ATOM 45 N ASP A 5 -8.058 0.586 -0.575 1.00 0.20 N ATOM 46 CA ASP A 5 -6.962 -0.209 -1.100 1.00 0.25 C ATOM 47 C ASP A 5 -7.175 -0.570 -2.562 1.00 0.23 C ATOM 48 O ASP A 5 -8.202 -1.139 -2.934 1.00 0.26 O ATOM 49 CB ASP A 5 -6.791 -1.480 -0.274 1.00 0.32 C ATOM 50 CG ASP A 5 -8.022 -2.364 -0.312 1.00 0.40 C ATOM 51 OD1 ASP A 5 -9.106 -1.890 0.088 1.00 1.11 O ATOM 52 OD2 ASP A 5 -7.902 -3.531 -0.740 1.00 1.24 O ATOM 53 H ASP A 5 -8.962 0.222 -0.598 1.00 0.23 H ATOM 54 HA ASP A 5 -6.067 0.382 -1.020 1.00 0.33 H ATOM 55 HB2 ASP A 5 -5.952 -2.043 -0.657 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.599 -1.205 0.748 1.00 0.38 H ATOM 57 N TYR A 6 -6.189 -0.239 -3.382 1.00 0.19 N ATOM 58 CA TYR A 6 -6.246 -0.529 -4.809 1.00 0.20 C ATOM 59 C TYR A 6 -6.002 -2.014 -5.088 1.00 0.19 C ATOM 60 O TYR A 6 -6.181 -2.473 -6.216 1.00 0.23 O ATOM 61 CB TYR A 6 -5.219 0.321 -5.563 1.00 0.20 C ATOM 62 CG TYR A 6 -5.839 1.330 -6.503 1.00 0.41 C ATOM 63 CD1 TYR A 6 -6.943 2.079 -6.118 1.00 1.24 C ATOM 64 CD2 TYR A 6 -5.319 1.534 -7.776 1.00 1.37 C ATOM 65 CE1 TYR A 6 -7.513 3.003 -6.973 1.00 1.33 C ATOM 66 CE2 TYR A 6 -5.883 2.456 -8.637 1.00 1.54 C ATOM 67 CZ TYR A 6 -6.980 3.187 -8.231 1.00 0.94 C ATOM 68 OH TYR A 6 -7.544 4.106 -9.086 1.00 1.21 O ATOM 69 H TYR A 6 -5.398 0.211 -3.015 1.00 0.18 H ATOM 70 HA TYR A 6 -7.235 -0.270 -5.158 1.00 0.23 H ATOM 71 HB2 TYR A 6 -4.619 0.862 -4.848 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.578 -0.326 -6.145 1.00 0.25 H ATOM 73 HD1 TYR A 6 -7.359 1.933 -5.132 1.00 2.12 H ATOM 74 HD2 TYR A 6 -4.461 0.959 -8.091 1.00 2.21 H ATOM 75 HE1 TYR A 6 -8.371 3.576 -6.655 1.00 2.18 H ATOM 76 HE2 TYR A 6 -5.465 2.600 -9.622 1.00 2.44 H ATOM 77 HH TYR A 6 -6.913 4.807 -9.265 1.00 1.49 H ATOM 78 N LEU A 7 -5.595 -2.767 -4.062 1.00 0.18 N ATOM 79 CA LEU A 7 -5.337 -4.197 -4.229 1.00 0.19 C ATOM 80 C LEU A 7 -5.638 -4.975 -2.954 1.00 0.20 C ATOM 81 O LEU A 7 -5.891 -4.392 -1.900 1.00 0.20 O ATOM 82 CB LEU A 7 -3.882 -4.448 -4.625 1.00 0.18 C ATOM 83 CG LEU A 7 -3.554 -4.221 -6.099 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.127 -3.721 -6.251 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.759 -5.509 -6.884 1.00 0.21 C ATOM 86 H LEU A 7 -5.469 -2.355 -3.179 1.00 0.19 H ATOM 87 HA LEU A 7 -5.980 -4.559 -5.017 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.252 -3.814 -4.029 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.643 -5.468 -4.387 1.00 0.18 H ATOM 90 HG LEU A 7 -4.218 -3.471 -6.501 1.00 0.24 H ATOM 91 HD11 LEU A 7 -1.538 -4.056 -5.409 1.00 1.03 H ATOM 92 HD12 LEU A 7 -2.125 -2.642 -6.286 1.00 1.07 H ATOM 93 HD13 LEU A 7 -1.704 -4.112 -7.164 1.00 1.01 H ATOM 94 HD21 LEU A 7 -2.929 -5.656 -7.559 1.00 1.04 H ATOM 95 HD22 LEU A 7 -4.676 -5.443 -7.450 1.00 1.02 H ATOM 96 HD23 LEU A 7 -3.818 -6.343 -6.198 1.00 1.01 H ATOM 97 N PRO A 8 -5.604 -6.316 -3.042 1.00 0.21 N ATOM 98 CA PRO A 8 -5.862 -7.206 -1.912 1.00 0.23 C ATOM 99 C PRO A 8 -4.884 -7.030 -0.780 1.00 0.21 C ATOM 100 O PRO A 8 -3.846 -6.381 -0.907 1.00 0.18 O ATOM 101 CB PRO A 8 -5.718 -8.607 -2.487 1.00 0.26 C ATOM 102 CG PRO A 8 -5.944 -8.419 -3.927 1.00 0.25 C ATOM 103 CD PRO A 8 -5.310 -7.095 -4.254 1.00 0.22 C ATOM 104 HA PRO A 8 -6.865 -7.077 -1.534 1.00 0.25 H ATOM 105 HB2 PRO A 8 -4.726 -8.986 -2.285 1.00 0.26 H ATOM 106 HB3 PRO A 8 -6.459 -9.260 -2.051 1.00 0.29 H ATOM 107 HG2 PRO A 8 -5.474 -9.218 -4.469 1.00 0.23 H ATOM 108 HG3 PRO A 8 -7.004 -8.388 -4.116 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.246 -7.207 -4.395 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.763 -6.649 -5.124 1.00 0.23 H ATOM 111 N LYS A 9 -5.245 -7.633 0.324 1.00 0.23 N ATOM 112 CA LYS A 9 -4.430 -7.591 1.532 1.00 0.23 C ATOM 113 C LYS A 9 -3.049 -8.197 1.283 1.00 0.22 C ATOM 114 O LYS A 9 -2.103 -7.933 2.025 1.00 0.22 O ATOM 115 CB LYS A 9 -5.130 -8.340 2.666 1.00 0.26 C ATOM 116 CG LYS A 9 -6.576 -7.918 2.871 1.00 0.30 C ATOM 117 CD LYS A 9 -7.171 -8.559 4.114 1.00 1.00 C ATOM 118 CE LYS A 9 -6.769 -7.809 5.374 1.00 1.48 C ATOM 119 NZ LYS A 9 -7.082 -6.357 5.278 1.00 2.12 N ATOM 120 H LYS A 9 -6.085 -8.143 0.313 1.00 0.25 H ATOM 121 HA LYS A 9 -4.311 -6.556 1.816 1.00 0.22 H ATOM 122 HB2 LYS A 9 -5.114 -9.398 2.446 1.00 0.28 H ATOM 123 HB3 LYS A 9 -4.591 -8.164 3.584 1.00 0.27 H ATOM 124 HG2 LYS A 9 -6.615 -6.844 2.978 1.00 0.86 H ATOM 125 HG3 LYS A 9 -7.154 -8.218 2.009 1.00 0.79 H ATOM 126 HD2 LYS A 9 -8.248 -8.551 4.031 1.00 1.52 H ATOM 127 HD3 LYS A 9 -6.821 -9.578 4.185 1.00 1.72 H ATOM 128 HE2 LYS A 9 -7.303 -8.229 6.213 1.00 2.03 H ATOM 129 HE3 LYS A 9 -5.707 -7.931 5.526 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -7.854 -6.201 4.599 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -6.243 -5.831 4.959 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -7.373 -5.992 6.208 1.00 2.60 H ATOM 133 N SER A 10 -2.944 -9.017 0.240 1.00 0.22 N ATOM 134 CA SER A 10 -1.683 -9.670 -0.100 1.00 0.23 C ATOM 135 C SER A 10 -0.796 -8.776 -0.967 1.00 0.22 C ATOM 136 O SER A 10 0.425 -8.762 -0.805 1.00 0.24 O ATOM 137 CB SER A 10 -1.952 -10.990 -0.825 1.00 0.27 C ATOM 138 OG SER A 10 -0.741 -11.657 -1.137 1.00 1.24 O ATOM 139 H SER A 10 -3.735 -9.195 -0.310 1.00 0.23 H ATOM 140 HA SER A 10 -1.163 -9.881 0.822 1.00 0.23 H ATOM 141 HB2 SER A 10 -2.548 -11.630 -0.193 1.00 1.04 H ATOM 142 HB3 SER A 10 -2.486 -10.791 -1.743 1.00 0.97 H ATOM 143 HG SER A 10 -0.801 -12.575 -0.861 1.00 1.69 H ATOM 144 N GLU A 11 -1.407 -8.038 -1.889 1.00 0.23 N ATOM 145 CA GLU A 11 -0.662 -7.157 -2.777 1.00 0.26 C ATOM 146 C GLU A 11 -0.096 -5.979 -2.011 1.00 0.26 C ATOM 147 O GLU A 11 1.017 -5.521 -2.270 1.00 0.30 O ATOM 148 CB GLU A 11 -1.593 -6.638 -3.867 1.00 0.31 C ATOM 149 CG GLU A 11 -1.290 -7.176 -5.252 1.00 0.38 C ATOM 150 CD GLU A 11 -0.473 -6.210 -6.089 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.375 -5.496 -5.513 1.00 1.16 O ATOM 152 OE2 GLU A 11 -0.681 -6.169 -7.320 1.00 1.31 O ATOM 153 H GLU A 11 -2.381 -8.086 -1.981 1.00 0.22 H ATOM 154 HA GLU A 11 0.144 -7.717 -3.220 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.602 -6.921 -3.613 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.530 -5.558 -3.895 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.740 -8.100 -5.155 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.227 -7.364 -5.756 1.00 0.38 H ATOM 159 N CYS A 12 -0.881 -5.495 -1.071 1.00 0.26 N ATOM 160 CA CYS A 12 -0.489 -4.367 -0.256 1.00 0.30 C ATOM 161 C CYS A 12 0.033 -4.848 1.084 1.00 0.24 C ATOM 162 O CYS A 12 -0.725 -5.337 1.923 1.00 0.28 O ATOM 163 CB CYS A 12 -1.676 -3.435 -0.075 1.00 0.46 C ATOM 164 SG CYS A 12 -1.845 -2.205 -1.386 1.00 0.80 S ATOM 165 H CYS A 12 -1.758 -5.908 -0.926 1.00 0.24 H ATOM 166 HA CYS A 12 0.300 -3.840 -0.771 1.00 0.35 H ATOM 167 HB2 CYS A 12 -2.580 -4.018 -0.069 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.582 -2.896 0.865 1.00 0.45 H ATOM 169 N THR A 13 1.336 -4.725 1.270 1.00 0.22 N ATOM 170 CA THR A 13 1.972 -5.165 2.498 1.00 0.20 C ATOM 171 C THR A 13 2.687 -4.006 3.175 1.00 0.22 C ATOM 172 O THR A 13 3.270 -3.156 2.506 1.00 0.23 O ATOM 173 CB THR A 13 2.956 -6.300 2.186 1.00 0.19 C ATOM 174 OG1 THR A 13 3.761 -5.974 1.069 1.00 0.19 O ATOM 175 CG2 THR A 13 2.266 -7.613 1.872 1.00 0.21 C ATOM 176 H THR A 13 1.889 -4.335 0.556 1.00 0.28 H ATOM 177 HA THR A 13 1.203 -5.537 3.159 1.00 0.25 H ATOM 178 HB THR A 13 3.608 -6.454 3.036 1.00 0.24 H ATOM 179 HG1 THR A 13 4.688 -6.067 1.304 1.00 0.78 H ATOM 180 HG21 THR A 13 1.780 -7.545 0.904 1.00 1.03 H ATOM 181 HG22 THR A 13 1.526 -7.821 2.630 1.00 1.04 H ATOM 182 HG23 THR A 13 2.995 -8.408 1.853 1.00 1.04 H ATOM 183 N GLN A 14 2.647 -3.976 4.507 1.00 0.29 N ATOM 184 CA GLN A 14 3.311 -2.915 5.262 1.00 0.33 C ATOM 185 C GLN A 14 4.728 -2.720 4.736 1.00 0.28 C ATOM 186 O GLN A 14 5.273 -1.616 4.758 1.00 0.31 O ATOM 187 CB GLN A 14 3.334 -3.256 6.754 1.00 0.42 C ATOM 188 CG GLN A 14 1.985 -3.703 7.297 1.00 0.72 C ATOM 189 CD GLN A 14 0.864 -2.741 6.948 1.00 0.88 C ATOM 190 OE1 GLN A 14 0.693 -1.710 7.598 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.092 -3.072 5.917 1.00 0.77 N ATOM 192 H GLN A 14 2.171 -4.684 4.989 1.00 0.34 H ATOM 193 HA GLN A 14 2.754 -2.002 5.115 1.00 0.35 H ATOM 194 HB2 GLN A 14 4.046 -4.052 6.918 1.00 0.67 H ATOM 195 HB3 GLN A 14 3.649 -2.383 7.306 1.00 0.49 H ATOM 196 HG2 GLN A 14 1.748 -4.673 6.886 1.00 1.40 H ATOM 197 HG3 GLN A 14 2.053 -3.777 8.373 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.282 -3.909 5.443 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.639 -2.466 5.673 1.00 1.26 H ATOM 200 N PHE A 15 5.296 -3.808 4.231 1.00 0.25 N ATOM 201 CA PHE A 15 6.627 -3.796 3.652 1.00 0.26 C ATOM 202 C PHE A 15 6.699 -2.839 2.467 1.00 0.22 C ATOM 203 O PHE A 15 7.710 -2.173 2.252 1.00 0.24 O ATOM 204 CB PHE A 15 6.995 -5.212 3.208 1.00 0.29 C ATOM 205 CG PHE A 15 7.919 -5.918 4.155 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.273 -5.627 4.158 1.00 1.14 C ATOM 207 CD2 PHE A 15 7.439 -6.870 5.040 1.00 1.25 C ATOM 208 CE1 PHE A 15 10.133 -6.270 5.025 1.00 1.17 C ATOM 209 CE2 PHE A 15 8.295 -7.518 5.911 1.00 1.29 C ATOM 210 CZ PHE A 15 9.644 -7.218 5.903 1.00 0.52 C ATOM 211 H PHE A 15 4.791 -4.647 4.228 1.00 0.26 H ATOM 212 HA PHE A 15 7.322 -3.472 4.412 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.090 -5.798 3.138 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.460 -5.175 2.239 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.657 -4.886 3.472 1.00 2.00 H ATOM 216 HD2 PHE A 15 6.385 -7.105 5.045 1.00 2.10 H ATOM 217 HE1 PHE A 15 11.186 -6.032 5.016 1.00 2.01 H ATOM 218 HE2 PHE A 15 7.909 -8.259 6.596 1.00 2.15 H ATOM 219 HZ PHE A 15 10.314 -7.723 6.583 1.00 0.58 H ATOM 220 N ARG A 16 5.618 -2.783 1.701 1.00 0.19 N ATOM 221 CA ARG A 16 5.546 -1.917 0.531 1.00 0.20 C ATOM 222 C ARG A 16 5.706 -0.453 0.915 1.00 0.17 C ATOM 223 O ARG A 16 6.444 0.283 0.267 1.00 0.19 O ATOM 224 CB ARG A 16 4.221 -2.140 -0.201 1.00 0.32 C ATOM 225 CG ARG A 16 3.928 -3.599 -0.478 1.00 0.24 C ATOM 226 CD ARG A 16 4.947 -4.204 -1.429 1.00 0.40 C ATOM 227 NE ARG A 16 4.925 -5.665 -1.399 1.00 0.78 N ATOM 228 CZ ARG A 16 5.653 -6.434 -2.205 1.00 0.89 C ATOM 229 NH1 ARG A 16 6.460 -5.887 -3.106 1.00 1.49 N ATOM 230 NH2 ARG A 16 5.575 -7.754 -2.110 1.00 1.39 N ATOM 231 H ARG A 16 4.847 -3.342 1.929 1.00 0.18 H ATOM 232 HA ARG A 16 6.357 -2.184 -0.128 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.416 -1.742 0.395 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.247 -1.623 -1.141 1.00 0.47 H ATOM 235 HG2 ARG A 16 3.957 -4.138 0.453 1.00 0.23 H ATOM 236 HG3 ARG A 16 2.945 -3.680 -0.914 1.00 0.37 H ATOM 237 HD2 ARG A 16 4.727 -3.872 -2.433 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.932 -3.863 -1.147 1.00 0.69 H ATOM 239 HE ARG A 16 4.338 -6.095 -0.743 1.00 1.52 H ATOM 240 HH11 ARG A 16 6.524 -4.892 -3.183 1.00 1.80 H ATOM 241 HH12 ARG A 16 7.004 -6.470 -3.709 1.00 1.98 H ATOM 242 HH21 ARG A 16 4.969 -8.172 -1.433 1.00 1.96 H ATOM 243 HH22 ARG A 16 6.121 -8.332 -2.716 1.00 1.54 H ATOM 244 N CYS A 17 5.022 -0.029 1.968 1.00 0.24 N ATOM 245 CA CYS A 17 5.116 1.356 2.415 1.00 0.33 C ATOM 246 C CYS A 17 6.479 1.642 3.036 1.00 0.34 C ATOM 247 O CYS A 17 6.907 2.791 3.119 1.00 0.45 O ATOM 248 CB CYS A 17 4.017 1.676 3.419 1.00 0.48 C ATOM 249 SG CYS A 17 2.426 2.121 2.658 1.00 0.58 S ATOM 250 H CYS A 17 4.448 -0.657 2.455 1.00 0.27 H ATOM 251 HA CYS A 17 4.994 1.986 1.552 1.00 0.36 H ATOM 252 HB2 CYS A 17 3.852 0.818 4.050 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.338 2.507 4.025 1.00 0.83 H ATOM 254 N ARG A 18 7.150 0.594 3.482 1.00 0.30 N ATOM 255 CA ARG A 18 8.463 0.739 4.102 1.00 0.40 C ATOM 256 C ARG A 18 9.509 1.173 3.107 1.00 0.41 C ATOM 257 O ARG A 18 10.314 2.069 3.361 1.00 0.51 O ATOM 258 CB ARG A 18 8.934 -0.602 4.669 1.00 0.45 C ATOM 259 CG ARG A 18 9.377 -0.530 6.121 1.00 0.60 C ATOM 260 CD ARG A 18 8.675 -1.574 6.974 1.00 1.08 C ATOM 261 NE ARG A 18 7.317 -1.167 7.329 1.00 1.48 N ATOM 262 CZ ARG A 18 6.622 -1.698 8.332 1.00 2.14 C ATOM 263 NH1 ARG A 18 7.152 -2.656 9.082 1.00 2.62 N ATOM 264 NH2 ARG A 18 5.393 -1.270 8.587 1.00 2.87 N ATOM 265 H ARG A 18 6.750 -0.294 3.403 1.00 0.26 H ATOM 266 HA ARG A 18 8.399 1.452 4.889 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.129 -1.317 4.590 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.783 -0.951 4.067 1.00 0.57 H ATOM 269 HG2 ARG A 18 10.443 -0.698 6.171 1.00 1.04 H ATOM 270 HG3 ARG A 18 9.148 0.453 6.508 1.00 1.01 H ATOM 271 HD2 ARG A 18 8.630 -2.500 6.422 1.00 1.66 H ATOM 272 HD3 ARG A 18 9.244 -1.722 7.880 1.00 1.70 H ATOM 273 HE ARG A 18 6.901 -0.462 6.791 1.00 1.87 H ATOM 274 HH11 ARG A 18 8.078 -2.984 8.896 1.00 2.57 H ATOM 275 HH12 ARG A 18 6.625 -3.050 9.835 1.00 3.34 H ATOM 276 HH21 ARG A 18 4.989 -0.548 8.025 1.00 3.09 H ATOM 277 HH22 ARG A 18 4.871 -1.668 9.340 1.00 3.44 H ATOM 278 N THR A 19 9.534 0.455 2.013 1.00 0.36 N ATOM 279 CA THR A 19 10.526 0.655 0.988 1.00 0.41 C ATOM 280 C THR A 19 9.938 1.110 -0.351 1.00 0.38 C ATOM 281 O THR A 19 10.589 1.832 -1.106 1.00 0.59 O ATOM 282 CB THR A 19 11.270 -0.664 0.878 1.00 0.48 C ATOM 283 OG1 THR A 19 12.164 -0.678 -0.220 1.00 0.56 O ATOM 284 CG2 THR A 19 10.335 -1.844 0.757 1.00 0.46 C ATOM 285 H THR A 19 8.896 -0.282 1.917 1.00 0.31 H ATOM 286 HA THR A 19 11.216 1.407 1.336 1.00 0.48 H ATOM 287 HB THR A 19 11.829 -0.804 1.799 1.00 0.55 H ATOM 288 HG1 THR A 19 12.646 0.152 -0.251 1.00 1.06 H ATOM 289 HG21 THR A 19 10.905 -2.746 0.600 1.00 1.13 H ATOM 290 HG22 THR A 19 9.661 -1.688 -0.071 1.00 1.04 H ATOM 291 HG23 THR A 19 9.765 -1.931 1.677 1.00 1.15 H ATOM 292 N SER A 20 8.714 0.681 -0.648 1.00 0.33 N ATOM 293 CA SER A 20 8.058 1.046 -1.905 1.00 0.32 C ATOM 294 C SER A 20 7.178 2.284 -1.738 1.00 0.28 C ATOM 295 O SER A 20 6.146 2.239 -1.070 1.00 0.42 O ATOM 296 CB SER A 20 7.219 -0.125 -2.423 1.00 0.35 C ATOM 297 OG SER A 20 7.914 -0.845 -3.426 1.00 0.73 O ATOM 298 H SER A 20 8.243 0.102 -0.013 1.00 0.47 H ATOM 299 HA SER A 20 8.830 1.267 -2.627 1.00 0.40 H ATOM 300 HB2 SER A 20 6.997 -0.795 -1.606 1.00 0.64 H ATOM 301 HB3 SER A 20 6.297 0.251 -2.841 1.00 0.58 H ATOM 302 HG SER A 20 7.856 -0.372 -4.259 1.00 0.97 H ATOM 303 N MET A 21 7.594 3.389 -2.349 1.00 0.27 N ATOM 304 CA MET A 21 6.848 4.644 -2.267 1.00 0.25 C ATOM 305 C MET A 21 5.649 4.662 -3.215 1.00 0.25 C ATOM 306 O MET A 21 4.797 5.543 -3.123 1.00 0.38 O ATOM 307 CB MET A 21 7.772 5.824 -2.584 1.00 0.35 C ATOM 308 CG MET A 21 8.278 6.552 -1.350 1.00 0.42 C ATOM 309 SD MET A 21 9.939 6.040 -0.873 1.00 0.95 S ATOM 310 CE MET A 21 10.921 6.869 -2.121 1.00 1.66 C ATOM 311 H MET A 21 8.425 3.363 -2.867 1.00 0.40 H ATOM 312 HA MET A 21 6.487 4.748 -1.255 1.00 0.26 H ATOM 313 HB2 MET A 21 8.626 5.458 -3.134 1.00 0.43 H ATOM 314 HB3 MET A 21 7.236 6.532 -3.199 1.00 0.42 H ATOM 315 HG2 MET A 21 8.289 7.613 -1.555 1.00 0.66 H ATOM 316 HG3 MET A 21 7.604 6.353 -0.530 1.00 0.42 H ATOM 317 HE1 MET A 21 10.693 7.925 -2.115 1.00 2.14 H ATOM 318 HE2 MET A 21 10.691 6.457 -3.092 1.00 2.17 H ATOM 319 HE3 MET A 21 11.970 6.726 -1.908 1.00 2.19 H ATOM 320 N LYS A 22 5.587 3.702 -4.130 1.00 0.28 N ATOM 321 CA LYS A 22 4.487 3.640 -5.090 1.00 0.35 C ATOM 322 C LYS A 22 3.260 2.950 -4.497 1.00 0.32 C ATOM 323 O LYS A 22 2.148 3.471 -4.564 1.00 0.47 O ATOM 324 CB LYS A 22 4.933 2.905 -6.355 1.00 0.45 C ATOM 325 CG LYS A 22 4.293 3.440 -7.627 1.00 0.58 C ATOM 326 CD LYS A 22 3.466 2.373 -8.329 1.00 1.33 C ATOM 327 CE LYS A 22 4.314 1.552 -9.286 1.00 1.62 C ATOM 328 NZ LYS A 22 4.729 0.253 -8.687 1.00 2.35 N ATOM 329 H LYS A 22 6.296 3.027 -4.170 1.00 0.37 H ATOM 330 HA LYS A 22 4.222 4.653 -5.352 1.00 0.39 H ATOM 331 HB2 LYS A 22 6.005 2.997 -6.452 1.00 0.48 H ATOM 332 HB3 LYS A 22 4.677 1.860 -6.259 1.00 0.47 H ATOM 333 HG2 LYS A 22 3.650 4.269 -7.374 1.00 1.38 H ATOM 334 HG3 LYS A 22 5.072 3.776 -8.296 1.00 1.13 H ATOM 335 HD2 LYS A 22 3.040 1.715 -7.586 1.00 1.94 H ATOM 336 HD3 LYS A 22 2.674 2.854 -8.885 1.00 2.10 H ATOM 337 HE2 LYS A 22 3.740 1.358 -10.180 1.00 1.80 H ATOM 338 HE3 LYS A 22 5.197 2.119 -9.542 1.00 2.10 H ATOM 339 HZ1 LYS A 22 5.015 -0.411 -9.434 1.00 2.86 H ATOM 340 HZ2 LYS A 22 3.939 -0.163 -8.153 1.00 2.67 H ATOM 341 HZ3 LYS A 22 5.531 0.398 -8.040 1.00 2.77 H ATOM 342 N TYR A 23 3.471 1.771 -3.930 1.00 0.24 N ATOM 343 CA TYR A 23 2.386 0.992 -3.338 1.00 0.23 C ATOM 344 C TYR A 23 1.634 1.774 -2.269 1.00 0.25 C ATOM 345 O TYR A 23 0.474 1.486 -1.975 1.00 0.33 O ATOM 346 CB TYR A 23 2.944 -0.281 -2.712 1.00 0.25 C ATOM 347 CG TYR A 23 3.238 -1.372 -3.708 1.00 0.25 C ATOM 348 CD1 TYR A 23 3.928 -1.099 -4.879 1.00 1.26 C ATOM 349 CD2 TYR A 23 2.831 -2.675 -3.472 1.00 1.16 C ATOM 350 CE1 TYR A 23 4.204 -2.099 -5.792 1.00 1.26 C ATOM 351 CE2 TYR A 23 3.103 -3.681 -4.375 1.00 1.18 C ATOM 352 CZ TYR A 23 3.789 -3.389 -5.535 1.00 0.36 C ATOM 353 OH TYR A 23 4.062 -4.389 -6.440 1.00 0.44 O ATOM 354 H TYR A 23 4.380 1.407 -3.916 1.00 0.30 H ATOM 355 HA TYR A 23 1.702 0.723 -4.126 1.00 0.26 H ATOM 356 HB2 TYR A 23 3.864 -0.045 -2.199 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.228 -0.666 -1.999 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.250 -0.086 -5.073 1.00 2.17 H ATOM 359 HD2 TYR A 23 2.292 -2.899 -2.564 1.00 2.06 H ATOM 360 HE1 TYR A 23 4.742 -1.868 -6.699 1.00 2.17 H ATOM 361 HE2 TYR A 23 2.777 -4.689 -4.169 1.00 2.10 H ATOM 362 HH TYR A 23 4.301 -5.191 -5.969 1.00 0.83 H ATOM 363 N ARG A 24 2.311 2.737 -1.666 1.00 0.25 N ATOM 364 CA ARG A 24 1.713 3.533 -0.593 1.00 0.29 C ATOM 365 C ARG A 24 0.670 4.517 -1.112 1.00 0.31 C ATOM 366 O ARG A 24 -0.495 4.468 -0.722 1.00 0.32 O ATOM 367 CB ARG A 24 2.792 4.315 0.170 1.00 0.35 C ATOM 368 CG ARG A 24 4.200 3.769 0.008 1.00 0.36 C ATOM 369 CD ARG A 24 5.150 4.375 1.027 1.00 0.31 C ATOM 370 NE ARG A 24 6.505 3.845 0.897 1.00 0.36 N ATOM 371 CZ ARG A 24 7.605 4.532 1.209 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.515 5.765 1.694 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.797 3.977 1.049 1.00 0.47 N ATOM 374 H ARG A 24 3.241 2.898 -1.930 1.00 0.28 H ATOM 375 HA ARG A 24 1.231 2.854 0.091 1.00 0.30 H ATOM 376 HB2 ARG A 24 2.791 5.334 -0.181 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.547 4.310 1.221 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.178 2.699 0.137 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.555 4.006 -0.985 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.176 5.444 0.881 1.00 0.33 H ATOM 381 HD3 ARG A 24 4.781 4.157 2.019 1.00 0.42 H ATOM 382 HE ARG A 24 6.602 2.927 0.558 1.00 0.40 H ATOM 383 HH11 ARG A 24 6.620 6.187 1.830 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.346 6.271 1.924 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.871 3.046 0.695 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.623 4.490 1.283 1.00 0.50 H ATOM 387 N LEU A 25 1.105 5.429 -1.964 1.00 0.32 N ATOM 388 CA LEU A 25 0.220 6.450 -2.509 1.00 0.37 C ATOM 389 C LEU A 25 -0.375 6.051 -3.853 1.00 0.36 C ATOM 390 O LEU A 25 -1.529 6.357 -4.151 1.00 0.39 O ATOM 391 CB LEU A 25 0.994 7.756 -2.660 1.00 0.42 C ATOM 392 CG LEU A 25 1.860 8.152 -1.451 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.214 7.717 -0.137 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.258 7.563 -1.577 1.00 0.42 C ATOM 395 H LEU A 25 2.052 5.431 -2.217 1.00 0.32 H ATOM 396 HA LEU A 25 -0.586 6.602 -1.805 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.639 7.660 -3.527 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.287 8.550 -2.844 1.00 0.45 H ATOM 399 HG LEU A 25 1.955 9.226 -1.431 1.00 0.47 H ATOM 400 HD11 LEU A 25 0.150 7.602 -0.278 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.397 8.466 0.619 1.00 1.08 H ATOM 402 HD13 LEU A 25 1.640 6.775 0.183 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.973 8.360 -1.714 1.00 1.04 H ATOM 404 HD22 LEU A 25 3.294 6.899 -2.426 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.502 7.012 -0.679 1.00 1.06 H ATOM 406 N ASN A 26 0.435 5.405 -4.675 1.00 0.34 N ATOM 407 CA ASN A 26 0.010 5.004 -6.009 1.00 0.36 C ATOM 408 C ASN A 26 -1.000 3.856 -5.981 1.00 0.32 C ATOM 409 O ASN A 26 -1.945 3.843 -6.769 1.00 0.38 O ATOM 410 CB ASN A 26 1.234 4.617 -6.830 1.00 0.37 C ATOM 411 CG ASN A 26 1.045 4.876 -8.312 1.00 0.54 C ATOM 412 OD1 ASN A 26 0.343 4.135 -8.999 1.00 1.22 O ATOM 413 ND2 ASN A 26 1.674 5.934 -8.812 1.00 1.28 N ATOM 414 H ASN A 26 1.354 5.220 -4.389 1.00 0.32 H ATOM 415 HA ASN A 26 -0.458 5.859 -6.473 1.00 0.42 H ATOM 416 HB2 ASN A 26 2.079 5.199 -6.484 1.00 0.36 H ATOM 417 HB3 ASN A 26 1.440 3.567 -6.686 1.00 0.34 H ATOM 418 HD21 ASN A 26 2.216 6.479 -8.206 1.00 1.98 H ATOM 419 HD22 ASN A 26 1.569 6.125 -9.768 1.00 1.37 H ATOM 420 N LEU A 27 -0.815 2.902 -5.074 1.00 0.27 N ATOM 421 CA LEU A 27 -1.742 1.776 -4.972 1.00 0.27 C ATOM 422 C LEU A 27 -2.752 2.015 -3.846 1.00 0.25 C ATOM 423 O LEU A 27 -3.601 2.899 -3.957 1.00 0.28 O ATOM 424 CB LEU A 27 -0.984 0.461 -4.765 1.00 0.29 C ATOM 425 CG LEU A 27 -0.512 -0.223 -6.048 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.516 0.634 -6.765 1.00 0.91 C ATOM 427 CD2 LEU A 27 0.056 -1.598 -5.736 1.00 1.05 C ATOM 428 H LEU A 27 -0.052 2.959 -4.462 1.00 0.27 H ATOM 429 HA LEU A 27 -2.284 1.720 -5.906 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.124 0.658 -4.145 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.633 -0.226 -4.243 1.00 0.63 H ATOM 432 HG LEU A 27 -1.357 -0.352 -6.709 1.00 0.93 H ATOM 433 HD11 LEU A 27 1.122 0.009 -7.404 1.00 1.50 H ATOM 434 HD12 LEU A 27 1.146 1.124 -6.038 1.00 1.21 H ATOM 435 HD13 LEU A 27 0.010 1.377 -7.363 1.00 1.49 H ATOM 436 HD21 LEU A 27 1.030 -1.491 -5.281 1.00 1.42 H ATOM 437 HD22 LEU A 27 0.145 -2.167 -6.649 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.605 -2.113 -5.054 1.00 1.69 H ATOM 439 N CYS A 28 -2.670 1.239 -2.764 1.00 0.25 N ATOM 440 CA CYS A 28 -3.590 1.404 -1.653 1.00 0.23 C ATOM 441 C CYS A 28 -3.043 2.406 -0.653 1.00 0.22 C ATOM 442 O CYS A 28 -1.834 2.503 -0.450 1.00 0.22 O ATOM 443 CB CYS A 28 -3.769 0.073 -0.959 1.00 0.25 C ATOM 444 SG CYS A 28 -2.212 -0.553 -0.296 1.00 0.50 S ATOM 445 H CYS A 28 -1.979 0.545 -2.708 1.00 0.29 H ATOM 446 HA CYS A 28 -4.541 1.745 -2.025 1.00 0.25 H ATOM 447 HB2 CYS A 28 -4.461 0.185 -0.137 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.151 -0.653 -1.661 1.00 0.26 H ATOM 449 N LYS A 29 -3.942 3.122 -0.014 1.00 0.24 N ATOM 450 CA LYS A 29 -3.571 4.096 0.991 1.00 0.27 C ATOM 451 C LYS A 29 -3.337 3.431 2.340 1.00 0.27 C ATOM 452 O LYS A 29 -2.277 3.563 2.941 1.00 0.30 O ATOM 453 CB LYS A 29 -4.644 5.175 1.098 1.00 0.33 C ATOM 454 CG LYS A 29 -4.769 6.016 -0.163 1.00 0.31 C ATOM 455 CD LYS A 29 -4.120 7.381 0.008 1.00 0.81 C ATOM 456 CE LYS A 29 -4.949 8.477 -0.643 1.00 0.97 C ATOM 457 NZ LYS A 29 -4.810 8.471 -2.126 1.00 1.30 N ATOM 458 H LYS A 29 -4.887 2.970 -0.202 1.00 0.26 H ATOM 459 HA LYS A 29 -2.648 4.556 0.672 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.596 4.702 1.286 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.404 5.830 1.923 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.282 5.497 -0.978 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.816 6.150 -0.392 1.00 0.56 H ATOM 464 HD2 LYS A 29 -4.025 7.594 1.062 1.00 1.21 H ATOM 465 HD3 LYS A 29 -3.141 7.363 -0.447 1.00 1.28 H ATOM 466 HE2 LYS A 29 -5.987 8.325 -0.388 1.00 1.60 H ATOM 467 HE3 LYS A 29 -4.621 9.433 -0.263 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -4.866 9.443 -2.494 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -5.571 7.907 -2.554 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -3.895 8.060 -2.398 1.00 1.88 H ATOM 471 N LYS A 30 -4.362 2.746 2.826 1.00 0.27 N ATOM 472 CA LYS A 30 -4.304 2.092 4.126 1.00 0.31 C ATOM 473 C LYS A 30 -3.636 0.716 4.106 1.00 0.29 C ATOM 474 O LYS A 30 -2.708 0.466 4.873 1.00 0.31 O ATOM 475 CB LYS A 30 -5.711 1.946 4.696 1.00 0.36 C ATOM 476 CG LYS A 30 -5.742 1.188 6.009 1.00 0.46 C ATOM 477 CD LYS A 30 -5.388 2.093 7.172 1.00 0.57 C ATOM 478 CE LYS A 30 -6.071 1.649 8.455 1.00 1.03 C ATOM 479 NZ LYS A 30 -5.459 2.279 9.658 1.00 1.66 N ATOM 480 H LYS A 30 -5.193 2.703 2.309 1.00 0.26 H ATOM 481 HA LYS A 30 -3.740 2.733 4.784 1.00 0.35 H ATOM 482 HB2 LYS A 30 -6.125 2.927 4.859 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.325 1.416 3.983 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.730 0.784 6.161 1.00 0.47 H ATOM 485 HG3 LYS A 30 -5.021 0.384 5.959 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.318 2.069 7.317 1.00 0.73 H ATOM 487 HD3 LYS A 30 -5.699 3.099 6.936 1.00 0.87 H ATOM 488 HE2 LYS A 30 -7.114 1.924 8.407 1.00 1.61 H ATOM 489 HE3 LYS A 30 -5.987 0.575 8.540 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -4.494 2.602 9.441 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -5.415 1.593 10.438 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -6.027 3.096 9.961 1.00 2.11 H ATOM 493 N THR A 31 -4.154 -0.195 3.289 1.00 0.28 N ATOM 494 CA THR A 31 -3.636 -1.562 3.256 1.00 0.32 C ATOM 495 C THR A 31 -2.116 -1.620 3.159 1.00 0.30 C ATOM 496 O THR A 31 -1.494 -2.555 3.663 1.00 0.37 O ATOM 497 CB THR A 31 -4.260 -2.353 2.115 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.672 -2.356 2.223 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.802 -3.790 2.090 1.00 0.54 C ATOM 500 H THR A 31 -4.928 0.040 2.729 1.00 0.28 H ATOM 501 HA THR A 31 -3.926 -2.030 4.185 1.00 0.36 H ATOM 502 HB THR A 31 -3.986 -1.898 1.174 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.927 -2.704 3.080 1.00 1.01 H ATOM 504 HG21 THR A 31 -2.727 -3.826 2.199 1.00 1.19 H ATOM 505 HG22 THR A 31 -4.088 -4.243 1.155 1.00 1.16 H ATOM 506 HG23 THR A 31 -4.262 -4.324 2.906 1.00 1.18 H ATOM 507 N CYS A 32 -1.520 -0.630 2.520 1.00 0.24 N ATOM 508 CA CYS A 32 -0.060 -0.604 2.382 1.00 0.26 C ATOM 509 C CYS A 32 0.592 -0.221 3.706 1.00 0.24 C ATOM 510 O CYS A 32 1.793 -0.410 3.900 1.00 0.26 O ATOM 511 CB CYS A 32 0.380 0.359 1.271 1.00 0.31 C ATOM 512 SG CYS A 32 2.171 0.700 1.233 1.00 0.89 S ATOM 513 H CYS A 32 -2.070 0.094 2.141 1.00 0.22 H ATOM 514 HA CYS A 32 0.258 -1.604 2.122 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.122 -0.068 0.315 1.00 0.47 H ATOM 516 HB3 CYS A 32 -0.133 1.301 1.393 1.00 0.43 H ATOM 517 N GLY A 33 -0.214 0.309 4.614 1.00 0.24 N ATOM 518 CA GLY A 33 0.286 0.707 5.917 1.00 0.29 C ATOM 519 C GLY A 33 0.860 2.112 5.931 1.00 0.35 C ATOM 520 O GLY A 33 1.994 2.319 6.362 1.00 0.46 O ATOM 521 H GLY A 33 -1.163 0.421 4.398 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.524 0.656 6.629 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.058 0.014 6.218 1.00 0.29 H ATOM 524 N THR A 34 0.076 3.084 5.469 1.00 0.34 N ATOM 525 CA THR A 34 0.525 4.475 5.446 1.00 0.44 C ATOM 526 C THR A 34 -0.594 5.433 5.846 1.00 0.52 C ATOM 527 O THR A 34 -0.341 6.458 6.480 1.00 0.68 O ATOM 528 CB THR A 34 1.061 4.856 4.064 1.00 0.51 C ATOM 529 OG1 THR A 34 1.195 6.261 3.948 1.00 1.06 O ATOM 530 CG2 THR A 34 0.192 4.386 2.923 1.00 0.54 C ATOM 531 H THR A 34 -0.820 2.862 5.144 1.00 0.32 H ATOM 532 HA THR A 34 1.326 4.568 6.164 1.00 0.50 H ATOM 533 HB THR A 34 2.033 4.415 3.938 1.00 0.78 H ATOM 534 HG1 THR A 34 1.707 6.596 4.687 1.00 1.39 H ATOM 535 HG21 THR A 34 0.751 4.435 2.001 1.00 1.16 H ATOM 536 HG22 THR A 34 -0.679 5.020 2.851 1.00 1.26 H ATOM 537 HG23 THR A 34 -0.116 3.367 3.103 1.00 1.18 H ATOM 538 N CYS A 35 -1.829 5.105 5.475 1.00 0.49 N ATOM 539 CA CYS A 35 -2.970 5.960 5.806 1.00 0.62 C ATOM 540 C CYS A 35 -2.965 6.328 7.287 1.00 0.95 C ATOM 541 O CYS A 35 -3.314 7.483 7.610 1.00 1.71 O ATOM 542 CB CYS A 35 -4.294 5.276 5.450 1.00 1.04 C ATOM 543 SG CYS A 35 -5.766 6.278 5.853 1.00 1.59 S ATOM 544 OXT CYS A 35 -2.612 5.459 8.111 1.00 1.64 O ATOM 545 H CYS A 35 -1.976 4.278 4.967 1.00 0.43 H ATOM 546 HA CYS A 35 -2.879 6.866 5.224 1.00 1.30 H ATOM 547 HB2 CYS A 35 -4.314 5.073 4.389 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.370 4.345 5.992 1.00 1.53 H