ATOM 23 N LYS A 4 -10.789 5.962 2.861 1.00 62.31 N ATOM 24 CA LYS A 4 -9.879 6.603 1.919 1.00 54.31 C ATOM 25 C LYS A 4 -8.770 5.646 1.495 1.00 73.11 C ATOM 26 O LYS A 4 -8.360 4.777 2.264 1.00 14.12 O ATOM 27 CB LYS A 4 -9.271 7.862 2.543 1.00 72.21 C ATOM 28 CG LYS A 4 -8.834 7.674 3.986 1.00 40.44 C ATOM 29 CD LYS A 4 -8.112 8.903 4.512 1.00 3.05 C ATOM 30 CE LYS A 4 -9.010 10.130 4.488 1.00 3.22 C ATOM 31 NZ LYS A 4 -8.402 11.277 5.220 1.00 41.14 N ATOM 32 H LYS A 4 -10.433 5.609 3.704 1.00 12.13 H ATOM 33 HA LYS A 4 -10.450 6.884 1.046 1.00 34.12 H ATOM 34 HB2 LYS A 4 -8.409 8.155 1.962 1.00 14.53 H ATOM 35 HB3 LYS A 4 -10.004 8.655 2.511 1.00 11.33 H ATOM 36 HG2 LYS A 4 -9.706 7.493 4.596 1.00 25.11 H ATOM 37 HG3 LYS A 4 -8.169 6.824 4.043 1.00 41.32 H ATOM 38 HD2 LYS A 4 -7.802 8.719 5.530 1.00 34.55 H ATOM 39 HD3 LYS A 4 -7.243 9.091 3.898 1.00 61.32 H ATOM 40 HE2 LYS A 4 -9.176 10.418 3.461 1.00 33.43 H ATOM 41 HE3 LYS A 4 -9.953 9.880 4.950 1.00 70.12 H ATOM 42 HZ1 LYS A 4 -9.143 11.832 5.693 1.00 21.01 H ATOM 43 HZ2 LYS A 4 -7.892 11.895 4.555 1.00 34.43 H ATOM 44 HZ3 LYS A 4 -7.732 10.929 5.935 1.00 14.20 H ATOM 45 N ARG A 5 -8.290 5.812 0.266 1.00 1.44 N ATOM 46 CA ARG A 5 -7.228 4.963 -0.258 1.00 42.04 C ATOM 47 C ARG A 5 -6.316 5.749 -1.197 1.00 15.15 C ATOM 48 O ARG A 5 -6.771 6.626 -1.932 1.00 23.42 O ATOM 49 CB ARG A 5 -7.824 3.763 -0.998 1.00 25.43 C ATOM 50 CG ARG A 5 -8.829 4.147 -2.071 1.00 40.14 C ATOM 51 CD ARG A 5 -8.137 4.517 -3.374 1.00 44.33 C ATOM 52 NE ARG A 5 -8.794 3.918 -4.533 1.00 15.04 N ATOM 53 CZ ARG A 5 -8.347 4.042 -5.777 1.00 31.31 C ATOM 54 NH1 ARG A 5 -7.247 4.739 -6.023 1.00 51.35 N ATOM 55 NH2 ARG A 5 -9.000 3.466 -6.779 1.00 12.33 N ATOM 56 H ARG A 5 -8.658 6.522 -0.300 1.00 4.53 H ATOM 57 HA ARG A 5 -6.644 4.606 0.576 1.00 51.21 H ATOM 58 HB2 ARG A 5 -7.024 3.210 -1.466 1.00 60.33 H ATOM 59 HB3 ARG A 5 -8.321 3.126 -0.281 1.00 61.25 H ATOM 60 HG2 ARG A 5 -9.486 3.310 -2.251 1.00 54.14 H ATOM 61 HG3 ARG A 5 -9.405 4.993 -1.726 1.00 61.34 H ATOM 62 HD2 ARG A 5 -8.151 5.592 -3.481 1.00 22.41 H ATOM 63 HD3 ARG A 5 -7.114 4.173 -3.334 1.00 60.13 H ATOM 64 HE ARG A 5 -9.609 3.397 -4.374 1.00 4.14 H ATOM 65 HH11 ARG A 5 -6.752 5.173 -5.270 1.00 51.33 H ATOM 66 HH12 ARG A 5 -6.912 4.830 -6.962 1.00 11.43 H ATOM 67 HH21 ARG A 5 -9.830 2.940 -6.597 1.00 74.41 H ATOM 68 HH22 ARG A 5 -8.663 3.561 -7.715 1.00 74.51 H ATOM 69 N LYS A 6 -5.027 5.431 -1.164 1.00 24.42 N ATOM 70 CA LYS A 6 -4.050 6.106 -2.010 1.00 73.22 C ATOM 71 C LYS A 6 -2.801 5.249 -2.191 1.00 21.45 C ATOM 72 O LYS A 6 -2.461 4.441 -1.325 1.00 44.23 O ATOM 73 CB LYS A 6 -3.670 7.460 -1.405 1.00 60.24 C ATOM 74 CG LYS A 6 -2.710 8.263 -2.267 1.00 61.50 C ATOM 75 CD LYS A 6 -2.826 9.752 -1.991 1.00 52.40 C ATOM 76 CE LYS A 6 -1.605 10.508 -2.491 1.00 42.15 C ATOM 77 NZ LYS A 6 -0.427 10.309 -1.603 1.00 5.15 N ATOM 78 H LYS A 6 -4.724 4.724 -0.556 1.00 71.14 H ATOM 79 HA LYS A 6 -4.504 6.267 -2.976 1.00 45.45 H ATOM 80 HB2 LYS A 6 -4.568 8.043 -1.266 1.00 3.02 H ATOM 81 HB3 LYS A 6 -3.205 7.293 -0.445 1.00 53.11 H ATOM 82 HG2 LYS A 6 -1.700 7.946 -2.055 1.00 64.52 H ATOM 83 HG3 LYS A 6 -2.936 8.079 -3.308 1.00 15.21 H ATOM 84 HD2 LYS A 6 -3.702 10.135 -2.492 1.00 12.44 H ATOM 85 HD3 LYS A 6 -2.922 9.905 -0.926 1.00 1.12 H ATOM 86 HE2 LYS A 6 -1.361 10.156 -3.483 1.00 2.54 H ATOM 87 HE3 LYS A 6 -1.841 11.561 -2.532 1.00 34.21 H ATOM 88 HZ1 LYS A 6 -0.687 10.501 -0.615 1.00 13.45 H ATOM 89 HZ2 LYS A 6 0.342 10.953 -1.879 1.00 52.33 H ATOM 90 HZ3 LYS A 6 -0.085 9.330 -1.676 1.00 61.51 H ATOM 91 N VAL A 7 -2.121 5.431 -3.317 1.00 52.44 N ATOM 92 CA VAL A 7 -0.908 4.676 -3.609 1.00 55.50 C ATOM 93 C VAL A 7 0.336 5.526 -3.379 1.00 41.22 C ATOM 94 O VAL A 7 0.361 6.713 -3.709 1.00 71.10 O ATOM 95 CB VAL A 7 -0.904 4.161 -5.061 1.00 22.11 C ATOM 96 CG1 VAL A 7 -1.080 5.313 -6.038 1.00 22.01 C ATOM 97 CG2 VAL A 7 0.381 3.397 -5.350 1.00 14.13 C ATOM 98 H VAL A 7 -2.443 6.090 -3.968 1.00 65.54 H ATOM 99 HA VAL A 7 -0.878 3.824 -2.946 1.00 61.42 H ATOM 100 HB VAL A 7 -1.736 3.483 -5.183 1.00 71.21 H ATOM 101 HG11 VAL A 7 -2.069 5.731 -5.925 1.00 72.12 H ATOM 102 HG12 VAL A 7 -0.341 6.074 -5.835 1.00 64.42 H ATOM 103 HG13 VAL A 7 -0.957 4.950 -7.047 1.00 71.51 H ATOM 104 HG21 VAL A 7 0.381 3.070 -6.379 1.00 72.33 H ATOM 105 HG22 VAL A 7 1.228 4.042 -5.175 1.00 65.05 H ATOM 106 HG23 VAL A 7 0.442 2.537 -4.699 1.00 2.23 H ATOM 107 N TYR A 8 1.370 4.912 -2.814 1.00 13.12 N ATOM 108 CA TYR A 8 2.618 5.613 -2.537 1.00 62.13 C ATOM 109 C TYR A 8 3.752 5.062 -3.396 1.00 61.42 C ATOM 110 O TYR A 8 4.440 4.119 -3.005 1.00 32.11 O ATOM 111 CB TYR A 8 2.979 5.491 -1.056 1.00 21.30 C ATOM 112 CG TYR A 8 3.266 6.819 -0.392 1.00 65.40 C ATOM 113 CD1 TYR A 8 4.204 7.695 -0.925 1.00 3.42 C ATOM 114 CD2 TYR A 8 2.601 7.196 0.768 1.00 62.22 C ATOM 115 CE1 TYR A 8 4.471 8.909 -0.321 1.00 53.04 C ATOM 116 CE2 TYR A 8 2.861 8.409 1.377 1.00 1.01 C ATOM 117 CZ TYR A 8 3.797 9.261 0.829 1.00 73.00 C ATOM 118 OH TYR A 8 4.058 10.469 1.434 1.00 65.32 O ATOM 119 H TYR A 8 1.290 3.965 -2.574 1.00 42.11 H ATOM 120 HA TYR A 8 2.473 6.656 -2.779 1.00 0.14 H ATOM 121 HB2 TYR A 8 2.159 5.028 -0.530 1.00 53.02 H ATOM 122 HB3 TYR A 8 3.858 4.872 -0.956 1.00 45.35 H ATOM 123 HD1 TYR A 8 4.731 7.416 -1.826 1.00 11.30 H ATOM 124 HD2 TYR A 8 1.870 6.526 1.195 1.00 70.25 H ATOM 125 HE1 TYR A 8 5.203 9.577 -0.750 1.00 64.41 H ATOM 126 HE2 TYR A 8 2.334 8.684 2.278 1.00 14.31 H ATOM 127 HH TYR A 8 4.255 10.326 2.363 1.00 71.25 H ATOM 128 N GLU A 9 3.943 5.659 -4.569 1.00 54.02 N ATOM 129 CA GLU A 9 4.994 5.229 -5.483 1.00 31.21 C ATOM 130 C GLU A 9 6.372 5.561 -4.922 1.00 44.22 C ATOM 131 O GLU A 9 7.389 5.072 -5.414 1.00 21.43 O ATOM 132 CB GLU A 9 4.814 5.892 -6.850 1.00 73.42 C ATOM 133 CG GLU A 9 4.957 7.403 -6.817 1.00 41.42 C ATOM 134 CD GLU A 9 4.547 8.057 -8.123 1.00 70.32 C ATOM 135 OE1 GLU A 9 4.070 7.334 -9.023 1.00 15.52 O ATOM 136 OE2 GLU A 9 4.704 9.290 -8.244 1.00 33.40 O ATOM 137 H GLU A 9 3.361 6.406 -4.825 1.00 64.33 H ATOM 138 HA GLU A 9 4.914 4.158 -5.599 1.00 32.31 H ATOM 139 HB2 GLU A 9 5.553 5.494 -7.530 1.00 10.43 H ATOM 140 HB3 GLU A 9 3.829 5.653 -7.226 1.00 22.44 H ATOM 141 HG2 GLU A 9 4.336 7.794 -6.026 1.00 32.02 H ATOM 142 HG3 GLU A 9 5.990 7.650 -6.617 1.00 50.24 H ATOM 143 N ASN A 10 6.399 6.398 -3.889 1.00 22.10 N ATOM 144 CA ASN A 10 7.653 6.798 -3.261 1.00 70.31 C ATOM 145 C ASN A 10 8.327 5.607 -2.584 1.00 52.45 C ATOM 146 O ASN A 10 9.527 5.633 -2.311 1.00 52.54 O ATOM 147 CB ASN A 10 7.404 7.907 -2.237 1.00 55.01 C ATOM 148 CG ASN A 10 8.668 8.667 -1.888 1.00 23.44 C ATOM 149 OD1 ASN A 10 9.148 9.489 -2.669 1.00 22.01 O ATOM 150 ND2 ASN A 10 9.217 8.393 -0.709 1.00 75.01 N ATOM 151 H ASN A 10 5.555 6.755 -3.541 1.00 44.45 H ATOM 152 HA ASN A 10 8.305 7.174 -4.035 1.00 2.51 H ATOM 153 HB2 ASN A 10 6.687 8.607 -2.641 1.00 11.03 H ATOM 154 HB3 ASN A 10 7.005 7.471 -1.333 1.00 4.41 H ATOM 155 HD21 ASN A 10 8.780 7.727 -0.139 1.00 35.35 H ATOM 156 HD22 ASN A 10 10.035 8.870 -0.458 1.00 52.11 H ATOM 157 N TYR A 11 7.546 4.566 -2.319 1.00 53.12 N ATOM 158 CA TYR A 11 8.066 3.367 -1.673 1.00 61.03 C ATOM 159 C TYR A 11 8.612 2.385 -2.705 1.00 75.55 C ATOM 160 O TYR A 11 8.210 2.380 -3.869 1.00 40.53 O ATOM 161 CB TYR A 11 6.971 2.694 -0.842 1.00 64.13 C ATOM 162 CG TYR A 11 7.172 2.834 0.650 1.00 53.32 C ATOM 163 CD1 TYR A 11 7.567 4.045 1.207 1.00 64.30 C ATOM 164 CD2 TYR A 11 6.965 1.758 1.503 1.00 73.43 C ATOM 165 CE1 TYR A 11 7.752 4.177 2.570 1.00 62.15 C ATOM 166 CE2 TYR A 11 7.146 1.881 2.867 1.00 73.02 C ATOM 167 CZ TYR A 11 7.539 3.092 3.395 1.00 25.12 C ATOM 168 OH TYR A 11 7.722 3.221 4.753 1.00 22.23 O ATOM 169 H TYR A 11 6.597 4.605 -2.561 1.00 61.32 H ATOM 170 HA TYR A 11 8.871 3.666 -1.017 1.00 35.23 H ATOM 171 HB2 TYR A 11 6.018 3.135 -1.091 1.00 22.11 H ATOM 172 HB3 TYR A 11 6.948 1.640 -1.076 1.00 52.51 H ATOM 173 HD1 TYR A 11 7.732 4.892 0.557 1.00 24.13 H ATOM 174 HD2 TYR A 11 6.656 0.810 1.086 1.00 52.12 H ATOM 175 HE1 TYR A 11 8.061 5.125 2.984 1.00 53.24 H ATOM 176 HE2 TYR A 11 6.980 1.032 3.514 1.00 51.42 H ATOM 177 HH TYR A 11 8.422 3.854 4.924 1.00 45.11 H ATOM 178 N PRO A 12 9.550 1.531 -2.270 1.00 74.12 N ATOM 179 CA PRO A 12 10.171 0.527 -3.139 1.00 60.43 C ATOM 180 C PRO A 12 9.201 -0.584 -3.527 1.00 41.51 C ATOM 181 O PRO A 12 8.429 -1.066 -2.698 1.00 24.50 O ATOM 182 CB PRO A 12 11.307 -0.032 -2.279 1.00 41.20 C ATOM 183 CG PRO A 12 10.870 0.203 -0.874 1.00 61.22 C ATOM 184 CD PRO A 12 10.076 1.480 -0.895 1.00 71.24 C ATOM 185 HA PRO A 12 10.580 0.975 -4.033 1.00 63.52 H ATOM 186 HB2 PRO A 12 11.432 -1.086 -2.485 1.00 31.35 H ATOM 187 HB3 PRO A 12 12.223 0.494 -2.500 1.00 44.43 H ATOM 188 HG2 PRO A 12 10.253 -0.617 -0.540 1.00 73.05 H ATOM 189 HG3 PRO A 12 11.734 0.309 -0.235 1.00 0.33 H ATOM 190 HD2 PRO A 12 9.272 1.436 -0.176 1.00 30.22 H ATOM 191 HD3 PRO A 12 10.717 2.325 -0.697 1.00 40.22 H ATOM 192 N VAL A 13 9.245 -0.985 -4.794 1.00 20.20 N ATOM 193 CA VAL A 13 8.371 -2.041 -5.292 1.00 41.42 C ATOM 194 C VAL A 13 8.743 -3.391 -4.692 1.00 32.23 C ATOM 195 O VAL A 13 7.891 -4.265 -4.525 1.00 51.41 O ATOM 196 CB VAL A 13 8.429 -2.139 -6.828 1.00 21.54 C ATOM 197 CG1 VAL A 13 9.783 -2.668 -7.278 1.00 11.24 C ATOM 198 CG2 VAL A 13 7.304 -3.022 -7.347 1.00 42.12 C ATOM 199 H VAL A 13 9.881 -0.562 -5.408 1.00 72.30 H ATOM 200 HA VAL A 13 7.358 -1.797 -5.006 1.00 32.32 H ATOM 201 HB VAL A 13 8.299 -1.149 -7.237 1.00 64.12 H ATOM 202 HG11 VAL A 13 10.567 -2.103 -6.796 1.00 41.52 H ATOM 203 HG12 VAL A 13 9.871 -3.710 -7.009 1.00 10.24 H ATOM 204 HG13 VAL A 13 9.871 -2.563 -8.349 1.00 64.53 H ATOM 205 HG21 VAL A 13 6.407 -2.838 -6.775 1.00 10.44 H ATOM 206 HG22 VAL A 13 7.121 -2.795 -8.388 1.00 4.14 H ATOM 207 HG23 VAL A 13 7.586 -4.061 -7.250 1.00 15.40 H ATOM 208 N SER A 14 10.022 -3.557 -4.368 1.00 41.24 N ATOM 209 CA SER A 14 10.509 -4.804 -3.789 1.00 51.40 C ATOM 210 C SER A 14 9.710 -5.172 -2.542 1.00 74.13 C ATOM 211 O SER A 14 9.565 -6.348 -2.208 1.00 64.12 O ATOM 212 CB SER A 14 11.993 -4.683 -3.439 1.00 42.33 C ATOM 213 OG SER A 14 12.707 -4.019 -4.468 1.00 71.45 O ATOM 214 H SER A 14 10.653 -2.824 -4.525 1.00 12.11 H ATOM 215 HA SER A 14 10.383 -5.583 -4.526 1.00 51.42 H ATOM 216 HB2 SER A 14 12.101 -4.121 -2.525 1.00 32.11 H ATOM 217 HB3 SER A 14 12.410 -5.670 -3.307 1.00 50.13 H ATOM 218 HG SER A 14 12.907 -3.122 -4.193 1.00 52.02 H ATOM 219 N LYS A 15 9.192 -4.158 -1.858 1.00 51.33 N ATOM 220 CA LYS A 15 8.405 -4.372 -0.649 1.00 65.32 C ATOM 221 C LYS A 15 7.068 -5.027 -0.979 1.00 14.34 C ATOM 222 O LYS A 15 6.512 -5.768 -0.168 1.00 33.32 O ATOM 223 CB LYS A 15 8.171 -3.044 0.073 1.00 10.40 C ATOM 224 CG LYS A 15 9.129 -2.800 1.226 1.00 30.44 C ATOM 225 CD LYS A 15 10.578 -2.888 0.776 1.00 14.24 C ATOM 226 CE LYS A 15 11.448 -1.870 1.496 1.00 33.04 C ATOM 227 NZ LYS A 15 11.919 -2.377 2.816 1.00 42.33 N ATOM 228 H LYS A 15 9.341 -3.242 -2.175 1.00 51.41 H ATOM 229 HA LYS A 15 8.965 -5.030 -0.002 1.00 22.20 H ATOM 230 HB2 LYS A 15 8.283 -2.237 -0.637 1.00 0.33 H ATOM 231 HB3 LYS A 15 7.163 -3.032 0.462 1.00 52.14 H ATOM 232 HG2 LYS A 15 8.949 -1.816 1.632 1.00 35.14 H ATOM 233 HG3 LYS A 15 8.953 -3.545 1.991 1.00 42.33 H ATOM 234 HD2 LYS A 15 10.952 -3.879 0.988 1.00 43.32 H ATOM 235 HD3 LYS A 15 10.627 -2.702 -0.288 1.00 12.02 H ATOM 236 HE2 LYS A 15 12.304 -1.647 0.880 1.00 62.23 H ATOM 237 HE3 LYS A 15 10.872 -0.970 1.652 1.00 54.44 H ATOM 238 HZ1 LYS A 15 12.349 -3.317 2.704 1.00 11.22 H ATOM 239 HZ2 LYS A 15 11.119 -2.449 3.476 1.00 11.21 H ATOM 240 HZ3 LYS A 15 12.627 -1.729 3.216 1.00 53.54 H ATOM 241 N CYS A 16 6.557 -4.749 -2.173 1.00 64.53 N ATOM 242 CA CYS A 16 5.286 -5.313 -2.611 1.00 54.03 C ATOM 243 C CYS A 16 5.285 -6.832 -2.467 1.00 12.41 C ATOM 244 O CYS A 16 4.241 -7.442 -2.235 1.00 51.33 O ATOM 245 CB CYS A 16 5.007 -4.927 -4.065 1.00 41.13 C ATOM 246 SG CYS A 16 3.481 -5.652 -4.747 1.00 3.40 S ATOM 247 H CYS A 16 7.048 -4.151 -2.776 1.00 62.44 H ATOM 248 HA CYS A 16 4.508 -4.903 -1.985 1.00 22.25 H ATOM 249 HB2 CYS A 16 4.919 -3.853 -4.135 1.00 1.34 H ATOM 250 HB3 CYS A 16 5.832 -5.255 -4.681 1.00 54.02 H ATOM 251 N GLN A 17 6.461 -7.435 -2.605 1.00 55.14 N ATOM 252 CA GLN A 17 6.596 -8.882 -2.492 1.00 15.45 C ATOM 253 C GLN A 17 6.098 -9.369 -1.135 1.00 71.20 C ATOM 254 O GLN A 17 5.720 -10.531 -0.982 1.00 31.32 O ATOM 255 CB GLN A 17 8.054 -9.297 -2.692 1.00 74.45 C ATOM 256 CG GLN A 17 8.667 -8.765 -3.978 1.00 33.45 C ATOM 257 CD GLN A 17 10.026 -9.369 -4.270 1.00 32.14 C ATOM 258 OE1 GLN A 17 10.126 -10.470 -4.814 1.00 52.12 O ATOM 259 NE2 GLN A 17 11.083 -8.651 -3.908 1.00 40.14 N ATOM 260 H GLN A 17 7.257 -6.893 -2.789 1.00 72.35 H ATOM 261 HA GLN A 17 5.993 -9.333 -3.265 1.00 51.44 H ATOM 262 HB2 GLN A 17 8.638 -8.931 -1.862 1.00 12.41 H ATOM 263 HB3 GLN A 17 8.109 -10.376 -2.712 1.00 61.22 H ATOM 264 HG2 GLN A 17 8.004 -8.996 -4.799 1.00 11.32 H ATOM 265 HG3 GLN A 17 8.775 -7.695 -3.893 1.00 2.10 H ATOM 266 HE21 GLN A 17 10.927 -7.784 -3.478 1.00 41.41 H ATOM 267 HE22 GLN A 17 11.973 -9.018 -4.085 1.00 24.15 H ATOM 268 N LEU A 18 6.099 -8.474 -0.153 1.00 64.53 N ATOM 269 CA LEU A 18 5.648 -8.813 1.192 1.00 51.24 C ATOM 270 C LEU A 18 4.300 -8.167 1.492 1.00 1.54 C ATOM 271 O LEU A 18 4.087 -6.989 1.206 1.00 73.15 O ATOM 272 CB LEU A 18 6.683 -8.366 2.226 1.00 35.13 C ATOM 273 CG LEU A 18 8.097 -8.915 2.040 1.00 24.45 C ATOM 274 CD1 LEU A 18 9.096 -8.106 2.854 1.00 55.40 C ATOM 275 CD2 LEU A 18 8.155 -10.385 2.433 1.00 2.21 C ATOM 276 H LEU A 18 6.412 -7.564 -0.336 1.00 30.41 H ATOM 277 HA LEU A 18 5.539 -9.887 1.245 1.00 53.22 H ATOM 278 HB2 LEU A 18 6.739 -7.290 2.193 1.00 44.43 H ATOM 279 HB3 LEU A 18 6.331 -8.677 3.200 1.00 30.04 H ATOM 280 HG LEU A 18 8.374 -8.836 0.999 1.00 64.44 H ATOM 281 HD11 LEU A 18 9.360 -7.211 2.310 1.00 4.31 H ATOM 282 HD12 LEU A 18 9.982 -8.697 3.028 1.00 63.03 H ATOM 283 HD13 LEU A 18 8.652 -7.835 3.801 1.00 63.40 H ATOM 284 HD21 LEU A 18 8.479 -10.971 1.587 1.00 44.02 H ATOM 285 HD22 LEU A 18 7.174 -10.713 2.744 1.00 2.14 H ATOM 286 HD23 LEU A 18 8.852 -10.512 3.248 1.00 23.34 H ATOM 287 N ALA A 19 3.394 -8.945 2.075 1.00 15.33 N ATOM 288 CA ALA A 19 2.067 -8.447 2.419 1.00 40.32 C ATOM 289 C ALA A 19 2.055 -7.838 3.817 1.00 12.30 C ATOM 290 O ALA A 19 1.331 -6.878 4.079 1.00 1.41 O ATOM 291 CB ALA A 19 1.041 -9.567 2.321 1.00 41.43 C ATOM 292 H ALA A 19 3.622 -9.875 2.280 1.00 51.03 H ATOM 293 HA ALA A 19 1.801 -7.684 1.702 1.00 54.41 H ATOM 294 HB1 ALA A 19 1.531 -10.517 2.470 1.00 3.35 H ATOM 295 HB2 ALA A 19 0.285 -9.428 3.080 1.00 41.22 H ATOM 296 HB3 ALA A 19 0.581 -9.548 1.345 1.00 42.44 H ATOM 297 N ASN A 20 2.862 -8.401 4.711 1.00 75.14 N ATOM 298 CA ASN A 20 2.942 -7.912 6.082 1.00 33.51 C ATOM 299 C ASN A 20 3.752 -6.623 6.154 1.00 41.42 C ATOM 300 O ASN A 20 3.633 -5.856 7.109 1.00 61.23 O ATOM 301 CB ASN A 20 3.571 -8.974 6.987 1.00 24.24 C ATOM 302 CG ASN A 20 2.757 -10.252 7.032 1.00 34.33 C ATOM 303 OD1 ASN A 20 1.666 -10.286 7.601 1.00 11.41 O ATOM 304 ND2 ASN A 20 3.285 -11.312 6.431 1.00 33.51 N ATOM 305 H ASN A 20 3.415 -9.164 4.442 1.00 52.35 H ATOM 306 HA ASN A 20 1.937 -7.713 6.422 1.00 1.43 H ATOM 307 HB2 ASN A 20 4.558 -9.213 6.618 1.00 5.33 H ATOM 308 HB3 ASN A 20 3.650 -8.583 7.990 1.00 25.41 H ATOM 309 HD21 ASN A 20 4.158 -11.211 5.998 1.00 61.21 H ATOM 310 HD22 ASN A 20 2.779 -12.151 6.445 1.00 21.32 H ATOM 311 N GLN A 21 4.575 -6.390 5.135 1.00 14.44 N ATOM 312 CA GLN A 21 5.404 -5.191 5.084 1.00 41.04 C ATOM 313 C GLN A 21 4.592 -3.986 4.622 1.00 55.22 C ATOM 314 O GLN A 21 4.735 -2.886 5.156 1.00 24.04 O ATOM 315 CB GLN A 21 6.593 -5.409 4.145 1.00 21.55 C ATOM 316 CG GLN A 21 7.517 -4.206 4.044 1.00 33.43 C ATOM 317 CD GLN A 21 7.735 -3.524 5.380 1.00 15.41 C ATOM 318 OE1 GLN A 21 7.365 -2.365 5.566 1.00 12.34 O ATOM 319 NE2 GLN A 21 8.339 -4.241 6.321 1.00 61.42 N ATOM 320 H GLN A 21 4.625 -7.038 4.403 1.00 13.23 H ATOM 321 HA GLN A 21 5.774 -5.001 6.080 1.00 54.24 H ATOM 322 HB2 GLN A 21 7.170 -6.250 4.503 1.00 13.40 H ATOM 323 HB3 GLN A 21 6.220 -5.634 3.157 1.00 12.14 H ATOM 324 HG2 GLN A 21 8.474 -4.534 3.664 1.00 13.35 H ATOM 325 HG3 GLN A 21 7.084 -3.493 3.359 1.00 30.41 H ATOM 326 HE21 GLN A 21 8.607 -5.159 6.100 1.00 4.15 H ATOM 327 HE22 GLN A 21 8.494 -3.825 7.193 1.00 13.04 H ATOM 328 N CYS A 22 3.739 -4.200 3.626 1.00 23.12 N ATOM 329 CA CYS A 22 2.904 -3.132 3.091 1.00 12.51 C ATOM 330 C CYS A 22 1.981 -2.572 4.169 1.00 14.44 C ATOM 331 O CYS A 22 2.073 -1.400 4.533 1.00 52.11 O ATOM 332 CB CYS A 22 2.076 -3.645 1.911 1.00 33.44 C ATOM 333 SG CYS A 22 2.607 -3.001 0.293 1.00 43.54 S ATOM 334 H CYS A 22 3.670 -5.100 3.240 1.00 12.11 H ATOM 335 HA CYS A 22 3.554 -2.343 2.747 1.00 54.34 H ATOM 336 HB2 CYS A 22 2.146 -4.722 1.875 1.00 74.54 H ATOM 337 HB3 CYS A 22 1.044 -3.362 2.056 1.00 72.34 H ATOM 338 N ASN A 23 1.090 -3.418 4.677 1.00 73.21 N ATOM 339 CA ASN A 23 0.149 -3.009 5.713 1.00 51.32 C ATOM 340 C ASN A 23 0.885 -2.440 6.922 1.00 65.12 C ATOM 341 O ASN A 23 0.355 -1.595 7.644 1.00 24.24 O ATOM 342 CB ASN A 23 -0.718 -4.194 6.141 1.00 13.21 C ATOM 343 CG ASN A 23 -0.073 -5.015 7.240 1.00 30.14 C ATOM 344 OD1 ASN A 23 1.067 -5.462 7.109 1.00 52.35 O ATOM 345 ND2 ASN A 23 -0.801 -5.219 8.332 1.00 3.43 N ATOM 346 H ASN A 23 1.065 -4.341 4.346 1.00 13.44 H ATOM 347 HA ASN A 23 -0.486 -2.240 5.299 1.00 44.31 H ATOM 348 HB2 ASN A 23 -1.667 -3.825 6.504 1.00 60.42 H ATOM 349 HB3 ASN A 23 -0.888 -4.835 5.290 1.00 51.25 H ATOM 350 HD21 ASN A 23 -1.702 -4.834 8.367 1.00 4.52 H ATOM 351 HD22 ASN A 23 -0.408 -5.746 9.058 1.00 24.21 H ATOM 352 N TYR A 24 2.110 -2.907 7.136 1.00 63.44 N ATOM 353 CA TYR A 24 2.920 -2.448 8.257 1.00 12.45 C ATOM 354 C TYR A 24 3.326 -0.988 8.075 1.00 63.45 C ATOM 355 O TYR A 24 3.170 -0.170 8.981 1.00 62.34 O ATOM 356 CB TYR A 24 4.166 -3.321 8.407 1.00 64.11 C ATOM 357 CG TYR A 24 5.188 -2.759 9.369 1.00 70.11 C ATOM 358 CD1 TYR A 24 5.039 -2.917 10.742 1.00 71.24 C ATOM 359 CD2 TYR A 24 6.302 -2.070 8.907 1.00 32.43 C ATOM 360 CE1 TYR A 24 5.969 -2.405 11.625 1.00 33.22 C ATOM 361 CE2 TYR A 24 7.238 -1.555 9.782 1.00 24.54 C ATOM 362 CZ TYR A 24 7.067 -1.726 11.141 1.00 51.33 C ATOM 363 OH TYR A 24 7.997 -1.214 12.017 1.00 51.12 O ATOM 364 H TYR A 24 2.478 -3.580 6.525 1.00 64.42 H ATOM 365 HA TYR A 24 2.323 -2.534 9.154 1.00 53.41 H ATOM 366 HB2 TYR A 24 3.874 -4.296 8.766 1.00 51.32 H ATOM 367 HB3 TYR A 24 4.641 -3.426 7.442 1.00 4.23 H ATOM 368 HD1 TYR A 24 4.177 -3.449 11.119 1.00 62.25 H ATOM 369 HD2 TYR A 24 6.433 -1.939 7.843 1.00 64.34 H ATOM 370 HE1 TYR A 24 5.835 -2.538 12.689 1.00 44.30 H ATOM 371 HE2 TYR A 24 8.099 -1.024 9.404 1.00 54.21 H ATOM 372 HH TYR A 24 8.203 -1.871 12.685 1.00 13.13 H ATOM 373 N ASP A 25 3.847 -0.671 6.895 1.00 41.43 N ATOM 374 CA ASP A 25 4.276 0.690 6.589 1.00 34.42 C ATOM 375 C ASP A 25 3.072 1.604 6.381 1.00 2.13 C ATOM 376 O ASP A 25 3.145 2.809 6.627 1.00 35.54 O ATOM 377 CB ASP A 25 5.162 0.700 5.343 1.00 52.12 C ATOM 378 CG ASP A 25 4.358 0.805 4.061 1.00 25.53 C ATOM 379 OD1 ASP A 25 3.908 1.922 3.732 1.00 33.42 O ATOM 380 OD2 ASP A 25 4.180 -0.231 3.388 1.00 61.44 O ATOM 381 H ASP A 25 3.946 -1.368 6.212 1.00 11.31 H ATOM 382 HA ASP A 25 4.847 1.054 7.429 1.00 23.31 H ATOM 383 HB2 ASP A 25 5.834 1.546 5.394 1.00 75.54 H ATOM 384 HB3 ASP A 25 5.739 -0.212 5.311 1.00 3.14 H ATOM 385 N CYS A 26 1.967 1.024 5.924 1.00 61.21 N ATOM 386 CA CYS A 26 0.748 1.786 5.681 1.00 5.42 C ATOM 387 C CYS A 26 0.043 2.117 6.993 1.00 3.21 C ATOM 388 O CYS A 26 -0.229 3.281 7.287 1.00 4.35 O ATOM 389 CB CYS A 26 -0.194 1.002 4.766 1.00 35.42 C ATOM 390 SG CYS A 26 0.365 0.895 3.035 1.00 4.15 S ATOM 391 H CYS A 26 1.971 0.059 5.747 1.00 42.54 H ATOM 392 HA CYS A 26 1.025 2.708 5.193 1.00 50.14 H ATOM 393 HB2 CYS A 26 -0.290 -0.008 5.142 1.00 52.41 H ATOM 394 HB3 CYS A 26 -1.165 1.475 4.770 1.00 63.14 H ATOM 395 N LYS A 27 -0.251 1.086 7.777 1.00 33.04 N ATOM 396 CA LYS A 27 -0.923 1.265 9.059 1.00 43.45 C ATOM 397 C LYS A 27 -0.028 2.011 10.042 1.00 1.23 C ATOM 398 O LYS A 27 -0.482 2.450 11.100 1.00 5.14 O ATOM 399 CB LYS A 27 -1.322 -0.091 9.642 1.00 13.25 C ATOM 400 CG LYS A 27 -2.235 -0.899 8.736 1.00 3.24 C ATOM 401 CD LYS A 27 -2.094 -2.390 8.989 1.00 63.41 C ATOM 402 CE LYS A 27 -2.898 -2.829 10.203 1.00 65.30 C ATOM 403 NZ LYS A 27 -2.142 -2.630 11.470 1.00 30.14 N ATOM 404 H LYS A 27 -0.009 0.181 7.487 1.00 1.14 H ATOM 405 HA LYS A 27 -1.814 1.850 8.887 1.00 62.02 H ATOM 406 HB2 LYS A 27 -0.428 -0.668 9.824 1.00 22.04 H ATOM 407 HB3 LYS A 27 -1.833 0.071 10.581 1.00 24.21 H ATOM 408 HG2 LYS A 27 -3.259 -0.610 8.921 1.00 4.20 H ATOM 409 HG3 LYS A 27 -1.980 -0.692 7.707 1.00 40.23 H ATOM 410 HD2 LYS A 27 -2.448 -2.929 8.123 1.00 31.04 H ATOM 411 HD3 LYS A 27 -1.050 -2.622 9.157 1.00 53.23 H ATOM 412 HE2 LYS A 27 -3.809 -2.253 10.242 1.00 34.04 H ATOM 413 HE3 LYS A 27 -3.140 -3.877 10.100 1.00 42.35 H ATOM 414 HZ1 LYS A 27 -2.228 -1.643 11.787 1.00 51.44 H ATOM 415 HZ2 LYS A 27 -1.136 -2.850 11.325 1.00 42.01 H ATOM 416 HZ3 LYS A 27 -2.518 -3.254 12.213 1.00 71.24 H ATOM 417 N LEU A 28 1.245 2.153 9.688 1.00 54.24 N ATOM 418 CA LEU A 28 2.203 2.849 10.539 1.00 61.52 C ATOM 419 C LEU A 28 2.059 4.361 10.399 1.00 21.24 C ATOM 420 O LEU A 28 1.746 5.056 11.366 1.00 12.11 O ATOM 421 CB LEU A 28 3.630 2.426 10.185 1.00 74.11 C ATOM 422 CG LEU A 28 4.749 3.303 10.747 1.00 64.05 C ATOM 423 CD1 LEU A 28 4.628 3.420 12.258 1.00 60.23 C ATOM 424 CD2 LEU A 28 6.110 2.743 10.360 1.00 41.32 C ATOM 425 H LEU A 28 1.547 1.783 8.832 1.00 61.20 H ATOM 426 HA LEU A 28 1.998 2.572 11.562 1.00 11.45 H ATOM 427 HB2 LEU A 28 3.779 1.423 10.554 1.00 44.31 H ATOM 428 HB3 LEU A 28 3.716 2.427 9.107 1.00 24.33 H ATOM 429 HG LEU A 28 4.664 4.296 10.327 1.00 51.40 H ATOM 430 HD11 LEU A 28 4.011 4.271 12.504 1.00 25.22 H ATOM 431 HD12 LEU A 28 5.610 3.549 12.689 1.00 41.32 H ATOM 432 HD13 LEU A 28 4.178 2.521 12.654 1.00 54.13 H ATOM 433 HD21 LEU A 28 6.868 3.162 11.006 1.00 25.33 H ATOM 434 HD22 LEU A 28 6.328 3.002 9.334 1.00 13.13 H ATOM 435 HD23 LEU A 28 6.100 1.668 10.465 1.00 3.15 H ATOM 436 N ASP A 29 2.289 4.863 9.192 1.00 64.40 N ATOM 437 CA ASP A 29 2.182 6.292 8.925 1.00 73.01 C ATOM 438 C ASP A 29 0.794 6.644 8.396 1.00 3.40 C ATOM 439 O ASP A 29 0.131 7.545 8.911 1.00 23.44 O ATOM 440 CB ASP A 29 3.249 6.726 7.919 1.00 1.35 C ATOM 441 CG ASP A 29 4.501 7.251 8.594 1.00 22.21 C ATOM 442 OD1 ASP A 29 4.407 8.270 9.310 1.00 64.23 O ATOM 443 OD2 ASP A 29 5.575 6.642 8.408 1.00 25.42 O ATOM 444 H ASP A 29 2.536 4.258 8.461 1.00 62.42 H ATOM 445 HA ASP A 29 2.342 6.817 9.855 1.00 63.41 H ATOM 446 HB2 ASP A 29 3.521 5.881 7.305 1.00 64.10 H ATOM 447 HB3 ASP A 29 2.847 7.508 7.291 1.00 33.44 H ATOM 448 N LYS A 30 0.362 5.929 7.363 1.00 22.43 N ATOM 449 CA LYS A 30 -0.946 6.164 6.764 1.00 11.42 C ATOM 450 C LYS A 30 -2.063 5.708 7.698 1.00 1.22 C ATOM 451 O LYS A 30 -3.238 5.985 7.458 1.00 34.30 O ATOM 452 CB LYS A 30 -1.056 5.430 5.425 1.00 24.12 C ATOM 453 CG LYS A 30 0.198 5.530 4.573 1.00 72.21 C ATOM 454 CD LYS A 30 0.608 6.976 4.353 1.00 64.44 C ATOM 455 CE LYS A 30 -0.474 7.757 3.625 1.00 42.45 C ATOM 456 NZ LYS A 30 -0.064 9.167 3.371 1.00 11.12 N ATOM 457 H LYS A 30 0.936 5.224 6.996 1.00 25.24 H ATOM 458 HA LYS A 30 -1.047 7.225 6.593 1.00 43.04 H ATOM 459 HB2 LYS A 30 -1.255 4.387 5.616 1.00 61.53 H ATOM 460 HB3 LYS A 30 -1.881 5.848 4.866 1.00 44.40 H ATOM 461 HG2 LYS A 30 1.003 5.010 5.071 1.00 34.53 H ATOM 462 HG3 LYS A 30 0.007 5.068 3.614 1.00 31.34 H ATOM 463 HD2 LYS A 30 0.790 7.440 5.310 1.00 22.22 H ATOM 464 HD3 LYS A 30 1.515 6.997 3.763 1.00 53.10 H ATOM 465 HE2 LYS A 30 -0.675 7.275 2.681 1.00 51.32 H ATOM 466 HE3 LYS A 30 -1.369 7.755 4.228 1.00 21.44 H ATOM 467 HZ1 LYS A 30 -0.678 9.818 3.901 1.00 43.55 H ATOM 468 HZ2 LYS A 30 -0.140 9.384 2.356 1.00 1.01 H ATOM 469 HZ3 LYS A 30 0.921 9.312 3.672 1.00 53.43 H ATOM 470 N HIS A 31 -1.688 5.010 8.765 1.00 71.32 N ATOM 471 CA HIS A 31 -2.658 4.518 9.737 1.00 70.22 C ATOM 472 C HIS A 31 -3.776 3.744 9.045 1.00 63.45 C ATOM 473 O HIS A 31 -4.893 3.662 9.552 1.00 30.21 O ATOM 474 CB HIS A 31 -3.247 5.681 10.535 1.00 64.11 C ATOM 475 CG HIS A 31 -2.352 6.165 11.635 1.00 54.31 C ATOM 476 ND1 HIS A 31 -1.995 5.384 12.714 1.00 45.03 N ATOM 477 CD2 HIS A 31 -1.742 7.359 11.818 1.00 1.44 C ATOM 478 CE1 HIS A 31 -1.204 6.076 13.514 1.00 12.41 C ATOM 479 NE2 HIS A 31 -1.035 7.279 12.993 1.00 52.40 N ATOM 480 H HIS A 31 -0.736 4.821 8.902 1.00 14.21 H ATOM 481 HA HIS A 31 -2.143 3.853 10.413 1.00 65.33 H ATOM 482 HB2 HIS A 31 -3.430 6.510 9.868 1.00 11.31 H ATOM 483 HB3 HIS A 31 -4.181 5.369 10.979 1.00 2.14 H ATOM 484 HD1 HIS A 31 -2.280 4.460 12.870 1.00 65.30 H ATOM 485 HD2 HIS A 31 -1.800 8.218 11.163 1.00 10.13 H ATOM 486 HE1 HIS A 31 -0.769 5.721 14.436 1.00 15.43 H ATOM 487 N ALA A 32 -3.465 3.178 7.883 1.00 62.02 N ATOM 488 CA ALA A 32 -4.443 2.409 7.122 1.00 2.40 C ATOM 489 C ALA A 32 -4.942 1.212 7.922 1.00 32.31 C ATOM 490 O ALA A 32 -4.735 1.132 9.132 1.00 11.44 O ATOM 491 CB ALA A 32 -3.841 1.951 5.801 1.00 55.20 C ATOM 492 H ALA A 32 -2.556 3.279 7.530 1.00 53.11 H ATOM 493 HA ALA A 32 -5.280 3.058 6.903 1.00 64.12 H ATOM 494 HB1 ALA A 32 -2.887 2.434 5.654 1.00 24.13 H ATOM 495 HB2 ALA A 32 -3.704 0.880 5.821 1.00 14.44 H ATOM 496 HB3 ALA A 32 -4.507 2.214 4.993 1.00 74.35 H ATOM 497 N ARG A 33 -5.602 0.282 7.237 1.00 11.40 N ATOM 498 CA ARG A 33 -6.132 -0.911 7.886 1.00 55.22 C ATOM 499 C ARG A 33 -5.753 -2.167 7.107 1.00 72.42 C ATOM 500 O ARG A 33 -5.382 -3.184 7.693 1.00 42.13 O ATOM 501 CB ARG A 33 -7.655 -0.815 8.010 1.00 63.42 C ATOM 502 CG ARG A 33 -8.249 -1.807 8.995 1.00 70.20 C ATOM 503 CD ARG A 33 -9.746 -1.975 8.785 1.00 42.52 C ATOM 504 NE ARG A 33 -10.065 -3.215 8.083 1.00 3.32 N ATOM 505 CZ ARG A 33 -11.273 -3.504 7.613 1.00 42.10 C ATOM 506 NH1 ARG A 33 -12.271 -2.645 7.769 1.00 33.44 N ATOM 507 NH2 ARG A 33 -11.485 -4.654 6.985 1.00 1.02 N ATOM 508 H ARG A 33 -5.735 0.402 6.274 1.00 12.13 H ATOM 509 HA ARG A 33 -5.703 -0.971 8.874 1.00 3.43 H ATOM 510 HB2 ARG A 33 -7.916 0.181 8.334 1.00 12.54 H ATOM 511 HB3 ARG A 33 -8.094 -0.996 7.040 1.00 22.32 H ATOM 512 HG2 ARG A 33 -7.768 -2.766 8.861 1.00 12.21 H ATOM 513 HG3 ARG A 33 -8.072 -1.452 10.000 1.00 73.40 H ATOM 514 HD2 ARG A 33 -10.233 -1.982 9.747 1.00 3.14 H ATOM 515 HD3 ARG A 33 -10.109 -1.140 8.204 1.00 5.01 H ATOM 516 HE ARG A 33 -9.342 -3.864 7.956 1.00 3.12 H ATOM 517 HH11 ARG A 33 -12.114 -1.778 8.241 1.00 51.15 H ATOM 518 HH12 ARG A 33 -13.179 -2.864 7.413 1.00 73.32 H ATOM 519 HH21 ARG A 33 -10.735 -5.303 6.866 1.00 22.10 H ATOM 520 HH22 ARG A 33 -12.395 -4.870 6.632 1.00 23.04 H ATOM 521 N SER A 34 -5.849 -2.089 5.784 1.00 12.10 N ATOM 522 CA SER A 34 -5.520 -3.221 4.925 1.00 15.52 C ATOM 523 C SER A 34 -4.497 -2.819 3.867 1.00 64.25 C ATOM 524 O SER A 34 -4.575 -3.249 2.717 1.00 24.44 O ATOM 525 CB SER A 34 -6.783 -3.759 4.250 1.00 33.31 C ATOM 526 OG SER A 34 -6.534 -5.007 3.626 1.00 74.42 O ATOM 527 H SER A 34 -6.152 -1.250 5.375 1.00 24.32 H ATOM 528 HA SER A 34 -5.096 -3.995 5.545 1.00 44.30 H ATOM 529 HB2 SER A 34 -7.557 -3.889 4.992 1.00 73.15 H ATOM 530 HB3 SER A 34 -7.116 -3.056 3.501 1.00 14.44 H ATOM 531 HG SER A 34 -7.332 -5.310 3.187 1.00 32.31 H ATOM 532 N GLY A 35 -3.536 -1.992 4.266 1.00 40.43 N ATOM 533 CA GLY A 35 -2.510 -1.546 3.342 1.00 3.30 C ATOM 534 C GLY A 35 -1.853 -2.697 2.605 1.00 53.34 C ATOM 535 O GLY A 35 -1.226 -3.559 3.219 1.00 54.30 O ATOM 536 H GLY A 35 -3.524 -1.681 5.195 1.00 4.32 H ATOM 537 HA2 GLY A 35 -2.955 -0.878 2.621 1.00 52.33 H ATOM 538 HA3 GLY A 35 -1.752 -1.010 3.894 1.00 31.10 H ATOM 539 N GLU A 36 -2.001 -2.712 1.284 1.00 72.55 N ATOM 540 CA GLU A 36 -1.419 -3.768 0.462 1.00 31.11 C ATOM 541 C GLU A 36 -1.094 -3.253 -0.937 1.00 11.44 C ATOM 542 O GLU A 36 -1.535 -2.173 -1.331 1.00 41.42 O ATOM 543 CB GLU A 36 -2.377 -4.958 0.370 1.00 22.04 C ATOM 544 CG GLU A 36 -1.676 -6.286 0.132 1.00 14.40 C ATOM 545 CD GLU A 36 -2.579 -7.476 0.387 1.00 13.45 C ATOM 546 OE1 GLU A 36 -3.048 -7.631 1.535 1.00 10.24 O ATOM 547 OE2 GLU A 36 -2.818 -8.253 -0.561 1.00 13.02 O ATOM 548 H GLU A 36 -2.512 -1.997 0.851 1.00 53.42 H ATOM 549 HA GLU A 36 -0.504 -4.090 0.936 1.00 71.22 H ATOM 550 HB2 GLU A 36 -2.934 -5.029 1.293 1.00 2.10 H ATOM 551 HB3 GLU A 36 -3.066 -4.788 -0.444 1.00 3.23 H ATOM 552 HG2 GLU A 36 -1.340 -6.322 -0.893 1.00 42.34 H ATOM 553 HG3 GLU A 36 -0.823 -6.351 0.792 1.00 60.53 H ATOM 554 N CYS A 37 -0.320 -4.033 -1.683 1.00 13.21 N ATOM 555 CA CYS A 37 0.066 -3.658 -3.037 1.00 51.42 C ATOM 556 C CYS A 37 -0.742 -4.439 -4.070 1.00 31.12 C ATOM 557 O CYS A 37 -1.190 -5.556 -3.808 1.00 63.11 O ATOM 558 CB CYS A 37 1.561 -3.903 -3.251 1.00 64.15 C ATOM 559 SG CYS A 37 2.011 -5.662 -3.401 1.00 60.32 S ATOM 560 H CYS A 37 0.001 -4.884 -1.313 1.00 54.41 H ATOM 561 HA CYS A 37 -0.138 -2.605 -3.161 1.00 34.40 H ATOM 562 HB2 CYS A 37 1.873 -3.407 -4.158 1.00 3.10 H ATOM 563 HB3 CYS A 37 2.108 -3.493 -2.416 1.00 21.14 H ATOM 564 N PHE A 38 -0.923 -3.844 -5.244 1.00 75.44 N ATOM 565 CA PHE A 38 -1.678 -4.484 -6.316 1.00 30.32 C ATOM 566 C PHE A 38 -1.403 -3.804 -7.655 1.00 31.33 C ATOM 567 O PHE A 38 -1.045 -2.627 -7.704 1.00 34.53 O ATOM 568 CB PHE A 38 -3.177 -4.443 -6.009 1.00 25.45 C ATOM 569 CG PHE A 38 -3.675 -5.668 -5.295 1.00 11.14 C ATOM 570 CD1 PHE A 38 -3.515 -6.926 -5.854 1.00 1.24 C ATOM 571 CD2 PHE A 38 -4.305 -5.561 -4.065 1.00 42.30 C ATOM 572 CE1 PHE A 38 -3.971 -8.054 -5.200 1.00 13.43 C ATOM 573 CE2 PHE A 38 -4.764 -6.686 -3.406 1.00 42.24 C ATOM 574 CZ PHE A 38 -4.598 -7.933 -3.975 1.00 25.11 C ATOM 575 H PHE A 38 -0.543 -2.954 -5.393 1.00 41.23 H ATOM 576 HA PHE A 38 -1.359 -5.513 -6.376 1.00 72.23 H ATOM 577 HB2 PHE A 38 -3.386 -3.589 -5.385 1.00 1.34 H ATOM 578 HB3 PHE A 38 -3.723 -4.351 -6.934 1.00 74.14 H ATOM 579 HD1 PHE A 38 -3.025 -7.021 -6.813 1.00 11.22 H ATOM 580 HD2 PHE A 38 -4.436 -4.585 -3.620 1.00 30.45 H ATOM 581 HE1 PHE A 38 -3.841 -9.028 -5.647 1.00 51.34 H ATOM 582 HE2 PHE A 38 -5.253 -6.588 -2.449 1.00 34.23 H ATOM 583 HZ PHE A 38 -4.956 -8.814 -3.462 1.00 2.42 H ATOM 584 N TYR A 39 -1.574 -4.554 -8.738 1.00 31.35 N ATOM 585 CA TYR A 39 -1.341 -4.026 -10.077 1.00 53.11 C ATOM 586 C TYR A 39 -2.248 -2.832 -10.356 1.00 52.32 C ATOM 587 O TYR A 39 -3.399 -2.795 -9.918 1.00 44.23 O ATOM 588 CB TYR A 39 -1.578 -5.115 -11.125 1.00 61.21 C ATOM 589 CG TYR A 39 -2.957 -5.732 -11.058 1.00 12.32 C ATOM 590 CD1 TYR A 39 -4.042 -5.123 -11.676 1.00 40.44 C ATOM 591 CD2 TYR A 39 -3.174 -6.924 -10.377 1.00 12.51 C ATOM 592 CE1 TYR A 39 -5.304 -5.682 -11.616 1.00 44.33 C ATOM 593 CE2 TYR A 39 -4.432 -7.491 -10.314 1.00 12.42 C ATOM 594 CZ TYR A 39 -5.494 -6.866 -10.935 1.00 52.31 C ATOM 595 OH TYR A 39 -6.749 -7.427 -10.874 1.00 52.41 O ATOM 596 H TYR A 39 -1.861 -5.485 -8.634 1.00 62.34 H ATOM 597 HA TYR A 39 -0.312 -3.703 -10.132 1.00 71.50 H ATOM 598 HB2 TYR A 39 -1.452 -4.691 -12.110 1.00 2.35 H ATOM 599 HB3 TYR A 39 -0.854 -5.904 -10.983 1.00 21.23 H ATOM 600 HD1 TYR A 39 -3.889 -4.196 -12.209 1.00 52.32 H ATOM 601 HD2 TYR A 39 -2.341 -7.410 -9.892 1.00 64.12 H ATOM 602 HE1 TYR A 39 -6.135 -5.193 -12.103 1.00 61.42 H ATOM 603 HE2 TYR A 39 -4.582 -8.417 -9.780 1.00 21.44 H ATOM 604 HH TYR A 39 -6.750 -8.138 -10.229 1.00 33.02 H ATOM 605 N ASP A 40 -1.721 -1.856 -11.087 1.00 51.14 N ATOM 606 CA ASP A 40 -2.482 -0.659 -11.428 1.00 24.25 C ATOM 607 C ASP A 40 -3.003 -0.734 -12.859 1.00 73.53 C ATOM 608 O ASP A 40 -2.859 -1.757 -13.528 1.00 34.31 O ATOM 609 CB ASP A 40 -1.614 0.589 -11.253 1.00 12.51 C ATOM 610 CG ASP A 40 -2.392 1.760 -10.686 1.00 34.45 C ATOM 611 OD1 ASP A 40 -3.048 1.584 -9.638 1.00 52.22 O ATOM 612 OD2 ASP A 40 -2.346 2.852 -11.290 1.00 54.44 O ATOM 613 H ASP A 40 -0.798 -1.943 -11.407 1.00 34.50 H ATOM 614 HA ASP A 40 -3.323 -0.598 -10.754 1.00 40.13 H ATOM 615 HB2 ASP A 40 -0.800 0.362 -10.581 1.00 10.24 H ATOM 616 HB3 ASP A 40 -1.213 0.878 -12.214 1.00 32.51 H ATOM 617 N GLU A 41 -3.610 0.354 -13.321 1.00 11.11 N ATOM 618 CA GLU A 41 -4.155 0.408 -14.672 1.00 41.52 C ATOM 619 C GLU A 41 -3.035 0.439 -15.709 1.00 74.44 C ATOM 620 O GLU A 41 -3.244 0.100 -16.875 1.00 25.22 O ATOM 621 CB GLU A 41 -5.050 1.639 -14.836 1.00 74.32 C ATOM 622 CG GLU A 41 -4.312 2.955 -14.664 1.00 52.21 C ATOM 623 CD GLU A 41 -5.234 4.093 -14.271 1.00 11.12 C ATOM 624 OE1 GLU A 41 -5.768 4.764 -15.179 1.00 13.51 O ATOM 625 OE2 GLU A 41 -5.423 4.313 -13.056 1.00 24.32 O ATOM 626 H GLU A 41 -3.694 1.137 -12.740 1.00 12.41 H ATOM 627 HA GLU A 41 -4.748 -0.480 -14.828 1.00 1.15 H ATOM 628 HB2 GLU A 41 -5.489 1.621 -15.823 1.00 50.43 H ATOM 629 HB3 GLU A 41 -5.840 1.594 -14.101 1.00 31.23 H ATOM 630 HG2 GLU A 41 -3.565 2.837 -13.894 1.00 60.34 H ATOM 631 HG3 GLU A 41 -3.830 3.208 -15.597 1.00 14.44 H ATOM 632 N LYS A 42 -1.848 0.848 -15.277 1.00 12.11 N ATOM 633 CA LYS A 42 -0.694 0.923 -16.166 1.00 11.22 C ATOM 634 C LYS A 42 0.198 -0.304 -16.004 1.00 12.00 C ATOM 635 O LYS A 42 1.400 -0.247 -16.263 1.00 23.32 O ATOM 636 CB LYS A 42 0.112 2.193 -15.882 1.00 51.41 C ATOM 637 CG LYS A 42 -0.655 3.474 -16.161 1.00 4.23 C ATOM 638 CD LYS A 42 -0.758 3.750 -17.652 1.00 31.41 C ATOM 639 CE LYS A 42 -1.493 5.051 -17.929 1.00 15.33 C ATOM 640 NZ LYS A 42 -2.051 5.091 -19.308 1.00 53.25 N ATOM 641 H LYS A 42 -1.745 1.105 -14.336 1.00 40.41 H ATOM 642 HA LYS A 42 -1.059 0.958 -17.180 1.00 63.43 H ATOM 643 HB2 LYS A 42 0.407 2.194 -14.843 1.00 63.01 H ATOM 644 HB3 LYS A 42 0.998 2.188 -16.500 1.00 25.44 H ATOM 645 HG2 LYS A 42 -1.651 3.384 -15.752 1.00 42.05 H ATOM 646 HG3 LYS A 42 -0.143 4.300 -15.686 1.00 62.15 H ATOM 647 HD2 LYS A 42 0.236 3.815 -18.067 1.00 1.42 H ATOM 648 HD3 LYS A 42 -1.293 2.937 -18.123 1.00 31.52 H ATOM 649 HE2 LYS A 42 -2.301 5.152 -17.221 1.00 35.44 H ATOM 650 HE3 LYS A 42 -0.803 5.873 -17.805 1.00 33.43 H ATOM 651 HZ1 LYS A 42 -2.965 4.596 -19.339 1.00 60.54 H ATOM 652 HZ2 LYS A 42 -1.396 4.629 -19.972 1.00 10.12 H ATOM 653 HZ3 LYS A 42 -2.193 6.076 -19.609 1.00 12.24 H ATOM 654 N ARG A 43 -0.399 -1.412 -15.576 1.00 15.41 N ATOM 655 CA ARG A 43 0.341 -2.652 -15.380 1.00 61.34 C ATOM 656 C ARG A 43 1.524 -2.437 -14.441 1.00 70.10 C ATOM 657 O ARG A 43 2.516 -3.160 -14.502 1.00 25.24 O ATOM 658 CB ARG A 43 0.836 -3.193 -16.724 1.00 14.51 C ATOM 659 CG ARG A 43 -0.270 -3.771 -17.592 1.00 23.24 C ATOM 660 CD ARG A 43 -0.889 -2.710 -18.488 1.00 3.34 C ATOM 661 NE ARG A 43 0.075 -2.169 -19.442 1.00 61.43 N ATOM 662 CZ ARG A 43 0.443 -2.800 -20.552 1.00 33.03 C ATOM 663 NH1 ARG A 43 -0.071 -3.987 -20.845 1.00 22.42 N ATOM 664 NH2 ARG A 43 1.326 -2.244 -21.372 1.00 3.42 N ATOM 665 H ARG A 43 -1.361 -1.394 -15.386 1.00 73.11 H ATOM 666 HA ARG A 43 -0.329 -3.373 -14.937 1.00 53.43 H ATOM 667 HB2 ARG A 43 1.308 -2.389 -17.270 1.00 63.14 H ATOM 668 HB3 ARG A 43 1.563 -3.969 -16.539 1.00 72.24 H ATOM 669 HG2 ARG A 43 0.143 -4.553 -18.212 1.00 3.34 H ATOM 670 HG3 ARG A 43 -1.037 -4.184 -16.953 1.00 44.42 H ATOM 671 HD2 ARG A 43 -1.710 -3.151 -19.031 1.00 54.43 H ATOM 672 HD3 ARG A 43 -1.257 -1.906 -17.868 1.00 74.01 H ATOM 673 HE ARG A 43 0.467 -1.293 -19.245 1.00 64.31 H ATOM 674 HH11 ARG A 43 -0.737 -4.408 -20.230 1.00 24.53 H ATOM 675 HH12 ARG A 43 0.207 -4.459 -21.682 1.00 23.44 H ATOM 676 HH21 ARG A 43 1.715 -1.349 -21.154 1.00 53.43 H ATOM 677 HH22 ARG A 43 1.602 -2.719 -22.206 1.00 51.34 H ATOM 678 N ASN A 44 1.408 -1.437 -13.573 1.00 25.12 N ATOM 679 CA ASN A 44 2.468 -1.126 -12.620 1.00 61.13 C ATOM 680 C ASN A 44 2.084 -1.574 -11.213 1.00 52.00 C ATOM 681 O ASN A 44 0.963 -1.337 -10.759 1.00 20.31 O ATOM 682 CB ASN A 44 2.763 0.375 -12.627 1.00 25.34 C ATOM 683 CG ASN A 44 3.695 0.776 -13.754 1.00 51.23 C ATOM 684 OD1 ASN A 44 4.335 -0.071 -14.377 1.00 62.40 O ATOM 685 ND2 ASN A 44 3.774 2.074 -14.023 1.00 1.21 N ATOM 686 H ASN A 44 0.591 -0.896 -13.573 1.00 3.25 H ATOM 687 HA ASN A 44 3.355 -1.660 -12.925 1.00 43.14 H ATOM 688 HB2 ASN A 44 1.837 0.918 -12.741 1.00 13.32 H ATOM 689 HB3 ASN A 44 3.223 0.650 -11.690 1.00 23.14 H ATOM 690 HD21 ASN A 44 3.235 2.692 -13.485 1.00 73.22 H ATOM 691 HD22 ASN A 44 4.368 2.361 -14.748 1.00 12.31 H ATOM 692 N LEU A 45 3.020 -2.221 -10.528 1.00 12.01 N ATOM 693 CA LEU A 45 2.781 -2.701 -9.172 1.00 35.03 C ATOM 694 C LEU A 45 3.206 -1.660 -8.141 1.00 33.11 C ATOM 695 O LEU A 45 4.342 -1.187 -8.158 1.00 14.34 O ATOM 696 CB LEU A 45 3.536 -4.010 -8.933 1.00 30.54 C ATOM 697 CG LEU A 45 3.572 -4.989 -10.107 1.00 10.30 C ATOM 698 CD1 LEU A 45 4.504 -6.151 -9.805 1.00 33.53 C ATOM 699 CD2 LEU A 45 2.172 -5.494 -10.424 1.00 2.33 C ATOM 700 H LEU A 45 3.893 -2.379 -10.942 1.00 64.41 H ATOM 701 HA LEU A 45 1.722 -2.882 -9.066 1.00 74.11 H ATOM 702 HB2 LEU A 45 4.555 -3.762 -8.677 1.00 71.32 H ATOM 703 HB3 LEU A 45 3.069 -4.512 -8.096 1.00 52.04 H ATOM 704 HG LEU A 45 3.950 -4.477 -10.982 1.00 1.22 H ATOM 705 HD11 LEU A 45 5.433 -5.774 -9.403 1.00 54.25 H ATOM 706 HD12 LEU A 45 4.701 -6.700 -10.713 1.00 64.55 H ATOM 707 HD13 LEU A 45 4.040 -6.806 -9.083 1.00 35.54 H ATOM 708 HD21 LEU A 45 1.679 -4.797 -11.086 1.00 11.14 H ATOM 709 HD22 LEU A 45 1.606 -5.582 -9.508 1.00 12.33 H ATOM 710 HD23 LEU A 45 2.237 -6.461 -10.901 1.00 3.21 H ATOM 711 N GLN A 46 2.288 -1.311 -7.247 1.00 13.50 N ATOM 712 CA GLN A 46 2.569 -0.326 -6.208 1.00 64.14 C ATOM 713 C GLN A 46 1.864 -0.692 -4.906 1.00 43.00 C ATOM 714 O GLN A 46 0.917 -1.478 -4.900 1.00 2.03 O ATOM 715 CB GLN A 46 2.132 1.067 -6.665 1.00 12.11 C ATOM 716 CG GLN A 46 2.532 1.393 -8.095 1.00 30.43 C ATOM 717 CD GLN A 46 2.327 2.855 -8.439 1.00 74.31 C ATOM 718 OE1 GLN A 46 2.632 3.741 -7.642 1.00 43.43 O ATOM 719 NE2 GLN A 46 1.805 3.113 -9.633 1.00 43.14 N ATOM 720 H GLN A 46 1.400 -1.723 -7.286 1.00 41.02 H ATOM 721 HA GLN A 46 3.635 -0.321 -6.037 1.00 12.50 H ATOM 722 HB2 GLN A 46 1.057 1.136 -6.589 1.00 73.11 H ATOM 723 HB3 GLN A 46 2.579 1.803 -6.013 1.00 34.34 H ATOM 724 HG2 GLN A 46 3.576 1.152 -8.226 1.00 23.52 H ATOM 725 HG3 GLN A 46 1.938 0.792 -8.766 1.00 70.45 H ATOM 726 HE21 GLN A 46 1.585 2.356 -10.216 1.00 70.10 H ATOM 727 HE22 GLN A 46 1.661 4.049 -9.882 1.00 1.03 H ATOM 728 N CYS A 47 2.333 -0.117 -3.804 1.00 25.22 N ATOM 729 CA CYS A 47 1.751 -0.383 -2.495 1.00 35.24 C ATOM 730 C CYS A 47 0.700 0.666 -2.144 1.00 54.41 C ATOM 731 O CYS A 47 1.025 1.828 -1.901 1.00 11.55 O ATOM 732 CB CYS A 47 2.841 -0.406 -1.421 1.00 72.43 C ATOM 733 SG CYS A 47 2.285 -1.047 0.191 1.00 64.42 S ATOM 734 H CYS A 47 3.092 0.501 -3.872 1.00 40.25 H ATOM 735 HA CYS A 47 1.275 -1.352 -2.533 1.00 43.23 H ATOM 736 HB2 CYS A 47 3.654 -1.032 -1.760 1.00 0.31 H ATOM 737 HB3 CYS A 47 3.206 0.598 -1.268 1.00 41.24 H ATOM 738 N ILE A 48 -0.561 0.248 -2.121 1.00 33.25 N ATOM 739 CA ILE A 48 -1.660 1.151 -1.800 1.00 22.24 C ATOM 740 C ILE A 48 -2.111 0.975 -0.354 1.00 34.33 C ATOM 741 O ILE A 48 -2.145 -0.142 0.166 1.00 53.23 O ATOM 742 CB ILE A 48 -2.864 0.927 -2.732 1.00 11.11 C ATOM 743 CG1 ILE A 48 -2.426 1.012 -4.196 1.00 11.33 C ATOM 744 CG2 ILE A 48 -3.956 1.946 -2.441 1.00 41.12 C ATOM 745 CD1 ILE A 48 -2.176 -0.338 -4.831 1.00 42.02 C ATOM 746 H ILE A 48 -0.758 -0.690 -2.324 1.00 33.32 H ATOM 747 HA ILE A 48 -1.308 2.164 -1.934 1.00 21.31 H ATOM 748 HB ILE A 48 -3.262 -0.057 -2.540 1.00 13.55 H ATOM 749 HG12 ILE A 48 -3.194 1.509 -4.767 1.00 15.03 H ATOM 750 HG13 ILE A 48 -1.511 1.584 -4.257 1.00 71.05 H ATOM 751 HG21 ILE A 48 -4.826 1.722 -3.040 1.00 34.31 H ATOM 752 HG22 ILE A 48 -4.219 1.901 -1.395 1.00 14.12 H ATOM 753 HG23 ILE A 48 -3.599 2.936 -2.680 1.00 55.13 H ATOM 754 HD11 ILE A 48 -2.298 -1.113 -4.087 1.00 63.23 H ATOM 755 HD12 ILE A 48 -2.881 -0.496 -5.633 1.00 14.32 H ATOM 756 HD13 ILE A 48 -1.171 -0.370 -5.223 1.00 62.43 H ATOM 757 N CYS A 49 -2.460 2.083 0.291 1.00 24.04 N ATOM 758 CA CYS A 49 -2.911 2.052 1.678 1.00 50.01 C ATOM 759 C CYS A 49 -4.351 2.543 1.792 1.00 42.03 C ATOM 760 O CYS A 49 -4.708 3.583 1.238 1.00 74.22 O ATOM 761 CB CYS A 49 -1.997 2.911 2.553 1.00 65.21 C ATOM 762 SG CYS A 49 -0.219 2.635 2.266 1.00 21.44 S ATOM 763 H CYS A 49 -2.411 2.944 -0.176 1.00 70.15 H ATOM 764 HA CYS A 49 -2.864 1.029 2.019 1.00 51.50 H ATOM 765 HB2 CYS A 49 -2.201 3.954 2.359 1.00 31.40 H ATOM 766 HB3 CYS A 49 -2.200 2.697 3.592 1.00 31.21 H ATOM 767 N ASP A 50 -5.172 1.789 2.513 1.00 10.44 N ATOM 768 CA ASP A 50 -6.573 2.147 2.701 1.00 3.22 C ATOM 769 C ASP A 50 -6.885 2.365 4.179 1.00 24.50 C ATOM 770 O ASP A 50 -6.676 1.476 5.005 1.00 33.33 O ATOM 771 CB ASP A 50 -7.482 1.058 2.131 1.00 20.34 C ATOM 772 CG ASP A 50 -8.923 1.511 2.008 1.00 14.45 C ATOM 773 OD1 ASP A 50 -9.421 2.169 2.948 1.00 42.25 O ATOM 774 OD2 ASP A 50 -9.554 1.210 0.974 1.00 14.31 O ATOM 775 H ASP A 50 -4.827 0.971 2.930 1.00 15.31 H ATOM 776 HA ASP A 50 -6.754 3.069 2.169 1.00 12.25 H ATOM 777 HB2 ASP A 50 -7.127 0.781 1.149 1.00 60.50 H ATOM 778 HB3 ASP A 50 -7.448 0.195 2.779 1.00 33.22 H ATOM 779 N TYR A 51 -7.383 3.552 4.505 1.00 3.51 N ATOM 780 CA TYR A 51 -7.719 3.888 5.883 1.00 4.24 C ATOM 781 C TYR A 51 -9.223 4.084 6.045 1.00 52.13 C ATOM 782 O TYR A 51 -9.825 4.930 5.383 1.00 54.03 O ATOM 783 CB TYR A 51 -6.978 5.154 6.318 1.00 41.32 C ATOM 784 CG TYR A 51 -7.334 5.614 7.714 1.00 4.21 C ATOM 785 CD1 TYR A 51 -7.479 4.702 8.752 1.00 53.14 C ATOM 786 CD2 TYR A 51 -7.520 6.962 7.995 1.00 35.54 C ATOM 787 CE1 TYR A 51 -7.804 5.119 10.027 1.00 33.53 C ATOM 788 CE2 TYR A 51 -7.844 7.387 9.268 1.00 11.24 C ATOM 789 CZ TYR A 51 -7.985 6.461 10.281 1.00 14.43 C ATOM 790 OH TYR A 51 -8.308 6.880 11.552 1.00 3.30 O ATOM 791 H TYR A 51 -7.526 4.220 3.803 1.00 65.13 H ATOM 792 HA TYR A 51 -7.406 3.067 6.510 1.00 23.34 H ATOM 793 HB2 TYR A 51 -5.916 4.968 6.291 1.00 61.02 H ATOM 794 HB3 TYR A 51 -7.216 5.954 5.633 1.00 15.35 H ATOM 795 HD1 TYR A 51 -7.336 3.650 8.549 1.00 74.20 H ATOM 796 HD2 TYR A 51 -7.410 7.685 7.200 1.00 62.23 H ATOM 797 HE1 TYR A 51 -7.915 4.393 10.821 1.00 41.51 H ATOM 798 HE2 TYR A 51 -7.987 8.440 9.468 1.00 32.31 H ATOM 799 HH TYR A 51 -7.598 7.426 11.899 1.00 51.22 H ATOM 800 N CYS A 52 -9.825 3.297 6.930 1.00 51.10 N ATOM 801 CA CYS A 52 -11.258 3.382 7.180 1.00 13.33 C ATOM 802 C CYS A 52 -11.539 4.124 8.484 1.00 33.04 C ATOM 803 O CYS A 52 -10.618 4.487 9.213 1.00 4.40 O ATOM 804 CB CYS A 52 -11.872 1.982 7.235 1.00 43.22 C ATOM 805 SG CYS A 52 -12.282 1.286 5.602 1.00 62.51 S ATOM 806 H CYS A 52 -9.291 2.641 7.427 1.00 13.12 H ATOM 807 HA CYS A 52 -11.706 3.930 6.365 1.00 2.24 H ATOM 808 HB2 CYS A 52 -11.174 1.310 7.712 1.00 71.51 H ATOM 809 HB3 CYS A 52 -12.782 2.018 7.815 1.00 51.34 H