ATOM 1 N ALA A 1 1.851 0.279 0.777 1.00 1.00 N ATOM 2 CA ALA A 1 2.962 0.451 -0.141 1.00 1.00 C ATOM 3 C ALA A 1 2.499 1.269 -1.349 1.00 1.00 C ATOM 4 O ALA A 1 2.291 0.721 -2.430 1.00 1.00 O ATOM 5 CB ALA A 1 3.511 -0.920 -0.542 1.00 1.00 C ATOM 6 H1 ALA A 1 1.432 1.128 1.098 1.00 99.99 H ATOM 7 HA ALA A 1 3.743 1.003 0.382 1.00 99.99 H ATOM 8 HB1 ALA A 1 4.113 -1.322 0.273 1.00 99.99 H ATOM 9 HB2 ALA A 1 2.683 -1.596 -0.751 1.00 99.99 H ATOM 10 HB3 ALA A 1 4.130 -0.817 -1.434 1.00 99.99 H ATOM 11 N ASP A 2 2.349 2.566 -1.123 1.00 1.00 N ATOM 12 CA ASP A 2 1.914 3.464 -2.179 1.00 1.00 C ATOM 13 C ASP A 2 0.385 3.516 -2.200 1.00 1.00 C ATOM 14 O ASP A 2 -0.200 4.581 -2.395 1.00 1.00 O ATOM 15 CB ASP A 2 2.389 2.975 -3.549 1.00 1.00 C ATOM 16 CG ASP A 2 3.817 2.428 -3.582 1.00 1.00 C ATOM 17 OD1 ASP A 2 4.725 2.977 -2.939 1.00 1.00 O ATOM 18 OD2 ASP A 2 3.984 1.379 -4.314 1.00 1.00 O ATOM 19 H ASP A 2 2.520 3.003 -0.240 1.00 99.99 H ATOM 20 HA ASP A 2 2.362 4.428 -1.938 1.00 99.99 H ATOM 21 HB2 ASP A 2 1.710 2.196 -3.895 1.00 99.99 H ATOM 22 HB3 ASP A 2 2.315 3.799 -4.258 1.00 99.99 H ATOM 23 HD2 ASP A 2 4.588 0.731 -3.852 1.00 99.99 H ATOM 24 N ASP A 3 -0.218 2.355 -1.994 1.00 1.00 N ATOM 25 CA ASP A 3 -1.667 2.256 -1.988 1.00 1.00 C ATOM 26 C ASP A 3 -2.124 1.614 -0.675 1.00 1.00 C ATOM 27 O ASP A 3 -1.544 0.626 -0.228 1.00 1.00 O ATOM 28 CB ASP A 3 -2.166 1.379 -3.139 1.00 1.00 C ATOM 29 CG ASP A 3 -3.534 0.734 -2.915 1.00 1.00 C ATOM 30 OD1 ASP A 3 -4.466 1.374 -2.405 1.00 1.00 O ATOM 31 OD2 ASP A 3 -3.626 -0.495 -3.294 1.00 1.00 O ATOM 32 H ASP A 3 0.266 1.494 -1.837 1.00 99.99 H ATOM 33 HA ASP A 3 -2.025 3.279 -2.098 1.00 99.99 H ATOM 34 HB2 ASP A 3 -2.210 1.986 -4.044 1.00 99.99 H ATOM 35 HB3 ASP A 3 -1.434 0.591 -3.318 1.00 99.99 H ATOM 36 HD2 ASP A 3 -4.065 -1.041 -2.580 1.00 99.99 H ATOM 37 N ILE A 4 -3.158 2.205 -0.093 1.00 1.00 N ATOM 38 CA ILE A 4 -3.697 1.704 1.159 1.00 1.00 C ATOM 39 C ILE A 4 -5.191 1.418 0.987 1.00 1.00 C ATOM 40 O ILE A 4 -5.986 2.339 0.809 1.00 1.00 O ATOM 41 CB ILE A 4 -3.385 2.671 2.302 1.00 1.00 C ATOM 42 CG1 ILE A 4 -1.876 2.870 2.455 1.00 1.00 C ATOM 43 CG2 ILE A 4 -4.036 2.207 3.607 1.00 1.00 C ATOM 44 CD1 ILE A 4 -1.525 3.351 3.865 1.00 1.00 C ATOM 45 H ILE A 4 -3.623 3.009 -0.462 1.00 99.99 H ATOM 46 HA ILE A 4 -3.190 0.766 1.382 1.00 99.99 H ATOM 47 HB ILE A 4 -3.814 3.642 2.056 1.00 99.99 H ATOM 48 HG12 ILE A 4 -1.359 1.933 2.247 1.00 99.99 H ATOM 49 HG23 ILE A 4 -3.913 2.978 4.369 1.00 99.99 H ATOM 50 HD11 ILE A 4 -1.579 2.512 4.558 1.00 99.99 H ATOM 51 N VAL A 5 -5.526 0.138 1.047 1.00 1.00 N ATOM 52 CA VAL A 5 -6.910 -0.281 0.900 1.00 1.00 C ATOM 53 C VAL A 5 -7.555 -0.387 2.283 1.00 1.00 C ATOM 54 O VAL A 5 -7.025 -1.055 3.170 1.00 1.00 O ATOM 55 CB VAL A 5 -6.980 -1.587 0.105 1.00 1.00 C ATOM 56 CG1 VAL A 5 -8.431 -2.027 -0.100 1.00 1.00 C ATOM 57 CG2 VAL A 5 -6.253 -1.453 -1.234 1.00 1.00 C ATOM 58 H VAL A 5 -4.873 -0.605 1.192 1.00 99.99 H ATOM 59 HA VAL A 5 -7.428 0.490 0.330 1.00 99.99 H ATOM 60 HB VAL A 5 -6.475 -2.359 0.685 1.00 99.99 H ATOM 61 HG13 VAL A 5 -8.940 -1.310 -0.744 1.00 99.99 H ATOM 62 HG21 VAL A 5 -6.909 -1.786 -2.038 1.00 99.99 H ATOM 63 N LEU A 6 -8.691 0.281 2.424 1.00 1.00 N ATOM 64 CA LEU A 6 -9.415 0.269 3.684 1.00 1.00 C ATOM 65 C LEU A 6 -10.632 -0.650 3.560 1.00 1.00 C ATOM 66 O LEU A 6 -11.652 -0.260 2.992 1.00 1.00 O ATOM 67 CB LEU A 6 -9.761 1.696 4.116 1.00 1.00 C ATOM 68 CG LEU A 6 -8.612 2.705 4.082 1.00 1.00 C ATOM 69 CD1 LEU A 6 -9.141 4.134 3.958 1.00 1.00 C ATOM 70 CD2 LEU A 6 -7.698 2.535 5.299 1.00 1.00 C ATOM 71 H LEU A 6 -9.116 0.821 1.698 1.00 99.99 H ATOM 72 HA LEU A 6 -8.747 -0.143 4.441 1.00 99.99 H ATOM 73 HB2 LEU A 6 -10.561 2.064 3.473 1.00 99.99 H ATOM 74 HB3 LEU A 6 -10.159 1.661 5.130 1.00 99.99 H ATOM 75 HG LEU A 6 -8.009 2.506 3.196 1.00 99.99 H ATOM 76 HD13 LEU A 6 -9.537 4.289 2.955 1.00 99.99 H ATOM 77 HD21 LEU A 6 -8.262 2.089 6.117 1.00 99.99 H ATOM 78 N LYS A 7 -10.485 -1.850 4.101 1.00 1.00 N ATOM 79 CA LYS A 7 -11.560 -2.827 4.057 1.00 1.00 C ATOM 80 C LYS A 7 -12.785 -2.262 4.779 1.00 1.00 C ATOM 81 O LYS A 7 -12.701 -1.879 5.945 1.00 1.00 O ATOM 82 CB LYS A 7 -11.085 -4.172 4.611 1.00 1.00 C ATOM 83 CG LYS A 7 -10.391 -4.997 3.526 1.00 1.00 C ATOM 84 CD LYS A 7 -11.006 -6.393 3.421 1.00 1.00 C ATOM 85 CE LYS A 7 -11.032 -6.874 1.969 1.00 1.00 C ATOM 86 NZ LYS A 7 -10.682 -8.310 1.892 1.00 1.00 N ATOM 87 H LYS A 7 -9.652 -2.158 4.560 1.00 99.99 H ATOM 88 HA LYS A 7 -11.818 -2.982 3.010 1.00 99.99 H ATOM 89 HB2 LYS A 7 -10.399 -4.005 5.441 1.00 99.99 H ATOM 90 HB3 LYS A 7 -11.936 -4.727 5.007 1.00 99.99 H ATOM 91 HG2 LYS A 7 -10.475 -4.486 2.566 1.00 99.99 H ATOM 92 HG3 LYS A 7 -9.327 -5.079 3.751 1.00 99.99 H ATOM 93 HD2 LYS A 7 -10.433 -7.094 4.029 1.00 99.99 H ATOM 94 HD3 LYS A 7 -12.020 -6.379 3.822 1.00 99.99 H ATOM 95 HE2 LYS A 7 -12.023 -6.711 1.544 1.00 99.99 H ATOM 96 HE3 LYS A 7 -10.331 -6.290 1.373 1.00 99.99 H ATOM 97 HZ1 LYS A 7 -11.346 -8.833 1.332 1.00 99.99 H ATOM 98 HZ2 LYS A 7 -9.769 -8.456 1.476 1.00 99.99 H ATOM 99 N ALA A 8 -13.895 -2.229 4.057 1.00 1.00 N ATOM 100 CA ALA A 8 -15.136 -1.718 4.614 1.00 1.00 C ATOM 101 C ALA A 8 -16.281 -2.669 4.258 1.00 1.00 C ATOM 102 O ALA A 8 -16.446 -3.037 3.096 1.00 1.00 O ATOM 103 CB ALA A 8 -15.379 -0.296 4.102 1.00 1.00 C ATOM 104 H ALA A 8 -13.955 -2.541 3.109 1.00 99.99 H ATOM 105 HA ALA A 8 -15.025 -1.687 5.697 1.00 99.99 H ATOM 106 HB1 ALA A 8 -15.183 0.417 4.903 1.00 99.99 H ATOM 107 HB2 ALA A 8 -14.712 -0.092 3.264 1.00 99.99 H ATOM 108 HB3 ALA A 8 -16.414 -0.200 3.775 1.00 99.99 H ATOM 109 N LYS A 9 -17.040 -3.039 5.278 1.00 1.00 N ATOM 110 CA LYS A 9 -18.163 -3.939 5.087 1.00 1.00 C ATOM 111 C LYS A 9 -19.132 -3.331 4.071 1.00 1.00 C ATOM 112 O LYS A 9 -19.880 -4.052 3.412 1.00 1.00 O ATOM 113 CB LYS A 9 -18.814 -4.277 6.429 1.00 1.00 C ATOM 114 CG LYS A 9 -18.229 -5.565 7.013 1.00 1.00 C ATOM 115 CD LYS A 9 -17.478 -5.285 8.317 1.00 1.00 C ATOM 116 CE LYS A 9 -18.165 -5.965 9.503 1.00 1.00 C ATOM 117 NZ LYS A 9 -19.015 -4.998 10.233 1.00 1.00 N ATOM 118 H LYS A 9 -16.898 -2.734 6.220 1.00 99.99 H ATOM 119 HA LYS A 9 -17.771 -4.869 4.676 1.00 99.99 H ATOM 120 HB2 LYS A 9 -18.663 -3.455 7.129 1.00 99.99 H ATOM 121 HB3 LYS A 9 -19.890 -4.389 6.299 1.00 99.99 H ATOM 122 HG2 LYS A 9 -19.029 -6.282 7.197 1.00 99.99 H ATOM 123 HG3 LYS A 9 -17.553 -6.021 6.291 1.00 99.99 H ATOM 124 HD2 LYS A 9 -16.452 -5.641 8.233 1.00 99.99 H ATOM 125 HD3 LYS A 9 -17.429 -4.209 8.488 1.00 99.99 H ATOM 126 HE2 LYS A 9 -18.772 -6.798 9.150 1.00 99.99 H ATOM 127 HE3 LYS A 9 -17.415 -6.380 10.176 1.00 99.99 H ATOM 128 HZ1 LYS A 9 -19.944 -4.929 9.830 1.00 99.99 H ATOM 129 HZ2 LYS A 9 -19.136 -5.257 11.206 1.00 99.99 H ATOM 130 N ASN A 10 -19.088 -2.010 3.976 1.00 1.00 N ATOM 131 CA ASN A 10 -19.952 -1.297 3.051 1.00 1.00 C ATOM 132 C ASN A 10 -19.106 -0.711 1.917 1.00 1.00 C ATOM 133 O ASN A 10 -19.095 0.501 1.710 1.00 1.00 O ATOM 134 CB ASN A 10 -20.672 -0.142 3.749 1.00 1.00 C ATOM 135 CG ASN A 10 -21.622 -0.661 4.830 1.00 1.00 C ATOM 136 OD1 ASN A 10 -21.488 -1.765 5.333 1.00 1.00 O ATOM 137 ND2 ASN A 10 -22.586 0.193 5.159 1.00 1.00 N ATOM 138 H ASN A 10 -18.477 -1.431 4.515 1.00 99.99 H ATOM 139 HA ASN A 10 -20.667 -2.039 2.696 1.00 99.99 H ATOM 140 HB2 ASN A 10 -19.939 0.531 4.196 1.00 99.99 H ATOM 141 HB3 ASN A 10 -21.232 0.439 3.016 1.00 99.99 H ATOM 142 HD21 ASN A 10 -23.257 -0.055 5.858 1.00 99.99 H ATOM 143 N GLY A 11 -18.419 -1.599 1.215 1.00 1.00 N ATOM 144 CA GLY A 11 -17.573 -1.186 0.108 1.00 1.00 C ATOM 145 C GLY A 11 -16.214 -0.697 0.611 1.00 1.00 C ATOM 146 O GLY A 11 -16.138 0.022 1.606 1.00 1.00 O ATOM 147 H GLY A 11 -18.435 -2.584 1.389 1.00 99.99 H ATOM 148 HA2 GLY A 11 -17.432 -2.021 -0.578 1.00 99.99 H ATOM 149 HA3 GLY A 11 -18.064 -0.391 -0.453 1.00 99.99 H ATOM 150 N ASP A 12 -15.174 -1.107 -0.100 1.00 1.00 N ATOM 151 CA ASP A 12 -13.820 -0.719 0.262 1.00 1.00 C ATOM 152 C ASP A 12 -13.562 0.713 -0.209 1.00 1.00 C ATOM 153 O ASP A 12 -14.398 1.309 -0.886 1.00 1.00 O ATOM 154 CB ASP A 12 -12.789 -1.630 -0.407 1.00 1.00 C ATOM 155 CG ASP A 12 -11.464 -1.769 0.345 1.00 1.00 C ATOM 156 OD1 ASP A 12 -11.157 -2.830 0.908 1.00 1.00 O ATOM 157 OD2 ASP A 12 -10.721 -0.714 0.339 1.00 1.00 O ATOM 158 H ASP A 12 -15.244 -1.691 -0.908 1.00 99.99 H ATOM 159 HA ASP A 12 -13.775 -0.817 1.346 1.00 99.99 H ATOM 160 HB2 ASP A 12 -13.227 -2.622 -0.528 1.00 99.99 H ATOM 161 HB3 ASP A 12 -12.584 -1.248 -1.407 1.00 99.99 H ATOM 162 HD2 ASP A 12 -10.693 -0.321 -0.579 1.00 99.99 H ATOM 163 N VAL A 13 -12.399 1.226 0.169 1.00 1.00 N ATOM 164 CA VAL A 13 -12.020 2.577 -0.206 1.00 1.00 C ATOM 165 C VAL A 13 -10.577 2.574 -0.715 1.00 1.00 C ATOM 166 O VAL A 13 -9.725 1.873 -0.171 1.00 1.00 O ATOM 167 CB VAL A 13 -12.236 3.528 0.973 1.00 1.00 C ATOM 168 CG1 VAL A 13 -11.532 4.865 0.735 1.00 1.00 C ATOM 169 CG2 VAL A 13 -13.728 3.733 1.244 1.00 1.00 C ATOM 170 H VAL A 13 -11.725 0.734 0.720 1.00 99.99 H ATOM 171 HA VAL A 13 -12.677 2.890 -1.017 1.00 99.99 H ATOM 172 HB VAL A 13 -11.795 3.070 1.858 1.00 99.99 H ATOM 173 HG13 VAL A 13 -11.601 5.129 -0.320 1.00 99.99 H ATOM 174 HG21 VAL A 13 -13.919 4.788 1.441 1.00 99.99 H ATOM 175 N LYS A 14 -10.348 3.367 -1.752 1.00 1.00 N ATOM 176 CA LYS A 14 -9.022 3.465 -2.339 1.00 1.00 C ATOM 177 C LYS A 14 -8.357 4.762 -1.875 1.00 1.00 C ATOM 178 O LYS A 14 -8.946 5.837 -1.979 1.00 1.00 O ATOM 179 CB LYS A 14 -9.099 3.324 -3.861 1.00 1.00 C ATOM 180 CG LYS A 14 -8.774 1.893 -4.296 1.00 1.00 C ATOM 181 CD LYS A 14 -7.443 1.428 -3.702 1.00 1.00 C ATOM 182 CE LYS A 14 -6.624 0.650 -4.734 1.00 1.00 C ATOM 183 NZ LYS A 14 -6.074 1.566 -5.757 1.00 1.00 N ATOM 184 H LYS A 14 -11.046 3.934 -2.187 1.00 99.99 H ATOM 185 HA LYS A 14 -8.437 2.624 -1.967 1.00 99.99 H ATOM 186 HB2 LYS A 14 -10.097 3.595 -4.205 1.00 99.99 H ATOM 187 HB3 LYS A 14 -8.402 4.018 -4.330 1.00 99.99 H ATOM 188 HG2 LYS A 14 -9.572 1.222 -3.978 1.00 99.99 H ATOM 189 HG3 LYS A 14 -8.729 1.841 -5.383 1.00 99.99 H ATOM 190 HD2 LYS A 14 -6.874 2.291 -3.357 1.00 99.99 H ATOM 191 HD3 LYS A 14 -7.628 0.800 -2.830 1.00 99.99 H ATOM 192 HE2 LYS A 14 -5.812 0.120 -4.237 1.00 99.99 H ATOM 193 HE3 LYS A 14 -7.251 -0.103 -5.211 1.00 99.99 H ATOM 194 HZ1 LYS A 14 -5.641 2.383 -5.342 1.00 99.99 H ATOM 195 HZ2 LYS A 14 -5.367 1.116 -6.329 1.00 99.99 H ATOM 196 N PHE A 15 -7.140 4.620 -1.373 1.00 1.00 N ATOM 197 CA PHE A 15 -6.388 5.767 -0.893 1.00 1.00 C ATOM 198 C PHE A 15 -4.896 5.607 -1.187 1.00 1.00 C ATOM 199 O PHE A 15 -4.206 4.761 -0.626 1.00 1.00 O ATOM 200 CB PHE A 15 -6.593 5.833 0.623 1.00 1.00 C ATOM 201 CG PHE A 15 -6.122 7.143 1.257 1.00 1.00 C ATOM 202 CD1 PHE A 15 -6.602 8.330 0.802 1.00 1.00 C ATOM 203 CD2 PHE A 15 -5.222 7.118 2.277 1.00 1.00 C ATOM 204 CE1 PHE A 15 -6.164 9.546 1.392 1.00 1.00 C ATOM 205 CE2 PHE A 15 -4.785 8.334 2.866 1.00 1.00 C ATOM 206 CZ PHE A 15 -5.265 9.522 2.411 1.00 1.00 C ATOM 207 H PHE A 15 -6.668 3.741 -1.292 1.00 99.99 H ATOM 208 HA PHE A 15 -6.769 6.644 -1.416 1.00 99.99 H ATOM 209 HB2 PHE A 15 -7.651 5.694 0.843 1.00 99.99 H ATOM 210 HB3 PHE A 15 -6.060 5.003 1.086 1.00 99.99 H ATOM 211 HD1 PHE A 15 -7.324 8.350 -0.015 1.00 99.99 H ATOM 212 HD2 PHE A 15 -4.836 6.166 2.642 1.00 99.99 H ATOM 213 HE1 PHE A 15 -6.550 10.498 1.028 1.00 99.99 H ATOM 214 HE2 PHE A 15 -4.063 8.314 3.684 1.00 99.99 H ATOM 215 HZ PHE A 15 -4.929 10.454 2.865 1.00 99.99 H ATOM 216 N PRO A 16 -4.407 6.455 -2.097 1.00 1.00 N ATOM 217 CA PRO A 16 -3.025 6.483 -2.526 1.00 1.00 C ATOM 218 C PRO A 16 -2.202 7.304 -1.543 1.00 1.00 C ATOM 219 O PRO A 16 -2.029 8.502 -1.759 1.00 1.00 O ATOM 220 CB PRO A 16 -3.056 7.146 -3.901 1.00 1.00 C ATOM 221 CG PRO A 16 -4.222 8.116 -3.762 1.00 1.00 C ATOM 222 CD PRO A 16 -5.190 7.464 -2.777 1.00 1.00 C ATOM 223 HA PRO A 16 -2.617 5.475 -2.598 1.00 99.99 H ATOM 224 HB2 PRO A 16 -2.142 7.701 -4.114 1.00 99.99 H ATOM 225 HB3 PRO A 16 -3.231 6.385 -4.662 1.00 99.99 H ATOM 226 HG2 PRO A 16 -4.232 9.195 -3.615 1.00 99.99 H ATOM 227 HG3 PRO A 16 -4.454 7.865 -4.797 1.00 99.99 H ATOM 228 HD2 PRO A 16 -5.588 8.201 -2.079 1.00 99.99 H ATOM 229 HD3 PRO A 16 -6.000 6.979 -3.321 1.00 99.99 H ATOM 230 N HIS A 17 -1.712 6.655 -0.486 1.00 1.00 N ATOM 231 CA HIS A 17 -0.908 7.309 0.541 1.00 1.00 C ATOM 232 C HIS A 17 0.177 8.177 -0.123 1.00 1.00 C ATOM 233 O HIS A 17 0.276 9.369 0.163 1.00 1.00 O ATOM 234 CB HIS A 17 -0.363 6.240 1.500 1.00 1.00 C ATOM 235 CG HIS A 17 0.268 6.735 2.781 1.00 1.00 C ATOM 236 ND1 HIS A 17 1.590 6.872 2.925 1.00 1.00 N ATOM 237 CD2 HIS A 17 -0.289 7.123 3.975 1.00 1.00 C ATOM 238 CE1 HIS A 17 1.846 7.327 4.162 1.00 1.00 C ATOM 239 NE2 HIS A 17 0.721 7.500 4.853 1.00 1.00 N ATOM 240 H HIS A 17 -1.907 5.669 -0.390 1.00 99.99 H ATOM 241 HA HIS A 17 -1.575 7.983 1.123 1.00 99.99 H ATOM 242 HB2 HIS A 17 -1.209 5.569 1.780 1.00 99.99 H ATOM 243 HB3 HIS A 17 0.406 5.649 0.951 1.00 99.99 H ATOM 244 HD1 HIS A 17 2.272 6.659 2.199 1.00 99.99 H ATOM 245 HD2 HIS A 17 -1.366 7.133 4.201 1.00 99.99 H ATOM 246 HE1 HIS A 17 2.855 7.531 4.554 1.00 99.99 H ATOM 247 N LYS A 18 0.956 7.546 -0.990 1.00 1.00 N ATOM 248 CA LYS A 18 2.019 8.247 -1.689 1.00 1.00 C ATOM 249 C LYS A 18 1.489 9.586 -2.205 1.00 1.00 C ATOM 250 O LYS A 18 2.212 10.580 -2.220 1.00 1.00 O ATOM 251 CB LYS A 18 2.618 7.360 -2.782 1.00 1.00 C ATOM 252 CG LYS A 18 3.820 8.039 -3.442 1.00 1.00 C ATOM 253 CD LYS A 18 4.235 7.300 -4.716 1.00 1.00 C ATOM 254 CE LYS A 18 4.464 8.281 -5.868 1.00 1.00 C ATOM 255 NZ LYS A 18 3.510 8.019 -6.969 1.00 1.00 N ATOM 256 H LYS A 18 0.869 6.576 -1.216 1.00 99.99 H ATOM 257 HA LYS A 18 2.811 8.445 -0.965 1.00 99.99 H ATOM 258 HB2 LYS A 18 2.926 6.405 -2.354 1.00 99.99 H ATOM 259 HB3 LYS A 18 1.861 7.142 -3.534 1.00 99.99 H ATOM 260 HG2 LYS A 18 3.572 9.072 -3.681 1.00 99.99 H ATOM 261 HG3 LYS A 18 4.657 8.065 -2.744 1.00 99.99 H ATOM 262 HD2 LYS A 18 5.147 6.732 -4.531 1.00 99.99 H ATOM 263 HD3 LYS A 18 3.463 6.583 -4.992 1.00 99.99 H ATOM 264 HE2 LYS A 18 4.346 9.304 -5.511 1.00 99.99 H ATOM 265 HE3 LYS A 18 5.487 8.187 -6.236 1.00 99.99 H ATOM 266 HZ1 LYS A 18 3.512 8.763 -7.658 1.00 99.99 H ATOM 267 HZ2 LYS A 18 3.726 7.161 -7.463 1.00 99.99 H ATOM 268 N ALA A 19 0.229 9.568 -2.616 1.00 1.00 N ATOM 269 CA ALA A 19 -0.406 10.768 -3.132 1.00 1.00 C ATOM 270 C ALA A 19 -0.642 11.749 -1.982 1.00 1.00 C ATOM 271 O ALA A 19 -0.338 12.936 -2.094 1.00 1.00 O ATOM 272 CB ALA A 19 -1.704 10.389 -3.851 1.00 1.00 C ATOM 273 H ALA A 19 -0.352 8.755 -2.600 1.00 99.99 H ATOM 274 HA ALA A 19 0.275 11.221 -3.852 1.00 99.99 H ATOM 275 HB1 ALA A 19 -2.473 10.160 -3.114 1.00 99.99 H ATOM 276 HB2 ALA A 19 -2.031 11.224 -4.471 1.00 99.99 H ATOM 277 HB3 ALA A 19 -1.529 9.516 -4.479 1.00 99.99 H ATOM 278 N HIS A 20 -1.189 11.216 -0.889 1.00 1.00 N ATOM 279 CA HIS A 20 -1.488 11.995 0.308 1.00 1.00 C ATOM 280 C HIS A 20 -0.235 12.083 1.198 1.00 1.00 C ATOM 281 O HIS A 20 -0.348 12.278 2.407 1.00 1.00 O ATOM 282 CB HIS A 20 -2.716 11.388 1.002 1.00 1.00 C ATOM 283 CG HIS A 20 -4.070 11.824 0.493 1.00 1.00 C ATOM 284 ND1 HIS A 20 -4.417 11.735 -0.795 1.00 1.00 N ATOM 285 CD2 HIS A 20 -5.155 12.359 1.145 1.00 1.00 C ATOM 286 CE1 HIS A 20 -5.670 12.196 -0.939 1.00 1.00 C ATOM 287 NE2 HIS A 20 -6.172 12.593 0.228 1.00 1.00 N ATOM 288 H HIS A 20 -1.408 10.230 -0.889 1.00 99.99 H ATOM 289 HA HIS A 20 -1.752 13.028 -0.013 1.00 99.99 H ATOM 290 HB2 HIS A 20 -2.657 10.280 0.894 1.00 99.99 H ATOM 291 HB3 HIS A 20 -2.661 11.652 2.083 1.00 99.99 H ATOM 292 HD1 HIS A 20 -3.811 11.373 -1.529 1.00 99.99 H ATOM 293 HD2 HIS A 20 -5.209 12.568 2.225 1.00 99.99 H ATOM 294 HE1 HIS A 20 -6.212 12.238 -1.897 1.00 99.99 H ATOM 295 N GLN A 21 0.921 11.936 0.566 1.00 1.00 N ATOM 296 CA GLN A 21 2.181 11.997 1.287 1.00 1.00 C ATOM 297 C GLN A 21 3.014 13.184 0.799 1.00 1.00 C ATOM 298 O GLN A 21 4.190 13.305 1.142 1.00 1.00 O ATOM 299 CB GLN A 21 2.958 10.687 1.146 1.00 1.00 C ATOM 300 CG GLN A 21 3.942 10.506 2.304 1.00 1.00 C ATOM 301 CD GLN A 21 4.461 9.068 2.362 1.00 1.00 C ATOM 302 OE1 GLN A 21 3.735 8.129 2.647 1.00 1.00 O ATOM 303 NE2 GLN A 21 5.754 8.949 2.076 1.00 1.00 N ATOM 304 H GLN A 21 1.003 11.778 -0.418 1.00 99.99 H ATOM 305 HA GLN A 21 1.909 12.141 2.333 1.00 99.99 H ATOM 306 HB2 GLN A 21 2.262 9.849 1.120 1.00 99.99 H ATOM 307 HB3 GLN A 21 3.500 10.681 0.200 1.00 99.99 H ATOM 308 HG2 GLN A 21 4.778 11.194 2.185 1.00 99.99 H ATOM 309 HG3 GLN A 21 3.452 10.758 3.244 1.00 99.99 H ATOM 310 HE21 GLN A 21 6.187 8.047 2.088 1.00 99.99 H ATOM 311 N LYS A 22 2.373 14.030 0.006 1.00 1.00 N ATOM 312 CA LYS A 22 3.039 15.204 -0.532 1.00 1.00 C ATOM 313 C LYS A 22 1.992 16.256 -0.902 1.00 1.00 C ATOM 314 O LYS A 22 2.236 17.105 -1.759 1.00 1.00 O ATOM 315 CB LYS A 22 3.956 14.813 -1.693 1.00 1.00 C ATOM 316 CG LYS A 22 4.812 16.000 -2.140 1.00 1.00 C ATOM 317 CD LYS A 22 6.299 15.715 -1.926 1.00 1.00 C ATOM 318 CE LYS A 22 7.039 16.974 -1.469 1.00 1.00 C ATOM 319 NZ LYS A 22 8.495 16.721 -1.393 1.00 1.00 N ATOM 320 H LYS A 22 1.417 13.925 -0.268 1.00 99.99 H ATOM 321 HA LYS A 22 3.674 15.610 0.256 1.00 99.99 H ATOM 322 HB2 LYS A 22 4.601 13.989 -1.391 1.00 99.99 H ATOM 323 HB3 LYS A 22 3.356 14.457 -2.531 1.00 99.99 H ATOM 324 HG2 LYS A 22 4.625 16.211 -3.193 1.00 99.99 H ATOM 325 HG3 LYS A 22 4.524 16.891 -1.581 1.00 99.99 H ATOM 326 HD2 LYS A 22 6.419 14.928 -1.181 1.00 99.99 H ATOM 327 HD3 LYS A 22 6.741 15.346 -2.852 1.00 99.99 H ATOM 328 HE2 LYS A 22 6.841 17.792 -2.163 1.00 99.99 H ATOM 329 HE3 LYS A 22 6.667 17.287 -0.493 1.00 99.99 H ATOM 330 HZ1 LYS A 22 8.825 16.685 -0.435 1.00 99.99 H ATOM 331 HZ2 LYS A 22 8.751 15.840 -1.825 1.00 99.99 H ATOM 332 N ALA A 23 0.849 16.166 -0.239 1.00 1.00 N ATOM 333 CA ALA A 23 -0.236 17.100 -0.487 1.00 1.00 C ATOM 334 C ALA A 23 -0.764 17.628 0.848 1.00 1.00 C ATOM 335 O ALA A 23 -1.902 18.087 0.931 1.00 1.00 O ATOM 336 CB ALA A 23 -1.324 16.410 -1.312 1.00 1.00 C ATOM 337 H ALA A 23 0.659 15.473 0.457 1.00 99.99 H ATOM 338 HA ALA A 23 0.167 17.932 -1.064 1.00 99.99 H ATOM 339 HB1 ALA A 23 -1.046 16.425 -2.366 1.00 99.99 H ATOM 340 HB2 ALA A 23 -1.433 15.378 -0.979 1.00 99.99 H ATOM 341 HB3 ALA A 23 -2.270 16.935 -1.178 1.00 99.99 H ATOM 342 N VAL A 24 0.088 17.546 1.859 1.00 1.00 N ATOM 343 CA VAL A 24 -0.278 18.011 3.186 1.00 1.00 C ATOM 344 C VAL A 24 0.962 18.565 3.889 1.00 1.00 C ATOM 345 O VAL A 24 1.742 17.841 4.504 1.00 1.00 O ATOM 346 CB VAL A 24 -0.954 16.882 3.968 1.00 1.00 C ATOM 347 CG1 VAL A 24 -1.049 17.227 5.455 1.00 1.00 C ATOM 348 CG2 VAL A 24 -2.333 16.564 3.389 1.00 1.00 C ATOM 349 H VAL A 24 1.012 17.171 1.783 1.00 99.99 H ATOM 350 HA VAL A 24 -1.002 18.817 3.065 1.00 99.99 H ATOM 351 HB VAL A 24 -0.335 15.990 3.870 1.00 99.99 H ATOM 352 HG13 VAL A 24 -1.754 18.046 5.594 1.00 99.99 H ATOM 353 HG21 VAL A 24 -2.893 15.954 4.098 1.00 99.99 H ATOM 354 N PRO A 25 1.131 19.885 3.780 1.00 1.00 N ATOM 355 CA PRO A 25 2.232 20.619 4.366 1.00 1.00 C ATOM 356 C PRO A 25 2.592 20.008 5.713 1.00 1.00 C ATOM 357 O PRO A 25 3.753 19.652 5.912 1.00 1.00 O ATOM 358 CB PRO A 25 1.708 22.043 4.533 1.00 1.00 C ATOM 359 CG PRO A 25 0.835 22.160 3.229 1.00 1.00 C ATOM 360 CD PRO A 25 0.234 20.766 3.064 1.00 1.00 C ATOM 361 HA PRO A 25 3.102 20.608 3.710 1.00 99.99 H ATOM 362 HB2 PRO A 25 1.165 22.178 5.468 1.00 99.99 H ATOM 363 HB3 PRO A 25 2.542 22.742 4.468 1.00 99.99 H ATOM 364 HG2 PRO A 25 0.079 22.831 3.638 1.00 99.99 H ATOM 365 HG3 PRO A 25 1.234 22.553 2.295 1.00 99.99 H ATOM 366 HD2 PRO A 25 -0.776 20.728 3.471 1.00 99.99 H ATOM 367 HD3 PRO A 25 0.229 20.489 2.010 1.00 99.99 H ATOM 368 N ASP A 26 1.613 19.903 6.599 1.00 1.00 N ATOM 369 CA ASP A 26 1.851 19.336 7.915 1.00 1.00 C ATOM 370 C ASP A 26 1.213 17.948 7.991 1.00 1.00 C ATOM 371 O ASP A 26 0.225 17.754 8.699 1.00 1.00 O ATOM 372 CB ASP A 26 1.229 20.204 9.010 1.00 1.00 C ATOM 373 CG ASP A 26 1.872 20.063 10.390 1.00 1.00 C ATOM 374 OD1 ASP A 26 2.830 19.299 10.574 1.00 1.00 O ATOM 375 OD2 ASP A 26 1.341 20.789 11.316 1.00 1.00 O ATOM 376 H ASP A 26 0.672 20.196 6.429 1.00 99.99 H ATOM 377 HA ASP A 26 2.936 19.302 8.020 1.00 99.99 H ATOM 378 HB2 ASP A 26 1.289 21.248 8.703 1.00 99.99 H ATOM 379 HB3 ASP A 26 0.171 19.956 9.091 1.00 99.99 H ATOM 380 HD2 ASP A 26 1.208 21.723 10.984 1.00 99.99 H ATOM 381 N CYS A 27 1.802 17.019 7.254 1.00 1.00 N ATOM 382 CA CYS A 27 1.302 15.655 7.229 1.00 1.00 C ATOM 383 C CYS A 27 0.988 15.232 8.665 1.00 1.00 C ATOM 384 O CYS A 27 0.118 14.393 8.893 1.00 1.00 O ATOM 385 CB CYS A 27 2.293 14.702 6.557 1.00 1.00 C ATOM 386 SG CYS A 27 2.879 13.330 7.618 1.00 1.00 S ATOM 387 H CYS A 27 2.604 17.185 6.682 1.00 99.99 H ATOM 388 HA CYS A 27 0.397 15.663 6.622 1.00 99.99 H ATOM 389 HB2 CYS A 27 1.823 14.279 5.669 1.00 99.99 H ATOM 390 HB3 CYS A 27 3.156 15.275 6.220 1.00 99.99 H ATOM 391 N LYS A 28 1.715 15.832 9.597 1.00 1.00 N ATOM 392 CA LYS A 28 1.524 15.529 11.005 1.00 1.00 C ATOM 393 C LYS A 28 0.037 15.634 11.349 1.00 1.00 C ATOM 394 O LYS A 28 -0.424 15.033 12.318 1.00 1.00 O ATOM 395 CB LYS A 28 2.419 16.418 11.870 1.00 1.00 C ATOM 396 CG LYS A 28 1.583 17.382 12.714 1.00 1.00 C ATOM 397 CD LYS A 28 2.478 18.263 13.588 1.00 1.00 C ATOM 398 CE LYS A 28 1.990 18.273 15.038 1.00 1.00 C ATOM 399 NZ LYS A 28 3.135 18.366 15.970 1.00 1.00 N ATOM 400 H LYS A 28 2.420 16.514 9.403 1.00 99.99 H ATOM 401 HA LYS A 28 1.844 14.499 11.163 1.00 99.99 H ATOM 402 HB2 LYS A 28 3.034 15.797 12.523 1.00 99.99 H ATOM 403 HB3 LYS A 28 3.101 16.982 11.235 1.00 99.99 H ATOM 404 HG2 LYS A 28 0.976 18.008 12.062 1.00 99.99 H ATOM 405 HG3 LYS A 28 0.896 16.818 13.345 1.00 99.99 H ATOM 406 HD2 LYS A 28 3.504 17.898 13.549 1.00 99.99 H ATOM 407 HD3 LYS A 28 2.487 19.280 13.197 1.00 99.99 H ATOM 408 HE2 LYS A 28 1.315 19.115 15.196 1.00 99.99 H ATOM 409 HE3 LYS A 28 1.420 17.367 15.242 1.00 99.99 H ATOM 410 HZ1 LYS A 28 3.673 17.507 15.999 1.00 99.99 H ATOM 411 HZ2 LYS A 28 3.778 19.107 15.710 1.00 99.99 H ATOM 412 N LYS A 29 -0.673 16.402 10.535 1.00 1.00 N ATOM 413 CA LYS A 29 -2.098 16.592 10.741 1.00 1.00 C ATOM 414 C LYS A 29 -2.728 15.271 11.185 1.00 1.00 C ATOM 415 O LYS A 29 -3.382 15.208 12.224 1.00 1.00 O ATOM 416 CB LYS A 29 -2.745 17.193 9.491 1.00 1.00 C ATOM 417 CG LYS A 29 -4.116 17.789 9.814 1.00 1.00 C ATOM 418 CD LYS A 29 -4.013 19.296 10.062 1.00 1.00 C ATOM 419 CE LYS A 29 -4.044 20.071 8.743 1.00 1.00 C ATOM 420 NZ LYS A 29 -3.759 21.505 8.979 1.00 1.00 N ATOM 421 H LYS A 29 -0.291 16.888 9.749 1.00 99.99 H ATOM 422 HA LYS A 29 -2.218 17.319 11.546 1.00 99.99 H ATOM 423 HB2 LYS A 29 -2.096 17.964 9.076 1.00 99.99 H ATOM 424 HB3 LYS A 29 -2.851 16.422 8.727 1.00 99.99 H ATOM 425 HG2 LYS A 29 -4.803 17.599 8.990 1.00 99.99 H ATOM 426 HG3 LYS A 29 -4.531 17.300 10.695 1.00 99.99 H ATOM 427 HD2 LYS A 29 -4.838 19.620 10.697 1.00 99.99 H ATOM 428 HD3 LYS A 29 -3.092 19.517 10.598 1.00 99.99 H ATOM 429 HE2 LYS A 29 -3.308 19.656 8.054 1.00 99.99 H ATOM 430 HE3 LYS A 29 -5.020 19.961 8.273 1.00 99.99 H ATOM 431 HZ1 LYS A 29 -4.414 21.920 9.632 1.00 99.99 H ATOM 432 HZ2 LYS A 29 -2.831 21.649 9.361 1.00 99.99 H ATOM 433 N CYS A 30 -2.507 14.246 10.374 1.00 1.00 N ATOM 434 CA CYS A 30 -3.044 12.929 10.670 1.00 1.00 C ATOM 435 C CYS A 30 -2.154 12.274 11.728 1.00 1.00 C ATOM 436 O CYS A 30 -2.630 11.854 12.780 1.00 1.00 O ATOM 437 CB CYS A 30 -3.160 12.069 9.410 1.00 1.00 C ATOM 438 SG CYS A 30 -3.581 13.120 7.971 1.00 1.00 S ATOM 439 H CYS A 30 -1.973 14.305 9.530 1.00 99.99 H ATOM 440 HA CYS A 30 -4.053 13.081 11.054 1.00 99.99 H ATOM 441 HB2 CYS A 30 -2.219 11.548 9.227 1.00 99.99 H ATOM 442 HB3 CYS A 30 -3.926 11.306 9.549 1.00 99.99 H ATOM 443 N HIS A 31 -0.861 12.203 11.411 1.00 1.00 N ATOM 444 CA HIS A 31 0.140 11.612 12.293 1.00 1.00 C ATOM 445 C HIS A 31 0.631 12.666 13.303 1.00 1.00 C ATOM 446 O HIS A 31 1.833 12.903 13.414 1.00 1.00 O ATOM 447 CB HIS A 31 1.253 10.991 11.436 1.00 1.00 C ATOM 448 CG HIS A 31 0.827 9.985 10.392 1.00 1.00 C ATOM 449 ND1 HIS A 31 -0.009 8.977 10.663 1.00 1.00 N ATOM 450 CD2 HIS A 31 1.150 9.866 9.062 1.00 1.00 C ATOM 451 CE1 HIS A 31 -0.198 8.259 9.545 1.00 1.00 C ATOM 452 NE2 HIS A 31 0.494 8.764 8.527 1.00 1.00 N ATOM 453 H HIS A 31 -0.559 12.574 10.520 1.00 99.99 H ATOM 454 HA HIS A 31 -0.349 10.792 12.865 1.00 99.99 H ATOM 455 HB2 HIS A 31 1.780 11.819 10.909 1.00 99.99 H ATOM 456 HB3 HIS A 31 1.968 10.482 12.122 1.00 99.99 H ATOM 457 HD1 HIS A 31 -0.421 8.804 11.578 1.00 99.99 H ATOM 458 HD2 HIS A 31 1.822 10.539 8.508 1.00 99.99 H ATOM 459 HE1 HIS A 31 -0.842 7.367 9.480 1.00 99.99 H ATOM 460 N GLU A 32 -0.320 13.263 14.006 1.00 1.00 N ATOM 461 CA GLU A 32 0.005 14.277 14.994 1.00 1.00 C ATOM 462 C GLU A 32 1.029 13.735 15.993 1.00 1.00 C ATOM 463 O GLU A 32 2.063 14.359 16.229 1.00 1.00 O ATOM 464 CB GLU A 32 -1.255 14.768 15.711 1.00 1.00 C ATOM 465 CG GLU A 32 -1.865 15.969 14.986 1.00 1.00 C ATOM 466 CD GLU A 32 -3.219 16.345 15.593 1.00 1.00 C ATOM 467 OE1 GLU A 32 -3.789 15.563 16.368 1.00 1.00 O ATOM 468 OE2 GLU A 32 -3.676 17.496 15.233 1.00 1.00 O ATOM 469 H GLU A 32 -1.295 13.065 13.908 1.00 99.99 H ATOM 470 HA GLU A 32 0.440 15.102 14.430 1.00 99.99 H ATOM 471 HB2 GLU A 32 -1.984 13.960 15.765 1.00 99.99 H ATOM 472 HB3 GLU A 32 -1.009 15.044 16.737 1.00 99.99 H ATOM 473 HG2 GLU A 32 -1.187 16.819 15.047 1.00 99.99 H ATOM 474 HG3 GLU A 32 -1.989 15.735 13.929 1.00 99.99 H ATOM 475 HE2 GLU A 32 -4.624 17.407 14.926 1.00 99.99 H ATOM 476 N LYS A 33 0.705 12.579 16.555 1.00 1.00 N ATOM 477 CA LYS A 33 1.585 11.946 17.524 1.00 1.00 C ATOM 478 C LYS A 33 2.788 11.344 16.796 1.00 1.00 C ATOM 479 O LYS A 33 3.917 11.796 16.977 1.00 1.00 O ATOM 480 CB LYS A 33 0.809 10.936 18.371 1.00 1.00 C ATOM 481 CG LYS A 33 0.236 11.598 19.625 1.00 1.00 C ATOM 482 CD LYS A 33 1.327 11.819 20.675 1.00 1.00 C ATOM 483 CE LYS A 33 1.816 10.487 21.246 1.00 1.00 C ATOM 484 NZ LYS A 33 3.156 10.154 20.711 1.00 1.00 N ATOM 485 H LYS A 33 -0.138 12.079 16.358 1.00 99.99 H ATOM 486 HA LYS A 33 1.942 12.724 18.198 1.00 99.99 H ATOM 487 HB2 LYS A 33 -0.001 10.506 17.780 1.00 99.99 H ATOM 488 HB3 LYS A 33 1.466 10.115 18.656 1.00 99.99 H ATOM 489 HG2 LYS A 33 -0.220 12.551 19.361 1.00 99.99 H ATOM 490 HG3 LYS A 33 -0.553 10.972 20.043 1.00 99.99 H ATOM 491 HD2 LYS A 33 2.163 12.356 20.228 1.00 99.99 H ATOM 492 HD3 LYS A 33 0.939 12.444 21.480 1.00 99.99 H ATOM 493 HE2 LYS A 33 1.857 10.544 22.335 1.00 99.99 H ATOM 494 HE3 LYS A 33 1.111 9.695 20.995 1.00 99.99 H ATOM 495 HZ1 LYS A 33 3.483 9.254 21.042 1.00 99.99 H ATOM 496 HZ2 LYS A 33 3.159 10.115 19.698 1.00 99.99 H ATOM 497 N GLY A 34 2.505 10.332 15.989 1.00 1.00 N ATOM 498 CA GLY A 34 3.551 9.663 15.233 1.00 1.00 C ATOM 499 C GLY A 34 2.953 8.719 14.187 1.00 1.00 C ATOM 500 O GLY A 34 1.740 8.568 14.062 1.00 1.00 O ATOM 501 H GLY A 34 1.584 9.970 15.847 1.00 99.99 H ATOM 502 HA2 GLY A 34 4.180 10.404 14.742 1.00 99.99 H ATOM 503 HA3 GLY A 34 4.191 9.099 15.912 1.00 99.99 H ATOM 504 N PRO A 35 3.845 8.078 13.430 1.00 1.00 N ATOM 505 CA PRO A 35 3.504 7.139 12.383 1.00 1.00 C ATOM 506 C PRO A 35 3.246 5.769 12.992 1.00 1.00 C ATOM 507 O PRO A 35 3.564 5.569 14.163 1.00 1.00 O ATOM 508 CB PRO A 35 4.726 7.111 11.467 1.00 1.00 C ATOM 509 CG PRO A 35 5.807 8.159 12.119 1.00 1.00 C ATOM 510 CD PRO A 35 5.279 8.232 13.551 1.00 1.00 C ATOM 511 HA PRO A 35 2.624 7.471 11.832 1.00 99.99 H ATOM 512 HB2 PRO A 35 5.187 6.125 11.423 1.00 99.99 H ATOM 513 HB3 PRO A 35 4.436 7.447 10.471 1.00 99.99 H ATOM 514 HG2 PRO A 35 6.886 8.305 12.126 1.00 99.99 H ATOM 515 HG3 PRO A 35 5.322 8.882 11.463 1.00 99.99 H ATOM 516 HD2 PRO A 35 5.717 7.445 14.166 1.00 99.99 H ATOM 517 HD3 PRO A 35 5.499 9.211 13.975 1.00 99.99 H ATOM 518 N GLY A 36 2.684 4.865 12.202 1.00 1.00 N ATOM 519 CA GLY A 36 2.394 3.526 12.685 1.00 1.00 C ATOM 520 C GLY A 36 0.885 3.276 12.737 1.00 1.00 C ATOM 521 O GLY A 36 0.094 4.209 12.611 1.00 1.00 O ATOM 522 H GLY A 36 2.429 5.036 11.251 1.00 99.99 H ATOM 523 HA2 GLY A 36 2.866 2.790 12.034 1.00 99.99 H ATOM 524 HA3 GLY A 36 2.822 3.393 13.679 1.00 99.99 H ATOM 525 N LYS A 37 0.533 2.012 12.920 1.00 1.00 N ATOM 526 CA LYS A 37 -0.867 1.628 12.989 1.00 1.00 C ATOM 527 C LYS A 37 -1.632 2.655 13.826 1.00 1.00 C ATOM 528 O LYS A 37 -1.574 2.627 15.055 1.00 1.00 O ATOM 529 CB LYS A 37 -1.004 0.192 13.500 1.00 1.00 C ATOM 530 CG LYS A 37 -0.238 0.001 14.811 1.00 1.00 C ATOM 531 CD LYS A 37 1.188 -0.485 14.546 1.00 1.00 C ATOM 532 CE LYS A 37 1.548 -1.655 15.464 1.00 1.00 C ATOM 533 NZ LYS A 37 2.169 -2.751 14.688 1.00 1.00 N ATOM 534 H LYS A 37 1.183 1.259 13.021 1.00 99.99 H ATOM 535 HA LYS A 37 -1.261 1.648 11.973 1.00 99.99 H ATOM 536 HB2 LYS A 37 -2.057 -0.044 13.652 1.00 99.99 H ATOM 537 HB3 LYS A 37 -0.627 -0.502 12.750 1.00 99.99 H ATOM 538 HG2 LYS A 37 -0.210 0.943 15.360 1.00 99.99 H ATOM 539 HG3 LYS A 37 -0.761 -0.719 15.440 1.00 99.99 H ATOM 540 HD2 LYS A 37 1.284 -0.792 13.504 1.00 99.99 H ATOM 541 HD3 LYS A 37 1.890 0.334 14.703 1.00 99.99 H ATOM 542 HE2 LYS A 37 2.234 -1.318 16.241 1.00 99.99 H ATOM 543 HE3 LYS A 37 0.651 -2.019 15.966 1.00 99.99 H ATOM 544 HZ1 LYS A 37 1.480 -3.417 14.353 1.00 99.99 H ATOM 545 HZ2 LYS A 37 2.665 -2.406 13.873 1.00 99.99 H ATOM 546 N ILE A 38 -2.332 3.537 13.128 1.00 1.00 N ATOM 547 CA ILE A 38 -3.109 4.570 13.793 1.00 1.00 C ATOM 548 C ILE A 38 -3.971 3.933 14.883 1.00 1.00 C ATOM 549 O ILE A 38 -4.630 2.921 14.647 1.00 1.00 O ATOM 550 CB ILE A 38 -3.909 5.379 12.770 1.00 1.00 C ATOM 551 CG1 ILE A 38 -2.979 6.157 11.836 1.00 1.00 C ATOM 552 CG2 ILE A 38 -4.919 6.295 13.465 1.00 1.00 C ATOM 553 CD1 ILE A 38 -3.778 7.044 10.880 1.00 1.00 C ATOM 554 H ILE A 38 -2.374 3.552 12.129 1.00 99.99 H ATOM 555 HA ILE A 38 -2.404 5.255 14.265 1.00 99.99 H ATOM 556 HB ILE A 38 -4.476 4.683 12.152 1.00 99.99 H ATOM 557 HG12 ILE A 38 -2.297 6.770 12.424 1.00 99.99 H ATOM 558 HG23 ILE A 38 -4.593 6.486 14.487 1.00 99.99 H ATOM 559 HD11 ILE A 38 -3.884 8.040 11.311 1.00 99.99 H ATOM 560 N GLU A 39 -3.940 4.551 16.055 1.00 1.00 N ATOM 561 CA GLU A 39 -4.711 4.057 17.183 1.00 1.00 C ATOM 562 C GLU A 39 -6.073 3.546 16.711 1.00 1.00 C ATOM 563 O GLU A 39 -7.023 4.319 16.592 1.00 1.00 O ATOM 564 CB GLU A 39 -4.870 5.138 18.253 1.00 1.00 C ATOM 565 CG GLU A 39 -3.604 5.260 19.103 1.00 1.00 C ATOM 566 CD GLU A 39 -3.806 6.253 20.249 1.00 1.00 C ATOM 567 OE1 GLU A 39 -4.407 5.902 21.275 1.00 1.00 O ATOM 568 OE2 GLU A 39 -3.311 7.427 20.046 1.00 1.00 O ATOM 569 H GLU A 39 -3.402 5.374 16.239 1.00 99.99 H ATOM 570 HA GLU A 39 -4.128 3.232 17.593 1.00 99.99 H ATOM 571 HB2 GLU A 39 -5.089 6.094 17.780 1.00 99.99 H ATOM 572 HB3 GLU A 39 -5.720 4.898 18.894 1.00 99.99 H ATOM 573 HG2 GLU A 39 -3.336 4.284 19.506 1.00 99.99 H ATOM 574 HG3 GLU A 39 -2.773 5.586 18.477 1.00 99.99 H ATOM 575 HE2 GLU A 39 -3.436 7.690 19.090 1.00 99.99 H ATOM 576 N GLY A 40 -6.127 2.247 16.457 1.00 1.00 N ATOM 577 CA GLY A 40 -7.358 1.625 16.001 1.00 1.00 C ATOM 578 C GLY A 40 -8.237 2.629 15.253 1.00 1.00 C ATOM 579 O GLY A 40 -9.068 3.304 15.858 1.00 1.00 O ATOM 580 H GLY A 40 -5.351 1.625 16.557 1.00 99.99 H ATOM 581 HA2 GLY A 40 -7.125 0.784 15.348 1.00 99.99 H ATOM 582 HA3 GLY A 40 -7.905 1.223 16.853 1.00 99.99 H ATOM 583 N PHE A 41 -8.024 2.696 13.947 1.00 1.00 N ATOM 584 CA PHE A 41 -8.786 3.608 13.109 1.00 1.00 C ATOM 585 C PHE A 41 -10.289 3.405 13.307 1.00 1.00 C ATOM 586 O PHE A 41 -10.737 2.300 13.607 1.00 1.00 O ATOM 587 CB PHE A 41 -8.427 3.287 11.657 1.00 1.00 C ATOM 588 CG PHE A 41 -9.227 4.086 10.627 1.00 1.00 C ATOM 589 CD1 PHE A 41 -10.561 3.864 10.480 1.00 1.00 C ATOM 590 CD2 PHE A 41 -8.605 5.019 9.858 1.00 1.00 C ATOM 591 CE1 PHE A 41 -11.304 4.606 9.525 1.00 1.00 C ATOM 592 CE2 PHE A 41 -9.348 5.762 8.902 1.00 1.00 C ATOM 593 CZ PHE A 41 -10.682 5.538 8.756 1.00 1.00 C ATOM 594 H PHE A 41 -7.347 2.143 13.462 1.00 99.99 H ATOM 595 HA PHE A 41 -8.516 4.621 13.405 1.00 99.99 H ATOM 596 HB2 PHE A 41 -7.365 3.478 11.505 1.00 99.99 H ATOM 597 HB3 PHE A 41 -8.587 2.223 11.481 1.00 99.99 H ATOM 598 HD1 PHE A 41 -11.060 3.115 11.098 1.00 99.99 H ATOM 599 HD2 PHE A 41 -7.536 5.197 9.976 1.00 99.99 H ATOM 600 HE1 PHE A 41 -12.373 4.427 9.408 1.00 99.99 H ATOM 601 HE2 PHE A 41 -8.850 6.509 8.286 1.00 99.99 H ATOM 602 HZ PHE A 41 -11.252 6.108 8.022 1.00 99.99 H ATOM 603 N GLY A 42 -11.027 4.491 13.131 1.00 1.00 N ATOM 604 CA GLY A 42 -12.472 4.447 13.287 1.00 1.00 C ATOM 605 C GLY A 42 -13.174 5.013 12.050 1.00 1.00 C ATOM 606 O GLY A 42 -12.630 5.877 11.364 1.00 1.00 O ATOM 607 H GLY A 42 -10.657 5.387 12.887 1.00 99.99 H ATOM 608 HA2 GLY A 42 -12.793 3.419 13.453 1.00 99.99 H ATOM 609 HA3 GLY A 42 -12.764 5.018 14.168 1.00 99.99 H ATOM 610 N LYS A 43 -14.371 4.502 11.804 1.00 1.00 N ATOM 611 CA LYS A 43 -15.153 4.945 10.662 1.00 1.00 C ATOM 612 C LYS A 43 -15.663 6.364 10.918 1.00 1.00 C ATOM 613 O LYS A 43 -15.399 7.274 10.134 1.00 1.00 O ATOM 614 CB LYS A 43 -16.263 3.939 10.350 1.00 1.00 C ATOM 615 CG LYS A 43 -15.811 2.510 10.655 1.00 1.00 C ATOM 616 CD LYS A 43 -14.454 2.215 10.011 1.00 1.00 C ATOM 617 CE LYS A 43 -13.433 1.772 11.060 1.00 1.00 C ATOM 618 NZ LYS A 43 -13.995 0.700 11.909 1.00 1.00 N ATOM 619 H LYS A 43 -14.807 3.800 12.366 1.00 99.99 H ATOM 620 HA LYS A 43 -14.487 4.968 9.799 1.00 99.99 H ATOM 621 HB2 LYS A 43 -17.150 4.176 10.937 1.00 99.99 H ATOM 622 HB3 LYS A 43 -16.546 4.019 9.300 1.00 99.99 H ATOM 623 HG2 LYS A 43 -15.743 2.370 11.734 1.00 99.99 H ATOM 624 HG3 LYS A 43 -16.553 1.803 10.287 1.00 99.99 H ATOM 625 HD2 LYS A 43 -14.568 1.436 9.257 1.00 99.99 H ATOM 626 HD3 LYS A 43 -14.091 3.104 9.496 1.00 99.99 H ATOM 627 HE2 LYS A 43 -12.527 1.419 10.568 1.00 99.99 H ATOM 628 HE3 LYS A 43 -13.147 2.623 11.679 1.00 99.99 H ATOM 629 HZ1 LYS A 43 -13.382 -0.106 11.959 1.00 99.99 H ATOM 630 HZ2 LYS A 43 -14.148 1.010 12.863 1.00 99.99 H ATOM 631 N GLU A 44 -16.386 6.509 12.019 1.00 1.00 N ATOM 632 CA GLU A 44 -16.935 7.803 12.389 1.00 1.00 C ATOM 633 C GLU A 44 -15.925 8.912 12.095 1.00 1.00 C ATOM 634 O GLU A 44 -16.300 9.995 11.647 1.00 1.00 O ATOM 635 CB GLU A 44 -17.356 7.819 13.861 1.00 1.00 C ATOM 636 CG GLU A 44 -16.153 8.071 14.771 1.00 1.00 C ATOM 637 CD GLU A 44 -15.236 6.847 14.822 1.00 1.00 C ATOM 638 OE1 GLU A 44 -15.582 5.791 14.270 1.00 1.00 O ATOM 639 OE2 GLU A 44 -14.129 7.020 15.460 1.00 1.00 O ATOM 640 H GLU A 44 -16.597 5.764 12.652 1.00 99.99 H ATOM 641 HA GLU A 44 -17.819 7.931 11.764 1.00 99.99 H ATOM 642 HB2 GLU A 44 -18.106 8.594 14.020 1.00 99.99 H ATOM 643 HB3 GLU A 44 -17.820 6.868 14.121 1.00 99.99 H ATOM 644 HG2 GLU A 44 -15.594 8.934 14.410 1.00 99.99 H ATOM 645 HG3 GLU A 44 -16.497 8.313 15.777 1.00 99.99 H ATOM 646 HE2 GLU A 44 -13.396 7.248 14.819 1.00 99.99 H ATOM 647 N MET A 45 -14.663 8.606 12.359 1.00 1.00 N ATOM 648 CA MET A 45 -13.596 9.564 12.128 1.00 1.00 C ATOM 649 C MET A 45 -13.446 9.869 10.637 1.00 1.00 C ATOM 650 O MET A 45 -13.301 11.027 10.247 1.00 1.00 O ATOM 651 CB MET A 45 -12.279 9.002 12.669 1.00 1.00 C ATOM 652 CG MET A 45 -11.667 9.945 13.708 1.00 1.00 C ATOM 653 SD MET A 45 -12.249 9.516 15.339 1.00 1.00 S ATOM 654 CE MET A 45 -11.061 10.400 16.335 1.00 1.00 C ATOM 655 H MET A 45 -14.367 7.723 12.724 1.00 99.99 H ATOM 656 HA MET A 45 -13.893 10.467 12.663 1.00 99.99 H ATOM 657 HB2 MET A 45 -12.454 8.025 13.118 1.00 99.99 H ATOM 658 HB3 MET A 45 -11.578 8.856 11.848 1.00 99.99 H ATOM 659 HG2 MET A 45 -10.580 9.881 13.673 1.00 99.99 H ATOM 660 HG3 MET A 45 -11.934 10.976 13.477 1.00 99.99 H ATOM 661 HE1 MET A 45 -11.112 10.043 17.364 1.00 99.99 H ATOM 662 HE2 MET A 45 -10.059 10.231 15.941 1.00 99.99 H ATOM 663 HE3 MET A 45 -11.287 11.467 16.309 1.00 99.99 H ATOM 664 N ALA A 46 -13.488 8.811 9.841 1.00 1.00 N ATOM 665 CA ALA A 46 -13.358 8.951 8.401 1.00 1.00 C ATOM 666 C ALA A 46 -14.267 10.083 7.919 1.00 1.00 C ATOM 667 O ALA A 46 -13.795 11.092 7.397 1.00 1.00 O ATOM 668 CB ALA A 46 -13.683 7.616 7.727 1.00 1.00 C ATOM 669 H ALA A 46 -13.605 7.871 10.166 1.00 99.99 H ATOM 670 HA ALA A 46 -12.322 9.210 8.184 1.00 99.99 H ATOM 671 HB1 ALA A 46 -12.986 7.443 6.907 1.00 99.99 H ATOM 672 HB2 ALA A 46 -13.596 6.809 8.456 1.00 99.99 H ATOM 673 HB3 ALA A 46 -14.701 7.644 7.337 1.00 99.99 H ATOM 674 N HIS A 47 -15.571 9.881 8.113 1.00 1.00 N ATOM 675 CA HIS A 47 -16.589 10.848 7.720 1.00 1.00 C ATOM 676 C HIS A 47 -16.409 12.150 8.523 1.00 1.00 C ATOM 677 O HIS A 47 -17.018 13.167 8.197 1.00 1.00 O ATOM 678 CB HIS A 47 -17.974 10.200 7.868 1.00 1.00 C ATOM 679 CG HIS A 47 -18.151 8.828 7.262 1.00 1.00 C ATOM 680 ND1 HIS A 47 -18.775 7.834 7.901 1.00 1.00 N ATOM 681 CD2 HIS A 47 -17.760 8.316 6.048 1.00 1.00 C ATOM 682 CE1 HIS A 47 -18.774 6.745 7.116 1.00 1.00 C ATOM 683 NE2 HIS A 47 -18.161 6.987 5.959 1.00 1.00 N ATOM 684 H HIS A 47 -15.868 9.020 8.550 1.00 99.99 H ATOM 685 HA HIS A 47 -16.436 11.088 6.643 1.00 99.99 H ATOM 686 HB2 HIS A 47 -18.197 10.119 8.957 1.00 99.99 H ATOM 687 HB3 HIS A 47 -18.720 10.878 7.393 1.00 99.99 H ATOM 688 HD1 HIS A 47 -19.178 7.915 8.833 1.00 99.99 H ATOM 689 HD2 HIS A 47 -17.217 8.871 5.268 1.00 99.99 H ATOM 690 HE1 HIS A 47 -19.223 5.777 7.393 1.00 99.99 H ATOM 691 N GLY A 48 -15.574 12.071 9.548 1.00 1.00 N ATOM 692 CA GLY A 48 -15.312 13.227 10.390 1.00 1.00 C ATOM 693 C GLY A 48 -14.292 14.161 9.735 1.00 1.00 C ATOM 694 O GLY A 48 -14.407 14.481 8.554 1.00 1.00 O ATOM 695 H GLY A 48 -15.082 11.239 9.808 1.00 99.99 H ATOM 696 HA2 GLY A 48 -16.241 13.767 10.571 1.00 99.99 H ATOM 697 HA3 GLY A 48 -14.939 12.897 11.360 1.00 99.99 H ATOM 698 N LYS A 49 -13.317 14.572 10.533 1.00 1.00 N ATOM 699 CA LYS A 49 -12.277 15.463 10.046 1.00 1.00 C ATOM 700 C LYS A 49 -10.961 14.691 9.932 1.00 1.00 C ATOM 701 O LYS A 49 -9.935 15.128 10.451 1.00 1.00 O ATOM 702 CB LYS A 49 -12.185 16.709 10.928 1.00 1.00 C ATOM 703 CG LYS A 49 -11.389 17.816 10.231 1.00 1.00 C ATOM 704 CD LYS A 49 -11.313 19.070 11.105 1.00 1.00 C ATOM 705 CE LYS A 49 -12.381 20.086 10.701 1.00 1.00 C ATOM 706 NZ LYS A 49 -11.966 21.454 11.084 1.00 1.00 N ATOM 707 H LYS A 49 -13.230 14.306 11.493 1.00 99.99 H ATOM 708 HA LYS A 49 -12.571 15.794 9.050 1.00 99.99 H ATOM 709 HB2 LYS A 49 -13.186 17.070 11.162 1.00 99.99 H ATOM 710 HB3 LYS A 49 -11.709 16.456 11.874 1.00 99.99 H ATOM 711 HG2 LYS A 49 -10.383 17.461 10.009 1.00 99.99 H ATOM 712 HG3 LYS A 49 -11.858 18.061 9.279 1.00 99.99 H ATOM 713 HD2 LYS A 49 -11.444 18.795 12.152 1.00 99.99 H ATOM 714 HD3 LYS A 49 -10.324 19.520 11.016 1.00 99.99 H ATOM 715 HE2 LYS A 49 -12.547 20.039 9.624 1.00 99.99 H ATOM 716 HE3 LYS A 49 -13.328 19.839 11.180 1.00 99.99 H ATOM 717 HZ1 LYS A 49 -11.040 21.681 10.739 1.00 99.99 H ATOM 718 HZ2 LYS A 49 -12.597 22.159 10.718 1.00 99.99 H ATOM 719 N GLY A 50 -11.035 13.556 9.252 1.00 1.00 N ATOM 720 CA GLY A 50 -9.862 12.720 9.063 1.00 1.00 C ATOM 721 C GLY A 50 -9.983 11.885 7.787 1.00 1.00 C ATOM 722 O GLY A 50 -9.427 10.791 7.701 1.00 1.00 O ATOM 723 H GLY A 50 -11.874 13.209 8.834 1.00 99.99 H ATOM 724 HA2 GLY A 50 -8.970 13.344 9.011 1.00 99.99 H ATOM 725 HA3 GLY A 50 -9.740 12.060 9.923 1.00 99.99 H ATOM 726 N CYS A 51 -10.714 12.432 6.826 1.00 1.00 N ATOM 727 CA CYS A 51 -10.915 11.752 5.559 1.00 1.00 C ATOM 728 C CYS A 51 -11.767 12.651 4.661 1.00 1.00 C ATOM 729 O CYS A 51 -11.272 13.205 3.681 1.00 1.00 O ATOM 730 CB CYS A 51 -11.548 10.373 5.751 1.00 1.00 C ATOM 731 SG CYS A 51 -11.026 9.112 4.532 1.00 1.00 S ATOM 732 H CYS A 51 -11.162 13.323 6.905 1.00 99.99 H ATOM 733 HA CYS A 51 -9.927 11.599 5.126 1.00 99.99 H ATOM 734 HB2 CYS A 51 -11.305 10.014 6.751 1.00 99.99 H ATOM 735 HB3 CYS A 51 -12.633 10.476 5.705 1.00 99.99 H ATOM 736 N LYS A 52 -13.035 12.769 5.029 1.00 1.00 N ATOM 737 CA LYS A 52 -13.961 13.592 4.269 1.00 1.00 C ATOM 738 C LYS A 52 -13.875 15.038 4.762 1.00 1.00 C ATOM 739 O LYS A 52 -13.594 15.947 3.984 1.00 1.00 O ATOM 740 CB LYS A 52 -15.373 13.004 4.328 1.00 1.00 C ATOM 741 CG LYS A 52 -16.345 13.826 3.480 1.00 1.00 C ATOM 742 CD LYS A 52 -17.596 14.194 4.280 1.00 1.00 C ATOM 743 CE LYS A 52 -18.850 14.109 3.408 1.00 1.00 C ATOM 744 NZ LYS A 52 -19.355 15.464 3.093 1.00 1.00 N ATOM 745 H LYS A 52 -13.430 12.316 5.827 1.00 99.99 H ATOM 746 HA LYS A 52 -13.644 13.563 3.226 1.00 99.99 H ATOM 747 HB2 LYS A 52 -15.357 11.974 3.975 1.00 99.99 H ATOM 748 HB3 LYS A 52 -15.718 12.982 5.363 1.00 99.99 H ATOM 749 HG2 LYS A 52 -15.851 14.733 3.131 1.00 99.99 H ATOM 750 HG3 LYS A 52 -16.629 13.257 2.594 1.00 99.99 H ATOM 751 HD2 LYS A 52 -17.695 13.525 5.134 1.00 99.99 H ATOM 752 HD3 LYS A 52 -17.492 15.204 4.677 1.00 99.99 H ATOM 753 HE2 LYS A 52 -18.622 13.576 2.485 1.00 99.99 H ATOM 754 HE3 LYS A 52 -19.621 13.538 3.925 1.00 99.99 H ATOM 755 HZ1 LYS A 52 -20.340 15.563 3.316 1.00 99.99 H ATOM 756 HZ2 LYS A 52 -18.863 16.183 3.611 1.00 99.99 H ATOM 757 N GLY A 53 -14.123 15.204 6.053 1.00 1.00 N ATOM 758 CA GLY A 53 -14.078 16.524 6.659 1.00 1.00 C ATOM 759 C GLY A 53 -13.029 17.405 5.976 1.00 1.00 C ATOM 760 O GLY A 53 -13.343 18.498 5.506 1.00 1.00 O ATOM 761 H GLY A 53 -14.351 14.459 6.679 1.00 99.99 H ATOM 762 HA2 GLY A 53 -15.057 16.996 6.588 1.00 99.99 H ATOM 763 HA3 GLY A 53 -13.844 16.433 7.720 1.00 99.99 H ATOM 764 N CYS A 54 -11.806 16.897 5.943 1.00 1.00 N ATOM 765 CA CYS A 54 -10.710 17.625 5.325 1.00 1.00 C ATOM 766 C CYS A 54 -11.220 18.246 4.023 1.00 1.00 C ATOM 767 O CYS A 54 -11.324 19.466 3.905 1.00 1.00 O ATOM 768 CB CYS A 54 -9.496 16.726 5.090 1.00 1.00 C ATOM 769 SG CYS A 54 -8.010 17.466 5.860 1.00 1.00 S ATOM 770 H CYS A 54 -11.559 16.008 6.328 1.00 99.99 H ATOM 771 HA CYS A 54 -10.411 18.398 6.031 1.00 99.99 H ATOM 772 HB2 CYS A 54 -9.678 15.736 5.511 1.00 99.99 H ATOM 773 HB3 CYS A 54 -9.333 16.592 4.021 1.00 99.99 H ATOM 774 N HIS A 55 -11.530 17.372 3.065 1.00 1.00 N ATOM 775 CA HIS A 55 -12.032 17.776 1.756 1.00 1.00 C ATOM 776 C HIS A 55 -13.133 18.840 1.927 1.00 1.00 C ATOM 777 O HIS A 55 -13.115 19.863 1.244 1.00 1.00 O ATOM 778 CB HIS A 55 -12.477 16.525 0.986 1.00 1.00 C ATOM 779 CG HIS A 55 -11.519 15.356 0.977 1.00 1.00 C ATOM 780 ND1 HIS A 55 -11.901 14.109 1.270 1.00 1.00 N ATOM 781 CD2 HIS A 55 -10.174 15.288 0.701 1.00 1.00 C ATOM 782 CE1 HIS A 55 -10.838 13.297 1.179 1.00 1.00 C ATOM 783 NE2 HIS A 55 -9.745 13.973 0.831 1.00 1.00 N ATOM 784 H HIS A 55 -11.413 16.387 3.252 1.00 99.99 H ATOM 785 HA HIS A 55 -11.191 18.243 1.196 1.00 99.99 H ATOM 786 HB2 HIS A 55 -13.435 16.171 1.432 1.00 99.99 H ATOM 787 HB3 HIS A 55 -12.656 16.822 -0.073 1.00 99.99 H ATOM 788 HD1 HIS A 55 -12.854 13.845 1.519 1.00 99.99 H ATOM 789 HD2 HIS A 55 -9.538 16.142 0.420 1.00 99.99 H ATOM 790 HE1 HIS A 55 -10.865 12.212 1.369 1.00 99.99 H ATOM 791 N GLU A 56 -14.056 18.560 2.835 1.00 1.00 N ATOM 792 CA GLU A 56 -15.151 19.478 3.098 1.00 1.00 C ATOM 793 C GLU A 56 -14.607 20.857 3.475 1.00 1.00 C ATOM 794 O GLU A 56 -15.226 21.877 3.172 1.00 1.00 O ATOM 795 CB GLU A 56 -16.072 18.933 4.190 1.00 1.00 C ATOM 796 CG GLU A 56 -17.031 20.017 4.689 1.00 1.00 C ATOM 797 CD GLU A 56 -18.477 19.518 4.676 1.00 1.00 C ATOM 798 OE1 GLU A 56 -19.133 19.542 3.624 1.00 1.00 O ATOM 799 OE2 GLU A 56 -18.917 19.091 5.811 1.00 1.00 O ATOM 800 H GLU A 56 -14.062 17.725 3.385 1.00 99.99 H ATOM 801 HA GLU A 56 -15.706 19.542 2.162 1.00 99.99 H ATOM 802 HB2 GLU A 56 -16.642 18.089 3.803 1.00 99.99 H ATOM 803 HB3 GLU A 56 -15.475 18.561 5.023 1.00 99.99 H ATOM 804 HG2 GLU A 56 -16.755 20.316 5.699 1.00 99.99 H ATOM 805 HG3 GLU A 56 -16.944 20.902 4.059 1.00 99.99 H ATOM 806 HE2 GLU A 56 -18.227 18.516 6.251 1.00 99.99 H ATOM 807 N GLU A 57 -13.457 20.846 4.132 1.00 1.00 N ATOM 808 CA GLU A 57 -12.824 22.085 4.555 1.00 1.00 C ATOM 809 C GLU A 57 -11.874 22.593 3.467 1.00 1.00 C ATOM 810 O GLU A 57 -11.963 23.746 3.051 1.00 1.00 O ATOM 811 CB GLU A 57 -12.087 21.899 5.882 1.00 1.00 C ATOM 812 CG GLU A 57 -11.606 23.241 6.435 1.00 1.00 C ATOM 813 CD GLU A 57 -10.158 23.147 6.922 1.00 1.00 C ATOM 814 OE1 GLU A 57 -9.267 22.776 6.145 1.00 1.00 O ATOM 815 OE2 GLU A 57 -9.976 23.478 8.155 1.00 1.00 O ATOM 816 H GLU A 57 -12.960 20.013 4.376 1.00 99.99 H ATOM 817 HA GLU A 57 -13.639 22.793 4.694 1.00 99.99 H ATOM 818 HB2 GLU A 57 -12.747 21.419 6.604 1.00 99.99 H ATOM 819 HB3 GLU A 57 -11.235 21.234 5.740 1.00 99.99 H ATOM 820 HG2 GLU A 57 -11.685 24.006 5.662 1.00 99.99 H ATOM 821 HG3 GLU A 57 -12.251 23.551 7.258 1.00 99.99 H ATOM 822 HE2 GLU A 57 -9.046 23.243 8.437 1.00 99.99 H ATOM 823 N MET A 58 -10.989 21.705 3.038 1.00 1.00 N ATOM 824 CA MET A 58 -10.024 22.049 2.007 1.00 1.00 C ATOM 825 C MET A 58 -10.720 22.308 0.669 1.00 1.00 C ATOM 826 O MET A 58 -10.095 22.783 -0.277 1.00 1.00 O ATOM 827 CB MET A 58 -9.017 20.908 1.848 1.00 1.00 C ATOM 828 CG MET A 58 -7.592 21.448 1.723 1.00 1.00 C ATOM 829 SD MET A 58 -6.541 20.686 2.948 1.00 1.00 S ATOM 830 CE MET A 58 -6.201 22.099 3.986 1.00 1.00 C ATOM 831 H MET A 58 -10.924 20.769 3.381 1.00 99.99 H ATOM 832 HA MET A 58 -9.537 22.961 2.354 1.00 99.99 H ATOM 833 HB2 MET A 58 -9.083 20.238 2.706 1.00 99.99 H ATOM 834 HB3 MET A 58 -9.267 20.319 0.965 1.00 99.99 H ATOM 835 HG2 MET A 58 -7.204 21.247 0.723 1.00 99.99 H ATOM 836 HG3 MET A 58 -7.591 22.530 1.853 1.00 99.99 H ATOM 837 HE1 MET A 58 -6.295 23.012 3.399 1.00 99.99 H ATOM 838 HE2 MET A 58 -6.913 22.122 4.811 1.00 99.99 H ATOM 839 HE3 MET A 58 -5.188 22.023 4.381 1.00 99.99 H ATOM 840 N LYS A 59 -12.004 21.983 0.634 1.00 1.00 N ATOM 841 CA LYS A 59 -12.791 22.173 -0.573 1.00 1.00 C ATOM 842 C LYS A 59 -12.123 21.436 -1.734 1.00 1.00 C ATOM 843 O LYS A 59 -12.374 21.745 -2.898 1.00 1.00 O ATOM 844 CB LYS A 59 -13.013 23.664 -0.837 1.00 1.00 C ATOM 845 CG LYS A 59 -14.010 24.256 0.162 1.00 1.00 C ATOM 846 CD LYS A 59 -13.714 25.736 0.419 1.00 1.00 C ATOM 847 CE LYS A 59 -13.992 26.105 1.877 1.00 1.00 C ATOM 848 NZ LYS A 59 -15.443 26.296 2.096 1.00 1.00 N ATOM 849 H LYS A 59 -12.504 21.597 1.409 1.00 99.99 H ATOM 850 HA LYS A 59 -13.770 21.728 -0.396 1.00 99.99 H ATOM 851 HB2 LYS A 59 -12.064 24.195 -0.768 1.00 99.99 H ATOM 852 HB3 LYS A 59 -13.384 23.806 -1.853 1.00 99.99 H ATOM 853 HG2 LYS A 59 -15.023 24.145 -0.221 1.00 99.99 H ATOM 854 HG3 LYS A 59 -13.960 23.704 1.100 1.00 99.99 H ATOM 855 HD2 LYS A 59 -12.673 25.950 0.177 1.00 99.99 H ATOM 856 HD3 LYS A 59 -14.327 26.352 -0.239 1.00 99.99 H ATOM 857 HE2 LYS A 59 -13.620 25.320 2.534 1.00 99.99 H ATOM 858 HE3 LYS A 59 -13.455 27.017 2.136 1.00 99.99 H ATOM 859 HZ1 LYS A 59 -16.001 25.727 1.469 1.00 99.99 H ATOM 860 HZ2 LYS A 59 -15.720 26.051 3.041 1.00 99.99 H ATOM 861 N LYS A 60 -11.285 20.473 -1.378 1.00 1.00 N ATOM 862 CA LYS A 60 -10.579 19.689 -2.377 1.00 1.00 C ATOM 863 C LYS A 60 -10.727 18.201 -2.049 1.00 1.00 C ATOM 864 O LYS A 60 -10.672 17.810 -0.884 1.00 1.00 O ATOM 865 CB LYS A 60 -9.125 20.151 -2.492 1.00 1.00 C ATOM 866 CG LYS A 60 -8.889 20.897 -3.806 1.00 1.00 C ATOM 867 CD LYS A 60 -9.412 22.332 -3.722 1.00 1.00 C ATOM 868 CE LYS A 60 -9.801 22.855 -5.107 1.00 1.00 C ATOM 869 NZ LYS A 60 -8.649 23.528 -5.748 1.00 1.00 N ATOM 870 H LYS A 60 -11.086 20.228 -0.430 1.00 99.99 H ATOM 871 HA LYS A 60 -11.054 19.879 -3.339 1.00 99.99 H ATOM 872 HB2 LYS A 60 -8.878 20.798 -1.651 1.00 99.99 H ATOM 873 HB3 LYS A 60 -8.461 19.288 -2.434 1.00 99.99 H ATOM 874 HG2 LYS A 60 -7.823 20.907 -4.036 1.00 99.99 H ATOM 875 HG3 LYS A 60 -9.386 20.371 -4.621 1.00 99.99 H ATOM 876 HD2 LYS A 60 -10.277 22.371 -3.060 1.00 99.99 H ATOM 877 HD3 LYS A 60 -8.648 22.978 -3.287 1.00 99.99 H ATOM 878 HE2 LYS A 60 -10.141 22.030 -5.731 1.00 99.99 H ATOM 879 HE3 LYS A 60 -10.633 23.553 -5.018 1.00 99.99 H ATOM 880 HZ1 LYS A 60 -8.917 24.011 -6.598 1.00 99.99 H ATOM 881 HZ2 LYS A 60 -8.225 24.219 -5.140 1.00 99.99 H ATOM 882 N GLY A 61 -10.913 17.413 -3.097 1.00 1.00 N ATOM 883 CA GLY A 61 -11.070 15.978 -2.936 1.00 1.00 C ATOM 884 C GLY A 61 -12.522 15.554 -3.175 1.00 1.00 C ATOM 885 O GLY A 61 -13.425 16.375 -3.318 1.00 1.00 O ATOM 886 H GLY A 61 -10.957 17.739 -4.041 1.00 99.99 H ATOM 887 HA2 GLY A 61 -10.416 15.456 -3.634 1.00 99.99 H ATOM 888 HA3 GLY A 61 -10.764 15.685 -1.932 1.00 99.99 H ATOM 889 N PRO A 62 -12.726 14.235 -3.214 1.00 1.00 N ATOM 890 CA PRO A 62 -14.016 13.616 -3.426 1.00 1.00 C ATOM 891 C PRO A 62 -14.789 13.586 -2.116 1.00 1.00 C ATOM 892 O PRO A 62 -14.173 13.405 -1.066 1.00 1.00 O ATOM 893 CB PRO A 62 -13.697 12.201 -3.906 1.00 1.00 C ATOM 894 CG PRO A 62 -12.084 12.097 -3.977 1.00 1.00 C ATOM 895 CD PRO A 62 -11.685 13.243 -3.050 1.00 1.00 C ATOM 896 HA PRO A 62 -14.589 14.152 -4.182 1.00 99.99 H ATOM 897 HB2 PRO A 62 -14.133 11.438 -3.263 1.00 99.99 H ATOM 898 HB3 PRO A 62 -14.043 12.084 -4.933 1.00 99.99 H ATOM 899 HG2 PRO A 62 -12.122 11.170 -3.405 1.00 99.99 H ATOM 900 HG3 PRO A 62 -11.410 12.000 -4.828 1.00 99.99 H ATOM 901 HD2 PRO A 62 -11.617 12.901 -2.017 1.00 99.99 H ATOM 902 HD3 PRO A 62 -10.735 13.666 -3.373 1.00 99.99 H ATOM 903 N THR A 63 -16.100 13.762 -2.196 1.00 1.00 N ATOM 904 CA THR A 63 -16.930 13.753 -1.004 1.00 1.00 C ATOM 905 C THR A 63 -17.997 12.660 -1.105 1.00 1.00 C ATOM 906 O THR A 63 -18.337 12.025 -0.108 1.00 1.00 O ATOM 907 CB THR A 63 -17.513 15.156 -0.823 1.00 1.00 C ATOM 908 OG1 THR A 63 -17.875 15.554 -2.142 1.00 1.00 O ATOM 909 CG2 THR A 63 -16.456 16.178 -0.402 1.00 1.00 C ATOM 910 H THR A 63 -16.593 13.908 -3.054 1.00 99.99 H ATOM 911 HA THR A 63 -16.301 13.506 -0.148 1.00 99.99 H ATOM 912 HB THR A 63 -18.345 15.144 -0.119 1.00 99.99 H ATOM 913 HG1 THR A 63 -17.054 15.758 -2.675 1.00 99.99 H ATOM 914 HG21 THR A 63 -15.534 15.997 -0.955 1.00 99.99 H ATOM 915 N LYS A 64 -18.496 12.476 -2.319 1.00 1.00 N ATOM 916 CA LYS A 64 -19.518 11.472 -2.563 1.00 1.00 C ATOM 917 C LYS A 64 -19.031 10.119 -2.044 1.00 1.00 C ATOM 918 O LYS A 64 -17.829 9.855 -2.017 1.00 1.00 O ATOM 919 CB LYS A 64 -19.911 11.457 -4.042 1.00 1.00 C ATOM 920 CG LYS A 64 -20.704 10.195 -4.386 1.00 1.00 C ATOM 921 CD LYS A 64 -22.164 10.328 -3.948 1.00 1.00 C ATOM 922 CE LYS A 64 -22.750 8.965 -3.570 1.00 1.00 C ATOM 923 NZ LYS A 64 -24.216 8.958 -3.771 1.00 1.00 N ATOM 924 H LYS A 64 -18.215 12.998 -3.124 1.00 99.99 H ATOM 925 HA LYS A 64 -20.403 11.761 -1.997 1.00 99.99 H ATOM 926 HB2 LYS A 64 -20.508 12.340 -4.272 1.00 99.99 H ATOM 927 HB3 LYS A 64 -19.016 11.508 -4.661 1.00 99.99 H ATOM 928 HG2 LYS A 64 -20.658 10.013 -5.460 1.00 99.99 H ATOM 929 HG3 LYS A 64 -20.251 9.332 -3.897 1.00 99.99 H ATOM 930 HD2 LYS A 64 -22.232 11.006 -3.096 1.00 99.99 H ATOM 931 HD3 LYS A 64 -22.751 10.768 -4.754 1.00 99.99 H ATOM 932 HE2 LYS A 64 -22.289 8.185 -4.176 1.00 99.99 H ATOM 933 HE3 LYS A 64 -22.517 8.739 -2.529 1.00 99.99 H ATOM 934 HZ1 LYS A 64 -24.516 8.180 -4.348 1.00 99.99 H ATOM 935 HZ2 LYS A 64 -24.719 8.883 -2.893 1.00 99.99 H ATOM 936 N CYS A 65 -19.988 9.295 -1.643 1.00 1.00 N ATOM 937 CA CYS A 65 -19.671 7.975 -1.125 1.00 1.00 C ATOM 938 C CYS A 65 -19.011 7.166 -2.242 1.00 1.00 C ATOM 939 O CYS A 65 -17.878 6.708 -2.096 1.00 1.00 O ATOM 940 CB CYS A 65 -20.913 7.272 -0.570 1.00 1.00 C ATOM 941 SG CYS A 65 -22.227 8.396 0.028 1.00 1.00 S ATOM 942 H CYS A 65 -20.963 9.517 -1.668 1.00 99.99 H ATOM 943 HA CYS A 65 -18.982 8.122 -0.294 1.00 99.99 H ATOM 944 HB2 CYS A 65 -21.328 6.630 -1.346 1.00 99.99 H ATOM 945 HB3 CYS A 65 -20.608 6.623 0.252 1.00 99.99 H ATOM 946 N GLY A 66 -19.747 7.014 -3.334 1.00 1.00 N ATOM 947 CA GLY A 66 -19.246 6.269 -4.477 1.00 1.00 C ATOM 948 C GLY A 66 -17.829 6.715 -4.843 1.00 1.00 C ATOM 949 O GLY A 66 -17.064 5.947 -5.426 1.00 1.00 O ATOM 950 H GLY A 66 -20.666 7.389 -3.446 1.00 99.99 H ATOM 951 HA2 GLY A 66 -19.248 5.203 -4.249 1.00 99.99 H ATOM 952 HA3 GLY A 66 -19.909 6.414 -5.329 1.00 99.99 H ATOM 953 N GLU A 67 -17.521 7.954 -4.489 1.00 1.00 N ATOM 954 CA GLU A 67 -16.210 8.511 -4.775 1.00 1.00 C ATOM 955 C GLU A 67 -15.164 7.914 -3.832 1.00 1.00 C ATOM 956 O GLU A 67 -13.974 7.902 -4.146 1.00 1.00 O ATOM 957 CB GLU A 67 -16.230 10.038 -4.675 1.00 1.00 C ATOM 958 CG GLU A 67 -16.764 10.664 -5.965 1.00 1.00 C ATOM 959 CD GLU A 67 -15.618 11.055 -6.900 1.00 1.00 C ATOM 960 OE1 GLU A 67 -15.220 12.229 -6.935 1.00 1.00 O ATOM 961 OE2 GLU A 67 -15.137 10.089 -7.606 1.00 1.00 O ATOM 962 H GLU A 67 -18.150 8.572 -4.017 1.00 99.99 H ATOM 963 HA GLU A 67 -15.990 8.222 -5.802 1.00 99.99 H ATOM 964 HB2 GLU A 67 -16.852 10.344 -3.834 1.00 99.99 H ATOM 965 HB3 GLU A 67 -15.224 10.406 -4.478 1.00 99.99 H ATOM 966 HG2 GLU A 67 -17.425 9.959 -6.469 1.00 99.99 H ATOM 967 HG3 GLU A 67 -17.360 11.545 -5.726 1.00 99.99 H ATOM 968 HE2 GLU A 67 -15.847 9.716 -8.204 1.00 99.99 H ATOM 969 N CYS A 68 -15.644 7.432 -2.695 1.00 1.00 N ATOM 970 CA CYS A 68 -14.764 6.835 -1.705 1.00 1.00 C ATOM 971 C CYS A 68 -14.994 5.322 -1.707 1.00 1.00 C ATOM 972 O CYS A 68 -14.054 4.541 -1.835 1.00 1.00 O ATOM 973 CB CYS A 68 -14.980 7.442 -0.317 1.00 1.00 C ATOM 974 SG CYS A 68 -13.724 8.735 0.002 1.00 1.00 S ATOM 975 H CYS A 68 -16.612 7.445 -2.447 1.00 99.99 H ATOM 976 HA CYS A 68 -13.744 7.072 -2.008 1.00 99.99 H ATOM 977 HB2 CYS A 68 -15.979 7.871 -0.249 1.00 99.99 H ATOM 978 HB3 CYS A 68 -14.914 6.664 0.444 1.00 99.99 H ATOM 979 N HIS A 69 -16.266 4.945 -1.563 1.00 1.00 N ATOM 980 CA HIS A 69 -16.679 3.547 -1.542 1.00 1.00 C ATOM 981 C HIS A 69 -16.961 3.066 -2.976 1.00 1.00 C ATOM 982 O HIS A 69 -17.282 3.872 -3.848 1.00 1.00 O ATOM 983 CB HIS A 69 -17.867 3.394 -0.580 1.00 1.00 C ATOM 984 CG HIS A 69 -17.612 3.730 0.872 1.00 1.00 C ATOM 985 ND1 HIS A 69 -16.817 2.992 1.653 1.00 1.00 N ATOM 986 CD2 HIS A 69 -18.078 4.754 1.661 1.00 1.00 C ATOM 987 CE1 HIS A 69 -16.789 3.534 2.880 1.00 1.00 C ATOM 988 NE2 HIS A 69 -17.550 4.625 2.940 1.00 1.00 N ATOM 989 H HIS A 69 -16.974 5.659 -1.464 1.00 99.99 H ATOM 990 HA HIS A 69 -15.833 2.945 -1.140 1.00 99.99 H ATOM 991 HB2 HIS A 69 -18.686 4.060 -0.940 1.00 99.99 H ATOM 992 HB3 HIS A 69 -18.210 2.336 -0.626 1.00 99.99 H ATOM 993 HD1 HIS A 69 -16.324 2.157 1.342 1.00 99.99 H ATOM 994 HD2 HIS A 69 -18.762 5.551 1.331 1.00 99.99 H ATOM 995 HE1 HIS A 69 -16.210 3.131 3.725 1.00 99.99 H ATOM 996 N LYS A 70 -16.832 1.761 -3.173 1.00 1.00 N ATOM 997 CA LYS A 70 -17.069 1.174 -4.480 1.00 1.00 C ATOM 998 C LYS A 70 -18.081 0.034 -4.346 1.00 1.00 C ATOM 999 O LYS A 70 -17.832 -0.942 -3.641 1.00 1.00 O ATOM 1000 CB LYS A 70 -15.749 0.752 -5.126 1.00 1.00 C ATOM 1001 CG LYS A 70 -15.995 -0.061 -6.398 1.00 1.00 C ATOM 1002 CD LYS A 70 -15.513 0.697 -7.636 1.00 1.00 C ATOM 1003 CE LYS A 70 -16.690 1.084 -8.534 1.00 1.00 C ATOM 1004 NZ LYS A 70 -16.757 0.192 -9.714 1.00 1.00 N ATOM 1005 H LYS A 70 -16.570 1.112 -2.459 1.00 99.99 H ATOM 1006 HA LYS A 70 -17.503 1.948 -5.112 1.00 99.99 H ATOM 1007 HB2 LYS A 70 -15.156 1.635 -5.365 1.00 99.99 H ATOM 1008 HB3 LYS A 70 -15.167 0.160 -4.418 1.00 99.99 H ATOM 1009 HG2 LYS A 70 -15.477 -1.018 -6.329 1.00 99.99 H ATOM 1010 HG3 LYS A 70 -17.058 -0.282 -6.493 1.00 99.99 H ATOM 1011 HD2 LYS A 70 -14.974 1.593 -7.331 1.00 99.99 H ATOM 1012 HD3 LYS A 70 -14.812 0.078 -8.197 1.00 99.99 H ATOM 1013 HE2 LYS A 70 -17.621 1.021 -7.971 1.00 99.99 H ATOM 1014 HE3 LYS A 70 -16.583 2.119 -8.858 1.00 99.99 H ATOM 1015 HZ1 LYS A 70 -17.327 0.585 -10.455 1.00 99.99 H ATOM 1016 HZ2 LYS A 70 -15.840 0.018 -10.111 1.00 99.99 H ATOM 1017 N LYS A 71 -19.202 0.196 -5.035 1.00 1.00 N ATOM 1018 CA LYS A 71 -20.252 -0.808 -5.001 1.00 1.00 C ATOM 1019 C LYS A 71 -20.634 -1.187 -6.434 1.00 1.00 C ATOM 1020 O LYS A 71 -21.515 -0.567 -7.029 1.00 1.00 O ATOM 1021 CB LYS A 71 -21.431 -0.320 -4.158 1.00 1.00 C ATOM 1022 CG LYS A 71 -21.457 -1.018 -2.796 1.00 1.00 C ATOM 1023 CD LYS A 71 -22.859 -0.975 -2.185 1.00 1.00 C ATOM 1024 CE LYS A 71 -22.790 -0.769 -0.670 1.00 1.00 C ATOM 1025 NZ LYS A 71 -24.090 -0.290 -0.152 1.00 1.00 N ATOM 1026 H LYS A 71 -19.396 0.993 -5.607 1.00 99.99 H ATOM 1027 HA LYS A 71 -19.845 -1.690 -4.507 1.00 99.99 H ATOM 1028 HB2 LYS A 71 -21.362 0.758 -4.017 1.00 99.99 H ATOM 1029 HB3 LYS A 71 -22.365 -0.512 -4.687 1.00 99.99 H ATOM 1030 HG2 LYS A 71 -21.137 -2.053 -2.909 1.00 99.99 H ATOM 1031 HG3 LYS A 71 -20.748 -0.535 -2.123 1.00 99.99 H ATOM 1032 HD2 LYS A 71 -23.433 -0.167 -2.639 1.00 99.99 H ATOM 1033 HD3 LYS A 71 -23.385 -1.903 -2.405 1.00 99.99 H ATOM 1034 HE2 LYS A 71 -22.520 -1.705 -0.182 1.00 99.99 H ATOM 1035 HE3 LYS A 71 -22.009 -0.048 -0.431 1.00 99.99 H ATOM 1036 HZ1 LYS A 71 -24.853 -0.495 -0.790 1.00 99.99 H ATOM 1037 HZ2 LYS A 71 -24.327 -0.719 0.736 1.00 99.99 H TER 1038 LYS A 71 HETATM 1039 FE HEC A 101 0.593 8.113 6.636 1.00 1.00 FE HETATM 1040 CHA HEC A 101 -0.186 4.811 7.424 1.00 1.00 C HETATM 1041 CHB HEC A 101 3.938 7.398 7.280 1.00 1.00 C HETATM 1042 CHC HEC A 101 1.454 11.347 5.879 1.00 1.00 C HETATM 1043 CHD HEC A 101 -2.755 8.856 6.552 1.00 1.00 C HETATM 1044 NA HEC A 101 1.647 6.457 7.282 1.00 1.00 N HETATM 1045 C1A HEC A 101 1.156 5.173 7.453 1.00 1.00 C HETATM 1046 C2A HEC A 101 2.243 4.247 7.666 1.00 1.00 C HETATM 1047 C3A HEC A 101 3.387 4.960 7.626 1.00 1.00 C HETATM 1048 C4A HEC A 101 3.021 6.336 7.388 1.00 1.00 C HETATM 1049 CMA HEC A 101 4.793 4.462 7.793 1.00 1.00 C HETATM 1050 CAA HEC A 101 2.082 2.770 7.886 1.00 1.00 C HETATM 1051 CBA HEC A 101 2.403 1.921 6.660 1.00 1.00 C HETATM 1052 CGA HEC A 101 1.805 0.527 6.787 1.00 1.00 C HETATM 1053 O1A HEC A 101 2.543 -0.367 7.252 1.00 1.00 O HETATM 1054 O2A HEC A 101 0.619 0.383 6.416 1.00 1.00 O HETATM 1055 NB HEC A 101 2.355 9.127 6.508 1.00 1.00 N HETATM 1056 C1B HEC A 101 3.592 8.710 6.968 1.00 1.00 C HETATM 1057 C2B HEC A 101 4.490 9.834 7.083 1.00 1.00 C HETATM 1058 C3B HEC A 101 3.804 10.931 6.696 1.00 1.00 C HETATM 1059 C4B HEC A 101 2.475 10.496 6.337 1.00 1.00 C HETATM 1060 CMB HEC A 101 5.914 9.753 7.551 1.00 1.00 C HETATM 1061 CAB HEC A 101 4.290 12.349 6.633 1.00 1.00 C HETATM 1062 CBB HEC A 101 5.525 12.622 7.486 1.00 1.00 C HETATM 1063 NC HEC A 101 -0.492 9.732 6.053 1.00 1.00 N HETATM 1064 C1C HEC A 101 0.015 11.013 5.927 1.00 1.00 C HETATM 1065 C2C HEC A 101 -1.030 11.988 6.137 1.00 1.00 C HETATM 1066 C3C HEC A 101 -2.166 11.304 6.391 1.00 1.00 C HETATM 1067 C4C HEC A 101 -1.836 9.899 6.340 1.00 1.00 C HETATM 1068 CMC HEC A 101 -0.840 13.475 6.075 1.00 1.00 C HETATM 1069 CAC HEC A 101 -3.532 11.857 6.677 1.00 1.00 C HETATM 1070 CBC HEC A 101 -4.195 12.525 5.476 1.00 1.00 C HETATM 1071 ND HEC A 101 -1.114 7.064 6.975 1.00 1.00 N HETATM 1072 C1D HEC A 101 -2.404 7.534 6.802 1.00 1.00 C HETATM 1073 C2D HEC A 101 -3.351 6.450 6.919 1.00 1.00 C HETATM 1074 C3D HEC A 101 -2.642 5.327 7.161 1.00 1.00 C HETATM 1075 C4D HEC A 101 -1.249 5.704 7.196 1.00 1.00 C HETATM 1076 CMD HEC A 101 -4.840 6.593 6.788 1.00 1.00 C HETATM 1077 CAD HEC A 101 -3.160 3.933 7.361 1.00 1.00 C HETATM 1078 CBD HEC A 101 -3.405 3.565 8.822 1.00 1.00 C HETATM 1079 CGD HEC A 101 -4.253 2.307 8.935 1.00 1.00 C HETATM 1080 O1D HEC A 101 -4.940 2.177 9.972 1.00 1.00 O HETATM 1081 O2D HEC A 101 -4.198 1.498 7.984 1.00 1.00 O HETATM 1082 FE HEC A 102 -7.886 13.285 0.547 1.00 1.00 FE HETATM 1083 CHA HEC A 102 -7.907 14.517 -2.706 1.00 1.00 C HETATM 1084 CHB HEC A 102 -9.330 10.336 -0.651 1.00 1.00 C HETATM 1085 CHC HEC A 102 -8.005 12.029 3.719 1.00 1.00 C HETATM 1086 CHD HEC A 102 -6.601 16.249 1.654 1.00 1.00 C HETATM 1087 NA HEC A 102 -8.521 12.586 -1.296 1.00 1.00 N HETATM 1088 C1A HEC A 102 -8.386 13.225 -2.518 1.00 1.00 C HETATM 1089 C2A HEC A 102 -8.818 12.355 -3.587 1.00 1.00 C HETATM 1090 C3A HEC A 102 -9.213 11.195 -3.020 1.00 1.00 C HETATM 1091 C4A HEC A 102 -9.031 11.335 -1.596 1.00 1.00 C HETATM 1092 CMA HEC A 102 -9.746 9.969 -3.702 1.00 1.00 C HETATM 1093 CAA HEC A 102 -8.809 12.717 -5.044 1.00 1.00 C HETATM 1094 CBA HEC A 102 -7.424 12.692 -5.683 1.00 1.00 C HETATM 1095 CGA HEC A 102 -6.765 11.331 -5.509 1.00 1.00 C HETATM 1096 O1A HEC A 102 -6.331 10.775 -6.542 1.00 1.00 O HETATM 1097 O2A HEC A 102 -6.706 10.872 -4.349 1.00 1.00 O HETATM 1098 NB HEC A 102 -8.546 11.547 1.350 1.00 1.00 N HETATM 1099 C1B HEC A 102 -9.086 10.443 0.714 1.00 1.00 C HETATM 1100 C2B HEC A 102 -9.369 9.400 1.673 1.00 1.00 C HETATM 1101 C3B HEC A 102 -9.002 9.867 2.885 1.00 1.00 C HETATM 1102 C4B HEC A 102 -8.490 11.202 2.690 1.00 1.00 C HETATM 1103 CMB HEC A 102 -9.960 8.062 1.337 1.00 1.00 C HETATM 1104 CAB HEC A 102 -9.092 9.167 4.210 1.00 1.00 C HETATM 1105 CBB HEC A 102 -8.469 7.774 4.221 1.00 1.00 C HETATM 1106 NC HEC A 102 -7.363 13.996 2.348 1.00 1.00 N HETATM 1107 C1C HEC A 102 -7.672 13.445 3.579 1.00 1.00 C HETATM 1108 C2C HEC A 102 -7.499 14.425 4.625 1.00 1.00 C HETATM 1109 C3C HEC A 102 -7.085 15.567 4.036 1.00 1.00 C HETATM 1110 C4C HEC A 102 -6.998 15.304 2.617 1.00 1.00 C HETATM 1111 CMC HEC A 102 -7.745 14.176 6.085 1.00 1.00 C HETATM 1112 CAC HEC A 102 -6.764 16.880 4.687 1.00 1.00 C HETATM 1113 CBC HEC A 102 -5.466 16.874 5.491 1.00 1.00 C HETATM 1114 ND HEC A 102 -7.439 15.052 -0.333 1.00 1.00 N HETATM 1115 C1D HEC A 102 -6.775 16.099 0.283 1.00 1.00 C HETATM 1116 C2D HEC A 102 -6.280 17.028 -0.705 1.00 1.00 C HETATM 1117 C3D HEC A 102 -6.640 16.551 -1.915 1.00 1.00 C HETATM 1118 C4D HEC A 102 -7.362 15.321 -1.689 1.00 1.00 C HETATM 1119 CMD HEC A 102 -5.511 18.280 -0.397 1.00 1.00 C HETATM 1120 CAD HEC A 102 -6.366 17.149 -3.264 1.00 1.00 C HETATM 1121 CBD HEC A 102 -5.538 16.255 -4.182 1.00 1.00 C HETATM 1122 CGD HEC A 102 -5.216 16.961 -5.491 1.00 1.00 C HETATM 1123 O1D HEC A 102 -6.099 16.946 -6.377 1.00 1.00 O HETATM 1124 O2D HEC A 102 -4.095 17.505 -5.583 1.00 1.00 O HETATM 1125 FE HEC A 103 -17.884 5.833 4.502 1.00 1.00 FE HETATM 1126 CHA HEC A 103 -16.779 3.413 6.624 1.00 1.00 C HETATM 1127 CHB HEC A 103 -21.115 4.753 4.856 1.00 1.00 C HETATM 1128 CHC HEC A 103 -18.987 8.250 2.217 1.00 1.00 C HETATM 1129 CHD HEC A 103 -14.604 6.808 3.891 1.00 1.00 C HETATM 1130 NA HEC A 103 -18.750 4.352 5.476 1.00 1.00 N HETATM 1131 C1A HEC A 103 -18.148 3.515 6.400 1.00 1.00 C HETATM 1132 C2A HEC A 103 -19.146 2.752 7.110 1.00 1.00 C HETATM 1133 C3A HEC A 103 -20.349 3.120 6.622 1.00 1.00 C HETATM 1134 C4A HEC A 103 -20.108 4.116 5.605 1.00 1.00 C HETATM 1135 CMA HEC A 103 -21.704 2.619 7.028 1.00 1.00 C HETATM 1136 CAA HEC A 103 -18.853 1.745 8.184 1.00 1.00 C HETATM 1137 CBA HEC A 103 -18.068 0.530 7.697 1.00 1.00 C HETATM 1138 CGA HEC A 103 -18.998 -0.528 7.121 1.00 1.00 C HETATM 1139 O1A HEC A 103 -20.188 -0.506 7.501 1.00 1.00 O HETATM 1140 O2A HEC A 103 -18.501 -1.339 6.309 1.00 1.00 O HETATM 1141 NB HEC A 103 -19.671 6.355 3.658 1.00 1.00 N HETATM 1142 C1B HEC A 103 -20.905 5.845 4.020 1.00 1.00 C HETATM 1143 C2B HEC A 103 -21.964 6.610 3.405 1.00 1.00 C HETATM 1144 C3B HEC A 103 -21.377 7.580 2.672 1.00 1.00 C HETATM 1145 C4B HEC A 103 -19.950 7.426 2.828 1.00 1.00 C HETATM 1146 CMB HEC A 103 -23.431 6.340 3.576 1.00 1.00 C HETATM 1147 CAB HEC A 103 -22.041 8.640 1.841 1.00 1.00 C HETATM 1148 CBB HEC A 103 -23.285 9.245 2.485 1.00 1.00 C HETATM 1149 NC HEC A 103 -16.976 7.361 3.440 1.00 1.00 N HETATM 1150 C1C HEC A 103 -17.587 8.267 2.589 1.00 1.00 C HETATM 1151 C2C HEC A 103 -16.592 9.004 1.845 1.00 1.00 C HETATM 1152 C3C HEC A 103 -15.384 8.550 2.240 1.00 1.00 C HETATM 1153 C4C HEC A 103 -15.618 7.528 3.233 1.00 1.00 C HETATM 1154 CMC HEC A 103 -16.893 10.068 0.830 1.00 1.00 C HETATM 1155 CAC HEC A 103 -14.030 8.993 1.767 1.00 1.00 C HETATM 1156 CBC HEC A 103 -13.754 10.479 1.981 1.00 1.00 C HETATM 1157 ND HEC A 103 -16.070 5.259 5.131 1.00 1.00 N HETATM 1158 C1D HEC A 103 -14.828 5.741 4.755 1.00 1.00 C HETATM 1159 C2D HEC A 103 -13.780 4.977 5.390 1.00 1.00 C HETATM 1160 C3D HEC A 103 -14.379 4.035 6.149 1.00 1.00 C HETATM 1161 C4D HEC A 103 -15.805 4.207 5.990 1.00 1.00 C HETATM 1162 CMD HEC A 103 -12.310 5.221 5.211 1.00 1.00 C HETATM 1163 CAD HEC A 103 -13.731 2.989 7.008 1.00 1.00 C HETATM 1164 CBD HEC A 103 -13.064 1.865 6.220 1.00 1.00 C HETATM 1165 CGD HEC A 103 -11.757 1.439 6.872 1.00 1.00 C HETATM 1166 O1D HEC A 103 -11.014 2.348 7.301 1.00 1.00 O HETATM 1167 O2D HEC A 103 -11.524 0.212 6.930 1.00 1.00 O