ATOM 45 N ASP A 5 -7.942 0.526 -0.146 1.00 0.20 N ATOM 46 CA ASP A 5 -6.923 -0.293 -0.772 1.00 0.25 C ATOM 47 C ASP A 5 -7.213 -0.498 -2.254 1.00 0.23 C ATOM 48 O ASP A 5 -8.276 -0.993 -2.631 1.00 0.26 O ATOM 49 CB ASP A 5 -6.840 -1.645 -0.065 1.00 0.32 C ATOM 50 CG ASP A 5 -8.128 -2.436 -0.175 1.00 0.40 C ATOM 51 OD1 ASP A 5 -9.204 -1.809 -0.268 1.00 1.11 O ATOM 52 OD2 ASP A 5 -8.061 -3.684 -0.167 1.00 1.24 O ATOM 53 H ASP A 5 -8.834 0.156 -0.023 1.00 0.23 H ATOM 54 HA ASP A 5 -5.978 0.218 -0.665 1.00 0.33 H ATOM 55 HB2 ASP A 5 -6.044 -2.228 -0.501 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.629 -1.479 0.979 1.00 0.38 H ATOM 57 N TYR A 6 -6.254 -0.118 -3.085 1.00 0.19 N ATOM 58 CA TYR A 6 -6.383 -0.258 -4.533 1.00 0.20 C ATOM 59 C TYR A 6 -6.145 -1.702 -4.977 1.00 0.19 C ATOM 60 O TYR A 6 -6.248 -2.015 -6.162 1.00 0.23 O ATOM 61 CB TYR A 6 -5.386 0.663 -5.243 1.00 0.20 C ATOM 62 CG TYR A 6 -5.779 1.004 -6.663 1.00 0.41 C ATOM 63 CD1 TYR A 6 -6.822 1.884 -6.923 1.00 1.24 C ATOM 64 CD2 TYR A 6 -5.105 0.447 -7.743 1.00 1.37 C ATOM 65 CE1 TYR A 6 -7.183 2.199 -8.219 1.00 1.33 C ATOM 66 CE2 TYR A 6 -5.461 0.758 -9.042 1.00 1.54 C ATOM 67 CZ TYR A 6 -6.500 1.633 -9.275 1.00 0.94 C ATOM 68 OH TYR A 6 -6.857 1.945 -10.567 1.00 1.21 O ATOM 69 H TYR A 6 -5.436 0.263 -2.713 1.00 0.18 H ATOM 70 HA TYR A 6 -7.385 0.032 -4.808 1.00 0.23 H ATOM 71 HB2 TYR A 6 -5.305 1.586 -4.692 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.416 0.181 -5.272 1.00 0.25 H ATOM 73 HD1 TYR A 6 -7.356 2.325 -6.094 1.00 2.12 H ATOM 74 HD2 TYR A 6 -4.292 -0.239 -7.558 1.00 2.21 H ATOM 75 HE1 TYR A 6 -7.997 2.885 -8.401 1.00 2.18 H ATOM 76 HE2 TYR A 6 -4.925 0.315 -9.869 1.00 2.44 H ATOM 77 HH TYR A 6 -6.787 1.161 -11.116 1.00 1.49 H ATOM 78 N LEU A 7 -5.823 -2.574 -4.023 1.00 0.18 N ATOM 79 CA LEU A 7 -5.561 -3.978 -4.322 1.00 0.19 C ATOM 80 C LEU A 7 -5.801 -4.845 -3.092 1.00 0.20 C ATOM 81 O LEU A 7 -6.077 -4.334 -2.006 1.00 0.20 O ATOM 82 CB LEU A 7 -4.117 -4.158 -4.792 1.00 0.18 C ATOM 83 CG LEU A 7 -3.869 -3.903 -6.279 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.545 -3.184 -6.475 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.890 -5.213 -7.054 1.00 0.21 C ATOM 86 H LEU A 7 -5.756 -2.267 -3.096 1.00 0.19 H ATOM 87 HA LEU A 7 -6.231 -4.289 -5.109 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.493 -3.493 -4.223 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.815 -5.164 -4.573 1.00 0.18 H ATOM 90 HG LEU A 7 -4.652 -3.271 -6.667 1.00 0.24 H ATOM 91 HD11 LEU A 7 -2.718 -2.120 -6.532 1.00 1.03 H ATOM 92 HD12 LEU A 7 -2.082 -3.525 -7.389 1.00 1.07 H ATOM 93 HD13 LEU A 7 -1.895 -3.399 -5.639 1.00 1.01 H ATOM 94 HD21 LEU A 7 -4.006 -6.038 -6.366 1.00 1.04 H ATOM 95 HD22 LEU A 7 -2.963 -5.327 -7.597 1.00 1.02 H ATOM 96 HD23 LEU A 7 -4.716 -5.207 -7.750 1.00 1.01 H ATOM 97 N PRO A 8 -5.691 -6.174 -3.243 1.00 0.21 N ATOM 98 CA PRO A 8 -5.886 -7.121 -2.149 1.00 0.23 C ATOM 99 C PRO A 8 -4.955 -6.886 -0.990 1.00 0.21 C ATOM 100 O PRO A 8 -3.980 -6.139 -1.076 1.00 0.18 O ATOM 101 CB PRO A 8 -5.595 -8.478 -2.768 1.00 0.26 C ATOM 102 CG PRO A 8 -5.873 -8.268 -4.195 1.00 0.25 C ATOM 103 CD PRO A 8 -5.363 -6.883 -4.489 1.00 0.22 C ATOM 104 HA PRO A 8 -6.905 -7.102 -1.793 1.00 0.25 H ATOM 105 HB2 PRO A 8 -4.563 -8.747 -2.596 1.00 0.26 H ATOM 106 HB3 PRO A 8 -6.249 -9.224 -2.342 1.00 0.29 H ATOM 107 HG2 PRO A 8 -5.350 -9.005 -4.774 1.00 0.23 H ATOM 108 HG3 PRO A 8 -6.936 -8.322 -4.360 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.296 -6.900 -4.655 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.873 -6.448 -5.333 1.00 0.23 H ATOM 111 N LYS A 9 -5.279 -7.551 0.090 1.00 0.23 N ATOM 112 CA LYS A 9 -4.495 -7.462 1.315 1.00 0.23 C ATOM 113 C LYS A 9 -3.057 -7.922 1.079 1.00 0.22 C ATOM 114 O LYS A 9 -2.157 -7.599 1.854 1.00 0.22 O ATOM 115 CB LYS A 9 -5.137 -8.308 2.416 1.00 0.26 C ATOM 116 CG LYS A 9 -6.607 -7.995 2.643 1.00 0.30 C ATOM 117 CD LYS A 9 -6.810 -7.133 3.879 1.00 1.00 C ATOM 118 CE LYS A 9 -8.283 -7.000 4.229 1.00 1.48 C ATOM 119 NZ LYS A 9 -8.851 -8.279 4.738 1.00 2.12 N ATOM 120 H LYS A 9 -6.067 -8.137 0.049 1.00 0.25 H ATOM 121 HA LYS A 9 -4.484 -6.429 1.628 1.00 0.22 H ATOM 122 HB2 LYS A 9 -5.050 -9.351 2.148 1.00 0.28 H ATOM 123 HB3 LYS A 9 -4.606 -8.137 3.341 1.00 0.27 H ATOM 124 HG2 LYS A 9 -6.990 -7.468 1.783 1.00 0.86 H ATOM 125 HG3 LYS A 9 -7.147 -8.922 2.769 1.00 0.79 H ATOM 126 HD2 LYS A 9 -6.292 -7.586 4.711 1.00 1.52 H ATOM 127 HD3 LYS A 9 -6.403 -6.150 3.690 1.00 1.72 H ATOM 128 HE2 LYS A 9 -8.392 -6.241 4.989 1.00 2.03 H ATOM 129 HE3 LYS A 9 -8.825 -6.702 3.343 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -8.283 -9.082 4.399 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -9.828 -8.395 4.403 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -8.850 -8.282 5.778 1.00 2.60 H ATOM 133 N SER A 10 -2.851 -8.689 0.010 1.00 0.22 N ATOM 134 CA SER A 10 -1.528 -9.208 -0.321 1.00 0.23 C ATOM 135 C SER A 10 -0.702 -8.212 -1.138 1.00 0.22 C ATOM 136 O SER A 10 0.506 -8.092 -0.934 1.00 0.24 O ATOM 137 CB SER A 10 -1.657 -10.523 -1.091 1.00 0.27 C ATOM 138 OG SER A 10 -0.633 -11.432 -0.726 1.00 1.24 O ATOM 139 H SER A 10 -3.609 -8.922 -0.564 1.00 0.23 H ATOM 140 HA SER A 10 -1.012 -9.402 0.607 1.00 0.23 H ATOM 141 HB2 SER A 10 -2.614 -10.973 -0.873 1.00 1.04 H ATOM 142 HB3 SER A 10 -1.586 -10.326 -2.151 1.00 0.97 H ATOM 143 HG SER A 10 -0.775 -11.729 0.176 1.00 1.69 H ATOM 144 N GLU A 11 -1.342 -7.518 -2.077 1.00 0.23 N ATOM 145 CA GLU A 11 -0.635 -6.563 -2.925 1.00 0.26 C ATOM 146 C GLU A 11 -0.046 -5.424 -2.120 1.00 0.26 C ATOM 147 O GLU A 11 1.057 -4.955 -2.399 1.00 0.30 O ATOM 148 CB GLU A 11 -1.595 -5.984 -3.954 1.00 0.31 C ATOM 149 CG GLU A 11 -1.321 -6.440 -5.373 1.00 0.38 C ATOM 150 CD GLU A 11 -0.565 -5.409 -6.187 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.190 -4.616 -5.586 1.00 1.16 O ATOM 152 OE2 GLU A 11 -0.727 -5.394 -7.426 1.00 1.31 O ATOM 153 H GLU A 11 -2.303 -7.659 -2.217 1.00 0.22 H ATOM 154 HA GLU A 11 0.161 -7.086 -3.427 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.599 -6.284 -3.692 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.531 -4.900 -3.919 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.737 -7.348 -5.340 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.266 -6.639 -5.854 1.00 0.38 H ATOM 159 N CYS A 12 -0.786 -4.983 -1.125 1.00 0.26 N ATOM 160 CA CYS A 12 -0.332 -3.895 -0.282 1.00 0.30 C ATOM 161 C CYS A 12 0.132 -4.443 1.053 1.00 0.24 C ATOM 162 O CYS A 12 -0.669 -4.808 1.911 1.00 0.28 O ATOM 163 CB CYS A 12 -1.423 -2.830 -0.104 1.00 0.46 C ATOM 164 SG CYS A 12 -3.094 -3.328 -0.634 1.00 0.80 S ATOM 165 H CYS A 12 -1.656 -5.401 -0.956 1.00 0.24 H ATOM 166 HA CYS A 12 0.517 -3.441 -0.773 1.00 0.35 H ATOM 167 HB2 CYS A 12 -1.483 -2.547 0.936 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.148 -1.966 -0.691 1.00 0.45 H ATOM 169 N THR A 13 1.443 -4.522 1.203 1.00 0.22 N ATOM 170 CA THR A 13 2.044 -5.050 2.413 1.00 0.20 C ATOM 171 C THR A 13 2.819 -3.964 3.140 1.00 0.22 C ATOM 172 O THR A 13 3.406 -3.086 2.509 1.00 0.23 O ATOM 173 CB THR A 13 2.971 -6.219 2.054 1.00 0.19 C ATOM 174 OG1 THR A 13 3.763 -5.904 0.925 1.00 0.19 O ATOM 175 CG2 THR A 13 2.220 -7.495 1.730 1.00 0.21 C ATOM 176 H THR A 13 2.025 -4.228 0.470 1.00 0.28 H ATOM 177 HA THR A 13 1.254 -5.408 3.053 1.00 0.25 H ATOM 178 HB THR A 13 3.637 -6.418 2.884 1.00 0.24 H ATOM 179 HG1 THR A 13 3.219 -5.924 0.134 1.00 0.78 H ATOM 180 HG21 THR A 13 1.415 -7.629 2.437 1.00 1.03 H ATOM 181 HG22 THR A 13 2.895 -8.335 1.789 1.00 1.04 H ATOM 182 HG23 THR A 13 1.813 -7.429 0.727 1.00 1.04 H ATOM 183 N GLN A 14 2.834 -4.030 4.470 1.00 0.29 N ATOM 184 CA GLN A 14 3.564 -3.050 5.269 1.00 0.33 C ATOM 185 C GLN A 14 4.963 -2.862 4.692 1.00 0.28 C ATOM 186 O GLN A 14 5.554 -1.785 4.782 1.00 0.31 O ATOM 187 CB GLN A 14 3.636 -3.500 6.729 1.00 0.42 C ATOM 188 CG GLN A 14 2.303 -3.984 7.283 1.00 0.72 C ATOM 189 CD GLN A 14 1.161 -3.027 6.989 1.00 0.88 C ATOM 190 OE1 GLN A 14 1.036 -1.980 7.625 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.319 -3.380 6.021 1.00 0.77 N ATOM 192 H GLN A 14 2.357 -4.758 4.919 1.00 0.34 H ATOM 193 HA GLN A 14 3.035 -2.111 5.211 1.00 0.35 H ATOM 194 HB2 GLN A 14 4.350 -4.306 6.810 1.00 0.67 H ATOM 195 HB3 GLN A 14 3.973 -2.670 7.333 1.00 0.49 H ATOM 196 HG2 GLN A 14 2.071 -4.942 6.844 1.00 1.40 H ATOM 197 HG3 GLN A 14 2.393 -4.094 8.354 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.475 -4.228 5.553 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.426 -2.777 5.814 1.00 1.26 H ATOM 200 N PHE A 15 5.461 -3.923 4.068 1.00 0.25 N ATOM 201 CA PHE A 15 6.762 -3.913 3.426 1.00 0.26 C ATOM 202 C PHE A 15 6.803 -2.906 2.279 1.00 0.22 C ATOM 203 O PHE A 15 7.781 -2.179 2.113 1.00 0.24 O ATOM 204 CB PHE A 15 7.081 -5.316 2.909 1.00 0.29 C ATOM 205 CG PHE A 15 8.040 -6.073 3.780 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.397 -5.801 3.724 1.00 1.14 C ATOM 207 CD2 PHE A 15 7.590 -7.051 4.651 1.00 1.25 C ATOM 208 CE1 PHE A 15 10.289 -6.490 4.519 1.00 1.17 C ATOM 209 CE2 PHE A 15 8.478 -7.745 5.451 1.00 1.29 C ATOM 210 CZ PHE A 15 9.830 -7.464 5.385 1.00 0.52 C ATOM 211 H PHE A 15 4.922 -4.739 4.018 1.00 0.26 H ATOM 212 HA PHE A 15 7.498 -3.634 4.164 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.164 -5.884 2.863 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.498 -5.248 1.920 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.756 -5.039 3.048 1.00 2.00 H ATOM 216 HD2 PHE A 15 6.534 -7.271 4.702 1.00 2.10 H ATOM 217 HE1 PHE A 15 11.344 -6.267 4.464 1.00 2.01 H ATOM 218 HE2 PHE A 15 8.116 -8.506 6.126 1.00 2.15 H ATOM 219 HZ PHE A 15 10.526 -8.005 6.009 1.00 0.58 H ATOM 220 N ARG A 16 5.734 -2.872 1.489 1.00 0.19 N ATOM 221 CA ARG A 16 5.649 -1.956 0.355 1.00 0.20 C ATOM 222 C ARG A 16 5.825 -0.511 0.800 1.00 0.17 C ATOM 223 O ARG A 16 6.594 0.236 0.205 1.00 0.19 O ATOM 224 CB ARG A 16 4.312 -2.122 -0.373 1.00 0.32 C ATOM 225 CG ARG A 16 3.970 -3.561 -0.696 1.00 0.24 C ATOM 226 CD ARG A 16 4.941 -4.159 -1.701 1.00 0.40 C ATOM 227 NE ARG A 16 4.400 -5.359 -2.335 1.00 0.78 N ATOM 228 CZ ARG A 16 5.149 -6.297 -2.912 1.00 0.89 C ATOM 229 NH1 ARG A 16 6.471 -6.178 -2.941 1.00 1.49 N ATOM 230 NH2 ARG A 16 4.574 -7.358 -3.461 1.00 1.39 N ATOM 231 H ARG A 16 4.987 -3.476 1.673 1.00 0.18 H ATOM 232 HA ARG A 16 6.449 -2.200 -0.327 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.524 -1.720 0.242 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.348 -1.575 -1.296 1.00 0.47 H ATOM 235 HG2 ARG A 16 4.008 -4.135 0.212 1.00 0.23 H ATOM 236 HG3 ARG A 16 2.971 -3.597 -1.105 1.00 0.37 H ATOM 237 HD2 ARG A 16 5.149 -3.423 -2.463 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.856 -4.414 -1.188 1.00 0.69 H ATOM 239 HE ARG A 16 3.427 -5.473 -2.331 1.00 1.52 H ATOM 240 HH11 ARG A 16 6.911 -5.380 -2.530 1.00 1.80 H ATOM 241 HH12 ARG A 16 7.026 -6.887 -3.376 1.00 1.98 H ATOM 242 HH21 ARG A 16 3.579 -7.454 -3.442 1.00 1.96 H ATOM 243 HH22 ARG A 16 5.136 -8.063 -3.895 1.00 1.54 H ATOM 244 N CYS A 17 5.116 -0.118 1.848 1.00 0.24 N ATOM 245 CA CYS A 17 5.215 1.245 2.354 1.00 0.33 C ATOM 246 C CYS A 17 6.599 1.518 2.933 1.00 0.34 C ATOM 247 O CYS A 17 7.019 2.667 3.056 1.00 0.45 O ATOM 248 CB CYS A 17 4.154 1.500 3.415 1.00 0.48 C ATOM 249 SG CYS A 17 2.522 1.941 2.741 1.00 0.58 S ATOM 250 H CYS A 17 4.516 -0.754 2.291 1.00 0.27 H ATOM 251 HA CYS A 17 5.051 1.914 1.528 1.00 0.36 H ATOM 252 HB2 CYS A 17 4.033 0.613 4.016 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.484 2.312 4.040 1.00 0.83 H ATOM 254 N ARG A 18 7.297 0.456 3.298 1.00 0.30 N ATOM 255 CA ARG A 18 8.633 0.580 3.871 1.00 0.40 C ATOM 256 C ARG A 18 9.646 1.035 2.851 1.00 0.41 C ATOM 257 O ARG A 18 10.469 1.915 3.103 1.00 0.51 O ATOM 258 CB ARG A 18 9.116 -0.778 4.385 1.00 0.45 C ATOM 259 CG ARG A 18 9.637 -0.742 5.813 1.00 0.60 C ATOM 260 CD ARG A 18 10.816 0.208 5.957 1.00 1.08 C ATOM 261 NE ARG A 18 12.040 -0.492 6.343 1.00 1.48 N ATOM 262 CZ ARG A 18 12.870 -1.073 5.478 1.00 2.14 C ATOM 263 NH1 ARG A 18 12.618 -1.038 4.175 1.00 2.62 N ATOM 264 NH2 ARG A 18 13.957 -1.691 5.919 1.00 2.87 N ATOM 265 H ARG A 18 6.900 -0.430 3.190 1.00 0.26 H ATOM 266 HA ARG A 18 8.602 1.272 4.678 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.298 -1.481 4.337 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.926 -1.126 3.732 1.00 0.57 H ATOM 269 HG2 ARG A 18 8.843 -0.415 6.467 1.00 1.04 H ATOM 270 HG3 ARG A 18 9.951 -1.736 6.095 1.00 1.01 H ATOM 271 HD2 ARG A 18 10.980 0.708 5.014 1.00 1.66 H ATOM 272 HD3 ARG A 18 10.579 0.941 6.714 1.00 1.70 H ATOM 273 HE ARG A 18 12.254 -0.533 7.298 1.00 1.87 H ATOM 274 HH11 ARG A 18 11.802 -0.573 3.835 1.00 2.57 H ATOM 275 HH12 ARG A 18 13.247 -1.477 3.534 1.00 3.34 H ATOM 276 HH21 ARG A 18 14.153 -1.721 6.899 1.00 3.09 H ATOM 277 HH22 ARG A 18 14.581 -2.128 5.271 1.00 3.44 H ATOM 278 N THR A 19 9.626 0.349 1.736 1.00 0.36 N ATOM 279 CA THR A 19 10.585 0.569 0.684 1.00 0.41 C ATOM 280 C THR A 19 9.958 1.074 -0.621 1.00 0.38 C ATOM 281 O THR A 19 10.595 1.810 -1.376 1.00 0.59 O ATOM 282 CB THR A 19 11.306 -0.755 0.507 1.00 0.48 C ATOM 283 OG1 THR A 19 12.164 -0.745 -0.620 1.00 0.56 O ATOM 284 CG2 THR A 19 10.352 -1.920 0.381 1.00 0.46 C ATOM 285 H THR A 19 8.978 -0.379 1.643 1.00 0.31 H ATOM 286 HA THR A 19 11.296 1.302 1.031 1.00 0.48 H ATOM 287 HB THR A 19 11.894 -0.932 1.405 1.00 0.55 H ATOM 288 HG1 THR A 19 11.641 -0.659 -1.420 1.00 1.06 H ATOM 289 HG21 THR A 19 10.907 -2.828 0.204 1.00 1.13 H ATOM 290 HG22 THR A 19 9.671 -1.742 -0.437 1.00 1.04 H ATOM 291 HG23 THR A 19 9.791 -2.012 1.306 1.00 1.15 H ATOM 292 N SER A 20 8.720 0.671 -0.889 1.00 0.33 N ATOM 293 CA SER A 20 8.027 1.082 -2.111 1.00 0.32 C ATOM 294 C SER A 20 7.112 2.281 -1.862 1.00 0.28 C ATOM 295 O SER A 20 6.153 2.195 -1.098 1.00 0.42 O ATOM 296 CB SER A 20 7.211 -0.084 -2.672 1.00 0.35 C ATOM 297 OG SER A 20 7.970 -0.839 -3.600 1.00 0.73 O ATOM 298 H SER A 20 8.263 0.079 -0.256 1.00 0.47 H ATOM 299 HA SER A 20 8.776 1.363 -2.836 1.00 0.40 H ATOM 300 HB2 SER A 20 6.909 -0.732 -1.862 1.00 0.64 H ATOM 301 HB3 SER A 20 6.333 0.300 -3.171 1.00 0.58 H ATOM 302 HG SER A 20 8.137 -1.714 -3.241 1.00 0.97 H ATOM 303 N MET A 21 7.418 3.401 -2.513 1.00 0.27 N ATOM 304 CA MET A 21 6.627 4.622 -2.363 1.00 0.25 C ATOM 305 C MET A 21 5.346 4.575 -3.196 1.00 0.25 C ATOM 306 O MET A 21 4.348 5.205 -2.850 1.00 0.38 O ATOM 307 CB MET A 21 7.460 5.840 -2.773 1.00 0.35 C ATOM 308 CG MET A 21 8.049 6.603 -1.597 1.00 0.42 C ATOM 309 SD MET A 21 9.762 7.094 -1.871 1.00 0.95 S ATOM 310 CE MET A 21 10.572 6.285 -0.494 1.00 1.66 C ATOM 311 H MET A 21 8.195 3.407 -3.110 1.00 0.40 H ATOM 312 HA MET A 21 6.361 4.717 -1.322 1.00 0.26 H ATOM 313 HB2 MET A 21 8.273 5.509 -3.402 1.00 0.43 H ATOM 314 HB3 MET A 21 6.835 6.518 -3.336 1.00 0.42 H ATOM 315 HG2 MET A 21 7.458 7.491 -1.430 1.00 0.66 H ATOM 316 HG3 MET A 21 8.004 5.975 -0.720 1.00 0.42 H ATOM 317 HE1 MET A 21 11.638 6.443 -0.559 1.00 2.14 H ATOM 318 HE2 MET A 21 10.362 5.226 -0.525 1.00 2.17 H ATOM 319 HE3 MET A 21 10.203 6.697 0.434 1.00 2.19 H ATOM 320 N LYS A 22 5.387 3.845 -4.304 1.00 0.28 N ATOM 321 CA LYS A 22 4.237 3.738 -5.199 1.00 0.35 C ATOM 322 C LYS A 22 3.064 3.001 -4.551 1.00 0.32 C ATOM 323 O LYS A 22 1.918 3.439 -4.642 1.00 0.47 O ATOM 324 CB LYS A 22 4.649 3.022 -6.488 1.00 0.45 C ATOM 325 CG LYS A 22 3.519 2.882 -7.497 1.00 0.58 C ATOM 326 CD LYS A 22 3.456 1.477 -8.080 1.00 1.33 C ATOM 327 CE LYS A 22 3.944 1.448 -9.520 1.00 1.62 C ATOM 328 NZ LYS A 22 5.419 1.266 -9.603 1.00 2.35 N ATOM 329 H LYS A 22 6.217 3.378 -4.536 1.00 0.37 H ATOM 330 HA LYS A 22 3.920 4.739 -5.447 1.00 0.39 H ATOM 331 HB2 LYS A 22 5.450 3.577 -6.953 1.00 0.48 H ATOM 332 HB3 LYS A 22 5.005 2.034 -6.238 1.00 0.47 H ATOM 333 HG2 LYS A 22 2.584 3.097 -7.005 1.00 1.38 H ATOM 334 HG3 LYS A 22 3.677 3.589 -8.299 1.00 1.13 H ATOM 335 HD2 LYS A 22 4.077 0.822 -7.488 1.00 1.94 H ATOM 336 HD3 LYS A 22 2.433 1.132 -8.049 1.00 2.10 H ATOM 337 HE2 LYS A 22 3.460 0.630 -10.034 1.00 1.80 H ATOM 338 HE3 LYS A 22 3.677 2.380 -9.996 1.00 2.10 H ATOM 339 HZ1 LYS A 22 5.651 0.255 -9.685 1.00 2.86 H ATOM 340 HZ2 LYS A 22 5.876 1.647 -8.750 1.00 2.67 H ATOM 341 HZ3 LYS A 22 5.795 1.765 -10.435 1.00 2.77 H ATOM 342 N TYR A 23 3.351 1.871 -3.920 1.00 0.24 N ATOM 343 CA TYR A 23 2.316 1.057 -3.283 1.00 0.23 C ATOM 344 C TYR A 23 1.606 1.793 -2.153 1.00 0.25 C ATOM 345 O TYR A 23 0.446 1.513 -1.848 1.00 0.33 O ATOM 346 CB TYR A 23 2.933 -0.218 -2.721 1.00 0.25 C ATOM 347 CG TYR A 23 3.193 -1.278 -3.758 1.00 0.25 C ATOM 348 CD1 TYR A 23 3.909 -0.986 -4.908 1.00 1.16 C ATOM 349 CD2 TYR A 23 2.724 -2.571 -3.584 1.00 1.26 C ATOM 350 CE1 TYR A 23 4.152 -1.957 -5.861 1.00 1.18 C ATOM 351 CE2 TYR A 23 2.962 -3.548 -4.528 1.00 1.26 C ATOM 352 CZ TYR A 23 3.677 -3.237 -5.666 1.00 0.36 C ATOM 353 OH TYR A 23 3.916 -4.208 -6.611 1.00 0.44 O ATOM 354 H TYR A 23 4.281 1.563 -3.895 1.00 0.30 H ATOM 355 HA TYR A 23 1.595 0.791 -4.038 1.00 0.26 H ATOM 356 HB2 TYR A 23 3.875 0.025 -2.254 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.267 -0.634 -1.979 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.278 0.020 -5.053 1.00 2.06 H ATOM 359 HD2 TYR A 23 2.164 -2.809 -2.692 1.00 2.17 H ATOM 360 HE1 TYR A 23 4.712 -1.712 -6.751 1.00 2.10 H ATOM 361 HE2 TYR A 23 2.589 -4.548 -4.370 1.00 2.17 H ATOM 362 HH TYR A 23 4.465 -4.898 -6.230 1.00 0.83 H ATOM 363 N ARG A 24 2.320 2.699 -1.509 1.00 0.25 N ATOM 364 CA ARG A 24 1.769 3.441 -0.371 1.00 0.29 C ATOM 365 C ARG A 24 0.651 4.398 -0.773 1.00 0.31 C ATOM 366 O ARG A 24 -0.472 4.296 -0.281 1.00 0.32 O ATOM 367 CB ARG A 24 2.869 4.241 0.341 1.00 0.35 C ATOM 368 CG ARG A 24 4.280 3.753 0.064 1.00 0.36 C ATOM 369 CD ARG A 24 5.273 4.326 1.060 1.00 0.31 C ATOM 370 NE ARG A 24 6.615 3.782 0.869 1.00 0.36 N ATOM 371 CZ ARG A 24 7.734 4.444 1.164 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.680 5.671 1.667 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.913 3.873 0.960 1.00 0.47 N ATOM 374 H ARG A 24 3.248 2.850 -1.784 1.00 0.28 H ATOM 375 HA ARG A 24 1.366 2.721 0.323 1.00 0.30 H ATOM 376 HB2 ARG A 24 2.807 5.269 0.024 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.698 4.195 1.405 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.297 2.677 0.126 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.564 4.061 -0.930 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.307 5.398 0.935 1.00 0.33 H ATOM 381 HD3 ARG A 24 4.937 4.091 2.060 1.00 0.42 H ATOM 382 HE ARG A 24 6.688 2.872 0.505 1.00 0.40 H ATOM 383 HH11 ARG A 24 6.796 6.108 1.831 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.525 6.159 1.884 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.961 2.948 0.587 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.753 4.368 1.180 1.00 0.50 H ATOM 387 N LEU A 25 0.976 5.351 -1.630 1.00 0.32 N ATOM 388 CA LEU A 25 0.010 6.357 -2.056 1.00 0.37 C ATOM 389 C LEU A 25 -0.710 5.977 -3.344 1.00 0.36 C ATOM 390 O LEU A 25 -1.908 6.218 -3.491 1.00 0.39 O ATOM 391 CB LEU A 25 0.727 7.692 -2.248 1.00 0.42 C ATOM 392 CG LEU A 25 1.701 8.087 -1.125 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.198 7.613 0.237 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.094 7.535 -1.401 1.00 0.42 C ATOM 395 H LEU A 25 1.896 5.400 -1.962 1.00 0.32 H ATOM 396 HA LEU A 25 -0.721 6.467 -1.271 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.282 7.640 -3.179 1.00 0.42 H ATOM 398 HB3 LEU A 25 -0.019 8.467 -2.337 1.00 0.45 H ATOM 399 HG LEU A 25 1.773 9.164 -1.091 1.00 0.47 H ATOM 400 HD11 LEU A 25 0.132 7.453 0.192 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.418 8.363 0.982 1.00 1.08 H ATOM 402 HD13 LEU A 25 1.690 6.688 0.504 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.067 6.910 -2.281 1.00 1.04 H ATOM 404 HD22 LEU A 25 3.427 6.950 -0.555 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.779 8.353 -1.563 1.00 1.06 H ATOM 406 N ASN A 26 0.032 5.422 -4.288 1.00 0.34 N ATOM 407 CA ASN A 26 -0.528 5.054 -5.581 1.00 0.36 C ATOM 408 C ASN A 26 -1.453 3.839 -5.500 1.00 0.32 C ATOM 409 O ASN A 26 -2.475 3.793 -6.184 1.00 0.38 O ATOM 410 CB ASN A 26 0.604 4.794 -6.567 1.00 0.37 C ATOM 411 CG ASN A 26 0.259 5.233 -7.977 1.00 0.54 C ATOM 412 OD1 ASN A 26 -0.045 6.401 -8.219 1.00 1.22 O ATOM 413 ND2 ASN A 26 0.305 4.295 -8.916 1.00 1.28 N ATOM 414 H ASN A 26 0.988 5.283 -4.123 1.00 0.32 H ATOM 415 HA ASN A 26 -1.102 5.896 -5.936 1.00 0.42 H ATOM 416 HB2 ASN A 26 1.480 5.341 -6.241 1.00 0.36 H ATOM 417 HB3 ASN A 26 0.826 3.738 -6.579 1.00 0.34 H ATOM 418 HD21 ASN A 26 0.555 3.386 -8.651 1.00 1.98 H ATOM 419 HD22 ASN A 26 0.086 4.551 -9.836 1.00 1.37 H ATOM 420 N LEU A 27 -1.104 2.856 -4.674 1.00 0.27 N ATOM 421 CA LEU A 27 -1.936 1.661 -4.544 1.00 0.27 C ATOM 422 C LEU A 27 -2.885 1.771 -3.348 1.00 0.25 C ATOM 423 O LEU A 27 -3.834 2.553 -3.387 1.00 0.28 O ATOM 424 CB LEU A 27 -1.072 0.403 -4.447 1.00 0.29 C ATOM 425 CG LEU A 27 -0.643 -0.184 -5.791 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.416 0.690 -6.442 1.00 0.91 C ATOM 427 CD2 LEU A 27 -0.136 -1.604 -5.609 1.00 1.05 C ATOM 428 H LEU A 27 -0.280 2.934 -4.149 1.00 0.27 H ATOM 429 HA LEU A 27 -2.536 1.594 -5.440 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.188 0.640 -3.877 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.630 -0.353 -3.917 1.00 0.63 H ATOM 432 HG LEU A 27 -1.498 -0.216 -6.451 1.00 0.93 H ATOM 433 HD11 LEU A 27 0.162 1.729 -6.298 1.00 1.50 H ATOM 434 HD12 LEU A 27 0.461 0.473 -7.499 1.00 1.21 H ATOM 435 HD13 LEU A 27 1.377 0.488 -5.992 1.00 1.49 H ATOM 436 HD21 LEU A 27 0.914 -1.583 -5.358 1.00 1.42 H ATOM 437 HD22 LEU A 27 -0.276 -2.156 -6.526 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.688 -2.081 -4.813 1.00 1.69 H ATOM 439 N CYS A 28 -2.647 0.995 -2.286 1.00 0.25 N ATOM 440 CA CYS A 28 -3.521 1.050 -1.123 1.00 0.23 C ATOM 441 C CYS A 28 -3.029 2.082 -0.125 1.00 0.22 C ATOM 442 O CYS A 28 -1.826 2.277 0.045 1.00 0.22 O ATOM 443 CB CYS A 28 -3.578 -0.330 -0.463 1.00 0.25 C ATOM 444 SG CYS A 28 -3.763 -1.703 -1.647 1.00 0.50 S ATOM 445 H CYS A 28 -1.885 0.382 -2.287 1.00 0.29 H ATOM 446 HA CYS A 28 -4.511 1.324 -1.450 1.00 0.25 H ATOM 447 HB2 CYS A 28 -2.664 -0.494 0.089 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.415 -0.365 0.218 1.00 0.26 H ATOM 449 N LYS A 29 -3.972 2.728 0.546 1.00 0.24 N ATOM 450 CA LYS A 29 -3.645 3.728 1.545 1.00 0.27 C ATOM 451 C LYS A 29 -3.326 3.084 2.884 1.00 0.27 C ATOM 452 O LYS A 29 -2.245 3.258 3.438 1.00 0.30 O ATOM 453 CB LYS A 29 -4.799 4.719 1.700 1.00 0.33 C ATOM 454 CG LYS A 29 -5.036 5.572 0.463 1.00 0.31 C ATOM 455 CD LYS A 29 -4.923 7.056 0.775 1.00 0.81 C ATOM 456 CE LYS A 29 -4.242 7.812 -0.354 1.00 0.97 C ATOM 457 NZ LYS A 29 -4.662 9.239 -0.400 1.00 1.30 N ATOM 458 H LYS A 29 -4.911 2.514 0.374 1.00 0.26 H ATOM 459 HA LYS A 29 -2.772 4.263 1.202 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.705 4.168 1.911 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.586 5.376 2.531 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.299 5.315 -0.285 1.00 0.44 H ATOM 463 HG3 LYS A 29 -6.025 5.367 0.081 1.00 0.56 H ATOM 464 HD2 LYS A 29 -5.914 7.460 0.918 1.00 1.21 H ATOM 465 HD3 LYS A 29 -4.347 7.181 1.680 1.00 1.28 H ATOM 466 HE2 LYS A 29 -3.173 7.765 -0.207 1.00 1.60 H ATOM 467 HE3 LYS A 29 -4.497 7.340 -1.291 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -4.585 9.604 -1.371 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -4.056 9.811 0.222 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -5.649 9.332 -0.083 1.00 1.88 H ATOM 471 N LYS A 30 -4.301 2.355 3.407 1.00 0.27 N ATOM 472 CA LYS A 30 -4.161 1.696 4.697 1.00 0.31 C ATOM 473 C LYS A 30 -3.462 0.346 4.607 1.00 0.29 C ATOM 474 O LYS A 30 -2.479 0.100 5.303 1.00 0.31 O ATOM 475 CB LYS A 30 -5.531 1.512 5.345 1.00 0.36 C ATOM 476 CG LYS A 30 -5.475 0.714 6.634 1.00 0.46 C ATOM 477 CD LYS A 30 -5.014 1.575 7.795 1.00 0.57 C ATOM 478 CE LYS A 30 -5.441 0.988 9.131 1.00 1.03 C ATOM 479 NZ LYS A 30 -4.470 1.309 10.214 1.00 1.66 N ATOM 480 H LYS A 30 -5.148 2.270 2.917 1.00 0.26 H ATOM 481 HA LYS A 30 -3.571 2.341 5.328 1.00 0.35 H ATOM 482 HB2 LYS A 30 -5.949 2.484 5.563 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.178 0.995 4.653 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.456 0.323 6.850 1.00 0.47 H ATOM 485 HG3 LYS A 30 -4.777 -0.101 6.504 1.00 0.48 H ATOM 486 HD2 LYS A 30 -3.937 1.645 7.770 1.00 0.73 H ATOM 487 HD3 LYS A 30 -5.443 2.560 7.689 1.00 0.87 H ATOM 488 HE2 LYS A 30 -6.407 1.391 9.395 1.00 1.61 H ATOM 489 HE3 LYS A 30 -5.514 -0.085 9.031 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -3.621 0.717 10.120 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -4.901 1.133 11.144 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -4.191 2.310 10.158 1.00 2.11 H ATOM 493 N THR A 31 -4.013 -0.546 3.794 1.00 0.28 N ATOM 494 CA THR A 31 -3.477 -1.897 3.664 1.00 0.32 C ATOM 495 C THR A 31 -1.959 -1.913 3.519 1.00 0.30 C ATOM 496 O THR A 31 -1.296 -2.848 3.969 1.00 0.37 O ATOM 497 CB THR A 31 -4.116 -2.609 2.480 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.528 -2.627 2.603 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.646 -4.035 2.342 1.00 0.54 C ATOM 500 H THR A 31 -4.823 -0.302 3.293 1.00 0.28 H ATOM 501 HA THR A 31 -3.737 -2.433 4.564 1.00 0.36 H ATOM 502 HB THR A 31 -3.858 -2.083 1.572 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.771 -3.041 3.434 1.00 1.01 H ATOM 504 HG21 THR A 31 -4.142 -4.499 1.505 1.00 1.19 H ATOM 505 HG22 THR A 31 -3.874 -4.576 3.247 1.00 1.16 H ATOM 506 HG23 THR A 31 -2.579 -4.041 2.180 1.00 1.18 H ATOM 507 N CYS A 32 -1.415 -0.888 2.888 1.00 0.24 N ATOM 508 CA CYS A 32 0.033 -0.810 2.688 1.00 0.26 C ATOM 509 C CYS A 32 0.752 -0.398 3.973 1.00 0.24 C ATOM 510 O CYS A 32 1.966 -0.559 4.091 1.00 0.26 O ATOM 511 CB CYS A 32 0.374 0.165 1.557 1.00 0.31 C ATOM 512 SG CYS A 32 2.158 0.491 1.369 1.00 0.89 S ATOM 513 H CYS A 32 -1.996 -0.176 2.548 1.00 0.22 H ATOM 514 HA CYS A 32 0.374 -1.796 2.409 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.019 -0.242 0.622 1.00 0.47 H ATOM 516 HB3 CYS A 32 -0.116 1.109 1.743 1.00 0.43 H ATOM 517 N GLY A 33 -0.002 0.121 4.936 1.00 0.24 N ATOM 518 CA GLY A 33 0.586 0.532 6.199 1.00 0.29 C ATOM 519 C GLY A 33 1.065 1.972 6.196 1.00 0.35 C ATOM 520 O GLY A 33 2.179 2.260 6.634 1.00 0.46 O ATOM 521 H GLY A 33 -0.965 0.220 4.792 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.151 0.414 6.978 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.426 -0.113 6.416 1.00 0.29 H ATOM 524 N THR A 34 0.224 2.881 5.711 1.00 0.34 N ATOM 525 CA THR A 34 0.580 4.298 5.669 1.00 0.44 C ATOM 526 C THR A 34 -0.601 5.185 6.057 1.00 0.52 C ATOM 527 O THR A 34 -0.414 6.267 6.614 1.00 0.68 O ATOM 528 CB THR A 34 1.094 4.689 4.281 1.00 0.51 C ATOM 529 OG1 THR A 34 1.376 6.075 4.224 1.00 1.06 O ATOM 530 CG2 THR A 34 0.129 4.373 3.161 1.00 0.54 C ATOM 531 H THR A 34 -0.650 2.593 5.380 1.00 0.32 H ATOM 532 HA THR A 34 1.372 4.454 6.386 1.00 0.50 H ATOM 533 HB THR A 34 2.006 4.151 4.089 1.00 0.78 H ATOM 534 HG1 THR A 34 2.326 6.207 4.184 1.00 1.39 H ATOM 535 HG21 THR A 34 -0.057 3.309 3.135 1.00 1.16 H ATOM 536 HG22 THR A 34 0.557 4.686 2.220 1.00 1.26 H ATOM 537 HG23 THR A 34 -0.799 4.899 3.327 1.00 1.18 H ATOM 538 N CYS A 35 -1.816 4.729 5.762 1.00 0.49 N ATOM 539 CA CYS A 35 -3.019 5.494 6.087 1.00 0.62 C ATOM 540 C CYS A 35 -3.002 5.953 7.542 1.00 0.95 C ATOM 541 O CYS A 35 -2.540 7.085 7.799 1.00 1.71 O ATOM 542 CB CYS A 35 -4.272 4.658 5.824 1.00 1.04 C ATOM 543 SG CYS A 35 -5.834 5.541 6.142 1.00 1.59 S ATOM 544 OXT CYS A 35 -3.450 5.177 8.412 1.00 1.64 O ATOM 545 H CYS A 35 -1.907 3.861 5.316 1.00 0.43 H ATOM 546 HA CYS A 35 -3.039 6.364 5.448 1.00 1.30 H ATOM 547 HB2 CYS A 35 -4.278 4.344 4.792 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.253 3.785 6.461 1.00 1.53 H