ATOM 45 N ASP A 5 -8.039 0.715 -0.099 1.00 0.20 N ATOM 46 CA ASP A 5 -6.977 -0.086 -0.683 1.00 0.25 C ATOM 47 C ASP A 5 -7.241 -0.393 -2.150 1.00 0.23 C ATOM 48 O ASP A 5 -8.282 -0.944 -2.508 1.00 0.26 O ATOM 49 CB ASP A 5 -6.814 -1.389 0.096 1.00 0.32 C ATOM 50 CG ASP A 5 -8.052 -2.262 0.031 1.00 0.40 C ATOM 51 OD1 ASP A 5 -9.171 -1.705 0.026 1.00 1.24 O ATOM 52 OD2 ASP A 5 -7.904 -3.501 -0.016 1.00 1.11 O ATOM 53 H ASP A 5 -8.947 0.361 -0.086 1.00 0.23 H ATOM 54 HA ASP A 5 -6.066 0.480 -0.609 1.00 0.33 H ATOM 55 HB2 ASP A 5 -5.982 -1.945 -0.310 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.615 -1.155 1.129 1.00 0.38 H ATOM 57 N TYR A 6 -6.278 -0.041 -2.990 1.00 0.19 N ATOM 58 CA TYR A 6 -6.379 -0.281 -4.424 1.00 0.20 C ATOM 59 C TYR A 6 -6.146 -1.757 -4.752 1.00 0.19 C ATOM 60 O TYR A 6 -6.328 -2.180 -5.894 1.00 0.23 O ATOM 61 CB TYR A 6 -5.363 0.582 -5.177 1.00 0.20 C ATOM 62 CG TYR A 6 -5.895 1.158 -6.469 1.00 0.41 C ATOM 63 CD1 TYR A 6 -5.867 0.418 -7.645 1.00 1.24 C ATOM 64 CD2 TYR A 6 -6.425 2.441 -6.514 1.00 1.37 C ATOM 65 CE1 TYR A 6 -6.351 0.942 -8.829 1.00 1.33 C ATOM 66 CE2 TYR A 6 -6.911 2.971 -7.694 1.00 1.54 C ATOM 67 CZ TYR A 6 -6.872 2.218 -8.848 1.00 0.94 C ATOM 68 OH TYR A 6 -7.355 2.743 -10.024 1.00 1.21 O ATOM 69 H TYR A 6 -5.473 0.388 -2.633 1.00 0.18 H ATOM 70 HA TYR A 6 -7.375 -0.006 -4.737 1.00 0.23 H ATOM 71 HB2 TYR A 6 -5.064 1.405 -4.546 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.495 -0.018 -5.412 1.00 0.25 H ATOM 73 HD1 TYR A 6 -5.458 -0.581 -7.626 1.00 2.12 H ATOM 74 HD2 TYR A 6 -6.453 3.029 -5.608 1.00 2.21 H ATOM 75 HE1 TYR A 6 -6.320 0.351 -9.732 1.00 2.18 H ATOM 76 HE2 TYR A 6 -7.319 3.971 -7.708 1.00 2.44 H ATOM 77 HH TYR A 6 -8.169 3.221 -9.852 1.00 1.49 H ATOM 78 N LEU A 7 -5.740 -2.538 -3.750 1.00 0.18 N ATOM 79 CA LEU A 7 -5.482 -3.961 -3.948 1.00 0.19 C ATOM 80 C LEU A 7 -5.803 -4.754 -2.687 1.00 0.20 C ATOM 81 O LEU A 7 -6.139 -4.175 -1.654 1.00 0.20 O ATOM 82 CB LEU A 7 -4.023 -4.176 -4.355 1.00 0.18 C ATOM 83 CG LEU A 7 -3.758 -4.043 -5.853 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.366 -3.490 -6.097 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.934 -5.381 -6.555 1.00 0.21 C ATOM 86 H LEU A 7 -5.610 -2.148 -2.858 1.00 0.19 H ATOM 87 HA LEU A 7 -6.122 -4.305 -4.747 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.415 -3.460 -3.831 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.718 -5.152 -4.045 1.00 0.18 H ATOM 90 HG LEU A 7 -4.472 -3.352 -6.273 1.00 0.24 H ATOM 91 HD11 LEU A 7 -2.369 -2.423 -5.933 1.00 1.03 H ATOM 92 HD12 LEU A 7 -2.070 -3.700 -7.113 1.00 1.07 H ATOM 93 HD13 LEU A 7 -1.672 -3.958 -5.415 1.00 1.01 H ATOM 94 HD21 LEU A 7 -3.855 -6.179 -5.835 1.00 1.04 H ATOM 95 HD22 LEU A 7 -3.168 -5.498 -7.307 1.00 1.02 H ATOM 96 HD23 LEU A 7 -4.907 -5.416 -7.024 1.00 1.01 H ATOM 97 N PRO A 8 -5.698 -6.094 -2.744 1.00 0.21 N ATOM 98 CA PRO A 8 -5.970 -6.951 -1.605 1.00 0.23 C ATOM 99 C PRO A 8 -4.768 -7.082 -0.686 1.00 0.21 C ATOM 100 O PRO A 8 -3.655 -6.679 -1.023 1.00 0.18 O ATOM 101 CB PRO A 8 -6.328 -8.278 -2.243 1.00 0.26 C ATOM 102 CG PRO A 8 -5.481 -8.329 -3.453 1.00 0.25 C ATOM 103 CD PRO A 8 -5.283 -6.897 -3.915 1.00 0.22 C ATOM 104 HA PRO A 8 -6.812 -6.587 -1.034 1.00 0.25 H ATOM 105 HB2 PRO A 8 -6.101 -9.085 -1.561 1.00 0.26 H ATOM 106 HB3 PRO A 8 -7.378 -8.292 -2.494 1.00 0.29 H ATOM 107 HG2 PRO A 8 -4.530 -8.772 -3.196 1.00 0.23 H ATOM 108 HG3 PRO A 8 -5.974 -8.907 -4.212 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.250 -6.737 -4.141 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.887 -6.673 -4.780 1.00 0.23 H ATOM 111 N LYS A 9 -5.019 -7.634 0.481 1.00 0.23 N ATOM 112 CA LYS A 9 -3.987 -7.822 1.499 1.00 0.23 C ATOM 113 C LYS A 9 -2.762 -8.550 0.948 1.00 0.22 C ATOM 114 O LYS A 9 -1.672 -8.453 1.512 1.00 0.22 O ATOM 115 CB LYS A 9 -4.560 -8.600 2.685 1.00 0.26 C ATOM 116 CG LYS A 9 -5.828 -7.988 3.257 1.00 0.30 C ATOM 117 CD LYS A 9 -5.532 -7.131 4.477 1.00 1.00 C ATOM 118 CE LYS A 9 -6.723 -6.262 4.849 1.00 1.48 C ATOM 119 NZ LYS A 9 -7.827 -7.061 5.449 1.00 2.12 N ATOM 120 H LYS A 9 -5.932 -7.927 0.662 1.00 0.25 H ATOM 121 HA LYS A 9 -3.683 -6.845 1.841 1.00 0.22 H ATOM 122 HB2 LYS A 9 -4.783 -9.607 2.366 1.00 0.28 H ATOM 123 HB3 LYS A 9 -3.818 -8.636 3.469 1.00 0.27 H ATOM 124 HG2 LYS A 9 -6.293 -7.372 2.501 1.00 0.86 H ATOM 125 HG3 LYS A 9 -6.503 -8.783 3.541 1.00 0.79 H ATOM 126 HD2 LYS A 9 -5.296 -7.776 5.309 1.00 1.52 H ATOM 127 HD3 LYS A 9 -4.686 -6.494 4.260 1.00 1.72 H ATOM 128 HE2 LYS A 9 -6.400 -5.518 5.561 1.00 2.03 H ATOM 129 HE3 LYS A 9 -7.087 -5.773 3.957 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -7.437 -7.798 6.071 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -8.388 -7.515 4.701 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -8.450 -6.444 6.009 1.00 2.60 H ATOM 133 N SER A 10 -2.944 -9.287 -0.140 1.00 0.22 N ATOM 134 CA SER A 10 -1.848 -10.038 -0.742 1.00 0.23 C ATOM 135 C SER A 10 -0.944 -9.149 -1.597 1.00 0.22 C ATOM 136 O SER A 10 0.198 -9.511 -1.878 1.00 0.24 O ATOM 137 CB SER A 10 -2.401 -11.184 -1.591 1.00 0.27 C ATOM 138 OG SER A 10 -1.659 -12.375 -1.388 1.00 1.24 O ATOM 139 H SER A 10 -3.836 -9.339 -0.542 1.00 0.23 H ATOM 140 HA SER A 10 -1.259 -10.456 0.060 1.00 0.23 H ATOM 141 HB2 SER A 10 -3.430 -11.366 -1.320 1.00 1.04 H ATOM 142 HB3 SER A 10 -2.347 -10.915 -2.636 1.00 0.97 H ATOM 143 HG SER A 10 -0.722 -12.170 -1.372 1.00 1.69 H ATOM 144 N GLU A 11 -1.456 -7.998 -2.025 1.00 0.23 N ATOM 145 CA GLU A 11 -0.681 -7.089 -2.860 1.00 0.26 C ATOM 146 C GLU A 11 -0.079 -5.960 -2.048 1.00 0.26 C ATOM 147 O GLU A 11 1.043 -5.520 -2.300 1.00 0.30 O ATOM 148 CB GLU A 11 -1.594 -6.492 -3.922 1.00 0.31 C ATOM 149 CG GLU A 11 -1.404 -7.073 -5.311 1.00 0.38 C ATOM 150 CD GLU A 11 -0.734 -6.104 -6.265 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.093 -5.291 -5.801 1.00 1.31 O ATOM 152 OE2 GLU A 11 -1.035 -6.158 -7.476 1.00 1.16 O ATOM 153 H GLU A 11 -2.377 -7.755 -1.786 1.00 0.22 H ATOM 154 HA GLU A 11 0.110 -7.648 -3.333 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.610 -6.671 -3.622 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.428 -5.424 -3.965 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.795 -7.962 -5.237 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.377 -7.336 -5.709 1.00 0.38 H ATOM 159 N CYS A 12 -0.844 -5.484 -1.087 1.00 0.26 N ATOM 160 CA CYS A 12 -0.411 -4.392 -0.244 1.00 0.30 C ATOM 161 C CYS A 12 0.154 -4.922 1.060 1.00 0.24 C ATOM 162 O CYS A 12 -0.577 -5.422 1.916 1.00 0.28 O ATOM 163 CB CYS A 12 -1.583 -3.453 0.003 1.00 0.46 C ATOM 164 SG CYS A 12 -1.735 -2.136 -1.225 1.00 0.80 S ATOM 165 H CYS A 12 -1.734 -5.871 -0.948 1.00 0.24 H ATOM 166 HA CYS A 12 0.365 -3.856 -0.768 1.00 0.35 H ATOM 167 HB2 CYS A 12 -2.496 -4.021 -0.030 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.479 -2.979 0.975 1.00 0.45 H ATOM 169 N THR A 13 1.467 -4.824 1.192 1.00 0.22 N ATOM 170 CA THR A 13 2.154 -5.305 2.377 1.00 0.20 C ATOM 171 C THR A 13 2.867 -4.162 3.080 1.00 0.22 C ATOM 172 O THR A 13 3.393 -3.259 2.431 1.00 0.23 O ATOM 173 CB THR A 13 3.156 -6.398 1.982 1.00 0.19 C ATOM 174 OG1 THR A 13 3.889 -6.017 0.834 1.00 0.19 O ATOM 175 CG2 THR A 13 2.495 -7.726 1.671 1.00 0.21 C ATOM 176 H THR A 13 1.992 -4.422 0.466 1.00 0.28 H ATOM 177 HA THR A 13 1.417 -5.725 3.045 1.00 0.25 H ATOM 178 HB THR A 13 3.857 -6.551 2.792 1.00 0.24 H ATOM 179 HG1 THR A 13 3.306 -6.001 0.071 1.00 0.78 H ATOM 180 HG21 THR A 13 1.737 -7.934 2.411 1.00 1.03 H ATOM 181 HG22 THR A 13 3.238 -8.510 1.685 1.00 1.04 H ATOM 182 HG23 THR A 13 2.038 -7.680 0.688 1.00 1.04 H ATOM 183 N GLN A 14 2.896 -4.205 4.409 1.00 0.29 N ATOM 184 CA GLN A 14 3.568 -3.168 5.188 1.00 0.33 C ATOM 185 C GLN A 14 4.964 -2.925 4.625 1.00 0.28 C ATOM 186 O GLN A 14 5.503 -1.822 4.707 1.00 0.31 O ATOM 187 CB GLN A 14 3.638 -3.574 6.660 1.00 0.42 C ATOM 188 CG GLN A 14 2.310 -4.070 7.215 1.00 0.72 C ATOM 189 CD GLN A 14 1.165 -3.108 6.949 1.00 0.88 C ATOM 190 OE1 GLN A 14 0.986 -2.128 7.672 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.379 -3.383 5.909 1.00 0.77 N ATOM 192 H GLN A 14 2.468 -4.954 4.874 1.00 0.34 H ATOM 193 HA GLN A 14 2.996 -2.258 5.096 1.00 0.35 H ATOM 194 HB2 GLN A 14 4.368 -4.362 6.771 1.00 0.67 H ATOM 195 HB3 GLN A 14 3.951 -2.720 7.243 1.00 0.49 H ATOM 196 HG2 GLN A 14 2.074 -5.020 6.759 1.00 1.40 H ATOM 197 HG3 GLN A 14 2.409 -4.201 8.283 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.574 -4.181 5.374 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.365 -2.774 5.720 1.00 1.26 H ATOM 200 N PHE A 15 5.520 -3.969 4.021 1.00 0.25 N ATOM 201 CA PHE A 15 6.828 -3.898 3.396 1.00 0.26 C ATOM 202 C PHE A 15 6.826 -2.890 2.250 1.00 0.22 C ATOM 203 O PHE A 15 7.810 -2.191 2.021 1.00 0.24 O ATOM 204 CB PHE A 15 7.216 -5.284 2.878 1.00 0.29 C ATOM 205 CG PHE A 15 8.189 -6.007 3.763 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.532 -5.671 3.749 1.00 1.25 C ATOM 207 CD2 PHE A 15 7.764 -7.020 4.607 1.00 1.14 C ATOM 208 CE1 PHE A 15 10.435 -6.330 4.559 1.00 1.29 C ATOM 209 CE2 PHE A 15 8.662 -7.685 5.420 1.00 1.17 C ATOM 210 CZ PHE A 15 10.000 -7.339 5.396 1.00 0.52 C ATOM 211 H PHE A 15 5.022 -4.810 3.973 1.00 0.26 H ATOM 212 HA PHE A 15 7.542 -3.585 4.142 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.324 -5.890 2.811 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.649 -5.192 1.898 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.874 -4.882 3.095 1.00 2.10 H ATOM 216 HD2 PHE A 15 6.719 -7.291 4.626 1.00 2.00 H ATOM 217 HE1 PHE A 15 11.480 -6.057 4.537 1.00 2.15 H ATOM 218 HE2 PHE A 15 8.319 -8.473 6.074 1.00 2.01 H ATOM 219 HZ PHE A 15 10.704 -7.857 6.031 1.00 0.58 H ATOM 220 N ARG A 16 5.709 -2.828 1.536 1.00 0.19 N ATOM 221 CA ARG A 16 5.563 -1.915 0.408 1.00 0.20 C ATOM 222 C ARG A 16 5.724 -0.466 0.838 1.00 0.17 C ATOM 223 O ARG A 16 6.390 0.314 0.163 1.00 0.19 O ATOM 224 CB ARG A 16 4.202 -2.116 -0.256 1.00 0.32 C ATOM 225 CG ARG A 16 3.937 -3.548 -0.664 1.00 0.24 C ATOM 226 CD ARG A 16 4.839 -3.984 -1.808 1.00 0.40 C ATOM 227 NE ARG A 16 5.848 -4.947 -1.372 1.00 0.78 N ATOM 228 CZ ARG A 16 6.477 -5.787 -2.192 1.00 0.89 C ATOM 229 NH1 ARG A 16 6.211 -5.781 -3.493 1.00 1.49 N ATOM 230 NH2 ARG A 16 7.376 -6.634 -1.711 1.00 1.39 N ATOM 231 H ARG A 16 4.961 -3.415 1.772 1.00 0.18 H ATOM 232 HA ARG A 16 6.337 -2.143 -0.306 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.427 -1.813 0.430 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.147 -1.505 -1.135 1.00 0.47 H ATOM 235 HG2 ARG A 16 4.116 -4.186 0.184 1.00 0.23 H ATOM 236 HG3 ARG A 16 2.906 -3.633 -0.974 1.00 0.37 H ATOM 237 HD2 ARG A 16 4.230 -4.439 -2.574 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.335 -3.114 -2.212 1.00 0.69 H ATOM 239 HE ARG A 16 6.067 -4.972 -0.417 1.00 1.52 H ATOM 240 HH11 ARG A 16 5.536 -5.144 -3.864 1.00 1.80 H ATOM 241 HH12 ARG A 16 6.687 -6.415 -4.103 1.00 1.98 H ATOM 242 HH21 ARG A 16 7.582 -6.641 -0.732 1.00 1.96 H ATOM 243 HH22 ARG A 16 7.849 -7.265 -2.326 1.00 1.54 H ATOM 244 N CYS A 17 5.114 -0.100 1.955 1.00 0.24 N ATOM 245 CA CYS A 17 5.212 1.269 2.437 1.00 0.33 C ATOM 246 C CYS A 17 6.624 1.578 2.918 1.00 0.34 C ATOM 247 O CYS A 17 7.059 2.729 2.905 1.00 0.45 O ATOM 248 CB CYS A 17 4.214 1.534 3.562 1.00 0.48 C ATOM 249 SG CYS A 17 2.531 1.926 2.991 1.00 0.58 S ATOM 250 H CYS A 17 4.589 -0.758 2.458 1.00 0.27 H ATOM 251 HA CYS A 17 4.985 1.916 1.610 1.00 0.36 H ATOM 252 HB2 CYS A 17 4.152 0.663 4.194 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.566 2.372 4.144 1.00 0.83 H ATOM 254 N ARG A 18 7.331 0.545 3.353 1.00 0.30 N ATOM 255 CA ARG A 18 8.693 0.708 3.850 1.00 0.40 C ATOM 256 C ARG A 18 9.650 1.149 2.772 1.00 0.41 C ATOM 257 O ARG A 18 10.464 2.054 2.959 1.00 0.51 O ATOM 258 CB ARG A 18 9.224 -0.625 4.380 1.00 0.45 C ATOM 259 CG ARG A 18 9.768 -0.549 5.797 1.00 0.60 C ATOM 260 CD ARG A 18 10.290 -1.897 6.266 1.00 1.08 C ATOM 261 NE ARG A 18 9.947 -2.162 7.662 1.00 1.48 N ATOM 262 CZ ARG A 18 8.711 -2.410 8.088 1.00 2.14 C ATOM 263 NH1 ARG A 18 7.697 -2.424 7.231 1.00 2.62 N ATOM 264 NH2 ARG A 18 8.487 -2.645 9.374 1.00 2.87 N ATOM 265 H ARG A 18 6.922 -0.345 3.352 1.00 0.26 H ATOM 266 HA ARG A 18 8.692 1.422 4.638 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.426 -1.352 4.359 1.00 0.57 H ATOM 268 HB3 ARG A 18 10.032 -0.963 3.719 1.00 0.57 H ATOM 269 HG2 ARG A 18 10.575 0.168 5.825 1.00 1.04 H ATOM 270 HG3 ARG A 18 8.976 -0.229 6.459 1.00 1.01 H ATOM 271 HD2 ARG A 18 9.860 -2.671 5.648 1.00 1.66 H ATOM 272 HD3 ARG A 18 11.365 -1.908 6.161 1.00 1.70 H ATOM 273 HE ARG A 18 10.677 -2.156 8.316 1.00 1.87 H ATOM 274 HH11 ARG A 18 7.859 -2.248 6.260 1.00 2.57 H ATOM 275 HH12 ARG A 18 6.770 -2.612 7.557 1.00 3.34 H ATOM 276 HH21 ARG A 18 9.247 -2.636 10.024 1.00 3.09 H ATOM 277 HH22 ARG A 18 7.558 -2.832 9.694 1.00 3.44 H ATOM 278 N THR A 19 9.599 0.429 1.680 1.00 0.36 N ATOM 279 CA THR A 19 10.510 0.642 0.584 1.00 0.41 C ATOM 280 C THR A 19 9.821 1.087 -0.710 1.00 0.38 C ATOM 281 O THR A 19 10.407 1.817 -1.509 1.00 0.59 O ATOM 282 CB THR A 19 11.262 -0.667 0.420 1.00 0.48 C ATOM 283 OG1 THR A 19 12.077 -0.668 -0.739 1.00 0.56 O ATOM 284 CG2 THR A 19 10.337 -1.859 0.364 1.00 0.46 C ATOM 285 H THR A 19 8.966 -0.317 1.634 1.00 0.31 H ATOM 286 HA THR A 19 11.213 1.403 0.880 1.00 0.48 H ATOM 287 HB THR A 19 11.887 -0.799 1.299 1.00 0.55 H ATOM 288 HG1 THR A 19 12.766 -1.329 -0.645 1.00 1.06 H ATOM 289 HG21 THR A 19 9.835 -1.954 1.322 1.00 1.13 H ATOM 290 HG22 THR A 19 10.907 -2.752 0.163 1.00 1.04 H ATOM 291 HG23 THR A 19 9.603 -1.711 -0.412 1.00 1.15 H ATOM 292 N SER A 20 8.585 0.643 -0.918 1.00 0.33 N ATOM 293 CA SER A 20 7.837 0.996 -2.125 1.00 0.32 C ATOM 294 C SER A 20 7.048 2.292 -1.937 1.00 0.28 C ATOM 295 O SER A 20 6.078 2.335 -1.181 1.00 0.42 O ATOM 296 CB SER A 20 6.887 -0.140 -2.510 1.00 0.35 C ATOM 297 OG SER A 20 7.342 -0.814 -3.671 1.00 0.73 O ATOM 298 H SER A 20 8.169 0.058 -0.250 1.00 0.47 H ATOM 299 HA SER A 20 8.549 1.139 -2.923 1.00 0.40 H ATOM 300 HB2 SER A 20 6.829 -0.849 -1.698 1.00 0.64 H ATOM 301 HB3 SER A 20 5.904 0.263 -2.705 1.00 0.58 H ATOM 302 HG SER A 20 6.678 -1.445 -3.956 1.00 0.97 H ATOM 303 N MET A 21 7.471 3.343 -2.634 1.00 0.27 N ATOM 304 CA MET A 21 6.807 4.641 -2.547 1.00 0.25 C ATOM 305 C MET A 21 5.534 4.682 -3.389 1.00 0.25 C ATOM 306 O MET A 21 4.614 5.448 -3.100 1.00 0.38 O ATOM 307 CB MET A 21 7.760 5.752 -2.997 1.00 0.35 C ATOM 308 CG MET A 21 8.408 6.504 -1.846 1.00 0.42 C ATOM 309 SD MET A 21 10.107 5.982 -1.542 1.00 0.95 S ATOM 310 CE MET A 21 10.809 7.487 -0.870 1.00 1.66 C ATOM 311 H MET A 21 8.248 3.243 -3.223 1.00 0.40 H ATOM 312 HA MET A 21 6.543 4.807 -1.517 1.00 0.26 H ATOM 313 HB2 MET A 21 8.543 5.316 -3.599 1.00 0.43 H ATOM 314 HB3 MET A 21 7.211 6.462 -3.598 1.00 0.42 H ATOM 315 HG2 MET A 21 8.407 7.559 -2.077 1.00 0.66 H ATOM 316 HG3 MET A 21 7.828 6.333 -0.951 1.00 0.42 H ATOM 317 HE1 MET A 21 11.341 8.015 -1.648 1.00 2.14 H ATOM 318 HE2 MET A 21 11.491 7.240 -0.071 1.00 2.17 H ATOM 319 HE3 MET A 21 10.017 8.113 -0.487 1.00 2.19 H ATOM 320 N LYS A 22 5.491 3.869 -4.436 1.00 0.28 N ATOM 321 CA LYS A 22 4.334 3.829 -5.325 1.00 0.35 C ATOM 322 C LYS A 22 3.186 3.016 -4.728 1.00 0.32 C ATOM 323 O LYS A 22 2.039 3.152 -5.146 1.00 0.47 O ATOM 324 CB LYS A 22 4.736 3.242 -6.680 1.00 0.45 C ATOM 325 CG LYS A 22 3.625 3.288 -7.718 1.00 0.58 C ATOM 326 CD LYS A 22 3.189 1.892 -8.135 1.00 1.33 C ATOM 327 CE LYS A 22 4.292 1.166 -8.888 1.00 1.62 C ATOM 328 NZ LYS A 22 3.933 -0.252 -9.166 1.00 2.35 N ATOM 329 H LYS A 22 6.258 3.289 -4.624 1.00 0.37 H ATOM 330 HA LYS A 22 3.998 4.844 -5.472 1.00 0.39 H ATOM 331 HB2 LYS A 22 5.579 3.798 -7.063 1.00 0.48 H ATOM 332 HB3 LYS A 22 5.028 2.212 -6.541 1.00 0.47 H ATOM 333 HG2 LYS A 22 2.777 3.808 -7.300 1.00 1.38 H ATOM 334 HG3 LYS A 22 3.982 3.820 -8.588 1.00 1.13 H ATOM 335 HD2 LYS A 22 2.937 1.325 -7.252 1.00 1.94 H ATOM 336 HD3 LYS A 22 2.322 1.973 -8.774 1.00 2.10 H ATOM 337 HE2 LYS A 22 4.466 1.674 -9.825 1.00 1.80 H ATOM 338 HE3 LYS A 22 5.193 1.191 -8.292 1.00 2.10 H ATOM 339 HZ1 LYS A 22 3.249 -0.593 -8.460 1.00 2.86 H ATOM 340 HZ2 LYS A 22 4.783 -0.851 -9.126 1.00 2.67 H ATOM 341 HZ3 LYS A 22 3.509 -0.335 -10.113 1.00 2.77 H ATOM 342 N TYR A 23 3.496 2.159 -3.763 1.00 0.24 N ATOM 343 CA TYR A 23 2.480 1.320 -3.136 1.00 0.23 C ATOM 344 C TYR A 23 1.733 2.049 -2.023 1.00 0.25 C ATOM 345 O TYR A 23 0.551 1.796 -1.790 1.00 0.33 O ATOM 346 CB TYR A 23 3.122 0.059 -2.569 1.00 0.25 C ATOM 347 CG TYR A 23 3.490 -0.956 -3.621 1.00 0.25 C ATOM 348 CD1 TYR A 23 4.329 -0.617 -4.673 1.00 1.26 C ATOM 349 CD2 TYR A 23 3.000 -2.252 -3.561 1.00 1.16 C ATOM 350 CE1 TYR A 23 4.669 -1.544 -5.639 1.00 1.26 C ATOM 351 CE2 TYR A 23 3.335 -3.185 -4.521 1.00 1.18 C ATOM 352 CZ TYR A 23 4.169 -2.827 -5.559 1.00 0.36 C ATOM 353 OH TYR A 23 4.506 -3.754 -6.518 1.00 0.44 O ATOM 354 H TYR A 23 4.429 2.079 -3.474 1.00 0.30 H ATOM 355 HA TYR A 23 1.775 1.035 -3.899 1.00 0.26 H ATOM 356 HB2 TYR A 23 4.023 0.329 -2.039 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.432 -0.409 -1.881 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.717 0.390 -4.730 1.00 2.17 H ATOM 359 HD2 TYR A 23 2.347 -2.529 -2.747 1.00 2.06 H ATOM 360 HE1 TYR A 23 5.323 -1.262 -6.451 1.00 2.17 H ATOM 361 HE2 TYR A 23 2.942 -4.189 -4.455 1.00 2.10 H ATOM 362 HH TYR A 23 5.441 -3.678 -6.723 1.00 0.83 H ATOM 363 N ARG A 24 2.433 2.928 -1.321 1.00 0.25 N ATOM 364 CA ARG A 24 1.835 3.662 -0.208 1.00 0.29 C ATOM 365 C ARG A 24 0.724 4.602 -0.658 1.00 0.31 C ATOM 366 O ARG A 24 -0.413 4.507 -0.199 1.00 0.32 O ATOM 367 CB ARG A 24 2.893 4.496 0.521 1.00 0.35 C ATOM 368 CG ARG A 24 4.190 3.768 0.802 1.00 0.36 C ATOM 369 CD ARG A 24 5.389 4.685 0.653 1.00 0.31 C ATOM 370 NE ARG A 24 6.650 3.943 0.673 1.00 0.36 N ATOM 371 CZ ARG A 24 7.825 4.487 0.985 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.910 5.776 1.292 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.919 3.739 0.994 1.00 0.47 N ATOM 374 H ARG A 24 3.377 3.070 -1.540 1.00 0.28 H ATOM 375 HA ARG A 24 1.424 2.943 0.482 1.00 0.30 H ATOM 376 HB2 ARG A 24 3.122 5.361 -0.078 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.484 4.823 1.465 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.165 3.404 1.814 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.289 2.940 0.117 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.306 5.218 -0.281 1.00 0.33 H ATOM 381 HD3 ARG A 24 5.387 5.392 1.470 1.00 0.42 H ATOM 382 HE ARG A 24 6.617 2.984 0.448 1.00 0.40 H ATOM 383 HH11 ARG A 24 7.089 6.346 1.291 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.796 6.177 1.524 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.861 2.768 0.769 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.802 4.147 1.227 1.00 0.50 H ATOM 387 N LEU A 25 1.084 5.547 -1.510 1.00 0.32 N ATOM 388 CA LEU A 25 0.145 6.561 -1.977 1.00 0.37 C ATOM 389 C LEU A 25 -0.544 6.208 -3.294 1.00 0.36 C ATOM 390 O LEU A 25 -1.736 6.464 -3.463 1.00 0.39 O ATOM 391 CB LEU A 25 0.893 7.883 -2.133 1.00 0.42 C ATOM 392 CG LEU A 25 1.875 8.224 -0.995 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.388 7.674 0.346 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.270 7.697 -1.310 1.00 0.42 C ATOM 395 H LEU A 25 2.020 5.594 -1.800 1.00 0.32 H ATOM 396 HA LEU A 25 -0.611 6.683 -1.217 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.449 7.842 -3.063 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.166 8.678 -2.203 1.00 0.45 H ATOM 399 HG LEU A 25 1.940 9.299 -0.904 1.00 0.47 H ATOM 400 HD11 LEU A 25 1.630 8.374 1.131 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.874 6.728 0.549 1.00 1.08 H ATOM 402 HD13 LEU A 25 0.319 7.528 0.310 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.925 8.526 -1.534 1.00 1.04 H ATOM 404 HD22 LEU A 25 3.223 7.037 -2.163 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.654 7.157 -0.456 1.00 1.06 H ATOM 406 N ASN A 26 0.213 5.675 -4.240 1.00 0.34 N ATOM 407 CA ASN A 26 -0.332 5.356 -5.556 1.00 0.36 C ATOM 408 C ASN A 26 -1.280 4.155 -5.534 1.00 0.32 C ATOM 409 O ASN A 26 -2.297 4.159 -6.228 1.00 0.38 O ATOM 410 CB ASN A 26 0.810 5.122 -6.537 1.00 0.37 C ATOM 411 CG ASN A 26 0.592 5.830 -7.860 1.00 0.54 C ATOM 412 OD1 ASN A 26 0.669 5.218 -8.926 1.00 1.22 O ATOM 413 ND2 ASN A 26 0.318 7.128 -7.798 1.00 1.28 N ATOM 414 H ASN A 26 1.166 5.529 -4.067 1.00 0.32 H ATOM 415 HA ASN A 26 -0.891 6.218 -5.887 1.00 0.42 H ATOM 416 HB2 ASN A 26 1.726 5.495 -6.097 1.00 0.36 H ATOM 417 HB3 ASN A 26 0.907 4.064 -6.726 1.00 0.34 H ATOM 418 HD21 ASN A 26 0.272 7.550 -6.914 1.00 1.98 H ATOM 419 HD22 ASN A 26 0.172 7.611 -8.638 1.00 1.37 H ATOM 420 N LEU A 27 -0.968 3.134 -4.740 1.00 0.27 N ATOM 421 CA LEU A 27 -1.836 1.960 -4.661 1.00 0.27 C ATOM 422 C LEU A 27 -2.836 2.113 -3.510 1.00 0.25 C ATOM 423 O LEU A 27 -3.745 2.940 -3.590 1.00 0.28 O ATOM 424 CB LEU A 27 -1.009 0.676 -4.519 1.00 0.29 C ATOM 425 CG LEU A 27 -0.665 -0.018 -5.837 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.333 0.805 -6.631 1.00 0.91 C ATOM 427 CD2 LEU A 27 -0.122 -1.414 -5.574 1.00 1.05 C ATOM 428 H LEU A 27 -0.154 3.173 -4.197 1.00 0.27 H ATOM 429 HA LEU A 27 -2.393 1.912 -5.586 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.090 0.918 -4.009 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.565 -0.021 -3.912 1.00 0.63 H ATOM 432 HG LEU A 27 -1.563 -0.115 -6.430 1.00 0.93 H ATOM 433 HD11 LEU A 27 0.747 0.201 -7.425 1.00 1.50 H ATOM 434 HD12 LEU A 27 1.127 1.136 -5.978 1.00 1.21 H ATOM 435 HD13 LEU A 27 -0.167 1.664 -7.055 1.00 1.49 H ATOM 436 HD21 LEU A 27 -0.753 -1.915 -4.854 1.00 1.42 H ATOM 437 HD22 LEU A 27 0.882 -1.343 -5.185 1.00 1.50 H ATOM 438 HD23 LEU A 27 -0.113 -1.977 -6.496 1.00 1.69 H ATOM 439 N CYS A 28 -2.677 1.336 -2.437 1.00 0.25 N ATOM 440 CA CYS A 28 -3.580 1.430 -1.303 1.00 0.23 C ATOM 441 C CYS A 28 -3.024 2.387 -0.262 1.00 0.22 C ATOM 442 O CYS A 28 -1.811 2.493 -0.084 1.00 0.22 O ATOM 443 CB CYS A 28 -3.732 0.060 -0.678 1.00 0.25 C ATOM 444 SG CYS A 28 -2.163 -0.566 -0.040 1.00 0.50 S ATOM 445 H CYS A 28 -1.938 0.690 -2.401 1.00 0.29 H ATOM 446 HA CYS A 28 -4.540 1.780 -1.640 1.00 0.25 H ATOM 447 HB2 CYS A 28 -4.429 0.115 0.146 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.095 -0.637 -1.417 1.00 0.26 H ATOM 449 N LYS A 29 -3.916 3.058 0.438 1.00 0.24 N ATOM 450 CA LYS A 29 -3.521 3.984 1.481 1.00 0.27 C ATOM 451 C LYS A 29 -3.239 3.255 2.788 1.00 0.27 C ATOM 452 O LYS A 29 -2.158 3.357 3.355 1.00 0.30 O ATOM 453 CB LYS A 29 -4.604 5.042 1.686 1.00 0.33 C ATOM 454 CG LYS A 29 -4.788 5.951 0.481 1.00 0.31 C ATOM 455 CD LYS A 29 -4.244 7.347 0.745 1.00 0.81 C ATOM 456 CE LYS A 29 -5.332 8.285 1.245 1.00 0.97 C ATOM 457 NZ LYS A 29 -5.266 8.477 2.720 1.00 1.30 N ATOM 458 H LYS A 29 -4.864 2.907 0.267 1.00 0.26 H ATOM 459 HA LYS A 29 -2.615 4.473 1.158 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.543 4.547 1.885 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.340 5.653 2.537 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.262 5.525 -0.362 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.842 6.022 0.253 1.00 0.56 H ATOM 464 HD2 LYS A 29 -3.467 7.284 1.492 1.00 1.21 H ATOM 465 HD3 LYS A 29 -3.834 7.742 -0.172 1.00 1.28 H ATOM 466 HE2 LYS A 29 -5.213 9.243 0.761 1.00 1.60 H ATOM 467 HE3 LYS A 29 -6.295 7.869 0.987 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -4.282 8.634 3.016 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -5.633 7.634 3.207 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -5.837 9.300 2.999 1.00 1.88 H ATOM 471 N LYS A 30 -4.249 2.551 3.278 1.00 0.27 N ATOM 472 CA LYS A 30 -4.150 1.838 4.544 1.00 0.31 C ATOM 473 C LYS A 30 -3.497 0.460 4.440 1.00 0.29 C ATOM 474 O LYS A 30 -2.566 0.158 5.185 1.00 0.31 O ATOM 475 CB LYS A 30 -5.537 1.691 5.163 1.00 0.36 C ATOM 476 CG LYS A 30 -5.550 0.812 6.400 1.00 0.46 C ATOM 477 CD LYS A 30 -4.960 1.532 7.598 1.00 0.57 C ATOM 478 CE LYS A 30 -5.995 2.403 8.292 1.00 1.03 C ATOM 479 NZ LYS A 30 -5.369 3.550 9.005 1.00 1.66 N ATOM 480 H LYS A 30 -5.099 2.536 2.790 1.00 0.26 H ATOM 481 HA LYS A 30 -3.551 2.442 5.206 1.00 0.35 H ATOM 482 HB2 LYS A 30 -5.904 2.669 5.435 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.200 1.256 4.430 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.567 0.531 6.622 1.00 0.47 H ATOM 485 HG3 LYS A 30 -4.962 -0.073 6.199 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.592 0.799 8.299 1.00 0.73 H ATOM 487 HD3 LYS A 30 -4.143 2.155 7.263 1.00 0.87 H ATOM 488 HE2 LYS A 30 -6.681 2.783 7.550 1.00 1.61 H ATOM 489 HE3 LYS A 30 -6.536 1.798 9.004 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -5.883 3.746 9.887 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -5.392 4.399 8.406 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -4.378 3.329 9.235 1.00 2.11 H ATOM 493 N THR A 31 -4.023 -0.401 3.574 1.00 0.28 N ATOM 494 CA THR A 31 -3.508 -1.764 3.464 1.00 0.32 C ATOM 495 C THR A 31 -1.992 -1.809 3.332 1.00 0.30 C ATOM 496 O THR A 31 -1.356 -2.771 3.762 1.00 0.37 O ATOM 497 CB THR A 31 -4.149 -2.499 2.295 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.559 -2.516 2.425 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.680 -3.930 2.191 1.00 0.54 C ATOM 500 H THR A 31 -4.796 -0.132 3.028 1.00 0.28 H ATOM 501 HA THR A 31 -3.778 -2.277 4.374 1.00 0.36 H ATOM 502 HB THR A 31 -3.893 -1.996 1.375 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.796 -2.809 3.308 1.00 1.01 H ATOM 504 HG21 THR A 31 -4.144 -4.514 2.970 1.00 1.19 H ATOM 505 HG22 THR A 31 -2.605 -3.965 2.310 1.00 1.16 H ATOM 506 HG23 THR A 31 -3.954 -4.328 1.228 1.00 1.18 H ATOM 507 N CYS A 32 -1.416 -0.779 2.742 1.00 0.24 N ATOM 508 CA CYS A 32 0.039 -0.740 2.571 1.00 0.26 C ATOM 509 C CYS A 32 0.720 -0.440 3.903 1.00 0.24 C ATOM 510 O CYS A 32 1.922 -0.649 4.061 1.00 0.26 O ATOM 511 CB CYS A 32 0.452 0.293 1.514 1.00 0.31 C ATOM 512 SG CYS A 32 2.239 0.638 1.454 1.00 0.89 S ATOM 513 H CYS A 32 -1.977 -0.037 2.420 1.00 0.22 H ATOM 514 HA CYS A 32 0.353 -1.720 2.241 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.170 -0.071 0.540 1.00 0.47 H ATOM 516 HB3 CYS A 32 -0.058 1.225 1.708 1.00 0.43 H ATOM 517 N GLY A 33 -0.065 0.034 4.860 1.00 0.24 N ATOM 518 CA GLY A 33 0.465 0.341 6.177 1.00 0.29 C ATOM 519 C GLY A 33 0.967 1.770 6.317 1.00 0.35 C ATOM 520 O GLY A 33 1.976 2.010 6.981 1.00 0.46 O ATOM 521 H GLY A 33 -1.018 0.160 4.673 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.312 0.177 6.908 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.281 -0.335 6.386 1.00 0.29 H ATOM 524 N THR A 34 0.266 2.725 5.708 1.00 0.34 N ATOM 525 CA THR A 34 0.665 4.132 5.798 1.00 0.44 C ATOM 526 C THR A 34 -0.487 5.007 6.283 1.00 0.52 C ATOM 527 O THR A 34 -0.270 6.005 6.971 1.00 0.68 O ATOM 528 CB THR A 34 1.176 4.653 4.452 1.00 0.51 C ATOM 529 OG1 THR A 34 1.386 6.052 4.507 1.00 1.06 O ATOM 530 CG2 THR A 34 0.241 4.380 3.298 1.00 0.54 C ATOM 531 H THR A 34 -0.535 2.483 5.199 1.00 0.32 H ATOM 532 HA THR A 34 1.466 4.195 6.520 1.00 0.50 H ATOM 533 HB THR A 34 2.116 4.182 4.231 1.00 0.78 H ATOM 534 HG1 THR A 34 2.144 6.284 3.966 1.00 1.39 H ATOM 535 HG21 THR A 34 0.030 3.322 3.248 1.00 1.16 H ATOM 536 HG22 THR A 34 0.705 4.698 2.376 1.00 1.26 H ATOM 537 HG23 THR A 34 -0.679 4.925 3.444 1.00 1.18 H ATOM 538 N CYS A 35 -1.710 4.635 5.922 1.00 0.49 N ATOM 539 CA CYS A 35 -2.888 5.399 6.326 1.00 0.62 C ATOM 540 C CYS A 35 -2.964 5.523 7.845 1.00 0.95 C ATOM 541 O CYS A 35 -3.728 6.384 8.331 1.00 1.71 O ATOM 542 CB CYS A 35 -4.160 4.740 5.794 1.00 1.04 C ATOM 543 SG CYS A 35 -5.588 5.866 5.660 1.00 1.59 S ATOM 544 OXT CYS A 35 -2.259 4.758 8.537 1.00 1.64 O ATOM 545 H CYS A 35 -1.825 3.830 5.372 1.00 0.43 H ATOM 546 HA CYS A 35 -2.801 6.388 5.901 1.00 1.30 H ATOM 547 HB2 CYS A 35 -3.965 4.345 4.811 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.439 3.931 6.452 1.00 1.53 H