ATOM 23 N LYS A 4 -10.814 6.072 2.885 1.00 22.21 N ATOM 24 CA LYS A 4 -9.866 6.856 2.101 1.00 73.51 C ATOM 25 C LYS A 4 -8.595 6.058 1.828 1.00 61.53 C ATOM 26 O LYS A 4 -7.873 5.686 2.753 1.00 21.22 O ATOM 27 CB LYS A 4 -9.518 8.154 2.832 1.00 23.32 C ATOM 28 CG LYS A 4 -8.227 8.795 2.353 1.00 70.50 C ATOM 29 CD LYS A 4 -8.252 10.303 2.535 1.00 41.33 C ATOM 30 CE LYS A 4 -6.899 10.924 2.226 1.00 50.52 C ATOM 31 NZ LYS A 4 -6.833 12.350 2.652 1.00 43.15 N ATOM 32 H LYS A 4 -10.584 5.827 3.807 1.00 5.52 H ATOM 33 HA LYS A 4 -10.335 7.097 1.160 1.00 61.10 H ATOM 34 HB2 LYS A 4 -10.322 8.861 2.689 1.00 64.34 H ATOM 35 HB3 LYS A 4 -9.419 7.944 3.888 1.00 74.24 H ATOM 36 HG2 LYS A 4 -7.401 8.388 2.918 1.00 15.44 H ATOM 37 HG3 LYS A 4 -8.093 8.570 1.304 1.00 23.03 H ATOM 38 HD2 LYS A 4 -8.990 10.725 1.868 1.00 4.43 H ATOM 39 HD3 LYS A 4 -8.518 10.530 3.557 1.00 33.42 H ATOM 40 HE2 LYS A 4 -6.134 10.368 2.746 1.00 75.43 H ATOM 41 HE3 LYS A 4 -6.725 10.867 1.162 1.00 40.02 H ATOM 42 HZ1 LYS A 4 -7.791 12.751 2.710 1.00 64.13 H ATOM 43 HZ2 LYS A 4 -6.278 12.902 1.966 1.00 20.00 H ATOM 44 HZ3 LYS A 4 -6.380 12.424 3.585 1.00 15.24 H ATOM 45 N ARG A 5 -8.327 5.799 0.552 1.00 22.44 N ATOM 46 CA ARG A 5 -7.143 5.045 0.158 1.00 72.04 C ATOM 47 C ARG A 5 -6.279 5.855 -0.804 1.00 22.52 C ATOM 48 O ARG A 5 -6.740 6.826 -1.404 1.00 10.44 O ATOM 49 CB ARG A 5 -7.548 3.722 -0.495 1.00 51.52 C ATOM 50 CG ARG A 5 -8.511 3.888 -1.659 1.00 73.42 C ATOM 51 CD ARG A 5 -7.773 4.201 -2.952 1.00 2.44 C ATOM 52 NE ARG A 5 -8.505 3.735 -4.127 1.00 4.21 N ATOM 53 CZ ARG A 5 -8.529 2.468 -4.522 1.00 32.35 C ATOM 54 NH1 ARG A 5 -7.867 1.543 -3.838 1.00 52.53 N ATOM 55 NH2 ARG A 5 -9.218 2.121 -5.601 1.00 64.45 N ATOM 56 H ARG A 5 -8.940 6.122 -0.141 1.00 13.23 H ATOM 57 HA ARG A 5 -6.571 4.836 1.049 1.00 63.13 H ATOM 58 HB2 ARG A 5 -6.660 3.226 -0.858 1.00 71.33 H ATOM 59 HB3 ARG A 5 -8.021 3.098 0.249 1.00 62.31 H ATOM 60 HG2 ARG A 5 -9.066 2.970 -1.789 1.00 44.10 H ATOM 61 HG3 ARG A 5 -9.193 4.694 -1.439 1.00 11.32 H ATOM 62 HD2 ARG A 5 -7.640 5.271 -3.024 1.00 4.24 H ATOM 63 HD3 ARG A 5 -6.807 3.720 -2.925 1.00 72.20 H ATOM 64 HE ARG A 5 -9.001 4.401 -4.646 1.00 2.42 H ATOM 65 HH11 ARG A 5 -7.349 1.802 -3.024 1.00 25.04 H ATOM 66 HH12 ARG A 5 -7.889 0.589 -4.137 1.00 4.34 H ATOM 67 HH21 ARG A 5 -9.718 2.814 -6.119 1.00 41.32 H ATOM 68 HH22 ARG A 5 -9.236 1.166 -5.898 1.00 44.55 H ATOM 69 N LYS A 6 -5.021 5.449 -0.946 1.00 41.32 N ATOM 70 CA LYS A 6 -4.091 6.134 -1.834 1.00 53.53 C ATOM 71 C LYS A 6 -2.858 5.277 -2.099 1.00 22.34 C ATOM 72 O LYS A 6 -2.437 4.496 -1.244 1.00 74.13 O ATOM 73 CB LYS A 6 -3.671 7.477 -1.229 1.00 53.04 C ATOM 74 CG LYS A 6 -2.625 8.212 -2.049 1.00 13.01 C ATOM 75 CD LYS A 6 -2.551 9.681 -1.668 1.00 44.41 C ATOM 76 CE LYS A 6 -1.907 9.872 -0.304 1.00 62.11 C ATOM 77 NZ LYS A 6 -1.655 11.310 -0.005 1.00 61.44 N ATOM 78 H LYS A 6 -4.712 4.667 -0.441 1.00 3.41 H ATOM 79 HA LYS A 6 -4.597 6.315 -2.771 1.00 20.33 H ATOM 80 HB2 LYS A 6 -4.543 8.109 -1.147 1.00 31.30 H ATOM 81 HB3 LYS A 6 -3.268 7.302 -0.243 1.00 1.34 H ATOM 82 HG2 LYS A 6 -1.661 7.758 -1.876 1.00 42.51 H ATOM 83 HG3 LYS A 6 -2.880 8.133 -3.096 1.00 0.20 H ATOM 84 HD2 LYS A 6 -1.964 10.207 -2.407 1.00 62.21 H ATOM 85 HD3 LYS A 6 -3.551 10.090 -1.645 1.00 35.42 H ATOM 86 HE2 LYS A 6 -2.564 9.466 0.449 1.00 14.34 H ATOM 87 HE3 LYS A 6 -0.968 9.340 -0.287 1.00 23.13 H ATOM 88 HZ1 LYS A 6 -2.544 11.846 -0.061 1.00 1.52 H ATOM 89 HZ2 LYS A 6 -0.981 11.703 -0.691 1.00 45.45 H ATOM 90 HZ3 LYS A 6 -1.260 11.411 0.951 1.00 3.33 H ATOM 91 N VAL A 7 -2.281 5.427 -3.287 1.00 42.53 N ATOM 92 CA VAL A 7 -1.094 4.668 -3.662 1.00 54.24 C ATOM 93 C VAL A 7 0.156 5.538 -3.603 1.00 43.01 C ATOM 94 O VAL A 7 0.151 6.684 -4.054 1.00 52.30 O ATOM 95 CB VAL A 7 -1.230 4.080 -5.079 1.00 63.42 C ATOM 96 CG1 VAL A 7 -1.488 5.183 -6.094 1.00 2.21 C ATOM 97 CG2 VAL A 7 0.014 3.287 -5.448 1.00 24.21 C ATOM 98 H VAL A 7 -2.662 6.065 -3.926 1.00 15.41 H ATOM 99 HA VAL A 7 -0.987 3.850 -2.965 1.00 5.52 H ATOM 100 HB VAL A 7 -2.075 3.408 -5.089 1.00 74.43 H ATOM 101 HG11 VAL A 7 -2.374 4.947 -6.665 1.00 62.11 H ATOM 102 HG12 VAL A 7 -1.630 6.122 -5.578 1.00 32.24 H ATOM 103 HG13 VAL A 7 -0.642 5.265 -6.761 1.00 23.31 H ATOM 104 HG21 VAL A 7 0.296 2.652 -4.621 1.00 30.23 H ATOM 105 HG22 VAL A 7 -0.191 2.677 -6.316 1.00 1.44 H ATOM 106 HG23 VAL A 7 0.824 3.967 -5.669 1.00 23.21 H ATOM 107 N TYR A 8 1.227 4.986 -3.043 1.00 41.43 N ATOM 108 CA TYR A 8 2.486 5.713 -2.923 1.00 4.34 C ATOM 109 C TYR A 8 3.582 5.046 -3.749 1.00 12.32 C ATOM 110 O TYR A 8 4.321 4.200 -3.250 1.00 24.21 O ATOM 111 CB TYR A 8 2.915 5.792 -1.457 1.00 55.21 C ATOM 112 CG TYR A 8 3.073 7.207 -0.948 1.00 52.51 C ATOM 113 CD1 TYR A 8 3.986 8.078 -1.529 1.00 11.30 C ATOM 114 CD2 TYR A 8 2.307 7.673 0.114 1.00 11.32 C ATOM 115 CE1 TYR A 8 4.134 9.371 -1.067 1.00 14.01 C ATOM 116 CE2 TYR A 8 2.447 8.966 0.582 1.00 51.11 C ATOM 117 CZ TYR A 8 3.362 9.811 -0.011 1.00 63.11 C ATOM 118 OH TYR A 8 3.506 11.098 0.451 1.00 15.42 O ATOM 119 H TYR A 8 1.171 4.070 -2.702 1.00 74.33 H ATOM 120 HA TYR A 8 2.329 6.715 -3.297 1.00 34.31 H ATOM 121 HB2 TYR A 8 2.174 5.301 -0.845 1.00 14.24 H ATOM 122 HB3 TYR A 8 3.863 5.289 -1.339 1.00 10.23 H ATOM 123 HD1 TYR A 8 4.588 7.731 -2.357 1.00 0.45 H ATOM 124 HD2 TYR A 8 1.591 7.010 0.577 1.00 61.20 H ATOM 125 HE1 TYR A 8 4.850 10.033 -1.532 1.00 14.34 H ATOM 126 HE2 TYR A 8 1.843 9.310 1.409 1.00 5.12 H ATOM 127 HH TYR A 8 4.281 11.498 0.050 1.00 21.21 H ATOM 128 N GLU A 9 3.678 5.434 -5.017 1.00 54.52 N ATOM 129 CA GLU A 9 4.682 4.874 -5.913 1.00 35.01 C ATOM 130 C GLU A 9 6.089 5.219 -5.436 1.00 60.02 C ATOM 131 O GLU A 9 7.062 4.572 -5.821 1.00 40.11 O ATOM 132 CB GLU A 9 4.473 5.394 -7.338 1.00 22.45 C ATOM 133 CG GLU A 9 4.905 6.837 -7.528 1.00 13.42 C ATOM 134 CD GLU A 9 4.523 7.386 -8.889 1.00 33.13 C ATOM 135 OE1 GLU A 9 5.301 7.194 -9.847 1.00 13.32 O ATOM 136 OE2 GLU A 9 3.444 8.007 -8.996 1.00 1.42 O ATOM 137 H GLU A 9 3.058 6.113 -5.358 1.00 14.44 H ATOM 138 HA GLU A 9 4.566 3.801 -5.911 1.00 43.25 H ATOM 139 HB2 GLU A 9 5.039 4.776 -8.019 1.00 51.41 H ATOM 140 HB3 GLU A 9 3.425 5.318 -7.585 1.00 14.24 H ATOM 141 HG2 GLU A 9 4.436 7.444 -6.768 1.00 51.13 H ATOM 142 HG3 GLU A 9 5.978 6.896 -7.421 1.00 45.23 H ATOM 143 N ASN A 10 6.189 6.243 -4.594 1.00 72.43 N ATOM 144 CA ASN A 10 7.477 6.675 -4.065 1.00 23.52 C ATOM 145 C ASN A 10 8.135 5.559 -3.259 1.00 11.12 C ATOM 146 O ASN A 10 9.345 5.577 -3.027 1.00 73.12 O ATOM 147 CB ASN A 10 7.301 7.917 -3.189 1.00 43.43 C ATOM 148 CG ASN A 10 8.483 8.864 -3.285 1.00 34.42 C ATOM 149 OD1 ASN A 10 9.452 8.741 -2.537 1.00 23.03 O ATOM 150 ND2 ASN A 10 8.406 9.814 -4.209 1.00 63.13 N ATOM 151 H ASN A 10 5.377 6.720 -4.324 1.00 14.31 H ATOM 152 HA ASN A 10 8.113 6.922 -4.902 1.00 32.32 H ATOM 153 HB2 ASN A 10 6.413 8.448 -3.502 1.00 45.42 H ATOM 154 HB3 ASN A 10 7.189 7.612 -2.160 1.00 3.34 H ATOM 155 HD21 ASN A 10 7.603 9.851 -4.770 1.00 63.12 H ATOM 156 HD22 ASN A 10 9.156 10.439 -4.293 1.00 61.24 H ATOM 157 N TYR A 11 7.332 4.591 -2.834 1.00 34.13 N ATOM 158 CA TYR A 11 7.834 3.469 -2.051 1.00 23.13 C ATOM 159 C TYR A 11 8.451 2.406 -2.956 1.00 54.34 C ATOM 160 O TYR A 11 8.107 2.280 -4.132 1.00 12.34 O ATOM 161 CB TYR A 11 6.708 2.854 -1.218 1.00 53.52 C ATOM 162 CG TYR A 11 6.512 3.523 0.124 1.00 64.32 C ATOM 163 CD1 TYR A 11 7.585 3.724 0.984 1.00 42.34 C ATOM 164 CD2 TYR A 11 5.256 3.954 0.530 1.00 35.23 C ATOM 165 CE1 TYR A 11 7.411 4.334 2.212 1.00 54.04 C ATOM 166 CE2 TYR A 11 5.073 4.565 1.756 1.00 72.11 C ATOM 167 CZ TYR A 11 6.153 4.753 2.592 1.00 13.32 C ATOM 168 OH TYR A 11 5.976 5.362 3.814 1.00 12.41 O ATOM 169 H TYR A 11 6.376 4.633 -3.049 1.00 64.24 H ATOM 170 HA TYR A 11 8.597 3.844 -1.385 1.00 3.34 H ATOM 171 HB2 TYR A 11 5.781 2.933 -1.766 1.00 21.21 H ATOM 172 HB3 TYR A 11 6.928 1.811 -1.041 1.00 43.24 H ATOM 173 HD1 TYR A 11 8.569 3.396 0.682 1.00 31.03 H ATOM 174 HD2 TYR A 11 4.412 3.805 -0.127 1.00 61.22 H ATOM 175 HE1 TYR A 11 8.256 4.481 2.867 1.00 44.14 H ATOM 176 HE2 TYR A 11 4.088 4.893 2.054 1.00 3.35 H ATOM 177 HH TYR A 11 6.703 5.128 4.396 1.00 35.01 H ATOM 178 N PRO A 12 9.384 1.622 -2.397 1.00 24.25 N ATOM 179 CA PRO A 12 10.068 0.556 -3.133 1.00 73.23 C ATOM 180 C PRO A 12 9.141 -0.612 -3.457 1.00 41.44 C ATOM 181 O PRO A 12 8.507 -1.178 -2.568 1.00 31.43 O ATOM 182 CB PRO A 12 11.172 0.111 -2.171 1.00 12.21 C ATOM 183 CG PRO A 12 10.662 0.468 -0.818 1.00 72.33 C ATOM 184 CD PRO A 12 9.843 1.716 -1.000 1.00 52.41 C ATOM 185 HA PRO A 12 10.511 0.925 -4.047 1.00 11.33 H ATOM 186 HB2 PRO A 12 11.328 -0.954 -2.267 1.00 22.41 H ATOM 187 HB3 PRO A 12 12.087 0.637 -2.399 1.00 35.21 H ATOM 188 HG2 PRO A 12 10.045 -0.331 -0.435 1.00 23.42 H ATOM 189 HG3 PRO A 12 11.490 0.658 -0.152 1.00 53.01 H ATOM 190 HD2 PRO A 12 9.006 1.722 -0.319 1.00 32.25 H ATOM 191 HD3 PRO A 12 10.456 2.593 -0.855 1.00 11.52 H ATOM 192 N VAL A 13 9.069 -0.966 -4.737 1.00 14.13 N ATOM 193 CA VAL A 13 8.220 -2.067 -5.177 1.00 25.20 C ATOM 194 C VAL A 13 8.748 -3.404 -4.670 1.00 12.14 C ATOM 195 O VAL A 13 8.034 -4.408 -4.678 1.00 23.03 O ATOM 196 CB VAL A 13 8.119 -2.117 -6.713 1.00 72.10 C ATOM 197 CG1 VAL A 13 7.100 -3.159 -7.148 1.00 61.12 C ATOM 198 CG2 VAL A 13 7.762 -0.747 -7.268 1.00 54.20 C ATOM 199 H VAL A 13 9.598 -0.476 -5.399 1.00 1.52 H ATOM 200 HA VAL A 13 7.229 -1.907 -4.777 1.00 44.42 H ATOM 201 HB VAL A 13 9.083 -2.402 -7.108 1.00 53.12 H ATOM 202 HG11 VAL A 13 6.890 -3.040 -8.201 1.00 44.21 H ATOM 203 HG12 VAL A 13 7.497 -4.148 -6.968 1.00 74.12 H ATOM 204 HG13 VAL A 13 6.189 -3.028 -6.583 1.00 35.42 H ATOM 205 HG21 VAL A 13 7.269 -0.165 -6.504 1.00 30.21 H ATOM 206 HG22 VAL A 13 8.662 -0.240 -7.582 1.00 32.33 H ATOM 207 HG23 VAL A 13 7.100 -0.862 -8.115 1.00 12.44 H ATOM 208 N SER A 14 10.001 -3.411 -4.228 1.00 4.32 N ATOM 209 CA SER A 14 10.626 -4.626 -3.719 1.00 0.30 C ATOM 210 C SER A 14 9.887 -5.143 -2.489 1.00 74.44 C ATOM 211 O SER A 14 9.863 -6.345 -2.224 1.00 31.33 O ATOM 212 CB SER A 14 12.093 -4.364 -3.373 1.00 50.42 C ATOM 213 OG SER A 14 12.758 -3.703 -4.436 1.00 63.45 O ATOM 214 H SER A 14 10.519 -2.578 -4.247 1.00 53.32 H ATOM 215 HA SER A 14 10.577 -5.374 -4.496 1.00 42.04 H ATOM 216 HB2 SER A 14 12.148 -3.744 -2.491 1.00 12.41 H ATOM 217 HB3 SER A 14 12.589 -5.305 -3.184 1.00 11.40 H ATOM 218 HG SER A 14 13.447 -4.272 -4.787 1.00 25.45 H ATOM 219 N LYS A 15 9.283 -4.227 -1.741 1.00 11.41 N ATOM 220 CA LYS A 15 8.540 -4.586 -0.539 1.00 24.43 C ATOM 221 C LYS A 15 7.165 -5.141 -0.895 1.00 2.41 C ATOM 222 O LYS A 15 6.525 -5.810 -0.083 1.00 53.14 O ATOM 223 CB LYS A 15 8.391 -3.371 0.377 1.00 2.53 C ATOM 224 CG LYS A 15 9.702 -2.656 0.660 1.00 32.43 C ATOM 225 CD LYS A 15 10.698 -3.574 1.351 1.00 41.45 C ATOM 226 CE LYS A 15 10.988 -3.113 2.771 1.00 35.20 C ATOM 227 NZ LYS A 15 12.423 -3.289 3.128 1.00 22.21 N ATOM 228 H LYS A 15 9.337 -3.283 -2.004 1.00 2.34 H ATOM 229 HA LYS A 15 9.100 -5.351 -0.020 1.00 42.22 H ATOM 230 HB2 LYS A 15 7.715 -2.666 -0.086 1.00 74.10 H ATOM 231 HB3 LYS A 15 7.970 -3.693 1.319 1.00 63.25 H ATOM 232 HG2 LYS A 15 10.126 -2.319 -0.273 1.00 22.21 H ATOM 233 HG3 LYS A 15 9.508 -1.806 1.299 1.00 60.31 H ATOM 234 HD2 LYS A 15 10.290 -4.573 1.384 1.00 23.45 H ATOM 235 HD3 LYS A 15 11.620 -3.578 0.787 1.00 3.20 H ATOM 236 HE2 LYS A 15 10.730 -2.069 2.856 1.00 14.04 H ATOM 237 HE3 LYS A 15 10.382 -3.692 3.453 1.00 3.44 H ATOM 238 HZ1 LYS A 15 12.528 -3.361 4.161 1.00 60.23 H ATOM 239 HZ2 LYS A 15 12.977 -2.477 2.790 1.00 31.51 H ATOM 240 HZ3 LYS A 15 12.796 -4.156 2.692 1.00 13.12 H ATOM 241 N CYS A 16 6.716 -4.859 -2.113 1.00 71.44 N ATOM 242 CA CYS A 16 5.417 -5.330 -2.578 1.00 35.32 C ATOM 243 C CYS A 16 5.270 -6.831 -2.352 1.00 61.44 C ATOM 244 O CYS A 16 4.188 -7.316 -2.019 1.00 42.13 O ATOM 245 CB CYS A 16 5.234 -5.006 -4.062 1.00 43.33 C ATOM 246 SG CYS A 16 3.645 -5.565 -4.755 1.00 64.43 S ATOM 247 H CYS A 16 7.273 -4.321 -2.716 1.00 35.40 H ATOM 248 HA CYS A 16 4.656 -4.817 -2.011 1.00 12.05 H ATOM 249 HB2 CYS A 16 5.292 -3.935 -4.199 1.00 24.40 H ATOM 250 HB3 CYS A 16 6.024 -5.479 -4.626 1.00 22.45 H ATOM 251 N GLN A 17 6.365 -7.562 -2.535 1.00 34.02 N ATOM 252 CA GLN A 17 6.358 -9.009 -2.352 1.00 31.20 C ATOM 253 C GLN A 17 5.905 -9.376 -0.943 1.00 62.30 C ATOM 254 O GLN A 17 5.276 -10.413 -0.732 1.00 72.51 O ATOM 255 CB GLN A 17 7.749 -9.585 -2.621 1.00 72.01 C ATOM 256 CG GLN A 17 8.324 -9.183 -3.969 1.00 73.33 C ATOM 257 CD GLN A 17 7.355 -9.419 -5.111 1.00 22.33 C ATOM 258 OE1 GLN A 17 6.777 -10.500 -5.236 1.00 32.15 O ATOM 259 NE2 GLN A 17 7.172 -8.408 -5.951 1.00 62.05 N ATOM 260 H GLN A 17 7.197 -7.118 -2.800 1.00 12.22 H ATOM 261 HA GLN A 17 5.661 -9.428 -3.061 1.00 74.52 H ATOM 262 HB2 GLN A 17 8.423 -9.243 -1.850 1.00 53.00 H ATOM 263 HB3 GLN A 17 7.692 -10.663 -2.586 1.00 13.21 H ATOM 264 HG2 GLN A 17 8.573 -8.132 -3.941 1.00 74.10 H ATOM 265 HG3 GLN A 17 9.219 -9.759 -4.151 1.00 11.03 H ATOM 266 HE21 GLN A 17 7.667 -7.578 -5.791 1.00 71.24 H ATOM 267 HE22 GLN A 17 6.552 -8.534 -6.699 1.00 21.11 H ATOM 268 N LEU A 18 6.231 -8.521 0.020 1.00 51.30 N ATOM 269 CA LEU A 18 5.858 -8.755 1.411 1.00 64.23 C ATOM 270 C LEU A 18 4.418 -8.326 1.668 1.00 22.44 C ATOM 271 O LEU A 18 3.997 -7.249 1.251 1.00 41.34 O ATOM 272 CB LEU A 18 6.804 -7.999 2.347 1.00 74.34 C ATOM 273 CG LEU A 18 8.125 -8.696 2.672 1.00 11.12 C ATOM 274 CD1 LEU A 18 7.928 -9.731 3.769 1.00 41.05 C ATOM 275 CD2 LEU A 18 8.708 -9.343 1.424 1.00 61.13 C ATOM 276 H LEU A 18 6.734 -7.712 -0.209 1.00 34.11 H ATOM 277 HA LEU A 18 5.946 -9.814 1.602 1.00 23.44 H ATOM 278 HB2 LEU A 18 7.035 -7.051 1.888 1.00 54.43 H ATOM 279 HB3 LEU A 18 6.280 -7.830 3.277 1.00 51.34 H ATOM 280 HG LEU A 18 8.833 -7.962 3.030 1.00 0.00 H ATOM 281 HD11 LEU A 18 8.275 -10.693 3.423 1.00 33.11 H ATOM 282 HD12 LEU A 18 6.880 -9.795 4.018 1.00 34.04 H ATOM 283 HD13 LEU A 18 8.489 -9.439 4.644 1.00 4.30 H ATOM 284 HD21 LEU A 18 8.819 -8.599 0.651 1.00 43.41 H ATOM 285 HD22 LEU A 18 8.044 -10.124 1.081 1.00 44.35 H ATOM 286 HD23 LEU A 18 9.674 -9.769 1.657 1.00 61.12 H ATOM 287 N ALA A 19 3.667 -9.177 2.361 1.00 25.15 N ATOM 288 CA ALA A 19 2.275 -8.884 2.679 1.00 4.11 C ATOM 289 C ALA A 19 2.155 -8.194 4.033 1.00 31.24 C ATOM 290 O ALA A 19 1.233 -7.413 4.262 1.00 12.52 O ATOM 291 CB ALA A 19 1.450 -10.162 2.660 1.00 14.34 C ATOM 292 H ALA A 19 4.061 -10.021 2.667 1.00 12.03 H ATOM 293 HA ALA A 19 1.891 -8.225 1.914 1.00 52.40 H ATOM 294 HB1 ALA A 19 0.683 -10.106 3.418 1.00 12.23 H ATOM 295 HB2 ALA A 19 0.990 -10.278 1.689 1.00 14.44 H ATOM 296 HB3 ALA A 19 2.091 -11.007 2.858 1.00 65.24 H ATOM 297 N ASN A 20 3.093 -8.489 4.928 1.00 41.51 N ATOM 298 CA ASN A 20 3.090 -7.897 6.261 1.00 2.31 C ATOM 299 C ASN A 20 3.888 -6.596 6.280 1.00 15.24 C ATOM 300 O ASN A 20 3.749 -5.785 7.196 1.00 75.35 O ATOM 301 CB ASN A 20 3.671 -8.879 7.279 1.00 24.03 C ATOM 302 CG ASN A 20 5.148 -9.140 7.052 1.00 22.25 C ATOM 303 OD1 ASN A 20 5.649 -9.011 5.935 1.00 34.24 O ATOM 304 ND2 ASN A 20 5.853 -9.510 8.115 1.00 30.32 N ATOM 305 H ASN A 20 3.803 -9.118 4.687 1.00 70.43 H ATOM 306 HA ASN A 20 2.066 -7.681 6.526 1.00 14.21 H ATOM 307 HB2 ASN A 20 3.546 -8.475 8.273 1.00 12.30 H ATOM 308 HB3 ASN A 20 3.143 -9.818 7.207 1.00 5.03 H ATOM 309 HD21 ASN A 20 5.388 -9.593 8.974 1.00 43.02 H ATOM 310 HD22 ASN A 20 6.811 -9.685 7.997 1.00 11.15 H ATOM 311 N GLN A 21 4.721 -6.404 5.263 1.00 30.22 N ATOM 312 CA GLN A 21 5.541 -5.203 5.163 1.00 14.55 C ATOM 313 C GLN A 21 4.711 -4.016 4.682 1.00 34.13 C ATOM 314 O GLN A 21 4.818 -2.912 5.216 1.00 23.45 O ATOM 315 CB GLN A 21 6.715 -5.438 4.212 1.00 3.32 C ATOM 316 CG GLN A 21 7.739 -4.314 4.220 1.00 3.33 C ATOM 317 CD GLN A 21 8.772 -4.474 5.318 1.00 3.40 C ATOM 318 OE1 GLN A 21 9.179 -5.589 5.646 1.00 3.31 O ATOM 319 NE2 GLN A 21 9.204 -3.357 5.893 1.00 63.03 N ATOM 320 H GLN A 21 4.787 -7.087 4.563 1.00 3.54 H ATOM 321 HA GLN A 21 5.925 -4.981 6.148 1.00 51.44 H ATOM 322 HB2 GLN A 21 7.215 -6.352 4.495 1.00 14.14 H ATOM 323 HB3 GLN A 21 6.335 -5.540 3.207 1.00 33.13 H ATOM 324 HG2 GLN A 21 8.248 -4.300 3.268 1.00 60.12 H ATOM 325 HG3 GLN A 21 7.223 -3.376 4.366 1.00 63.04 H ATOM 326 HE21 GLN A 21 8.835 -2.504 5.581 1.00 62.14 H ATOM 327 HE22 GLN A 21 9.872 -3.431 6.606 1.00 53.24 H ATOM 328 N CYS A 22 3.884 -4.252 3.669 1.00 10.13 N ATOM 329 CA CYS A 22 3.036 -3.204 3.114 1.00 12.32 C ATOM 330 C CYS A 22 2.084 -2.656 4.174 1.00 52.41 C ATOM 331 O CYS A 22 2.149 -1.482 4.533 1.00 4.22 O ATOM 332 CB CYS A 22 2.238 -3.741 1.924 1.00 14.33 C ATOM 333 SG CYS A 22 2.722 -3.026 0.320 1.00 52.01 S ATOM 334 H CYS A 22 3.843 -5.154 3.285 1.00 55.34 H ATOM 335 HA CYS A 22 3.676 -2.403 2.775 1.00 70.43 H ATOM 336 HB2 CYS A 22 2.376 -4.811 1.861 1.00 12.31 H ATOM 337 HB3 CYS A 22 1.190 -3.527 2.077 1.00 5.34 H ATOM 338 N ASN A 23 1.200 -3.516 4.669 1.00 42.13 N ATOM 339 CA ASN A 23 0.235 -3.119 5.686 1.00 35.14 C ATOM 340 C ASN A 23 0.937 -2.493 6.888 1.00 2.23 C ATOM 341 O ASN A 23 0.365 -1.657 7.588 1.00 11.01 O ATOM 342 CB ASN A 23 -0.589 -4.327 6.136 1.00 34.03 C ATOM 343 CG ASN A 23 0.073 -5.091 7.268 1.00 51.34 C ATOM 344 OD1 ASN A 23 1.156 -5.652 7.101 1.00 53.21 O ATOM 345 ND2 ASN A 23 -0.577 -5.114 8.425 1.00 55.12 N ATOM 346 H ASN A 23 1.197 -4.440 4.342 1.00 21.43 H ATOM 347 HA ASN A 23 -0.426 -2.387 5.249 1.00 41.25 H ATOM 348 HB2 ASN A 23 -1.558 -3.988 6.476 1.00 73.12 H ATOM 349 HB3 ASN A 23 -0.720 -4.998 5.301 1.00 25.24 H ATOM 350 HD21 ASN A 23 -1.435 -4.645 8.485 1.00 55.52 H ATOM 351 HD22 ASN A 23 -0.171 -5.600 9.173 1.00 33.41 H ATOM 352 N TYR A 24 2.179 -2.903 7.120 1.00 70.03 N ATOM 353 CA TYR A 24 2.959 -2.384 8.237 1.00 11.10 C ATOM 354 C TYR A 24 3.325 -0.920 8.012 1.00 4.10 C ATOM 355 O TYR A 24 3.129 -0.077 8.888 1.00 51.02 O ATOM 356 CB TYR A 24 4.229 -3.215 8.429 1.00 41.44 C ATOM 357 CG TYR A 24 5.221 -2.592 9.385 1.00 63.14 C ATOM 358 CD1 TYR A 24 4.840 -2.221 10.669 1.00 75.44 C ATOM 359 CD2 TYR A 24 6.540 -2.373 9.004 1.00 33.31 C ATOM 360 CE1 TYR A 24 5.743 -1.651 11.545 1.00 11.05 C ATOM 361 CE2 TYR A 24 7.449 -1.806 9.875 1.00 42.03 C ATOM 362 CZ TYR A 24 7.047 -1.446 11.144 1.00 35.31 C ATOM 363 OH TYR A 24 7.949 -0.878 12.014 1.00 61.52 O ATOM 364 H TYR A 24 2.580 -3.571 6.526 1.00 23.10 H ATOM 365 HA TYR A 24 2.354 -2.458 9.128 1.00 35.51 H ATOM 366 HB2 TYR A 24 3.960 -4.185 8.817 1.00 31.41 H ATOM 367 HB3 TYR A 24 4.719 -3.336 7.474 1.00 33.23 H ATOM 368 HD1 TYR A 24 3.818 -2.383 10.980 1.00 54.13 H ATOM 369 HD2 TYR A 24 6.852 -2.657 8.009 1.00 15.53 H ATOM 370 HE1 TYR A 24 5.427 -1.370 12.539 1.00 4.32 H ATOM 371 HE2 TYR A 24 8.470 -1.644 9.561 1.00 71.31 H ATOM 372 HH TYR A 24 8.838 -1.150 11.773 1.00 5.52 H ATOM 373 N ASP A 25 3.858 -0.625 6.831 1.00 10.14 N ATOM 374 CA ASP A 25 4.251 0.738 6.488 1.00 63.51 C ATOM 375 C ASP A 25 3.026 1.630 6.322 1.00 12.30 C ATOM 376 O ASP A 25 3.080 2.832 6.588 1.00 14.13 O ATOM 377 CB ASP A 25 5.080 0.744 5.203 1.00 74.22 C ATOM 378 CG ASP A 25 5.924 1.995 5.065 1.00 65.05 C ATOM 379 OD1 ASP A 25 5.391 3.099 5.302 1.00 44.24 O ATOM 380 OD2 ASP A 25 7.118 1.870 4.720 1.00 32.54 O ATOM 381 H ASP A 25 3.990 -1.340 6.174 1.00 31.42 H ATOM 382 HA ASP A 25 4.854 1.122 7.296 1.00 2.24 H ATOM 383 HB2 ASP A 25 5.737 -0.113 5.202 1.00 23.34 H ATOM 384 HB3 ASP A 25 4.415 0.683 4.354 1.00 61.23 H ATOM 385 N CYS A 26 1.922 1.037 5.880 1.00 53.21 N ATOM 386 CA CYS A 26 0.683 1.778 5.677 1.00 31.20 C ATOM 387 C CYS A 26 -0.006 2.061 7.008 1.00 12.22 C ATOM 388 O CYS A 26 -0.327 3.208 7.323 1.00 75.33 O ATOM 389 CB CYS A 26 -0.258 0.996 4.759 1.00 73.10 C ATOM 390 SG CYS A 26 0.269 0.954 3.015 1.00 33.44 S ATOM 391 H CYS A 26 1.941 0.076 5.685 1.00 20.34 H ATOM 392 HA CYS A 26 0.932 2.717 5.207 1.00 33.05 H ATOM 393 HB2 CYS A 26 -0.322 -0.025 5.106 1.00 13.02 H ATOM 394 HB3 CYS A 26 -1.239 1.446 4.795 1.00 35.44 H ATOM 395 N LYS A 27 -0.231 1.009 7.788 1.00 63.20 N ATOM 396 CA LYS A 27 -0.880 1.142 9.087 1.00 43.35 C ATOM 397 C LYS A 27 0.008 1.908 10.063 1.00 73.43 C ATOM 398 O LYS A 27 -0.437 2.307 11.139 1.00 25.45 O ATOM 399 CB LYS A 27 -1.213 -0.238 9.657 1.00 3.41 C ATOM 400 CG LYS A 27 -2.294 -0.972 8.883 1.00 4.23 C ATOM 401 CD LYS A 27 -3.247 -1.702 9.814 1.00 54.31 C ATOM 402 CE LYS A 27 -2.517 -2.720 10.676 1.00 10.50 C ATOM 403 NZ LYS A 27 -3.372 -3.896 10.991 1.00 72.42 N ATOM 404 H LYS A 27 0.049 0.120 7.482 1.00 34.43 H ATOM 405 HA LYS A 27 -1.796 1.694 8.944 1.00 72.20 H ATOM 406 HB2 LYS A 27 -0.318 -0.843 9.649 1.00 71.03 H ATOM 407 HB3 LYS A 27 -1.547 -0.121 10.678 1.00 15.30 H ATOM 408 HG2 LYS A 27 -2.854 -0.257 8.299 1.00 62.31 H ATOM 409 HG3 LYS A 27 -1.826 -1.691 8.225 1.00 35.42 H ATOM 410 HD2 LYS A 27 -3.730 -0.982 10.457 1.00 14.15 H ATOM 411 HD3 LYS A 27 -3.993 -2.214 9.221 1.00 20.41 H ATOM 412 HE2 LYS A 27 -1.638 -3.055 10.147 1.00 2.11 H ATOM 413 HE3 LYS A 27 -2.222 -2.243 11.599 1.00 5.23 H ATOM 414 HZ1 LYS A 27 -2.781 -4.741 11.130 1.00 41.21 H ATOM 415 HZ2 LYS A 27 -4.034 -4.075 10.209 1.00 73.20 H ATOM 416 HZ3 LYS A 27 -3.917 -3.721 11.858 1.00 23.35 H ATOM 417 N LEU A 28 1.263 2.110 9.679 1.00 23.12 N ATOM 418 CA LEU A 28 2.214 2.830 10.520 1.00 32.30 C ATOM 419 C LEU A 28 1.998 4.336 10.420 1.00 60.34 C ATOM 420 O LEU A 28 1.674 4.995 11.408 1.00 22.45 O ATOM 421 CB LEU A 28 3.648 2.480 10.118 1.00 21.02 C ATOM 422 CG LEU A 28 4.743 3.385 10.682 1.00 12.00 C ATOM 423 CD1 LEU A 28 5.936 2.559 11.137 1.00 22.11 C ATOM 424 CD2 LEU A 28 5.169 4.416 9.647 1.00 3.01 C ATOM 425 H LEU A 28 1.560 1.768 8.810 1.00 11.32 H ATOM 426 HA LEU A 28 2.050 2.522 11.542 1.00 10.14 H ATOM 427 HB2 LEU A 28 3.848 1.473 10.450 1.00 63.43 H ATOM 428 HB3 LEU A 28 3.707 2.520 9.040 1.00 41.32 H ATOM 429 HG LEU A 28 4.356 3.914 11.543 1.00 3.13 H ATOM 430 HD11 LEU A 28 6.198 1.850 10.366 1.00 12.53 H ATOM 431 HD12 LEU A 28 5.683 2.030 12.044 1.00 62.32 H ATOM 432 HD13 LEU A 28 6.776 3.213 11.326 1.00 13.04 H ATOM 433 HD21 LEU A 28 5.050 4.003 8.657 1.00 33.15 H ATOM 434 HD22 LEU A 28 6.205 4.677 9.806 1.00 14.45 H ATOM 435 HD23 LEU A 28 4.555 5.300 9.746 1.00 10.35 H ATOM 436 N ASP A 29 2.178 4.876 9.219 1.00 71.54 N ATOM 437 CA ASP A 29 2.000 6.304 8.987 1.00 0.14 C ATOM 438 C ASP A 29 0.590 6.603 8.488 1.00 62.31 C ATOM 439 O ASP A 29 -0.107 7.456 9.035 1.00 5.43 O ATOM 440 CB ASP A 29 3.030 6.811 7.978 1.00 45.32 C ATOM 441 CG ASP A 29 4.172 7.557 8.639 1.00 23.15 C ATOM 442 OD1 ASP A 29 3.901 8.390 9.530 1.00 23.34 O ATOM 443 OD2 ASP A 29 5.338 7.307 8.269 1.00 71.32 O ATOM 444 H ASP A 29 2.437 4.298 8.470 1.00 54.15 H ATOM 445 HA ASP A 29 2.151 6.813 9.928 1.00 72.01 H ATOM 446 HB2 ASP A 29 3.440 5.970 7.438 1.00 51.24 H ATOM 447 HB3 ASP A 29 2.545 7.478 7.281 1.00 14.53 H ATOM 448 N LYS A 30 0.176 5.893 7.444 1.00 1.10 N ATOM 449 CA LYS A 30 -1.151 6.080 6.869 1.00 71.31 C ATOM 450 C LYS A 30 -2.230 5.542 7.804 1.00 53.31 C ATOM 451 O LYS A 30 -3.421 5.771 7.590 1.00 22.34 O ATOM 452 CB LYS A 30 -1.244 5.382 5.511 1.00 54.12 C ATOM 453 CG LYS A 30 -0.011 5.570 4.644 1.00 12.15 C ATOM 454 CD LYS A 30 0.325 7.041 4.464 1.00 12.22 C ATOM 455 CE LYS A 30 -0.808 7.791 3.781 1.00 0.51 C ATOM 456 NZ LYS A 30 -0.345 9.077 3.190 1.00 44.23 N ATOM 457 H LYS A 30 0.778 5.226 7.051 1.00 74.43 H ATOM 458 HA LYS A 30 -1.307 7.139 6.731 1.00 1.25 H ATOM 459 HB2 LYS A 30 -1.387 4.324 5.673 1.00 64.12 H ATOM 460 HB3 LYS A 30 -2.098 5.774 4.975 1.00 1.03 H ATOM 461 HG2 LYS A 30 0.826 5.076 5.113 1.00 2.20 H ATOM 462 HG3 LYS A 30 -0.194 5.130 3.674 1.00 63.11 H ATOM 463 HD2 LYS A 30 0.501 7.483 5.434 1.00 34.50 H ATOM 464 HD3 LYS A 30 1.217 7.127 3.861 1.00 65.30 H ATOM 465 HE2 LYS A 30 -1.213 7.170 2.997 1.00 72.23 H ATOM 466 HE3 LYS A 30 -1.578 7.997 4.510 1.00 21.01 H ATOM 467 HZ1 LYS A 30 0.095 8.906 2.262 1.00 4.14 H ATOM 468 HZ2 LYS A 30 0.354 9.527 3.816 1.00 3.10 H ATOM 469 HZ3 LYS A 30 -1.149 9.725 3.065 1.00 34.52 H ATOM 470 N HIS A 31 -1.806 4.829 8.842 1.00 23.42 N ATOM 471 CA HIS A 31 -2.736 4.260 9.811 1.00 64.20 C ATOM 472 C HIS A 31 -3.845 3.484 9.108 1.00 74.35 C ATOM 473 O HIS A 31 -4.961 3.378 9.617 1.00 22.22 O ATOM 474 CB HIS A 31 -3.340 5.365 10.677 1.00 11.15 C ATOM 475 CG HIS A 31 -2.336 6.068 11.538 1.00 2.43 C ATOM 476 ND1 HIS A 31 -1.859 7.332 11.259 1.00 33.14 N ATOM 477 CD2 HIS A 31 -1.719 5.678 12.678 1.00 22.00 C ATOM 478 CE1 HIS A 31 -0.991 7.687 12.190 1.00 54.33 C ATOM 479 NE2 HIS A 31 -0.888 6.702 13.063 1.00 62.55 N ATOM 480 H HIS A 31 -0.844 4.681 8.959 1.00 44.45 H ATOM 481 HA HIS A 31 -2.183 3.581 10.442 1.00 22.25 H ATOM 482 HB2 HIS A 31 -3.803 6.102 10.039 1.00 2.11 H ATOM 483 HB3 HIS A 31 -4.090 4.935 11.325 1.00 11.55 H ATOM 484 HD1 HIS A 31 -2.118 7.885 10.493 1.00 61.22 H ATOM 485 HD2 HIS A 31 -1.853 4.735 13.190 1.00 4.33 H ATOM 486 HE1 HIS A 31 -0.457 8.625 12.230 1.00 62.01 H ATOM 487 N ALA A 32 -3.532 2.944 7.934 1.00 1.15 N ATOM 488 CA ALA A 32 -4.502 2.178 7.163 1.00 71.32 C ATOM 489 C ALA A 32 -4.980 0.956 7.941 1.00 50.42 C ATOM 490 O ALA A 32 -4.766 0.855 9.148 1.00 33.22 O ATOM 491 CB ALA A 32 -3.901 1.756 5.830 1.00 20.14 C ATOM 492 H ALA A 32 -2.626 3.064 7.581 1.00 74.42 H ATOM 493 HA ALA A 32 -5.349 2.817 6.961 1.00 4.45 H ATOM 494 HB1 ALA A 32 -3.751 0.686 5.826 1.00 75.05 H ATOM 495 HB2 ALA A 32 -4.573 2.028 5.030 1.00 53.30 H ATOM 496 HB3 ALA A 32 -2.953 2.252 5.690 1.00 41.25 H ATOM 497 N ARG A 33 -5.628 0.031 7.240 1.00 0.14 N ATOM 498 CA ARG A 33 -6.138 -1.183 7.866 1.00 52.03 C ATOM 499 C ARG A 33 -5.750 -2.416 7.056 1.00 72.13 C ATOM 500 O ARG A 33 -5.393 -3.453 7.616 1.00 14.03 O ATOM 501 CB ARG A 33 -7.659 -1.110 8.007 1.00 51.21 C ATOM 502 CG ARG A 33 -8.161 0.237 8.503 1.00 70.21 C ATOM 503 CD ARG A 33 -7.711 0.507 9.930 1.00 20.14 C ATOM 504 NE ARG A 33 -8.675 0.013 10.911 1.00 63.34 N ATOM 505 CZ ARG A 33 -8.721 0.431 12.171 1.00 33.20 C ATOM 506 NH1 ARG A 33 -7.865 1.347 12.601 1.00 73.11 N ATOM 507 NH2 ARG A 33 -9.628 -0.066 13.002 1.00 30.22 N ATOM 508 H ARG A 33 -5.768 0.169 6.280 1.00 62.31 H ATOM 509 HA ARG A 33 -5.697 -1.260 8.849 1.00 14.44 H ATOM 510 HB2 ARG A 33 -8.108 -1.302 7.043 1.00 61.02 H ATOM 511 HB3 ARG A 33 -7.981 -1.868 8.703 1.00 32.04 H ATOM 512 HG2 ARG A 33 -7.772 1.014 7.862 1.00 20.11 H ATOM 513 HG3 ARG A 33 -9.240 0.244 8.467 1.00 12.14 H ATOM 514 HD2 ARG A 33 -6.763 0.017 10.094 1.00 62.43 H ATOM 515 HD3 ARG A 33 -7.592 1.572 10.062 1.00 51.04 H ATOM 516 HE ARG A 33 -9.317 -0.664 10.614 1.00 71.33 H ATOM 517 HH11 ARG A 33 -7.182 1.724 11.976 1.00 43.12 H ATOM 518 HH12 ARG A 33 -7.903 1.662 13.550 1.00 32.10 H ATOM 519 HH21 ARG A 33 -10.276 -0.756 12.682 1.00 23.32 H ATOM 520 HH22 ARG A 33 -9.662 0.250 13.950 1.00 32.12 H ATOM 521 N SER A 34 -5.825 -2.297 5.734 1.00 64.34 N ATOM 522 CA SER A 34 -5.486 -3.404 4.846 1.00 0.40 C ATOM 523 C SER A 34 -4.433 -2.980 3.827 1.00 3.45 C ATOM 524 O SER A 34 -4.486 -3.370 2.662 1.00 53.01 O ATOM 525 CB SER A 34 -6.737 -3.906 4.123 1.00 21.54 C ATOM 526 OG SER A 34 -6.574 -5.248 3.696 1.00 41.52 O ATOM 527 H SER A 34 -6.116 -1.445 5.346 1.00 34.55 H ATOM 528 HA SER A 34 -5.083 -4.202 5.451 1.00 52.11 H ATOM 529 HB2 SER A 34 -7.582 -3.856 4.794 1.00 62.24 H ATOM 530 HB3 SER A 34 -6.925 -3.285 3.260 1.00 23.23 H ATOM 531 HG SER A 34 -7.201 -5.439 2.994 1.00 41.45 H ATOM 532 N GLY A 35 -3.473 -2.175 4.277 1.00 62.03 N ATOM 533 CA GLY A 35 -2.421 -1.711 3.392 1.00 3.22 C ATOM 534 C GLY A 35 -1.766 -2.843 2.626 1.00 44.42 C ATOM 535 O GLY A 35 -1.147 -3.726 3.219 1.00 3.53 O ATOM 536 H GLY A 35 -3.481 -1.896 5.216 1.00 1.12 H ATOM 537 HA2 GLY A 35 -2.840 -1.009 2.688 1.00 12.25 H ATOM 538 HA3 GLY A 35 -1.667 -1.207 3.981 1.00 33.45 H ATOM 539 N GLU A 36 -1.903 -2.818 1.304 1.00 10.32 N ATOM 540 CA GLU A 36 -1.321 -3.851 0.456 1.00 21.12 C ATOM 541 C GLU A 36 -1.006 -3.303 -0.933 1.00 2.41 C ATOM 542 O GLU A 36 -1.468 -2.225 -1.307 1.00 1.34 O ATOM 543 CB GLU A 36 -2.274 -5.043 0.341 1.00 70.32 C ATOM 544 CG GLU A 36 -1.563 -6.383 0.250 1.00 31.31 C ATOM 545 CD GLU A 36 -0.640 -6.635 1.426 1.00 15.03 C ATOM 546 OE1 GLU A 36 0.543 -6.243 1.348 1.00 52.43 O ATOM 547 OE2 GLU A 36 -1.101 -7.226 2.426 1.00 52.33 O ATOM 548 H GLU A 36 -2.407 -2.086 0.889 1.00 34.45 H ATOM 549 HA GLU A 36 -0.402 -4.180 0.917 1.00 14.12 H ATOM 550 HB2 GLU A 36 -2.918 -5.059 1.207 1.00 10.14 H ATOM 551 HB3 GLU A 36 -2.879 -4.920 -0.545 1.00 40.22 H ATOM 552 HG2 GLU A 36 -2.304 -7.168 0.219 1.00 21.33 H ATOM 553 HG3 GLU A 36 -0.979 -6.406 -0.659 1.00 33.13 H ATOM 554 N CYS A 37 -0.215 -4.052 -1.693 1.00 22.04 N ATOM 555 CA CYS A 37 0.165 -3.643 -3.040 1.00 13.15 C ATOM 556 C CYS A 37 -0.621 -4.425 -4.088 1.00 41.21 C ATOM 557 O CYS A 37 -1.046 -5.554 -3.845 1.00 61.40 O ATOM 558 CB CYS A 37 1.666 -3.848 -3.254 1.00 3.25 C ATOM 559 SG CYS A 37 2.153 -5.586 -3.491 1.00 35.40 S ATOM 560 H CYS A 37 0.123 -4.902 -1.339 1.00 74.30 H ATOM 561 HA CYS A 37 -0.065 -2.593 -3.144 1.00 25.20 H ATOM 562 HB2 CYS A 37 1.975 -3.297 -4.130 1.00 71.34 H ATOM 563 HB3 CYS A 37 2.199 -3.471 -2.393 1.00 0.01 H ATOM 564 N PHE A 38 -0.809 -3.817 -5.254 1.00 12.35 N ATOM 565 CA PHE A 38 -1.544 -4.455 -6.339 1.00 54.30 C ATOM 566 C PHE A 38 -1.316 -3.719 -7.657 1.00 14.10 C ATOM 567 O PHE A 38 -1.004 -2.529 -7.670 1.00 2.44 O ATOM 568 CB PHE A 38 -3.039 -4.496 -6.017 1.00 60.02 C ATOM 569 CG PHE A 38 -3.488 -5.798 -5.417 1.00 2.04 C ATOM 570 CD1 PHE A 38 -3.270 -6.994 -6.081 1.00 5.42 C ATOM 571 CD2 PHE A 38 -4.127 -5.825 -4.188 1.00 34.03 C ATOM 572 CE1 PHE A 38 -3.680 -8.193 -5.530 1.00 64.55 C ATOM 573 CE2 PHE A 38 -4.540 -7.022 -3.632 1.00 53.23 C ATOM 574 CZ PHE A 38 -4.317 -8.207 -4.305 1.00 13.20 C ATOM 575 H PHE A 38 -0.446 -2.915 -5.387 1.00 60.11 H ATOM 576 HA PHE A 38 -1.178 -5.465 -6.438 1.00 20.25 H ATOM 577 HB2 PHE A 38 -3.271 -3.710 -5.314 1.00 2.34 H ATOM 578 HB3 PHE A 38 -3.600 -4.337 -6.925 1.00 35.33 H ATOM 579 HD1 PHE A 38 -2.771 -6.985 -7.039 1.00 50.41 H ATOM 580 HD2 PHE A 38 -4.304 -4.899 -3.661 1.00 11.11 H ATOM 581 HE1 PHE A 38 -3.504 -9.118 -6.059 1.00 71.23 H ATOM 582 HE2 PHE A 38 -5.039 -7.029 -2.674 1.00 64.13 H ATOM 583 HZ PHE A 38 -4.639 -9.143 -3.873 1.00 62.01 H ATOM 584 N TYR A 39 -1.476 -4.436 -8.763 1.00 34.42 N ATOM 585 CA TYR A 39 -1.286 -3.853 -10.086 1.00 21.52 C ATOM 586 C TYR A 39 -2.230 -2.675 -10.304 1.00 10.34 C ATOM 587 O TYR A 39 -3.371 -2.686 -9.840 1.00 42.52 O ATOM 588 CB TYR A 39 -1.512 -4.909 -11.169 1.00 71.34 C ATOM 589 CG TYR A 39 -2.892 -5.530 -11.131 1.00 5.13 C ATOM 590 CD1 TYR A 39 -3.977 -4.893 -11.719 1.00 21.12 C ATOM 591 CD2 TYR A 39 -3.107 -6.752 -10.508 1.00 20.32 C ATOM 592 CE1 TYR A 39 -5.239 -5.456 -11.686 1.00 43.30 C ATOM 593 CE2 TYR A 39 -4.365 -7.323 -10.472 1.00 32.25 C ATOM 594 CZ TYR A 39 -5.428 -6.670 -11.061 1.00 22.35 C ATOM 595 OH TYR A 39 -6.682 -7.235 -11.027 1.00 41.21 O ATOM 596 H TYR A 39 -1.727 -5.381 -8.689 1.00 22.14 H ATOM 597 HA TYR A 39 -0.267 -3.501 -10.149 1.00 4.10 H ATOM 598 HB2 TYR A 39 -1.380 -4.456 -12.139 1.00 13.33 H ATOM 599 HB3 TYR A 39 -0.789 -5.703 -11.047 1.00 3.43 H ATOM 600 HD1 TYR A 39 -3.826 -3.941 -12.207 1.00 60.44 H ATOM 601 HD2 TYR A 39 -2.273 -7.262 -10.046 1.00 52.34 H ATOM 602 HE1 TYR A 39 -6.070 -4.944 -12.147 1.00 72.55 H ATOM 603 HE2 TYR A 39 -4.513 -8.275 -9.982 1.00 0.34 H ATOM 604 HH TYR A 39 -7.173 -6.971 -11.809 1.00 64.44 H ATOM 605 N ASP A 40 -1.746 -1.661 -11.012 1.00 2.01 N ATOM 606 CA ASP A 40 -2.546 -0.475 -11.293 1.00 44.32 C ATOM 607 C ASP A 40 -2.985 -0.449 -12.754 1.00 3.31 C ATOM 608 O ASP A 40 -2.725 -1.388 -13.506 1.00 4.40 O ATOM 609 CB ASP A 40 -1.752 0.791 -10.964 1.00 62.00 C ATOM 610 CG ASP A 40 -0.353 0.766 -11.547 1.00 40.01 C ATOM 611 OD1 ASP A 40 -0.228 0.639 -12.783 1.00 11.13 O ATOM 612 OD2 ASP A 40 0.617 0.871 -10.767 1.00 62.30 O ATOM 613 H ASP A 40 -0.829 -1.712 -11.354 1.00 5.35 H ATOM 614 HA ASP A 40 -3.424 -0.510 -10.667 1.00 60.03 H ATOM 615 HB2 ASP A 40 -2.272 1.649 -11.364 1.00 34.30 H ATOM 616 HB3 ASP A 40 -1.674 0.891 -9.891 1.00 53.02 H ATOM 617 N GLU A 41 -3.652 0.631 -13.147 1.00 32.03 N ATOM 618 CA GLU A 41 -4.129 0.777 -14.517 1.00 51.05 C ATOM 619 C GLU A 41 -2.959 0.868 -15.494 1.00 12.04 C ATOM 620 O GLU A 41 -3.115 0.633 -16.692 1.00 12.44 O ATOM 621 CB GLU A 41 -5.012 2.020 -14.645 1.00 23.32 C ATOM 622 CG GLU A 41 -4.255 3.325 -14.460 1.00 73.51 C ATOM 623 CD GLU A 41 -5.164 4.538 -14.512 1.00 75.33 C ATOM 624 OE1 GLU A 41 -6.058 4.572 -15.384 1.00 0.20 O ATOM 625 OE2 GLU A 41 -4.982 5.452 -13.682 1.00 50.41 O ATOM 626 H GLU A 41 -3.829 1.346 -12.501 1.00 51.42 H ATOM 627 HA GLU A 41 -4.716 -0.096 -14.759 1.00 64.50 H ATOM 628 HB2 GLU A 41 -5.466 2.025 -15.625 1.00 1.33 H ATOM 629 HB3 GLU A 41 -5.790 1.970 -13.897 1.00 42.43 H ATOM 630 HG2 GLU A 41 -3.760 3.306 -13.501 1.00 44.33 H ATOM 631 HG3 GLU A 41 -3.518 3.413 -15.244 1.00 64.31 H ATOM 632 N LYS A 42 -1.787 1.213 -14.972 1.00 60.41 N ATOM 633 CA LYS A 42 -0.589 1.335 -15.795 1.00 4.01 C ATOM 634 C LYS A 42 0.218 0.041 -15.777 1.00 45.13 C ATOM 635 O LYS A 42 1.419 0.044 -16.048 1.00 12.42 O ATOM 636 CB LYS A 42 0.277 2.496 -15.300 1.00 63.30 C ATOM 637 CG LYS A 42 -0.486 3.798 -15.136 1.00 33.01 C ATOM 638 CD LYS A 42 -0.973 4.332 -16.473 1.00 11.13 C ATOM 639 CE LYS A 42 -1.782 5.609 -16.301 1.00 70.35 C ATOM 640 NZ LYS A 42 -2.043 6.279 -17.607 1.00 21.54 N ATOM 641 H LYS A 42 -1.724 1.387 -14.009 1.00 14.54 H ATOM 642 HA LYS A 42 -0.902 1.537 -16.808 1.00 23.13 H ATOM 643 HB2 LYS A 42 0.703 2.230 -14.344 1.00 23.40 H ATOM 644 HB3 LYS A 42 1.077 2.659 -16.008 1.00 63.11 H ATOM 645 HG2 LYS A 42 -1.340 3.627 -14.497 1.00 73.40 H ATOM 646 HG3 LYS A 42 0.164 4.532 -14.680 1.00 73.55 H ATOM 647 HD2 LYS A 42 -0.118 4.543 -17.099 1.00 73.53 H ATOM 648 HD3 LYS A 42 -1.593 3.583 -16.945 1.00 4.11 H ATOM 649 HE2 LYS A 42 -2.725 5.362 -15.839 1.00 10.02 H ATOM 650 HE3 LYS A 42 -1.233 6.285 -15.664 1.00 33.35 H ATOM 651 HZ1 LYS A 42 -3.066 6.319 -17.789 1.00 30.14 H ATOM 652 HZ2 LYS A 42 -1.585 5.750 -18.377 1.00 0.51 H ATOM 653 HZ3 LYS A 42 -1.665 7.247 -17.592 1.00 53.31 H ATOM 654 N ARG A 43 -0.449 -1.063 -15.458 1.00 74.12 N ATOM 655 CA ARG A 43 0.206 -2.364 -15.407 1.00 24.44 C ATOM 656 C ARG A 43 1.447 -2.313 -14.519 1.00 61.01 C ATOM 657 O ARG A 43 2.403 -3.058 -14.729 1.00 4.43 O ATOM 658 CB ARG A 43 0.592 -2.821 -16.814 1.00 74.13 C ATOM 659 CG ARG A 43 -0.594 -3.262 -17.657 1.00 43.04 C ATOM 660 CD ARG A 43 -1.142 -2.114 -18.491 1.00 73.53 C ATOM 661 NE ARG A 43 -0.211 -1.705 -19.539 1.00 63.53 N ATOM 662 CZ ARG A 43 -0.009 -2.401 -20.653 1.00 44.24 C ATOM 663 NH1 ARG A 43 -0.668 -3.532 -20.863 1.00 1.24 N ATOM 664 NH2 ARG A 43 0.855 -1.964 -21.561 1.00 42.43 N ATOM 665 H ARG A 43 -1.406 -1.001 -15.252 1.00 1.21 H ATOM 666 HA ARG A 43 -0.493 -3.071 -14.987 1.00 31.31 H ATOM 667 HB2 ARG A 43 1.083 -2.006 -17.323 1.00 42.43 H ATOM 668 HB3 ARG A 43 1.278 -3.651 -16.736 1.00 33.55 H ATOM 669 HG2 ARG A 43 -0.278 -4.054 -18.320 1.00 30.23 H ATOM 670 HG3 ARG A 43 -1.373 -3.625 -17.004 1.00 20.24 H ATOM 671 HD2 ARG A 43 -2.068 -2.429 -18.948 1.00 21.25 H ATOM 672 HD3 ARG A 43 -1.329 -1.273 -17.841 1.00 14.44 H ATOM 673 HE ARG A 43 0.287 -0.874 -19.405 1.00 4.40 H ATOM 674 HH11 ARG A 43 -1.320 -3.862 -20.181 1.00 32.32 H ATOM 675 HH12 ARG A 43 -0.515 -4.052 -21.703 1.00 45.22 H ATOM 676 HH21 ARG A 43 1.354 -1.111 -21.407 1.00 24.21 H ATOM 677 HH22 ARG A 43 1.008 -2.487 -22.399 1.00 70.44 H ATOM 678 N ASN A 44 1.424 -1.427 -13.529 1.00 35.54 N ATOM 679 CA ASN A 44 2.546 -1.278 -12.610 1.00 42.52 C ATOM 680 C ASN A 44 2.168 -1.744 -11.207 1.00 54.44 C ATOM 681 O ASN A 44 0.998 -1.702 -10.822 1.00 22.43 O ATOM 682 CB ASN A 44 3.007 0.181 -12.568 1.00 60.52 C ATOM 683 CG ASN A 44 3.971 0.514 -13.690 1.00 52.33 C ATOM 684 OD1 ASN A 44 4.478 -0.375 -14.374 1.00 74.35 O ATOM 685 ND2 ASN A 44 4.228 1.803 -13.885 1.00 63.14 N ATOM 686 H ASN A 44 0.632 -0.861 -13.411 1.00 42.11 H ATOM 687 HA ASN A 44 3.356 -1.892 -12.975 1.00 4.25 H ATOM 688 HB2 ASN A 44 2.145 0.827 -12.656 1.00 63.12 H ATOM 689 HB3 ASN A 44 3.500 0.370 -11.627 1.00 33.12 H ATOM 690 HD21 ASN A 44 3.789 2.456 -13.302 1.00 1.43 H ATOM 691 HD22 ASN A 44 4.848 2.047 -14.604 1.00 71.12 H ATOM 692 N LEU A 45 3.164 -2.184 -10.447 1.00 75.14 N ATOM 693 CA LEU A 45 2.937 -2.657 -9.087 1.00 31.15 C ATOM 694 C LEU A 45 3.300 -1.581 -8.068 1.00 44.41 C ATOM 695 O LEU A 45 4.408 -1.045 -8.087 1.00 55.21 O ATOM 696 CB LEU A 45 3.754 -3.922 -8.822 1.00 24.35 C ATOM 697 CG LEU A 45 3.842 -4.919 -9.978 1.00 11.20 C ATOM 698 CD1 LEU A 45 4.816 -6.038 -9.645 1.00 60.43 C ATOM 699 CD2 LEU A 45 2.466 -5.484 -10.301 1.00 30.34 C ATOM 700 H LEU A 45 4.074 -2.192 -10.809 1.00 70.22 H ATOM 701 HA LEU A 45 1.887 -2.889 -8.987 1.00 62.03 H ATOM 702 HB2 LEU A 45 4.759 -3.620 -8.569 1.00 71.52 H ATOM 703 HB3 LEU A 45 3.311 -4.431 -7.978 1.00 21.54 H ATOM 704 HG LEU A 45 4.210 -4.409 -10.857 1.00 51.25 H ATOM 705 HD11 LEU A 45 5.598 -5.657 -9.007 1.00 42.12 H ATOM 706 HD12 LEU A 45 5.248 -6.422 -10.557 1.00 22.52 H ATOM 707 HD13 LEU A 45 4.290 -6.833 -9.135 1.00 52.11 H ATOM 708 HD21 LEU A 45 1.936 -4.796 -10.941 1.00 61.15 H ATOM 709 HD22 LEU A 45 1.912 -5.625 -9.385 1.00 13.21 H ATOM 710 HD23 LEU A 45 2.577 -6.434 -10.804 1.00 14.33 H ATOM 711 N GLN A 46 2.360 -1.272 -7.180 1.00 41.32 N ATOM 712 CA GLN A 46 2.583 -0.261 -6.153 1.00 55.41 C ATOM 713 C GLN A 46 1.884 -0.643 -4.853 1.00 71.43 C ATOM 714 O GLN A 46 0.936 -1.428 -4.853 1.00 72.41 O ATOM 715 CB GLN A 46 2.083 1.103 -6.634 1.00 34.01 C ATOM 716 CG GLN A 46 2.512 1.443 -8.052 1.00 20.04 C ATOM 717 CD GLN A 46 1.878 2.722 -8.561 1.00 41.14 C ATOM 718 OE1 GLN A 46 0.671 2.928 -8.427 1.00 32.42 O ATOM 719 NE2 GLN A 46 2.690 3.591 -9.152 1.00 41.43 N ATOM 720 H GLN A 46 1.497 -1.734 -7.217 1.00 2.22 H ATOM 721 HA GLN A 46 3.646 -0.201 -5.972 1.00 74.22 H ATOM 722 HB2 GLN A 46 1.004 1.111 -6.595 1.00 13.34 H ATOM 723 HB3 GLN A 46 2.465 1.866 -5.972 1.00 53.24 H ATOM 724 HG2 GLN A 46 3.585 1.559 -8.071 1.00 50.13 H ATOM 725 HG3 GLN A 46 2.226 0.631 -8.705 1.00 45.31 H ATOM 726 HE21 GLN A 46 3.640 3.360 -9.226 1.00 30.14 H ATOM 727 HE22 GLN A 46 2.307 4.426 -9.492 1.00 3.00 H ATOM 728 N CYS A 47 2.359 -0.083 -3.746 1.00 13.23 N ATOM 729 CA CYS A 47 1.781 -0.365 -2.437 1.00 64.11 C ATOM 730 C CYS A 47 0.715 0.667 -2.079 1.00 52.03 C ATOM 731 O CYS A 47 1.024 1.832 -1.828 1.00 32.34 O ATOM 732 CB CYS A 47 2.874 -0.378 -1.365 1.00 60.15 C ATOM 733 SG CYS A 47 2.348 -1.096 0.223 1.00 34.33 S ATOM 734 H CYS A 47 3.118 0.535 -3.809 1.00 0.50 H ATOM 735 HA CYS A 47 1.320 -1.340 -2.481 1.00 2.15 H ATOM 736 HB2 CYS A 47 3.713 -0.956 -1.725 1.00 14.41 H ATOM 737 HB3 CYS A 47 3.195 0.636 -1.179 1.00 50.40 H ATOM 738 N ILE A 48 -0.540 0.230 -2.059 1.00 62.02 N ATOM 739 CA ILE A 48 -1.651 1.114 -1.732 1.00 11.44 C ATOM 740 C ILE A 48 -2.117 0.902 -0.295 1.00 52.00 C ATOM 741 O ILE A 48 -2.064 -0.210 0.228 1.00 25.35 O ATOM 742 CB ILE A 48 -2.843 0.898 -2.683 1.00 44.45 C ATOM 743 CG1 ILE A 48 -2.387 1.014 -4.139 1.00 73.33 C ATOM 744 CG2 ILE A 48 -3.946 1.902 -2.386 1.00 74.11 C ATOM 745 CD1 ILE A 48 -2.151 -0.323 -4.806 1.00 41.44 C ATOM 746 H ILE A 48 -0.722 -0.710 -2.269 1.00 53.33 H ATOM 747 HA ILE A 48 -1.308 2.133 -1.841 1.00 15.31 H ATOM 748 HB ILE A 48 -3.234 -0.092 -2.514 1.00 31.51 H ATOM 749 HG12 ILE A 48 -3.141 1.538 -4.705 1.00 53.23 H ATOM 750 HG13 ILE A 48 -1.462 1.573 -4.176 1.00 74.32 H ATOM 751 HG21 ILE A 48 -3.554 2.904 -2.474 1.00 52.15 H ATOM 752 HG22 ILE A 48 -4.753 1.769 -3.091 1.00 31.30 H ATOM 753 HG23 ILE A 48 -4.314 1.746 -1.383 1.00 51.11 H ATOM 754 HD11 ILE A 48 -2.264 -1.113 -4.079 1.00 22.41 H ATOM 755 HD12 ILE A 48 -2.870 -0.461 -5.601 1.00 53.32 H ATOM 756 HD13 ILE A 48 -1.152 -0.350 -5.215 1.00 72.32 H ATOM 757 N CYS A 49 -2.576 1.978 0.337 1.00 31.40 N ATOM 758 CA CYS A 49 -3.054 1.911 1.713 1.00 71.45 C ATOM 759 C CYS A 49 -4.526 2.304 1.797 1.00 60.22 C ATOM 760 O CYS A 49 -4.985 3.186 1.072 1.00 12.34 O ATOM 761 CB CYS A 49 -2.218 2.825 2.610 1.00 63.34 C ATOM 762 SG CYS A 49 -0.422 2.699 2.332 1.00 41.11 S ATOM 763 H CYS A 49 -2.594 2.838 -0.133 1.00 71.02 H ATOM 764 HA CYS A 49 -2.947 0.892 2.052 1.00 62.12 H ATOM 765 HB2 CYS A 49 -2.505 3.851 2.434 1.00 74.25 H ATOM 766 HB3 CYS A 49 -2.409 2.575 3.643 1.00 0.22 H ATOM 767 N ASP A 50 -5.259 1.643 2.686 1.00 11.33 N ATOM 768 CA ASP A 50 -6.678 1.924 2.867 1.00 2.55 C ATOM 769 C ASP A 50 -6.974 2.317 4.312 1.00 54.12 C ATOM 770 O ASP A 50 -6.800 1.517 5.232 1.00 70.33 O ATOM 771 CB ASP A 50 -7.516 0.707 2.474 1.00 24.24 C ATOM 772 CG ASP A 50 -8.803 1.091 1.774 1.00 52.25 C ATOM 773 OD1 ASP A 50 -9.272 2.232 1.975 1.00 63.21 O ATOM 774 OD2 ASP A 50 -9.343 0.253 1.022 1.00 31.11 O ATOM 775 H ASP A 50 -4.835 0.950 3.235 1.00 12.35 H ATOM 776 HA ASP A 50 -6.937 2.752 2.223 1.00 75.41 H ATOM 777 HB2 ASP A 50 -6.939 0.081 1.809 1.00 20.13 H ATOM 778 HB3 ASP A 50 -7.764 0.146 3.364 1.00 3.41 H ATOM 779 N TYR A 51 -7.423 3.552 4.504 1.00 62.24 N ATOM 780 CA TYR A 51 -7.741 4.051 5.837 1.00 40.52 C ATOM 781 C TYR A 51 -9.247 4.227 6.009 1.00 64.24 C ATOM 782 O TYR A 51 -9.861 5.080 5.369 1.00 41.12 O ATOM 783 CB TYR A 51 -7.029 5.382 6.088 1.00 21.31 C ATOM 784 CG TYR A 51 -7.198 5.902 7.498 1.00 34.33 C ATOM 785 CD1 TYR A 51 -7.093 5.050 8.591 1.00 73.54 C ATOM 786 CD2 TYR A 51 -7.461 7.244 7.737 1.00 0.32 C ATOM 787 CE1 TYR A 51 -7.248 5.521 9.880 1.00 23.33 C ATOM 788 CE2 TYR A 51 -7.615 7.725 9.024 1.00 74.43 C ATOM 789 CZ TYR A 51 -7.509 6.858 10.092 1.00 21.13 C ATOM 790 OH TYR A 51 -7.662 7.331 11.376 1.00 60.54 O ATOM 791 H TYR A 51 -7.542 4.144 3.732 1.00 62.52 H ATOM 792 HA TYR A 51 -7.390 3.325 6.555 1.00 61.01 H ATOM 793 HB2 TYR A 51 -5.973 5.258 5.906 1.00 63.52 H ATOM 794 HB3 TYR A 51 -7.422 6.126 5.411 1.00 4.24 H ATOM 795 HD1 TYR A 51 -6.889 4.003 8.422 1.00 64.10 H ATOM 796 HD2 TYR A 51 -7.545 7.921 6.899 1.00 31.13 H ATOM 797 HE1 TYR A 51 -7.164 4.842 10.717 1.00 4.20 H ATOM 798 HE2 TYR A 51 -7.821 8.771 9.190 1.00 3.42 H ATOM 799 HH TYR A 51 -6.983 6.952 11.938 1.00 32.23 H ATOM 800 N CYS A 52 -9.835 3.411 6.878 1.00 42.21 N ATOM 801 CA CYS A 52 -11.268 3.474 7.136 1.00 53.44 C ATOM 802 C CYS A 52 -11.552 4.182 8.458 1.00 73.45 C ATOM 803 O CYS A 52 -10.982 3.837 9.493 1.00 74.33 O ATOM 804 CB CYS A 52 -11.865 2.066 7.160 1.00 23.41 C ATOM 805 SG CYS A 52 -11.887 1.239 5.538 1.00 53.31 S ATOM 806 H CYS A 52 -9.291 2.750 7.357 1.00 53.11 H ATOM 807 HA CYS A 52 -11.726 4.035 6.335 1.00 22.13 H ATOM 808 HB2 CYS A 52 -11.287 1.449 7.834 1.00 1.50 H ATOM 809 HB3 CYS A 52 -12.883 2.120 7.516 1.00 21.01 H