1.00 1.76 H ATOM 101 HG21 THR A 6 3.057 -7.447 2.595 1.00 1.66 H ATOM 102 HG22 THR A 6 2.958 -9.183 2.299 1.00 1.79 H ATOM 103 HG23 THR A 6 3.199 -8.581 3.938 1.00 1.53 H ATOM 104 N TRP A 7 -1.755 -8.084 0.959 1.00 0.44 N ATOM 105 CA TRP A 7 -3.182 -8.361 0.963 1.00 0.38 C ATOM 106 C TRP A 7 -3.465 -9.691 0.270 1.00 0.51 C ATOM 107 O TRP A 7 -3.873 -9.729 -0.896 1.00 0.61 O ATOM 108 CB TRP A 7 -3.938 -7.224 0.277 1.00 0.39 C ATOM 109 CG TRP A 7 -5.409 -7.233 0.544 1.00 0.42 C ATOM 110 CD1 TRP A 7 -6.370 -7.876 -0.174 1.00 0.49 C ATOM 111 CD2 TRP A 7 -6.084 -6.555 1.603 1.00 0.51 C ATOM 112 NE1 TRP A 7 -7.603 -7.642 0.376 1.00 0.57 N ATOM 113 CE2 TRP A 7 -7.455 -6.834 1.469 1.00 0.59 C ATOM 114 CE3 TRP A 7 -5.661 -5.740 2.655 1.00 0.62 C ATOM 115 CZ2 TRP A 7 -8.407 -6.325 2.344 1.00 0.73 C ATOM 116 CZ3 TRP A 7 -6.605 -5.235 3.524 1.00 0.78 C ATOM 117 CH2 TRP A 7 -7.965 -5.529 3.365 1.00 0.82 C ATOM 118 H TRP A 7 -1.358 -7.637 0.180 1.00 0.52 H ATOM 119 HA TRP A 7 -3.506 -8.428 1.991 1.00 0.36 H ATOM 120 HB2 TRP A 7 -3.545 -6.279 0.617 1.00 0.42 H ATOM 121 HB3 TRP A 7 -3.794 -7.303 -0.789 1.00 0.45 H ATOM 122 HD1 TRP A 7 -6.173 -8.479 -1.046 1.00 0.55 H ATOM 123 HE1 TRP A 7 -8.455 -7.997 0.041 1.00 0.66 H ATOM 124 HE3 TRP A 7 -4.615 -5.502 2.791 1.00 0.64 H ATOM 125 HZ2 TRP A 7 -9.459 -6.543 2.236 1.00 0.80 H ATOM 126 HZ3 TRP A 7 -6.298 -4.602 4.343 1.00 0.91 H ATOM 127 HH2 TRP A 7 -8.671 -5.111 4.067 1.00 0.95 H ATOM 146 N CYS A 9 -2.033 -9.689 -3.016 1.00 0.41 N ATOM 147 CA CYS A 9 -1.535 -8.474 -3.638 1.00 0.30 C ATOM 148 C CYS A 9 -0.269 -8.011 -2.922 1.00 0.26 C ATOM 149 O CYS A 9 -0.313 -7.670 -1.739 1.00 0.34 O ATOM 150 CB CYS A 9 -2.609 -7.388 -3.584 1.00 0.29 C ATOM 151 SG CYS A 9 -2.046 -5.752 -4.095 1.00 0.23 S ATOM 152 H CYS A 9 -2.894 -9.660 -2.541 1.00 0.39 H ATOM 153 HA CYS A 9 -1.301 -8.694 -4.668 1.00 0.32 H ATOM 154 HB2 CYS A 9 -3.427 -7.668 -4.229 1.00 0.33 H ATOM 155 HB3 CYS A 9 -2.970 -7.307 -2.572 1.00 0.30 H ATOM 156 N GLY A 10 0.853 -8.014 -3.634 1.00 0.25 N ATOM 157 CA GLY A 10 2.121 -7.678 -3.023 1.00 0.27 C ATOM 158 C GLY A 10 2.856 -6.572 -3.745 1.00 0.21 C ATOM 159 O GLY A 10 4.051 -6.679 -4.012 1.00 0.30 O ATOM 160 H GLY A 10 0.819 -8.249 -4.586 1.00 0.32 H ATOM 161 HA2 GLY A 10 1.945 -7.370 -2.004 1.00 0.31 H ATOM 162 HA3 GLY A 10 2.743 -8.559 -3.015 1.00 0.34 H ATOM 163 N LYS A 11 2.138 -5.512 -4.072 1.00 0.17 N ATOM 164 CA LYS A 11 2.735 -4.352 -4.716 1.00 0.16 C ATOM 165 C LYS A 11 3.609 -3.600 -3.713 1.00 0.16 C ATOM 166 O LYS A 11 3.166 -3.300 -2.606 1.00 0.21 O ATOM 167 CB LYS A 11 1.631 -3.449 -5.270 1.00 0.24 C ATOM 168 CG LYS A 11 2.132 -2.300 -6.128 1.00 0.75 C ATOM 169 CD LYS A 11 0.981 -1.607 -6.841 1.00 0.58 C ATOM 170 CE LYS A 11 1.454 -0.411 -7.649 1.00 1.49 C ATOM 171 NZ LYS A 11 0.323 0.275 -8.329 1.00 2.05 N1+ ATOM 172 H LYS A 11 1.181 -5.509 -3.876 1.00 0.24 H ATOM 173 HA LYS A 11 3.353 -4.700 -5.529 1.00 0.18 H ATOM 174 HB2 LYS A 11 0.961 -4.048 -5.869 1.00 0.71 H ATOM 175 HB3 LYS A 11 1.077 -3.032 -4.441 1.00 0.81 H ATOM 176 HG2 LYS A 11 2.633 -1.584 -5.496 1.00 1.30 H ATOM 177 HG3 LYS A 11 2.821 -2.684 -6.864 1.00 1.24 H ATOM 178 HD2 LYS A 11 0.512 -2.313 -7.507 1.00 0.70 H ATOM 179 HD3 LYS A 11 0.264 -1.274 -6.107 1.00 0.86 H ATOM 180 HE2 LYS A 11 1.941 0.288 -6.986 1.00 2.21 H ATOM 181 HE3 LYS A 11 2.160 -0.752 -8.394 1.00 1.86 H ATOM 182 HZ1 LYS A 11 -0.101 -0.349 -9.046 1.00 2.40 H ATOM 183 HZ2 LYS A 11 0.657 1.142 -8.798 1.00 2.57 H ATOM 184 HZ3 LYS A 11 -0.408 0.534 -7.635 1.00 2.43 H ATOM 185 N ARG A 12 4.849 -3.323 -4.088 1.00 0.14 N ATOM 186 CA ARG A 12 5.796 -2.706 -3.164 1.00 0.17 C ATOM 187 C ARG A 12 6.021 -1.236 -3.486 1.00 0.15 C ATOM 188 O ARG A 12 5.975 -0.824 -4.646 1.00 0.24 O ATOM 189 CB ARG A 12 7.130 -3.461 -3.162 1.00 0.26 C ATOM 190 CG ARG A 12 7.872 -3.400 -4.486 1.00 0.83 C ATOM 191 CD ARG A 12 9.242 -4.049 -4.391 1.00 0.78 C ATOM 192 NE ARG A 12 9.984 -3.929 -5.641 1.00 1.85 N ATOM 193 CZ ARG A 12 11.105 -4.592 -5.909 1.00 2.32 C ATOM 194 NH1 ARG A 12 11.627 -5.420 -5.012 1.00 2.15 N1+ ATOM 195 NH2 ARG A 12 11.708 -4.423 -7.079 1.00 3.36 N ATOM 196 H ARG A 12 5.131 -3.526 -5.005 1.00 0.14 H ATOM 197 HA ARG A 12 5.365 -2.766 -2.180 1.00 0.21 H ATOM 198 HB2 ARG A 12 7.767 -3.040 -2.399 1.00 0.90 H ATOM 199 HB3 ARG A 12 6.942 -4.498 -2.929 1.00 0.85 H ATOM 200 HG2 ARG A 12 7.292 -3.918 -5.235 1.00 1.33 H ATOM 201 HG3 ARG A 12 7.990 -2.366 -4.772 1.00 1.38 H ATOM 202 HD2 ARG A 12 9.804 -3.569 -3.603 1.00 0.99 H ATOM 203 HD3 ARG A 12 9.116 -5.096 -4.158 1.00 0.93 H ATOM 204 HE ARG A 12 9.623 -3.316 -6.320 1.00 2.49 H ATOM 205 HH11 ARG A 12 11.178 -5.550 -4.123 1.00 1.82 H ATOM 206 HH12 ARG A 12 12.471 -5.920 -5.220 1.00 2.73 H ATOM 207 HH21 ARG A 12 12.555 -4.923 -7.285 1.00 3.75 H ATOM 208 HH22 ARG A 12 11.321 -3.794 -7.758 1.00 3.87 H ATOM 209 N PHE A 13 6.261 -0.452 -2.444 1.00 0.10 N ATOM 210 CA PHE A 13 6.414 0.986 -2.574 1.00 0.10 C ATOM 211 C PHE A 13 7.647 1.471 -1.826 1.00 0.12 C ATOM 212 O PHE A 13 8.126 0.812 -0.901 1.00 0.18 O ATOM 213 CB PHE A 13 5.176 1.683 -2.018 1.00 0.12 C ATOM 214 CG PHE A 13 3.904 1.186 -2.623 1.00 0.14 C ATOM 215 CD1 PHE A 13 3.439 1.713 -3.813 1.00 0.19 C ATOM 216 CD2 PHE A 13 3.179 0.183 -2.005 1.00 0.16 C ATOM 217 CE1 PHE A 13 2.272 1.249 -4.375 1.00 0.22 C ATOM 218 CE2 PHE A 13 2.012 -0.285 -2.562 1.00 0.20 C ATOM 219 CZ PHE A 13 1.558 0.248 -3.747 1.00 0.21 C ATOM 220 H PHE A 13 6.325 -0.855 -1.549 1.00 0.14 H ATOM 221 HA PHE A 13 6.513 1.223 -3.621 1.00 0.13 H ATOM 222 HB2 PHE A 13 5.122 1.518 -0.953 1.00 0.12 H ATOM 223 HB3 PHE A 13 5.248 2.741 -2.214 1.00 0.14 H ATOM 224 HD1 PHE A 13 3.999 2.493 -4.302 1.00 0.21 H ATOM 225 HD2 PHE A 13 3.540 -0.236 -1.077 1.00 0.16 H ATOM 226 HE1 PHE A 13 1.918 1.666 -5.303 1.00 0.27 H ATOM 227 HE2 PHE A 13 1.454 -1.069 -2.072 1.00 0.22 H ATOM 228 HZ PHE A 13 0.642 -0.116 -4.183 1.00 0.25 H ATOM 229 N THR A 14 8.156 2.625 -2.227 1.00 0.15 N ATOM 230 CA THR A 14 9.299 3.228 -1.566 1.00 0.17 C ATOM 231 C THR A 14 8.858 4.300 -0.570 1.00 0.13 C ATOM 232 O THR A 14 9.684 4.913 0.109 1.00 0.24 O ATOM 233 CB THR A 14 10.259 3.846 -2.597 1.00 0.28 C ATOM 234 OG1 THR A 14 9.503 4.483 -3.634 1.00 0.85 O ATOM 235 CG2 THR A 14 11.174 2.790 -3.202 1.00 0.95 C ATOM 236 H THR A 14 7.759 3.081 -3.001 1.00 0.20 H ATOM 237 HA THR A 14 9.826 2.451 -1.033 1.00 0.23 H ATOM 238 HB THR A 14 10.866 4.588 -2.099 1.00 0.82 H ATOM 239 HG1 THR A 14 9.296 3.836 -4.320 1.00 1.26 H ATOM 240 HG21 THR A 14 11.775 2.343 -2.423 1.00 1.58 H ATOM 241 HG22 THR A 14 11.822 3.252 -3.934 1.00 1.36 H ATOM 242 HG23 THR A 14 10.578 2.028 -3.678 1.00 1.65 H ATOM 243 N ARG A 15 7.550 4.524 -0.485 1.00 0.13 N ATOM 244 CA ARG A 15 7.006 5.511 0.439 1.00 0.18 C ATOM 245 C ARG A 15 5.788 4.946 1.162 1.00 0.14 C ATOM 246 O ARG A 15 4.944 4.273 0.558 1.00 0.13 O ATOM 247 CB ARG A 15 6.599 6.797 -0.293 1.00 0.31 C ATOM 248 CG ARG A 15 7.690 7.409 -1.153 1.00 0.38 C ATOM 249 CD ARG A 15 7.359 8.847 -1.528 1.00 0.91 C ATOM 250 NE ARG A 15 6.029 8.982 -2.127 1.00 1.61 N ATOM 251 CZ ARG A 15 5.330 10.120 -2.131 1.00 2.07 C ATOM 252 NH1 ARG A 15 5.850 11.229 -1.610 1.00 1.87 N1+ ATOM 253 NH2 ARG A 15 4.117 10.158 -2.667 1.00 3.12 N ATOM 254 H ARG A 15 6.938 4.004 -1.048 1.00 0.20 H ATOM 255 HA ARG A 15 7.770 5.741 1.167 1.00 0.22 H ATOM 256 HB2 ARG A 15 5.758 6.578 -0.930 1.00 0.37 H ATOM 257 HB3 ARG A 15 6.297 7.531 0.439 1.00 0.40 H ATOM 258 HG2 ARG A 15 8.620 7.392 -0.606 1.00 0.69 H ATOM 259 HG3 ARG A 15 7.791 6.824 -2.057 1.00 0.59 H ATOM 260 HD2 ARG A 15 7.403 9.457 -0.639 1.00 1.32 H ATOM 261 HD3 ARG A 15 8.094 9.196 -2.235 1.00 1.67 H ATOM 262 HE ARG A 15 5.637 8.185 -2.545 1.00 2.18 H ATOM 263 HH11 ARG A 15 6.772 11.218 -1.209 1.00 1.78 H ATOM 264 HH12 ARG A 15 5.323 12.085 -1.619 1.00 2.28 H ATOM 265 HH21 ARG A 15 3.710 9.326 -3.078 1.00 3.70 H ATOM 266 HH22 ARG A 15 3.598 11.016 -2.673 1.00 3.46 H ATOM 267 N SER A 16 5.703 5.232 2.457 1.00 0.15 N ATOM 268 CA SER A 16 4.559 4.831 3.267 1.00 0.14 C ATOM 269 C SER A 16 3.293 5.503 2.750 1.00 0.12 C ATOM 270 O SER A 16 2.206 4.934 2.819 1.00 0.15 O ATOM 271 CB SER A 16 4.787 5.197 4.742 1.00 0.22 C ATOM 272 OG SER A 16 3.667 4.849 5.539 1.00 1.22 O ATOM 273 H SER A 16 6.433 5.737 2.884 1.00 0.19 H ATOM 274 HA SER A 16 4.449 3.760 3.180 1.00 0.16 H ATOM 275 HB2 SER A 16 5.651 4.666 5.111 1.00 0.90 H ATOM 276 HB3 SER A 16 4.955 6.260 4.826 1.00 1.04 H ATOM 277 HG SER A 16 3.421 3.931 5.361 1.00 1.52 H ATOM 278 N ASP A 17 3.450 6.719 2.230 1.00 0.14 N ATOM 279 CA ASP A 17 2.342 7.455 1.636 1.00 0.19 C ATOM 280 C ASP A 17 1.730 6.658 0.498 1.00 0.16 C ATOM 281 O ASP A 17 0.510 6.540 0.390 1.00 0.18 O ATOM 282 CB ASP A 17 2.819 8.811 1.110 1.00 0.28 C ATOM 283 CG ASP A 17 3.459 9.664 2.183 1.00 1.40 C ATOM 284 OD1 ASP A 17 2.769 10.545 2.740 1.00 2.04 O ATOM 285 OD2 ASP A 17 4.654 9.459 2.477 1.00 2.15 O1- ATOM 286 H ASP A 17 4.336 7.139 2.263 1.00 0.15 H ATOM 287 HA ASP A 17 1.593 7.610 2.397 1.00 0.24 H ATOM 288 HB2 ASP A 17 3.541 8.652 0.327 1.00 1.06 H ATOM 289 HB3 ASP A 17 1.975 9.347 0.708 1.00 0.95 H ATOM 290 N GLU A 18 2.593 6.084 -0.329 1.00 0.15 N ATOM 291 CA GLU A 18 2.157 5.301 -1.471 1.00 0.16 C ATOM 292 C GLU A 18 1.411 4.062 -1.012 1.00 0.11 C ATOM 293 O GLU A 18 0.355 3.733 -1.545 1.00 0.13 O ATOM 294 CB GLU A 18 3.352 4.900 -2.330 1.00 0.25 C ATOM 295 CG GLU A 18 4.033 6.068 -3.015 1.00 0.40 C ATOM 296 CD GLU A 18 3.111 6.807 -3.958 1.00 1.31 C ATOM 297 OE1 GLU A 18 2.884 8.019 -3.758 1.00 2.28 O ATOM 298 OE2 GLU A 18 2.598 6.172 -4.898 1.00 1.61 O1- ATOM 299 H GLU A 18 3.549 6.174 -0.153 1.00 0.16 H ATOM 300 HA GLU A 18 1.492 5.913 -2.058 1.00 0.24 H ATOM 301 HB2 GLU A 18 4.079 4.409 -1.702 1.00 0.27 H ATOM 302 HB3 GLU A 18 3.019 4.210 -3.090 1.00 0.28 H ATOM 303 HG2 GLU A 18 4.375 6.761 -2.261 1.00 0.80 H ATOM 304 HG3 GLU A 18 4.877 5.695 -3.574 1.00 0.93 H ATOM 305 N LEU A 19 1.956 3.387 -0.005 1.00 0.11 N ATOM 306 CA LEU A 19 1.330 2.183 0.525 1.00 0.12 C ATOM 307 C LEU A 19 -0.025 2.506 1.149 1.00 0.12 C ATOM 308 O LEU A 19 -0.976 1.748 0.994 1.00 0.14 O ATOM 309 CB LEU A 19 2.238 1.500 1.551 1.00 0.14 C ATOM 310 CG LEU A 19 1.655 0.232 2.188 1.00 0.15 C ATOM 311 CD1 LEU A 19 1.347 -0.818 1.129 1.00 0.17 C ATOM 312 CD2 LEU A 19 2.612 -0.330 3.226 1.00 0.17 C ATOM 313 H LEU A 19 2.801 3.704 0.387 1.00 0.12 H ATOM 314 HA LEU A 19 1.171 1.510 -0.303 1.00 0.14 H ATOM 315 HB2 LEU A 19 3.169 1.243 1.063 1.00 0.15 H ATOM 316 HB3 LEU A 19 2.449 2.205 2.339 1.00 0.15 H ATOM 317 HG LEU A 19 0.729 0.484 2.686 1.00 0.15 H ATOM 318 HD11 LEU A 19 2.250 -1.064 0.590 1.00 0.93 H ATOM 319 HD12 LEU A 19 0.611 -0.429 0.439 1.00 0.92 H ATOM 320 HD13 LEU A 19 0.959 -1.706 1.604 1.00 0.94 H ATOM 321 HD21 LEU A 19 3.501 -0.695 2.735 1.00 0.94 H ATOM 322 HD22 LEU A 19 2.133 -1.140 3.756 1.00 1.07 H ATOM 323 HD23 LEU A 19 2.882 0.448 3.924 1.00 1.03 H ATOM 324 N GLN A 20 -0.109 3.637 1.848 1.00 0.15 N ATOM 325 CA GLN A 20 -1.370 4.074 2.441 1.00 0.19 C ATOM 326 C GLN A 20 -2.412 4.325 1.354 1.00 0.15 C ATOM 327 O GLN A 20 -3.546 3.836 1.430 1.00 0.16 O ATOM 328 CB GLN A 20 -1.168 5.346 3.271 1.00 0.27 C ATOM 329 CG GLN A 20 -2.465 5.917 3.831 1.00 1.15 C ATOM 330 CD GLN A 20 -2.272 7.221 4.582 1.00 1.67 C ATOM 331 OE1 GLN A 20 -3.013 7.525 5.517 1.00 2.11 O ATOM 332 NE2 GLN A 20 -1.288 8.007 4.177 1.00 2.50 N ATOM 333 H GLN A 20 0.698 4.183 1.975 1.00 0.17 H ATOM 334 HA GLN A 20 -1.721 3.285 3.086 1.00 0.23 H ATOM 335 HB2 GLN A 20 -0.512 5.122 4.097 1.00 0.82 H ATOM 336 HB3 GLN A 20 -0.705 6.100 2.650 1.00 0.82 H ATOM 337 HG2 GLN A 20 -3.146 6.093 3.012 1.00 1.84 H ATOM 338 HG3 GLN A 20 -2.897 5.191 4.505 1.00 1.71 H ATOM 339 HE21 GLN A 20 -0.739 7.714 3.421 1.00 2.87 H ATOM 340 HE22 GLN A 20 -1.145 8.856 4.653 1.00 3.01 H ATOM 341 N ARG A 21 -2.012 5.079 0.337 1.00 0.15 N ATOM 342 CA ARG A 21 -2.892 5.380 -0.786 1.00 0.19 C ATOM 343 C ARG A 21 -3.339 4.090 -1.454 1.00 0.14 C ATOM 344 O ARG A 21 -4.518 3.902 -1.747 1.00 0.16 O ATOM 345 CB ARG A 21 -2.182 6.274 -1.804 1.00 0.28 C ATOM 346 CG ARG A 21 -1.808 7.646 -1.267 1.00 0.90 C ATOM 347 CD ARG A 21 -0.916 8.390 -2.245 1.00 0.92 C ATOM 348 NE ARG A 21 -0.485 9.685 -1.721 1.00 1.52 N ATOM 349 CZ ARG A 21 0.340 10.510 -2.364 1.00 1.91 C ATOM 350 NH1 ARG A 21 0.830 10.172 -3.552 1.00 1.87 N1+ ATOM 351 NH2 ARG A 21 0.678 11.670 -1.815 1.00 2.78 N ATOM 352 H ARG A 21 -1.093 5.433 0.339 1.00 0.17 H ATOM 353 HA ARG A 21 -3.759 5.896 -0.404 1.00 0.24 H ATOM 354 HB2 ARG A 21 -1.280 5.781 -2.127 1.00 0.71 H ATOM 355 HB3 ARG A 21 -2.833 6.410 -2.656 1.00 0.85 H ATOM 356 HG2 ARG A 21 -2.709 8.219 -1.108 1.00 1.39 H ATOM 357 HG3 ARG A 21 -1.283 7.528 -0.330 1.00 1.31 H ATOM 358 HD2 ARG A 21 -0.043 7.788 -2.447 1.00 1.26 H ATOM 359 HD3 ARG A 21 -1.462 8.548 -3.162 1.00 1.23 H ATOM 360 HE ARG A 21 -0.831 9.951 -0.836 1.00 2.02 H ATOM 361 HH11 ARG A 21 0.584 9.291 -3.971 1.00 1.76 H ATOM 362 HH12 ARG A 21 1.448 10.795 -4.042 1.00 2.33 H ATOM 363 HH21 ARG A 21 0.315 11.926 -0.913 1.00 3.23 H ATOM 364 HH22 ARG A 21 1.301 12.296 -2.296 1.00 3.13 H ATOM 365 N HIS A 22 -2.387 3.194 -1.665 1.00 0.11 N ATOM 366 CA HIS A 22 -2.664 1.906 -2.267 1.00 0.09 C ATOM 367 C HIS A 22 -3.631 1.095 -1.404 1.00 0.11 C ATOM 368 O HIS A 22 -4.553 0.469 -1.920 1.00 0.15 O ATOM 369 CB HIS A 22 -1.357 1.139 -2.480 1.00 0.11 C ATOM 370 CG HIS A 22 -1.571 -0.275 -2.905 1.00 0.11 C ATOM 371 ND1 HIS A 22 -1.637 -0.697 -4.229 1.00 0.18 N ATOM 372 CD2 HIS A 22 -1.809 -1.367 -2.144 1.00 0.11 C ATOM 373 CE1 HIS A 22 -1.924 -2.010 -4.221 1.00 0.21 C ATOM 374 NE2 HIS A 22 -2.032 -2.427 -2.984 1.00 0.15 N ATOM 375 H HIS A 22 -1.462 3.409 -1.408 1.00 0.13 H ATOM 376 HA HIS A 22 -3.123 2.085 -3.225 1.00 0.11 H ATOM 377 HB2 HIS A 22 -0.775 1.634 -3.241 1.00 0.14 H ATOM 378 HB3 HIS A 22 -0.799 1.128 -1.554 1.00 0.12 H ATOM 379 HD1 HIS A 22 -1.496 -0.139 -5.027 1.00 0.24 H ATOM 380 HD2 HIS A 22 -1.802 -1.412 -1.065 1.00 0.14 H ATOM 381 HE1 HIS A 22 -2.042 -2.627 -5.098 1.00 0.28 H ATOM 382 N LYS A 23 -3.415 1.109 -0.093 1.00 0.13 N ATOM 383 CA LYS A 23 -4.288 0.408 0.847 1.00 0.18 C ATOM 384 C LYS A 23 -5.739 0.828 0.667 1.00 0.17 C ATOM 385 O LYS A 23 -6.655 0.035 0.904 1.00 0.21 O ATOM 386 CB LYS A 23 -3.855 0.676 2.289 1.00 0.26 C ATOM 387 CG LYS A 23 -2.713 -0.204 2.780 1.00 0.57 C ATOM 388 CD LYS A 23 -3.204 -1.560 3.282 1.00 0.99 C ATOM 389 CE LYS A 23 -4.177 -1.411 4.446 1.00 1.50 C ATOM 390 NZ LYS A 23 -4.451 -2.705 5.128 1.00 1.93 N1+ ATOM 391 H LYS A 23 -2.636 1.601 0.257 1.00 0.13 H ATOM 392 HA LYS A 23 -4.206 -0.648 0.646 1.00 0.24 H ATOM 393 HB2 LYS A 23 -3.540 1.706 2.366 1.00 0.56 H ATOM 394 HB3 LYS A 23 -4.703 0.521 2.936 1.00 0.66 H ATOM 395 HG2 LYS A 23 -2.024 -0.366 1.965 1.00 1.21 H ATOM 396 HG3 LYS A 23 -2.204 0.304 3.585 1.00 1.27 H ATOM 397 HD2 LYS A 23 -3.700 -2.076 2.476 1.00 1.75 H ATOM 398 HD3 LYS A 23 -2.353 -2.138 3.610 1.00 1.44 H ATOM 399 HE2 LYS A 23 -3.757 -0.724 5.162 1.00 1.79 H ATOM 400 HE3 LYS A 23 -5.108 -1.011 4.070 1.00 2.05 H ATOM 401 HZ1 LYS A 23 -3.573 -3.085 5.538 1.00 2.29 H ATOM 402 HZ2 LYS A 23 -4.832 -3.396 4.455 1.00 2.36 H ATOM 403 HZ3 LYS A 23 -5.144 -2.565 5.894 1.00 2.11 H ATOM 404 N ARG A 24 -5.945 2.068 0.232 1.00 0.17 N ATOM 405 CA ARG A 24 -7.292 2.583 0.007 1.00 0.23 C ATOM 406 C ARG A 24 -8.032 1.780 -1.059 1.00 0.22 C ATOM 407 O ARG A 24 -9.260 1.775 -1.092 1.00 0.33 O ATOM 408 CB ARG A 24 -7.254 4.055 -0.398 1.00 0.34 C ATOM 409 CG ARG A 24 -6.782 4.986 0.703 1.00 0.92 C ATOM 410 CD ARG A 24 -6.818 6.435 0.248 1.00 0.92 C ATOM 411 NE ARG A 24 -6.391 7.351 1.302 1.00 1.57 N ATOM 412 CZ ARG A 24 -6.266 8.664 1.140 1.00 1.89 C ATOM 413 NH1 ARG A 24 -6.511 9.216 -0.043 1.00 1.57 N1+ ATOM 414 NH2 ARG A 24 -5.894 9.427 2.158 1.00 2.84 N ATOM 415 H ARG A 24 -5.169 2.653 0.059 1.00 0.18 H ATOM 416 HA ARG A 24 -7.831 2.495 0.938 1.00 0.28 H ATOM 417 HB2 ARG A 24 -6.589 4.166 -1.241 1.00 0.81 H ATOM 418 HB3 ARG A 24 -8.248 4.358 -0.694 1.00 0.82 H ATOM 419 HG2 ARG A 24 -7.427 4.871 1.562 1.00 1.39 H ATOM 420 HG3 ARG A 24 -5.770 4.726 0.974 1.00 1.39 H ATOM 421 HD2 ARG A 24 -6.164 6.551 -0.602 1.00 1.14 H ATOM 422 HD3 ARG A 24 -7.829 6.683 -0.041 1.00 1.40 H ATOM 423 HE ARG A 24 -6.197 6.960 2.185 1.00 2.11 H ATOM 424 HH11 ARG A 24 -6.417 10.207 -0.167 1.00 1.94 H ATOM 425 HH12 ARG A 24 -6.794 8.646 -0.819 1.00 1.49 H ATOM 426 HH21 ARG A 24 -5.797 10.418 2.037 1.00 3.18 H ATOM 427 HH22 ARG A 24 -5.711 9.016 3.058 1.00 3.39 H ATOM 428 N THR A 25 -7.290 1.096 -1.929 1.00 0.21 N ATOM 429 CA THR A 25 -7.908 0.293 -2.974 1.00 0.27 C ATOM 430 C THR A 25 -8.540 -0.959 -2.376 1.00 0.26 C ATOM 431 O THR A 25 -9.516 -1.491 -2.907 1.00 0.34 O ATOM 432 CB THR A 25 -6.903 -0.119 -4.075 1.00 0.37 C ATOM 433 OG1 THR A 25 -5.911 -1.010 -3.546 1.00 1.28 O ATOM 434 CG2 THR A 25 -6.218 1.101 -4.678 1.00 1.04 C ATOM 435 H THR A 25 -6.310 1.135 -1.864 1.00 0.23 H ATOM 436 HA THR A 25 -8.685 0.889 -3.429 1.00 0.29 H ATOM 437 HB THR A 25 -7.445 -0.627 -4.858 1.00 0.93 H ATOM 438 HG1 THR A 25 -5.248 -0.501 -3.056 1.00 1.45 H ATOM 439 HG21 THR A 25 -5.666 1.620 -3.909 1.00 1.50 H ATOM 440 HG22 THR A 25 -6.962 1.763 -5.095 1.00 1.73 H ATOM 441 HG23 THR A 25 -5.539 0.784 -5.456 1.00 1.63 H ATOM 442 N HIS A 26 -7.983 -1.417 -1.258 1.00 0.22 N ATOM 443 CA HIS A 26 -8.499 -2.594 -0.573 1.00 0.25 C ATOM 444 C HIS A 26 -9.513 -2.192 0.493 1.00 0.32 C ATOM 445 O HIS A 26 -10.490 -2.896 0.737 1.00 0.40 O ATOM 446 CB HIS A 26 -7.370 -3.382 0.097 1.00 0.27 C ATOM 447 CG HIS A 26 -6.306 -3.881 -0.832 1.00 0.23 C ATOM 448 ND1 HIS A 26 -6.511 -4.844 -1.816 1.00 0.26 N ATOM 449 CD2 HIS A 26 -4.986 -3.563 -0.886 1.00 0.20 C ATOM 450 CE1 HIS A 26 -5.329 -5.075 -2.417 1.00 0.26 C ATOM 451 NE2 HIS A 26 -4.405 -4.323 -1.879 1.00 0.21 N ATOM 452 H HIS A 26 -7.200 -0.952 -0.890 1.00 0.22 H ATOM 453 HA HIS A 26 -8.985 -3.222 -1.302 1.00 0.30 H ATOM 454 HB2 HIS A 26 -6.891 -2.748 0.829 1.00 0.30 H ATOM 455 HB3 HIS A 26 -7.795 -4.237 0.602 1.00 0.34 H ATOM 456 HD1 HIS A 26 -7.364 -5.289 -2.025 1.00 0.30 H ATOM 457 HD2 HIS A 26 -4.471 -2.851 -0.259 1.00 0.20 H ATOM 458 HE1 HIS A 26 -5.166 -5.780 -3.219 1.00 0.32 H