ATOM 1 N ALA A 1 3.166 2.053 1.563 1.00 1.00 N ATOM 2 CA ALA A 1 3.461 1.315 0.347 1.00 1.00 C ATOM 3 C ALA A 1 3.086 2.169 -0.866 1.00 1.00 C ATOM 4 O ALA A 1 3.955 2.568 -1.641 1.00 1.00 O ATOM 5 CB ALA A 1 2.721 -0.024 0.369 1.00 1.00 C ATOM 6 H1 ALA A 1 2.729 1.518 2.286 1.00 99.99 H ATOM 7 HA ALA A 1 4.534 1.122 0.328 1.00 99.99 H ATOM 8 HB1 ALA A 1 2.724 -0.457 -0.631 1.00 99.99 H ATOM 9 HB2 ALA A 1 3.218 -0.703 1.061 1.00 99.99 H ATOM 10 HB3 ALA A 1 1.692 0.135 0.693 1.00 99.99 H ATOM 11 N ASP A 2 1.793 2.425 -0.992 1.00 1.00 N ATOM 12 CA ASP A 2 1.292 3.224 -2.097 1.00 1.00 C ATOM 13 C ASP A 2 -0.235 3.280 -2.030 1.00 1.00 C ATOM 14 O ASP A 2 -0.819 4.361 -1.991 1.00 1.00 O ATOM 15 CB ASP A 2 1.684 2.610 -3.443 1.00 1.00 C ATOM 16 CG ASP A 2 2.790 3.354 -4.195 1.00 1.00 C ATOM 17 OD1 ASP A 2 3.595 4.079 -3.594 1.00 1.00 O ATOM 18 OD2 ASP A 2 2.805 3.163 -5.471 1.00 1.00 O ATOM 19 H ASP A 2 1.094 2.097 -0.357 1.00 99.99 H ATOM 20 HA ASP A 2 1.750 4.205 -1.972 1.00 99.99 H ATOM 21 HB2 ASP A 2 2.007 1.582 -3.275 1.00 99.99 H ATOM 22 HB3 ASP A 2 0.799 2.568 -4.078 1.00 99.99 H ATOM 23 HD2 ASP A 2 1.875 3.014 -5.805 1.00 99.99 H ATOM 24 N ASP A 3 -0.838 2.100 -2.018 1.00 1.00 N ATOM 25 CA ASP A 3 -2.287 2.001 -1.957 1.00 1.00 C ATOM 26 C ASP A 3 -2.692 1.319 -0.649 1.00 1.00 C ATOM 27 O ASP A 3 -2.209 0.232 -0.336 1.00 1.00 O ATOM 28 CB ASP A 3 -2.831 1.163 -3.116 1.00 1.00 C ATOM 29 CG ASP A 3 -4.239 1.542 -3.582 1.00 1.00 C ATOM 30 OD1 ASP A 3 -4.472 1.785 -4.775 1.00 1.00 O ATOM 31 OD2 ASP A 3 -5.129 1.584 -2.649 1.00 1.00 O ATOM 32 H ASP A 3 -0.356 1.225 -2.051 1.00 99.99 H ATOM 33 HA ASP A 3 -2.648 3.028 -2.021 1.00 99.99 H ATOM 34 HB2 ASP A 3 -2.149 1.252 -3.960 1.00 99.99 H ATOM 35 HB3 ASP A 3 -2.834 0.115 -2.816 1.00 99.99 H ATOM 36 HD2 ASP A 3 -5.204 2.514 -2.290 1.00 99.99 H ATOM 37 N ILE A 4 -3.574 1.986 0.081 1.00 1.00 N ATOM 38 CA ILE A 4 -4.050 1.457 1.348 1.00 1.00 C ATOM 39 C ILE A 4 -5.554 1.191 1.253 1.00 1.00 C ATOM 40 O ILE A 4 -6.353 2.125 1.246 1.00 1.00 O ATOM 41 CB ILE A 4 -3.662 2.390 2.497 1.00 1.00 C ATOM 42 CG1 ILE A 4 -2.146 2.594 2.550 1.00 1.00 C ATOM 43 CG2 ILE A 4 -4.218 1.881 3.828 1.00 1.00 C ATOM 44 CD1 ILE A 4 -1.708 3.100 3.926 1.00 1.00 C ATOM 45 H ILE A 4 -3.963 2.869 -0.181 1.00 99.99 H ATOM 46 HA ILE A 4 -3.541 0.508 1.518 1.00 99.99 H ATOM 47 HB ILE A 4 -4.112 3.365 2.312 1.00 99.99 H ATOM 48 HG12 ILE A 4 -1.641 1.653 2.326 1.00 99.99 H ATOM 49 HG23 ILE A 4 -3.477 1.243 4.311 1.00 99.99 H ATOM 50 HD11 ILE A 4 -2.517 3.677 4.375 1.00 99.99 H ATOM 51 N VAL A 5 -5.893 -0.088 1.183 1.00 1.00 N ATOM 52 CA VAL A 5 -7.286 -0.488 1.089 1.00 1.00 C ATOM 53 C VAL A 5 -7.879 -0.593 2.495 1.00 1.00 C ATOM 54 O VAL A 5 -7.344 -1.303 3.347 1.00 1.00 O ATOM 55 CB VAL A 5 -7.404 -1.790 0.292 1.00 1.00 C ATOM 56 CG1 VAL A 5 -8.813 -2.376 0.406 1.00 1.00 C ATOM 57 CG2 VAL A 5 -7.018 -1.572 -1.173 1.00 1.00 C ATOM 58 H VAL A 5 -5.236 -0.842 1.189 1.00 99.99 H ATOM 59 HA VAL A 5 -7.817 0.292 0.542 1.00 99.99 H ATOM 60 HB VAL A 5 -6.706 -2.509 0.720 1.00 99.99 H ATOM 61 HG13 VAL A 5 -8.893 -2.950 1.330 1.00 99.99 H ATOM 62 HG21 VAL A 5 -6.785 -0.519 -1.334 1.00 99.99 H ATOM 63 N LEU A 6 -8.974 0.124 2.697 1.00 1.00 N ATOM 64 CA LEU A 6 -9.645 0.121 3.985 1.00 1.00 C ATOM 65 C LEU A 6 -10.874 -0.788 3.914 1.00 1.00 C ATOM 66 O LEU A 6 -12.000 -0.306 3.786 1.00 1.00 O ATOM 67 CB LEU A 6 -9.961 1.550 4.429 1.00 1.00 C ATOM 68 CG LEU A 6 -8.784 2.527 4.435 1.00 1.00 C ATOM 69 CD1 LEU A 6 -9.255 3.955 4.150 1.00 1.00 C ATOM 70 CD2 LEU A 6 -7.999 2.432 5.745 1.00 1.00 C ATOM 71 H LEU A 6 -9.403 0.698 1.999 1.00 99.99 H ATOM 72 HA LEU A 6 -8.950 -0.296 4.714 1.00 99.99 H ATOM 73 HB2 LEU A 6 -10.736 1.950 3.774 1.00 99.99 H ATOM 74 HB3 LEU A 6 -10.382 1.514 5.434 1.00 99.99 H ATOM 75 HG LEU A 6 -8.103 2.247 3.632 1.00 99.99 H ATOM 76 HD13 LEU A 6 -8.398 4.631 4.173 1.00 99.99 H ATOM 77 HD21 LEU A 6 -7.908 3.424 6.187 1.00 99.99 H ATOM 78 N LYS A 7 -10.618 -2.084 3.999 1.00 1.00 N ATOM 79 CA LYS A 7 -11.690 -3.064 3.945 1.00 1.00 C ATOM 80 C LYS A 7 -12.922 -2.505 4.661 1.00 1.00 C ATOM 81 O LYS A 7 -12.859 -2.170 5.842 1.00 1.00 O ATOM 82 CB LYS A 7 -11.215 -4.409 4.499 1.00 1.00 C ATOM 83 CG LYS A 7 -10.567 -4.238 5.873 1.00 1.00 C ATOM 84 CD LYS A 7 -10.858 -5.442 6.771 1.00 1.00 C ATOM 85 CE LYS A 7 -9.916 -6.605 6.451 1.00 1.00 C ATOM 86 NZ LYS A 7 -10.543 -7.896 6.814 1.00 1.00 N ATOM 87 H LYS A 7 -9.700 -2.467 4.104 1.00 99.99 H ATOM 88 HA LYS A 7 -11.940 -3.217 2.896 1.00 99.99 H ATOM 89 HB2 LYS A 7 -12.059 -5.095 4.573 1.00 99.99 H ATOM 90 HB3 LYS A 7 -10.500 -4.858 3.809 1.00 99.99 H ATOM 91 HG2 LYS A 7 -9.489 -4.117 5.760 1.00 99.99 H ATOM 92 HG3 LYS A 7 -10.941 -3.329 6.346 1.00 99.99 H ATOM 93 HD2 LYS A 7 -10.747 -5.157 7.817 1.00 99.99 H ATOM 94 HD3 LYS A 7 -11.892 -5.760 6.635 1.00 99.99 H ATOM 95 HE2 LYS A 7 -9.669 -6.600 5.389 1.00 99.99 H ATOM 96 HE3 LYS A 7 -8.979 -6.483 6.997 1.00 99.99 H ATOM 97 HZ1 LYS A 7 -11.358 -7.770 7.404 1.00 99.99 H ATOM 98 HZ2 LYS A 7 -10.850 -8.411 5.997 1.00 99.99 H ATOM 99 N ALA A 8 -14.014 -2.423 3.915 1.00 1.00 N ATOM 100 CA ALA A 8 -15.258 -1.911 4.462 1.00 1.00 C ATOM 101 C ALA A 8 -16.356 -2.963 4.292 1.00 1.00 C ATOM 102 O ALA A 8 -16.225 -3.876 3.479 1.00 1.00 O ATOM 103 CB ALA A 8 -15.608 -0.587 3.783 1.00 1.00 C ATOM 104 H ALA A 8 -14.056 -2.699 2.954 1.00 99.99 H ATOM 105 HA ALA A 8 -15.103 -1.730 5.526 1.00 99.99 H ATOM 106 HB1 ALA A 8 -16.632 -0.630 3.409 1.00 99.99 H ATOM 107 HB2 ALA A 8 -15.519 0.227 4.503 1.00 99.99 H ATOM 108 HB3 ALA A 8 -14.926 -0.413 2.951 1.00 99.99 H ATOM 109 N LYS A 9 -17.414 -2.799 5.073 1.00 1.00 N ATOM 110 CA LYS A 9 -18.534 -3.723 5.018 1.00 1.00 C ATOM 111 C LYS A 9 -19.499 -3.285 3.914 1.00 1.00 C ATOM 112 O LYS A 9 -20.272 -4.093 3.403 1.00 1.00 O ATOM 113 CB LYS A 9 -19.191 -3.849 6.393 1.00 1.00 C ATOM 114 CG LYS A 9 -19.408 -5.318 6.765 1.00 1.00 C ATOM 115 CD LYS A 9 -19.694 -5.469 8.260 1.00 1.00 C ATOM 116 CE LYS A 9 -19.603 -6.935 8.692 1.00 1.00 C ATOM 117 NZ LYS A 9 -18.212 -7.280 9.059 1.00 1.00 N ATOM 118 H LYS A 9 -17.513 -2.054 5.731 1.00 99.99 H ATOM 119 HA LYS A 9 -18.137 -4.704 4.759 1.00 99.99 H ATOM 120 HB2 LYS A 9 -18.566 -3.369 7.145 1.00 99.99 H ATOM 121 HB3 LYS A 9 -20.149 -3.326 6.394 1.00 99.99 H ATOM 122 HG2 LYS A 9 -20.239 -5.724 6.189 1.00 99.99 H ATOM 123 HG3 LYS A 9 -18.523 -5.898 6.500 1.00 99.99 H ATOM 124 HD2 LYS A 9 -18.984 -4.873 8.833 1.00 99.99 H ATOM 125 HD3 LYS A 9 -20.689 -5.081 8.485 1.00 99.99 H ATOM 126 HE2 LYS A 9 -20.264 -7.113 9.539 1.00 99.99 H ATOM 127 HE3 LYS A 9 -19.943 -7.580 7.882 1.00 99.99 H ATOM 128 HZ1 LYS A 9 -17.932 -8.180 8.685 1.00 99.99 H ATOM 129 HZ2 LYS A 9 -17.546 -6.598 8.711 1.00 99.99 H ATOM 130 N ASN A 10 -19.420 -2.006 3.577 1.00 1.00 N ATOM 131 CA ASN A 10 -20.276 -1.450 2.544 1.00 1.00 C ATOM 132 C ASN A 10 -19.409 -0.776 1.478 1.00 1.00 C ATOM 133 O ASN A 10 -19.452 0.443 1.317 1.00 1.00 O ATOM 134 CB ASN A 10 -21.222 -0.395 3.120 1.00 1.00 C ATOM 135 CG ASN A 10 -21.881 0.419 2.003 1.00 1.00 C ATOM 136 OD1 ASN A 10 -21.845 0.064 0.837 1.00 1.00 O ATOM 137 ND2 ASN A 10 -22.485 1.526 2.426 1.00 1.00 N ATOM 138 H ASN A 10 -18.789 -1.355 3.998 1.00 99.99 H ATOM 139 HA ASN A 10 -20.838 -2.297 2.150 1.00 99.99 H ATOM 140 HB2 ASN A 10 -21.990 -0.880 3.723 1.00 99.99 H ATOM 141 HB3 ASN A 10 -20.670 0.272 3.782 1.00 99.99 H ATOM 142 HD21 ASN A 10 -22.945 2.126 1.770 1.00 99.99 H ATOM 143 N GLY A 11 -18.643 -1.598 0.776 1.00 1.00 N ATOM 144 CA GLY A 11 -17.768 -1.097 -0.269 1.00 1.00 C ATOM 145 C GLY A 11 -16.410 -0.685 0.303 1.00 1.00 C ATOM 146 O GLY A 11 -16.344 -0.025 1.340 1.00 1.00 O ATOM 147 H GLY A 11 -18.615 -2.589 0.913 1.00 99.99 H ATOM 148 HA2 GLY A 11 -17.628 -1.865 -1.030 1.00 99.99 H ATOM 149 HA3 GLY A 11 -18.234 -0.244 -0.761 1.00 99.99 H ATOM 150 N ASP A 12 -15.361 -1.090 -0.397 1.00 1.00 N ATOM 151 CA ASP A 12 -14.009 -0.770 0.029 1.00 1.00 C ATOM 152 C ASP A 12 -13.703 0.689 -0.314 1.00 1.00 C ATOM 153 O ASP A 12 -14.488 1.350 -0.991 1.00 1.00 O ATOM 154 CB ASP A 12 -12.983 -1.649 -0.689 1.00 1.00 C ATOM 155 CG ASP A 12 -13.478 -3.048 -1.062 1.00 1.00 C ATOM 156 OD1 ASP A 12 -13.678 -3.908 -0.190 1.00 1.00 O ATOM 157 OD2 ASP A 12 -13.662 -3.244 -2.323 1.00 1.00 O ATOM 158 H ASP A 12 -15.423 -1.625 -1.239 1.00 99.99 H ATOM 159 HA ASP A 12 -13.995 -0.958 1.102 1.00 99.99 H ATOM 160 HB2 ASP A 12 -12.663 -1.140 -1.598 1.00 99.99 H ATOM 161 HB3 ASP A 12 -12.104 -1.749 -0.053 1.00 99.99 H ATOM 162 HD2 ASP A 12 -14.280 -2.549 -2.690 1.00 99.99 H ATOM 163 N VAL A 13 -12.559 1.150 0.171 1.00 1.00 N ATOM 164 CA VAL A 13 -12.139 2.520 -0.076 1.00 1.00 C ATOM 165 C VAL A 13 -10.747 2.515 -0.711 1.00 1.00 C ATOM 166 O VAL A 13 -9.835 1.857 -0.212 1.00 1.00 O ATOM 167 CB VAL A 13 -12.202 3.327 1.222 1.00 1.00 C ATOM 168 CG1 VAL A 13 -11.585 4.716 1.033 1.00 1.00 C ATOM 169 CG2 VAL A 13 -13.639 3.431 1.735 1.00 1.00 C ATOM 170 H VAL A 13 -11.925 0.607 0.721 1.00 99.99 H ATOM 171 HA VAL A 13 -12.845 2.958 -0.782 1.00 99.99 H ATOM 172 HB VAL A 13 -11.614 2.800 1.973 1.00 99.99 H ATOM 173 HG13 VAL A 13 -11.974 5.165 0.120 1.00 99.99 H ATOM 174 HG21 VAL A 13 -13.792 2.709 2.538 1.00 99.99 H ATOM 175 N LYS A 14 -10.628 3.256 -1.803 1.00 1.00 N ATOM 176 CA LYS A 14 -9.362 3.346 -2.511 1.00 1.00 C ATOM 177 C LYS A 14 -8.629 4.617 -2.078 1.00 1.00 C ATOM 178 O LYS A 14 -8.851 5.688 -2.641 1.00 1.00 O ATOM 179 CB LYS A 14 -9.586 3.249 -4.022 1.00 1.00 C ATOM 180 CG LYS A 14 -8.266 3.397 -4.783 1.00 1.00 C ATOM 181 CD LYS A 14 -7.385 2.160 -4.596 1.00 1.00 C ATOM 182 CE LYS A 14 -7.126 1.465 -5.934 1.00 1.00 C ATOM 183 NZ LYS A 14 -6.112 2.207 -6.716 1.00 1.00 N ATOM 184 H LYS A 14 -11.374 3.788 -2.202 1.00 99.99 H ATOM 185 HA LYS A 14 -8.762 2.484 -2.218 1.00 99.99 H ATOM 186 HB2 LYS A 14 -10.045 2.291 -4.265 1.00 99.99 H ATOM 187 HB3 LYS A 14 -10.282 4.026 -4.340 1.00 99.99 H ATOM 188 HG2 LYS A 14 -8.468 3.548 -5.842 1.00 99.99 H ATOM 189 HG3 LYS A 14 -7.736 4.282 -4.430 1.00 99.99 H ATOM 190 HD2 LYS A 14 -6.436 2.450 -4.143 1.00 99.99 H ATOM 191 HD3 LYS A 14 -7.867 1.466 -3.909 1.00 99.99 H ATOM 192 HE2 LYS A 14 -6.785 0.444 -5.761 1.00 99.99 H ATOM 193 HE3 LYS A 14 -8.055 1.399 -6.502 1.00 99.99 H ATOM 194 HZ1 LYS A 14 -5.775 3.026 -6.221 1.00 99.99 H ATOM 195 HZ2 LYS A 14 -5.301 1.636 -6.926 1.00 99.99 H ATOM 196 N PHE A 15 -7.771 4.457 -1.082 1.00 1.00 N ATOM 197 CA PHE A 15 -7.003 5.579 -0.567 1.00 1.00 C ATOM 198 C PHE A 15 -5.533 5.472 -0.977 1.00 1.00 C ATOM 199 O PHE A 15 -4.784 4.621 -0.502 1.00 1.00 O ATOM 200 CB PHE A 15 -7.101 5.524 0.959 1.00 1.00 C ATOM 201 CG PHE A 15 -6.605 6.791 1.660 1.00 1.00 C ATOM 202 CD1 PHE A 15 -6.790 8.006 1.078 1.00 1.00 C ATOM 203 CD2 PHE A 15 -5.980 6.701 2.864 1.00 1.00 C ATOM 204 CE1 PHE A 15 -6.331 9.182 1.728 1.00 1.00 C ATOM 205 CE2 PHE A 15 -5.522 7.876 3.515 1.00 1.00 C ATOM 206 CZ PHE A 15 -5.706 9.093 2.933 1.00 1.00 C ATOM 207 H PHE A 15 -7.595 3.582 -0.630 1.00 99.99 H ATOM 208 HA PHE A 15 -7.433 6.486 -0.992 1.00 99.99 H ATOM 209 HB2 PHE A 15 -8.138 5.347 1.241 1.00 99.99 H ATOM 210 HB3 PHE A 15 -6.523 4.672 1.319 1.00 99.99 H ATOM 211 HD1 PHE A 15 -7.291 8.077 0.112 1.00 99.99 H ATOM 212 HD2 PHE A 15 -5.833 5.727 3.330 1.00 99.99 H ATOM 213 HE1 PHE A 15 -6.479 10.155 1.262 1.00 99.99 H ATOM 214 HE2 PHE A 15 -5.020 7.805 4.480 1.00 99.99 H ATOM 215 HZ PHE A 15 -5.353 9.995 3.432 1.00 99.99 H ATOM 216 N PRO A 16 -5.134 6.368 -1.883 1.00 1.00 N ATOM 217 CA PRO A 16 -3.789 6.450 -2.410 1.00 1.00 C ATOM 218 C PRO A 16 -2.900 7.202 -1.430 1.00 1.00 C ATOM 219 O PRO A 16 -2.827 8.427 -1.504 1.00 1.00 O ATOM 220 CB PRO A 16 -3.929 7.220 -3.722 1.00 1.00 C ATOM 221 CG PRO A 16 -5.088 8.157 -3.419 1.00 1.00 C ATOM 222 CD PRO A 16 -5.989 7.381 -2.461 1.00 1.00 C ATOM 223 HA PRO A 16 -3.378 5.457 -2.595 1.00 99.99 H ATOM 224 HB2 PRO A 16 -3.044 7.811 -3.951 1.00 99.99 H ATOM 225 HB3 PRO A 16 -4.143 6.518 -4.528 1.00 99.99 H ATOM 226 HG2 PRO A 16 -5.150 9.221 -3.189 1.00 99.99 H ATOM 227 HG3 PRO A 16 -5.337 7.973 -4.464 1.00 99.99 H ATOM 228 HD2 PRO A 16 -6.404 8.039 -1.698 1.00 99.99 H ATOM 229 HD3 PRO A 16 -6.789 6.896 -3.020 1.00 99.99 H ATOM 230 N HIS A 17 -2.246 6.465 -0.530 1.00 1.00 N ATOM 231 CA HIS A 17 -1.360 7.044 0.473 1.00 1.00 C ATOM 232 C HIS A 17 -0.216 7.807 -0.219 1.00 1.00 C ATOM 233 O HIS A 17 -0.039 9.001 0.014 1.00 1.00 O ATOM 234 CB HIS A 17 -0.894 5.933 1.426 1.00 1.00 C ATOM 235 CG HIS A 17 -0.225 6.372 2.707 1.00 1.00 C ATOM 236 ND1 HIS A 17 1.086 6.223 2.923 1.00 1.00 N ATOM 237 CD2 HIS A 17 -0.733 6.965 3.838 1.00 1.00 C ATOM 238 CE1 HIS A 17 1.382 6.704 4.141 1.00 1.00 C ATOM 239 NE2 HIS A 17 0.296 7.175 4.749 1.00 1.00 N ATOM 240 H HIS A 17 -2.368 5.463 -0.545 1.00 99.99 H ATOM 241 HA HIS A 17 -1.950 7.780 1.067 1.00 99.99 H ATOM 242 HB2 HIS A 17 -1.787 5.325 1.704 1.00 99.99 H ATOM 243 HB3 HIS A 17 -0.173 5.290 0.872 1.00 99.99 H ATOM 244 HD1 HIS A 17 1.732 5.808 2.255 1.00 99.99 H ATOM 245 HD2 HIS A 17 -1.790 7.232 3.997 1.00 99.99 H ATOM 246 HE1 HIS A 17 2.393 6.707 4.578 1.00 99.99 H ATOM 247 N LYS A 18 0.523 7.086 -1.049 1.00 1.00 N ATOM 248 CA LYS A 18 1.636 7.682 -1.770 1.00 1.00 C ATOM 249 C LYS A 18 1.203 9.034 -2.340 1.00 1.00 C ATOM 250 O LYS A 18 2.003 9.966 -2.413 1.00 1.00 O ATOM 251 CB LYS A 18 2.171 6.713 -2.827 1.00 1.00 C ATOM 252 CG LYS A 18 2.789 7.470 -4.003 1.00 1.00 C ATOM 253 CD LYS A 18 3.974 6.701 -4.589 1.00 1.00 C ATOM 254 CE LYS A 18 4.860 7.619 -5.434 1.00 1.00 C ATOM 255 NZ LYS A 18 6.245 7.625 -4.913 1.00 1.00 N ATOM 256 H LYS A 18 0.373 6.114 -1.233 1.00 99.99 H ATOM 257 HA LYS A 18 2.437 7.850 -1.052 1.00 99.99 H ATOM 258 HB2 LYS A 18 2.918 6.057 -2.378 1.00 99.99 H ATOM 259 HB3 LYS A 18 1.362 6.076 -3.183 1.00 99.99 H ATOM 260 HG2 LYS A 18 2.035 7.627 -4.774 1.00 99.99 H ATOM 261 HG3 LYS A 18 3.118 8.455 -3.673 1.00 99.99 H ATOM 262 HD2 LYS A 18 4.563 6.262 -3.783 1.00 99.99 H ATOM 263 HD3 LYS A 18 3.609 5.876 -5.202 1.00 99.99 H ATOM 264 HE2 LYS A 18 4.857 7.283 -6.471 1.00 99.99 H ATOM 265 HE3 LYS A 18 4.457 8.631 -5.425 1.00 99.99 H ATOM 266 HZ1 LYS A 18 6.830 8.299 -5.394 1.00 99.99 H ATOM 267 HZ2 LYS A 18 6.279 7.860 -3.927 1.00 99.99 H ATOM 268 N ALA A 19 -0.061 9.099 -2.729 1.00 1.00 N ATOM 269 CA ALA A 19 -0.610 10.322 -3.290 1.00 1.00 C ATOM 270 C ALA A 19 -0.762 11.364 -2.180 1.00 1.00 C ATOM 271 O ALA A 19 -0.445 12.537 -2.368 1.00 1.00 O ATOM 272 CB ALA A 19 -1.938 10.014 -3.985 1.00 1.00 C ATOM 273 H ALA A 19 -0.706 8.337 -2.666 1.00 99.99 H ATOM 274 HA ALA A 19 0.097 10.694 -4.032 1.00 99.99 H ATOM 275 HB1 ALA A 19 -1.798 9.193 -4.688 1.00 99.99 H ATOM 276 HB2 ALA A 19 -2.682 9.733 -3.240 1.00 99.99 H ATOM 277 HB3 ALA A 19 -2.279 10.899 -4.524 1.00 99.99 H ATOM 278 N HIS A 20 -1.251 10.897 -1.031 1.00 1.00 N ATOM 279 CA HIS A 20 -1.466 11.740 0.139 1.00 1.00 C ATOM 280 C HIS A 20 -0.151 11.883 0.926 1.00 1.00 C ATOM 281 O HIS A 20 -0.170 12.240 2.103 1.00 1.00 O ATOM 282 CB HIS A 20 -2.633 11.167 0.958 1.00 1.00 C ATOM 283 CG HIS A 20 -4.027 11.534 0.505 1.00 1.00 C ATOM 284 ND1 HIS A 20 -4.484 11.250 -0.719 1.00 1.00 N ATOM 285 CD2 HIS A 20 -5.053 12.175 1.157 1.00 1.00 C ATOM 286 CE1 HIS A 20 -5.744 11.697 -0.825 1.00 1.00 C ATOM 287 NE2 HIS A 20 -6.146 12.276 0.305 1.00 1.00 N ATOM 288 H HIS A 20 -1.485 9.916 -0.968 1.00 99.99 H ATOM 289 HA HIS A 20 -1.763 12.752 -0.217 1.00 99.99 H ATOM 290 HB2 HIS A 20 -2.553 10.054 0.933 1.00 99.99 H ATOM 291 HB3 HIS A 20 -2.517 11.517 2.009 1.00 99.99 H ATOM 292 HD1 HIS A 20 -3.942 10.773 -1.437 1.00 99.99 H ATOM 293 HD2 HIS A 20 -5.014 12.548 2.192 1.00 99.99 H ATOM 294 HE1 HIS A 20 -6.366 11.597 -1.729 1.00 99.99 H ATOM 295 N GLN A 21 0.951 11.602 0.246 1.00 1.00 N ATOM 296 CA GLN A 21 2.260 11.697 0.868 1.00 1.00 C ATOM 297 C GLN A 21 3.008 12.925 0.344 1.00 1.00 C ATOM 298 O GLN A 21 4.180 13.124 0.659 1.00 1.00 O ATOM 299 CB GLN A 21 3.072 10.420 0.635 1.00 1.00 C ATOM 300 CG GLN A 21 3.790 9.988 1.915 1.00 1.00 C ATOM 301 CD GLN A 21 4.043 8.479 1.918 1.00 1.00 C ATOM 302 OE1 GLN A 21 4.681 7.929 1.036 1.00 1.00 O ATOM 303 NE2 GLN A 21 3.509 7.844 2.958 1.00 1.00 N ATOM 304 H GLN A 21 0.957 11.312 -0.712 1.00 99.99 H ATOM 305 HA GLN A 21 2.067 11.808 1.934 1.00 99.99 H ATOM 306 HB2 GLN A 21 2.411 9.622 0.297 1.00 99.99 H ATOM 307 HB3 GLN A 21 3.801 10.588 -0.157 1.00 99.99 H ATOM 308 HG2 GLN A 21 4.739 10.520 2.001 1.00 99.99 H ATOM 309 HG3 GLN A 21 3.191 10.263 2.784 1.00 99.99 H ATOM 310 HE21 GLN A 21 3.619 6.855 3.049 1.00 99.99 H ATOM 311 N LYS A 22 2.299 13.717 -0.447 1.00 1.00 N ATOM 312 CA LYS A 22 2.882 14.920 -1.018 1.00 1.00 C ATOM 313 C LYS A 22 1.761 15.862 -1.462 1.00 1.00 C ATOM 314 O LYS A 22 1.842 16.471 -2.528 1.00 1.00 O ATOM 315 CB LYS A 22 3.864 14.562 -2.135 1.00 1.00 C ATOM 316 CG LYS A 22 5.204 15.272 -1.934 1.00 1.00 C ATOM 317 CD LYS A 22 6.360 14.419 -2.462 1.00 1.00 C ATOM 318 CE LYS A 22 7.708 15.075 -2.158 1.00 1.00 C ATOM 319 NZ LYS A 22 8.679 14.789 -3.238 1.00 1.00 N ATOM 320 H LYS A 22 1.346 13.548 -0.699 1.00 99.99 H ATOM 321 HA LYS A 22 3.453 15.411 -0.231 1.00 99.99 H ATOM 322 HB2 LYS A 22 4.018 13.484 -2.157 1.00 99.99 H ATOM 323 HB3 LYS A 22 3.440 14.843 -3.100 1.00 99.99 H ATOM 324 HG2 LYS A 22 5.192 16.233 -2.448 1.00 99.99 H ATOM 325 HG3 LYS A 22 5.355 15.479 -0.875 1.00 99.99 H ATOM 326 HD2 LYS A 22 6.323 13.429 -2.009 1.00 99.99 H ATOM 327 HD3 LYS A 22 6.252 14.281 -3.538 1.00 99.99 H ATOM 328 HE2 LYS A 22 7.580 16.153 -2.052 1.00 99.99 H ATOM 329 HE3 LYS A 22 8.093 14.706 -1.208 1.00 99.99 H ATOM 330 HZ1 LYS A 22 8.234 14.754 -4.149 1.00 99.99 H ATOM 331 HZ2 LYS A 22 9.406 15.495 -3.292 1.00 99.99 H ATOM 332 N ALA A 23 0.740 15.953 -0.622 1.00 1.00 N ATOM 333 CA ALA A 23 -0.396 16.811 -0.915 1.00 1.00 C ATOM 334 C ALA A 23 -0.710 17.671 0.310 1.00 1.00 C ATOM 335 O ALA A 23 -0.841 18.890 0.201 1.00 1.00 O ATOM 336 CB ALA A 23 -1.587 15.953 -1.346 1.00 1.00 C ATOM 337 H ALA A 23 0.681 15.456 0.242 1.00 99.99 H ATOM 338 HA ALA A 23 -0.116 17.462 -1.744 1.00 99.99 H ATOM 339 HB1 ALA A 23 -2.498 16.550 -1.312 1.00 99.99 H ATOM 340 HB2 ALA A 23 -1.428 15.592 -2.362 1.00 99.99 H ATOM 341 HB3 ALA A 23 -1.685 15.103 -0.670 1.00 99.99 H ATOM 342 N VAL A 24 -0.820 17.004 1.449 1.00 1.00 N ATOM 343 CA VAL A 24 -1.116 17.692 2.694 1.00 1.00 C ATOM 344 C VAL A 24 0.179 18.265 3.275 1.00 1.00 C ATOM 345 O VAL A 24 1.092 17.543 3.667 1.00 1.00 O ATOM 346 CB VAL A 24 -1.836 16.746 3.657 1.00 1.00 C ATOM 347 CG1 VAL A 24 -1.971 17.375 5.045 1.00 1.00 C ATOM 348 CG2 VAL A 24 -3.203 16.338 3.104 1.00 1.00 C ATOM 349 H VAL A 24 -0.712 16.013 1.530 1.00 99.99 H ATOM 350 HA VAL A 24 -1.791 18.515 2.462 1.00 99.99 H ATOM 351 HB VAL A 24 -1.232 15.844 3.755 1.00 99.99 H ATOM 352 HG13 VAL A 24 -1.299 18.229 5.124 1.00 99.99 H ATOM 353 HG21 VAL A 24 -3.909 17.156 3.239 1.00 99.99 H ATOM 354 N PRO A 25 0.235 19.598 3.321 1.00 1.00 N ATOM 355 CA PRO A 25 1.361 20.349 3.833 1.00 1.00 C ATOM 356 C PRO A 25 1.856 19.713 5.123 1.00 1.00 C ATOM 357 O PRO A 25 2.994 19.248 5.158 1.00 1.00 O ATOM 358 CB PRO A 25 0.812 21.751 4.089 1.00 1.00 C ATOM 359 CG PRO A 25 -0.310 21.887 3.149 1.00 1.00 C ATOM 360 CD PRO A 25 -0.822 20.476 2.868 1.00 1.00 C ATOM 361 HA PRO A 25 2.171 20.386 3.103 1.00 99.99 H ATOM 362 HB2 PRO A 25 0.442 21.871 5.107 1.00 99.99 H ATOM 363 HB3 PRO A 25 1.587 22.485 3.871 1.00 99.99 H ATOM 364 HG2 PRO A 25 -1.146 22.522 3.439 1.00 99.99 H ATOM 365 HG3 PRO A 25 0.220 22.312 2.296 1.00 99.99 H ATOM 366 HD2 PRO A 25 -1.754 20.289 3.399 1.00 99.99 H ATOM 367 HD3 PRO A 25 -0.962 20.341 1.796 1.00 99.99 H ATOM 368 N ASP A 26 1.009 19.703 6.143 1.00 1.00 N ATOM 369 CA ASP A 26 1.384 19.121 7.420 1.00 1.00 C ATOM 370 C ASP A 26 0.786 17.718 7.532 1.00 1.00 C ATOM 371 O ASP A 26 -0.132 17.491 8.318 1.00 1.00 O ATOM 372 CB ASP A 26 0.849 19.957 8.585 1.00 1.00 C ATOM 373 CG ASP A 26 1.528 19.700 9.931 1.00 1.00 C ATOM 374 OD1 ASP A 26 2.694 19.282 9.989 1.00 1.00 O ATOM 375 OD2 ASP A 26 0.800 19.951 10.967 1.00 1.00 O ATOM 376 H ASP A 26 0.086 20.083 6.106 1.00 99.99 H ATOM 377 HA ASP A 26 2.474 19.111 7.422 1.00 99.99 H ATOM 378 HB2 ASP A 26 0.959 21.013 8.335 1.00 99.99 H ATOM 379 HB3 ASP A 26 -0.219 19.764 8.690 1.00 99.99 H ATOM 380 HD2 ASP A 26 0.087 19.255 11.059 1.00 99.99 H ATOM 381 N CYS A 27 1.330 16.812 6.732 1.00 1.00 N ATOM 382 CA CYS A 27 0.862 15.437 6.731 1.00 1.00 C ATOM 383 C CYS A 27 0.608 15.014 8.180 1.00 1.00 C ATOM 384 O CYS A 27 -0.250 14.172 8.443 1.00 1.00 O ATOM 385 CB CYS A 27 1.850 14.503 6.029 1.00 1.00 C ATOM 386 SG CYS A 27 2.516 13.160 7.079 1.00 1.00 S ATOM 387 H CYS A 27 2.077 17.005 6.095 1.00 99.99 H ATOM 388 HA CYS A 27 -0.064 15.422 6.155 1.00 99.99 H ATOM 389 HB2 CYS A 27 1.356 14.059 5.164 1.00 99.99 H ATOM 390 HB3 CYS A 27 2.682 15.097 5.651 1.00 99.99 H ATOM 391 N LYS A 28 1.369 15.617 9.080 1.00 1.00 N ATOM 392 CA LYS A 28 1.237 15.314 10.495 1.00 1.00 C ATOM 393 C LYS A 28 -0.232 15.438 10.905 1.00 1.00 C ATOM 394 O LYS A 28 -0.647 14.878 11.917 1.00 1.00 O ATOM 395 CB LYS A 28 2.182 16.190 11.320 1.00 1.00 C ATOM 396 CG LYS A 28 3.640 15.778 11.107 1.00 1.00 C ATOM 397 CD LYS A 28 4.245 15.217 12.395 1.00 1.00 C ATOM 398 CE LYS A 28 5.452 16.044 12.840 1.00 1.00 C ATOM 399 NZ LYS A 28 5.243 16.574 14.206 1.00 1.00 N ATOM 400 H LYS A 28 2.064 16.301 8.857 1.00 99.99 H ATOM 401 HA LYS A 28 1.550 14.280 10.638 1.00 99.99 H ATOM 402 HB2 LYS A 28 2.052 17.236 11.042 1.00 99.99 H ATOM 403 HB3 LYS A 28 1.928 16.108 12.377 1.00 99.99 H ATOM 404 HG2 LYS A 28 3.698 15.029 10.318 1.00 99.99 H ATOM 405 HG3 LYS A 28 4.220 16.638 10.773 1.00 99.99 H ATOM 406 HD2 LYS A 28 3.492 15.213 13.183 1.00 99.99 H ATOM 407 HD3 LYS A 28 4.547 14.181 12.238 1.00 99.99 H ATOM 408 HE2 LYS A 28 6.352 15.429 12.816 1.00 99.99 H ATOM 409 HE3 LYS A 28 5.612 16.868 12.144 1.00 99.99 H ATOM 410 HZ1 LYS A 28 5.917 17.294 14.442 1.00 99.99 H ATOM 411 HZ2 LYS A 28 4.323 16.986 14.317 1.00 99.99 H ATOM 412 N LYS A 29 -0.978 16.177 10.096 1.00 1.00 N ATOM 413 CA LYS A 29 -2.392 16.381 10.361 1.00 1.00 C ATOM 414 C LYS A 29 -3.012 15.067 10.839 1.00 1.00 C ATOM 415 O LYS A 29 -3.625 15.018 11.905 1.00 1.00 O ATOM 416 CB LYS A 29 -3.086 16.979 9.135 1.00 1.00 C ATOM 417 CG LYS A 29 -4.474 17.510 9.496 1.00 1.00 C ATOM 418 CD LYS A 29 -4.969 18.510 8.448 1.00 1.00 C ATOM 419 CE LYS A 29 -4.951 19.937 9.001 1.00 1.00 C ATOM 420 NZ LYS A 29 -6.285 20.305 9.526 1.00 1.00 N ATOM 421 H LYS A 29 -0.632 16.630 9.274 1.00 99.99 H ATOM 422 HA LYS A 29 -2.470 17.114 11.165 1.00 99.99 H ATOM 423 HB2 LYS A 29 -2.479 17.786 8.726 1.00 99.99 H ATOM 424 HB3 LYS A 29 -3.174 16.221 8.357 1.00 99.99 H ATOM 425 HG2 LYS A 29 -5.177 16.681 9.572 1.00 99.99 H ATOM 426 HG3 LYS A 29 -4.441 17.990 10.475 1.00 99.99 H ATOM 427 HD2 LYS A 29 -4.339 18.453 7.560 1.00 99.99 H ATOM 428 HD3 LYS A 29 -5.980 18.248 8.139 1.00 99.99 H ATOM 429 HE2 LYS A 29 -4.207 20.018 9.793 1.00 99.99 H ATOM 430 HE3 LYS A 29 -4.657 20.634 8.215 1.00 99.99 H ATOM 431 HZ1 LYS A 29 -7.033 19.991 8.918 1.00 99.99 H ATOM 432 HZ2 LYS A 29 -6.459 19.901 10.439 1.00 99.99 H ATOM 433 N CYS A 30 -2.832 14.035 10.028 1.00 1.00 N ATOM 434 CA CYS A 30 -3.366 12.724 10.356 1.00 1.00 C ATOM 435 C CYS A 30 -2.442 12.073 11.386 1.00 1.00 C ATOM 436 O CYS A 30 -2.903 11.466 12.352 1.00 1.00 O ATOM 437 CB CYS A 30 -3.532 11.854 9.108 1.00 1.00 C ATOM 438 SG CYS A 30 -4.005 12.894 7.678 1.00 1.00 S ATOM 439 H CYS A 30 -2.332 14.084 9.163 1.00 99.99 H ATOM 440 HA CYS A 30 -4.359 12.886 10.774 1.00 99.99 H ATOM 441 HB2 CYS A 30 -2.602 11.328 8.894 1.00 99.99 H ATOM 442 HB3 CYS A 30 -4.295 11.094 9.284 1.00 99.99 H ATOM 443 N HIS A 31 -1.139 12.219 11.148 1.00 1.00 N ATOM 444 CA HIS A 31 -0.107 11.668 12.020 1.00 1.00 C ATOM 445 C HIS A 31 0.405 12.761 12.976 1.00 1.00 C ATOM 446 O HIS A 31 1.598 13.062 12.988 1.00 1.00 O ATOM 447 CB HIS A 31 0.985 11.026 11.152 1.00 1.00 C ATOM 448 CG HIS A 31 0.536 9.981 10.157 1.00 1.00 C ATOM 449 ND1 HIS A 31 -0.308 8.997 10.478 1.00 1.00 N ATOM 450 CD2 HIS A 31 0.844 9.801 8.829 1.00 1.00 C ATOM 451 CE1 HIS A 31 -0.518 8.233 9.394 1.00 1.00 C ATOM 452 NE2 HIS A 31 0.170 8.685 8.348 1.00 1.00 N ATOM 453 H HIS A 31 -0.851 12.735 10.328 1.00 99.99 H ATOM 454 HA HIS A 31 -0.571 10.865 12.635 1.00 99.99 H ATOM 455 HB2 HIS A 31 1.491 11.839 10.580 1.00 99.99 H ATOM 456 HB3 HIS A 31 1.724 10.546 11.833 1.00 99.99 H ATOM 457 HD1 HIS A 31 -0.713 8.868 11.404 1.00 99.99 H ATOM 458 HD2 HIS A 31 1.520 10.441 8.240 1.00 99.99 H ATOM 459 HE1 HIS A 31 -1.172 7.347 9.374 1.00 99.99 H ATOM 460 N GLU A 32 -0.518 13.317 13.747 1.00 1.00 N ATOM 461 CA GLU A 32 -0.171 14.361 14.696 1.00 1.00 C ATOM 462 C GLU A 32 0.907 13.862 15.661 1.00 1.00 C ATOM 463 O GLU A 32 1.902 14.548 15.893 1.00 1.00 O ATOM 464 CB GLU A 32 -1.407 14.843 15.457 1.00 1.00 C ATOM 465 CG GLU A 32 -2.255 15.777 14.590 1.00 1.00 C ATOM 466 CD GLU A 32 -2.735 16.987 15.395 1.00 1.00 C ATOM 467 OE1 GLU A 32 -2.074 17.387 16.365 1.00 1.00 O ATOM 468 OE2 GLU A 32 -3.835 17.517 14.979 1.00 1.00 O ATOM 469 H GLU A 32 -1.486 13.065 13.730 1.00 99.99 H ATOM 470 HA GLU A 32 0.221 15.180 14.094 1.00 99.99 H ATOM 471 HB2 GLU A 32 -2.005 13.987 15.767 1.00 99.99 H ATOM 472 HB3 GLU A 32 -1.100 15.363 16.365 1.00 99.99 H ATOM 473 HG2 GLU A 32 -1.670 16.113 13.734 1.00 99.99 H ATOM 474 HG3 GLU A 32 -3.114 15.233 14.197 1.00 99.99 H ATOM 475 HE2 GLU A 32 -3.778 17.696 13.997 1.00 99.99 H ATOM 476 N LYS A 33 0.674 12.674 16.198 1.00 1.00 N ATOM 477 CA LYS A 33 1.612 12.076 17.132 1.00 1.00 C ATOM 478 C LYS A 33 2.814 11.530 16.361 1.00 1.00 C ATOM 479 O LYS A 33 3.948 11.944 16.596 1.00 1.00 O ATOM 480 CB LYS A 33 0.910 11.030 18.000 1.00 1.00 C ATOM 481 CG LYS A 33 0.146 11.693 19.148 1.00 1.00 C ATOM 482 CD LYS A 33 -0.790 12.785 18.626 1.00 1.00 C ATOM 483 CE LYS A 33 -1.928 13.051 19.613 1.00 1.00 C ATOM 484 NZ LYS A 33 -2.763 14.180 19.148 1.00 1.00 N ATOM 485 H LYS A 33 -0.138 12.123 16.004 1.00 99.99 H ATOM 486 HA LYS A 33 1.958 12.867 17.798 1.00 99.99 H ATOM 487 HB2 LYS A 33 0.222 10.447 17.389 1.00 99.99 H ATOM 488 HB3 LYS A 33 1.647 10.334 18.403 1.00 99.99 H ATOM 489 HG2 LYS A 33 -0.432 10.942 19.687 1.00 99.99 H ATOM 490 HG3 LYS A 33 0.852 12.123 19.859 1.00 99.99 H ATOM 491 HD2 LYS A 33 -0.226 13.702 18.459 1.00 99.99 H ATOM 492 HD3 LYS A 33 -1.202 12.485 17.662 1.00 99.99 H ATOM 493 HE2 LYS A 33 -2.541 12.157 19.719 1.00 99.99 H ATOM 494 HE3 LYS A 33 -1.518 13.274 20.598 1.00 99.99 H ATOM 495 HZ1 LYS A 33 -2.466 14.526 18.242 1.00 99.99 H ATOM 496 HZ2 LYS A 33 -3.739 13.920 19.058 1.00 99.99 H ATOM 497 N GLY A 34 2.527 10.607 15.455 1.00 1.00 N ATOM 498 CA GLY A 34 3.571 9.999 14.648 1.00 1.00 C ATOM 499 C GLY A 34 2.980 9.001 13.649 1.00 1.00 C ATOM 500 O GLY A 34 1.776 8.762 13.600 1.00 1.00 O ATOM 501 H GLY A 34 1.602 10.274 15.270 1.00 99.99 H ATOM 502 HA2 GLY A 34 4.119 10.774 14.113 1.00 99.99 H ATOM 503 HA3 GLY A 34 4.286 9.490 15.295 1.00 99.99 H ATOM 504 N PRO A 35 3.870 8.417 12.842 1.00 1.00 N ATOM 505 CA PRO A 35 3.533 7.443 11.826 1.00 1.00 C ATOM 506 C PRO A 35 3.399 6.067 12.463 1.00 1.00 C ATOM 507 O PRO A 35 4.232 5.716 13.298 1.00 1.00 O ATOM 508 CB PRO A 35 4.703 7.482 10.845 1.00 1.00 C ATOM 509 CG PRO A 35 5.733 8.633 11.411 1.00 1.00 C ATOM 510 CD PRO A 35 5.293 8.675 12.873 1.00 1.00 C ATOM 511 HA PRO A 35 2.605 7.709 11.321 1.00 99.99 H ATOM 512 HB2 PRO A 35 5.237 6.532 10.800 1.00 99.99 H ATOM 513 HB3 PRO A 35 4.333 7.764 9.859 1.00 99.99 H ATOM 514 HG2 PRO A 35 6.791 8.884 11.348 1.00 99.99 H ATOM 515 HG3 PRO A 35 5.139 9.295 10.781 1.00 99.99 H ATOM 516 HD2 PRO A 35 5.824 7.925 13.461 1.00 99.99 H ATOM 517 HD3 PRO A 35 5.465 9.671 13.282 1.00 99.99 H ATOM 518 N GLY A 36 2.375 5.326 12.066 1.00 1.00 N ATOM 519 CA GLY A 36 2.156 3.997 12.613 1.00 1.00 C ATOM 520 C GLY A 36 0.668 3.645 12.617 1.00 1.00 C ATOM 521 O GLY A 36 -0.114 4.225 11.864 1.00 1.00 O ATOM 522 H GLY A 36 1.703 5.619 11.386 1.00 99.99 H ATOM 523 HA2 GLY A 36 2.706 3.264 12.024 1.00 99.99 H ATOM 524 HA3 GLY A 36 2.548 3.949 13.629 1.00 99.99 H ATOM 525 N LYS A 37 0.320 2.696 13.474 1.00 1.00 N ATOM 526 CA LYS A 37 -1.062 2.259 13.586 1.00 1.00 C ATOM 527 C LYS A 37 -1.874 3.332 14.313 1.00 1.00 C ATOM 528 O LYS A 37 -1.854 3.404 15.541 1.00 1.00 O ATOM 529 CB LYS A 37 -1.136 0.879 14.244 1.00 1.00 C ATOM 530 CG LYS A 37 -0.118 -0.079 13.623 1.00 1.00 C ATOM 531 CD LYS A 37 1.200 -0.060 14.400 1.00 1.00 C ATOM 532 CE LYS A 37 1.703 -1.481 14.661 1.00 1.00 C ATOM 533 NZ LYS A 37 3.177 -1.492 14.798 1.00 1.00 N ATOM 534 H LYS A 37 0.962 2.229 14.083 1.00 99.99 H ATOM 535 HA LYS A 37 -1.455 2.154 12.575 1.00 99.99 H ATOM 536 HB2 LYS A 37 -0.947 0.972 15.314 1.00 99.99 H ATOM 537 HB3 LYS A 37 -2.141 0.473 14.132 1.00 99.99 H ATOM 538 HG2 LYS A 37 -0.525 -1.091 13.615 1.00 99.99 H ATOM 539 HG3 LYS A 37 0.064 0.200 12.585 1.00 99.99 H ATOM 540 HD2 LYS A 37 1.949 0.498 13.838 1.00 99.99 H ATOM 541 HD3 LYS A 37 1.059 0.459 15.349 1.00 99.99 H ATOM 542 HE2 LYS A 37 1.245 -1.876 15.567 1.00 99.99 H ATOM 543 HE3 LYS A 37 1.405 -2.135 13.842 1.00 99.99 H ATOM 544 HZ1 LYS A 37 3.468 -1.450 15.769 1.00 99.99 H ATOM 545 HZ2 LYS A 37 3.589 -2.330 14.403 1.00 99.99 H ATOM 546 N ILE A 38 -2.568 4.139 13.526 1.00 1.00 N ATOM 547 CA ILE A 38 -3.385 5.205 14.079 1.00 1.00 C ATOM 548 C ILE A 38 -4.294 4.632 15.169 1.00 1.00 C ATOM 549 O ILE A 38 -4.937 3.602 14.969 1.00 1.00 O ATOM 550 CB ILE A 38 -4.144 5.932 12.967 1.00 1.00 C ATOM 551 CG1 ILE A 38 -3.176 6.616 11.999 1.00 1.00 C ATOM 552 CG2 ILE A 38 -5.162 6.915 13.549 1.00 1.00 C ATOM 553 CD1 ILE A 38 -3.921 7.194 10.795 1.00 1.00 C ATOM 554 H ILE A 38 -2.579 4.074 12.528 1.00 99.99 H ATOM 555 HA ILE A 38 -2.712 5.930 14.537 1.00 99.99 H ATOM 556 HB ILE A 38 -4.703 5.192 12.394 1.00 99.99 H ATOM 557 HG12 ILE A 38 -2.640 7.412 12.517 1.00 99.99 H ATOM 558 HG23 ILE A 38 -5.568 7.533 12.748 1.00 99.99 H ATOM 559 HD11 ILE A 38 -3.561 6.719 9.882 1.00 99.99 H ATOM 560 N GLU A 39 -4.317 5.323 16.299 1.00 1.00 N ATOM 561 CA GLU A 39 -5.135 4.896 17.421 1.00 1.00 C ATOM 562 C GLU A 39 -6.452 4.300 16.921 1.00 1.00 C ATOM 563 O GLU A 39 -7.412 5.028 16.671 1.00 1.00 O ATOM 564 CB GLU A 39 -5.390 6.054 18.387 1.00 1.00 C ATOM 565 CG GLU A 39 -4.718 5.800 19.738 1.00 1.00 C ATOM 566 CD GLU A 39 -5.554 4.850 20.597 1.00 1.00 C ATOM 567 OE1 GLU A 39 -5.729 3.678 20.233 1.00 1.00 O ATOM 568 OE2 GLU A 39 -6.029 5.368 21.678 1.00 1.00 O ATOM 569 H GLU A 39 -3.791 6.159 16.454 1.00 99.99 H ATOM 570 HA GLU A 39 -4.552 4.128 17.930 1.00 99.99 H ATOM 571 HB2 GLU A 39 -5.011 6.981 17.957 1.00 99.99 H ATOM 572 HB3 GLU A 39 -6.463 6.185 18.530 1.00 99.99 H ATOM 573 HG2 GLU A 39 -3.726 5.376 19.580 1.00 99.99 H ATOM 574 HG3 GLU A 39 -4.580 6.746 20.263 1.00 99.99 H ATOM 575 HE2 GLU A 39 -6.948 5.725 21.511 1.00 99.99 H ATOM 576 N GLY A 40 -6.456 2.981 16.789 1.00 1.00 N ATOM 577 CA GLY A 40 -7.640 2.279 16.323 1.00 1.00 C ATOM 578 C GLY A 40 -8.505 3.186 15.445 1.00 1.00 C ATOM 579 O GLY A 40 -9.442 3.817 15.933 1.00 1.00 O ATOM 580 H GLY A 40 -5.671 2.396 16.994 1.00 99.99 H ATOM 581 HA2 GLY A 40 -7.344 1.395 15.758 1.00 99.99 H ATOM 582 HA3 GLY A 40 -8.222 1.931 17.177 1.00 99.99 H ATOM 583 N PHE A 41 -8.160 3.221 14.166 1.00 1.00 N ATOM 584 CA PHE A 41 -8.894 4.040 13.216 1.00 1.00 C ATOM 585 C PHE A 41 -10.344 3.573 13.094 1.00 1.00 C ATOM 586 O PHE A 41 -10.621 2.555 12.460 1.00 1.00 O ATOM 587 CB PHE A 41 -8.203 3.881 11.861 1.00 1.00 C ATOM 588 CG PHE A 41 -8.974 4.498 10.693 1.00 1.00 C ATOM 589 CD1 PHE A 41 -8.799 5.811 10.382 1.00 1.00 C ATOM 590 CD2 PHE A 41 -9.832 3.735 9.965 1.00 1.00 C ATOM 591 CE1 PHE A 41 -9.515 6.384 9.297 1.00 1.00 C ATOM 592 CE2 PHE A 41 -10.548 4.308 8.881 1.00 1.00 C ATOM 593 CZ PHE A 41 -10.374 5.621 8.570 1.00 1.00 C ATOM 594 H PHE A 41 -7.396 2.706 13.779 1.00 99.99 H ATOM 595 HA PHE A 41 -8.875 5.065 13.590 1.00 99.99 H ATOM 596 HB2 PHE A 41 -7.214 4.336 11.912 1.00 99.99 H ATOM 597 HB3 PHE A 41 -8.053 2.819 11.664 1.00 99.99 H ATOM 598 HD1 PHE A 41 -8.111 6.422 10.964 1.00 99.99 H ATOM 599 HD2 PHE A 41 -9.971 2.683 10.215 1.00 99.99 H ATOM 600 HE1 PHE A 41 -9.376 7.436 9.048 1.00 99.99 H ATOM 601 HE2 PHE A 41 -11.237 3.696 8.298 1.00 99.99 H ATOM 602 HZ PHE A 41 -10.923 6.060 7.737 1.00 99.99 H ATOM 603 N GLY A 42 -11.234 4.336 13.712 1.00 1.00 N ATOM 604 CA GLY A 42 -12.650 4.012 13.680 1.00 1.00 C ATOM 605 C GLY A 42 -13.292 4.488 12.376 1.00 1.00 C ATOM 606 O GLY A 42 -12.623 5.078 11.529 1.00 1.00 O ATOM 607 H GLY A 42 -11.001 5.162 14.226 1.00 99.99 H ATOM 608 HA2 GLY A 42 -12.782 2.935 13.784 1.00 99.99 H ATOM 609 HA3 GLY A 42 -13.152 4.478 14.528 1.00 99.99 H ATOM 610 N LYS A 43 -14.582 4.211 12.253 1.00 1.00 N ATOM 611 CA LYS A 43 -15.322 4.602 11.065 1.00 1.00 C ATOM 612 C LYS A 43 -15.658 6.092 11.148 1.00 1.00 C ATOM 613 O LYS A 43 -15.241 6.875 10.295 1.00 1.00 O ATOM 614 CB LYS A 43 -16.547 3.705 10.878 1.00 1.00 C ATOM 615 CG LYS A 43 -16.211 2.246 11.192 1.00 1.00 C ATOM 616 CD LYS A 43 -15.542 1.567 9.994 1.00 1.00 C ATOM 617 CE LYS A 43 -14.019 1.683 10.079 1.00 1.00 C ATOM 618 NZ LYS A 43 -13.473 0.671 11.011 1.00 1.00 N ATOM 619 H LYS A 43 -15.119 3.729 12.946 1.00 99.99 H ATOM 620 HA LYS A 43 -14.671 4.442 10.207 1.00 99.99 H ATOM 621 HB2 LYS A 43 -17.354 4.044 11.527 1.00 99.99 H ATOM 622 HB3 LYS A 43 -16.907 3.786 9.852 1.00 99.99 H ATOM 623 HG2 LYS A 43 -15.549 2.200 12.057 1.00 99.99 H ATOM 624 HG3 LYS A 43 -17.122 1.709 11.457 1.00 99.99 H ATOM 625 HD2 LYS A 43 -15.830 0.516 9.961 1.00 99.99 H ATOM 626 HD3 LYS A 43 -15.895 2.023 9.070 1.00 99.99 H ATOM 627 HE2 LYS A 43 -13.583 1.545 9.090 1.00 99.99 H ATOM 628 HE3 LYS A 43 -13.743 2.682 10.413 1.00 99.99 H ATOM 629 HZ1 LYS A 43 -13.216 -0.186 10.535 1.00 99.99 H ATOM 630 HZ2 LYS A 43 -12.643 1.003 11.488 1.00 99.99 H ATOM 631 N GLU A 44 -16.409 6.441 12.182 1.00 1.00 N ATOM 632 CA GLU A 44 -16.806 7.823 12.388 1.00 1.00 C ATOM 633 C GLU A 44 -15.650 8.765 12.044 1.00 1.00 C ATOM 634 O GLU A 44 -15.849 9.786 11.391 1.00 1.00 O ATOM 635 CB GLU A 44 -17.290 8.048 13.822 1.00 1.00 C ATOM 636 CG GLU A 44 -17.672 9.512 14.048 1.00 1.00 C ATOM 637 CD GLU A 44 -18.613 10.010 12.950 1.00 1.00 C ATOM 638 OE1 GLU A 44 -18.191 10.165 11.795 1.00 1.00 O ATOM 639 OE2 GLU A 44 -19.824 10.237 13.332 1.00 1.00 O ATOM 640 H GLU A 44 -16.745 5.798 12.872 1.00 99.99 H ATOM 641 HA GLU A 44 -17.636 7.991 11.700 1.00 99.99 H ATOM 642 HB2 GLU A 44 -18.150 7.409 14.024 1.00 99.99 H ATOM 643 HB3 GLU A 44 -16.507 7.759 14.522 1.00 99.99 H ATOM 644 HG2 GLU A 44 -18.152 9.620 15.021 1.00 99.99 H ATOM 645 HG3 GLU A 44 -16.773 10.127 14.067 1.00 99.99 H ATOM 646 HE2 GLU A 44 -19.878 11.124 13.791 1.00 99.99 H ATOM 647 N MET A 45 -14.465 8.385 12.502 1.00 1.00 N ATOM 648 CA MET A 45 -13.277 9.182 12.253 1.00 1.00 C ATOM 649 C MET A 45 -13.140 9.511 10.766 1.00 1.00 C ATOM 650 O MET A 45 -12.816 10.641 10.403 1.00 1.00 O ATOM 651 CB MET A 45 -12.040 8.415 12.724 1.00 1.00 C ATOM 652 CG MET A 45 -10.851 9.358 12.919 1.00 1.00 C ATOM 653 SD MET A 45 -9.988 9.583 11.373 1.00 1.00 S ATOM 654 CE MET A 45 -8.390 10.094 11.981 1.00 1.00 C ATOM 655 H MET A 45 -14.312 7.553 13.034 1.00 99.99 H ATOM 656 HA MET A 45 -13.415 10.100 12.825 1.00 99.99 H ATOM 657 HB2 MET A 45 -12.259 7.901 13.659 1.00 99.99 H ATOM 658 HB3 MET A 45 -11.783 7.648 11.991 1.00 99.99 H ATOM 659 HG2 MET A 45 -11.198 10.321 13.295 1.00 99.99 H ATOM 660 HG3 MET A 45 -10.172 8.951 13.668 1.00 99.99 H ATOM 661 HE1 MET A 45 -8.443 11.128 12.321 1.00 99.99 H ATOM 662 HE2 MET A 45 -8.096 9.452 12.812 1.00 99.99 H ATOM 663 HE3 MET A 45 -7.653 10.012 11.181 1.00 99.99 H ATOM 664 N ALA A 46 -13.392 8.503 9.944 1.00 1.00 N ATOM 665 CA ALA A 46 -13.302 8.670 8.503 1.00 1.00 C ATOM 666 C ALA A 46 -14.113 9.897 8.084 1.00 1.00 C ATOM 667 O ALA A 46 -13.557 10.898 7.636 1.00 1.00 O ATOM 668 CB ALA A 46 -13.777 7.393 7.809 1.00 1.00 C ATOM 669 H ALA A 46 -13.656 7.587 10.247 1.00 99.99 H ATOM 670 HA ALA A 46 -12.254 8.836 8.254 1.00 99.99 H ATOM 671 HB1 ALA A 46 -14.825 7.217 8.049 1.00 99.99 H ATOM 672 HB2 ALA A 46 -13.665 7.502 6.731 1.00 99.99 H ATOM 673 HB3 ALA A 46 -13.179 6.548 8.153 1.00 99.99 H ATOM 674 N HIS A 47 -15.433 9.783 8.245 1.00 1.00 N ATOM 675 CA HIS A 47 -16.368 10.848 7.903 1.00 1.00 C ATOM 676 C HIS A 47 -16.102 12.079 8.789 1.00 1.00 C ATOM 677 O HIS A 47 -16.638 13.156 8.527 1.00 1.00 O ATOM 678 CB HIS A 47 -17.799 10.301 7.994 1.00 1.00 C ATOM 679 CG HIS A 47 -18.055 8.957 7.352 1.00 1.00 C ATOM 680 ND1 HIS A 47 -18.810 8.017 7.928 1.00 1.00 N ATOM 681 CD2 HIS A 47 -17.627 8.425 6.159 1.00 1.00 C ATOM 682 CE1 HIS A 47 -18.851 6.941 7.126 1.00 1.00 C ATOM 683 NE2 HIS A 47 -18.138 7.140 6.019 1.00 1.00 N ATOM 684 H HIS A 47 -15.801 8.921 8.622 1.00 99.99 H ATOM 685 HA HIS A 47 -16.180 11.142 6.845 1.00 99.99 H ATOM 686 HB2 HIS A 47 -18.064 10.214 9.073 1.00 99.99 H ATOM 687 HB3 HIS A 47 -18.478 11.040 7.510 1.00 99.99 H ATOM 688 HD1 HIS A 47 -19.269 8.123 8.831 1.00 99.99 H ATOM 689 HD2 HIS A 47 -16.981 8.937 5.429 1.00 99.99 H ATOM 690 HE1 HIS A 47 -19.403 6.016 7.353 1.00 99.99 H ATOM 691 N GLY A 48 -15.281 11.877 9.809 1.00 1.00 N ATOM 692 CA GLY A 48 -14.945 12.954 10.724 1.00 1.00 C ATOM 693 C GLY A 48 -13.924 13.906 10.098 1.00 1.00 C ATOM 694 O GLY A 48 -14.060 14.293 8.938 1.00 1.00 O ATOM 695 H GLY A 48 -14.851 10.999 10.014 1.00 99.99 H ATOM 696 HA2 GLY A 48 -15.847 13.506 10.988 1.00 99.99 H ATOM 697 HA3 GLY A 48 -14.542 12.540 11.647 1.00 99.99 H ATOM 698 N LYS A 49 -12.924 14.257 10.893 1.00 1.00 N ATOM 699 CA LYS A 49 -11.881 15.157 10.431 1.00 1.00 C ATOM 700 C LYS A 49 -10.597 14.360 10.189 1.00 1.00 C ATOM 701 O LYS A 49 -9.522 14.758 10.635 1.00 1.00 O ATOM 702 CB LYS A 49 -11.706 16.322 11.408 1.00 1.00 C ATOM 703 CG LYS A 49 -12.471 17.558 10.928 1.00 1.00 C ATOM 704 CD LYS A 49 -11.647 18.829 11.140 1.00 1.00 C ATOM 705 CE LYS A 49 -12.543 20.069 11.150 1.00 1.00 C ATOM 706 NZ LYS A 49 -12.552 20.713 9.818 1.00 1.00 N ATOM 707 H LYS A 49 -12.821 13.939 11.835 1.00 99.99 H ATOM 708 HA LYS A 49 -12.209 15.579 9.482 1.00 99.99 H ATOM 709 HB2 LYS A 49 -12.063 16.030 12.396 1.00 99.99 H ATOM 710 HB3 LYS A 49 -10.648 16.561 11.508 1.00 99.99 H ATOM 711 HG2 LYS A 49 -12.716 17.451 9.872 1.00 99.99 H ATOM 712 HG3 LYS A 49 -13.415 17.638 11.467 1.00 99.99 H ATOM 713 HD2 LYS A 49 -11.103 18.761 12.082 1.00 99.99 H ATOM 714 HD3 LYS A 49 -10.903 18.920 10.349 1.00 99.99 H ATOM 715 HE2 LYS A 49 -13.558 19.789 11.432 1.00 99.99 H ATOM 716 HE3 LYS A 49 -12.188 20.776 11.899 1.00 99.99 H ATOM 717 HZ1 LYS A 49 -12.152 20.114 9.104 1.00 99.99 H ATOM 718 HZ2 LYS A 49 -13.491 20.944 9.514 1.00 99.99 H ATOM 719 N GLY A 50 -10.752 13.250 9.484 1.00 1.00 N ATOM 720 CA GLY A 50 -9.618 12.394 9.178 1.00 1.00 C ATOM 721 C GLY A 50 -9.867 11.591 7.899 1.00 1.00 C ATOM 722 O GLY A 50 -9.439 10.442 7.790 1.00 1.00 O ATOM 723 H GLY A 50 -11.629 12.934 9.124 1.00 99.99 H ATOM 724 HA2 GLY A 50 -8.720 13.001 9.060 1.00 99.99 H ATOM 725 HA3 GLY A 50 -9.436 11.713 10.009 1.00 99.99 H ATOM 726 N CYS A 51 -10.558 12.227 6.964 1.00 1.00 N ATOM 727 CA CYS A 51 -10.868 11.586 5.698 1.00 1.00 C ATOM 728 C CYS A 51 -11.707 12.555 4.861 1.00 1.00 C ATOM 729 O CYS A 51 -11.206 13.151 3.910 1.00 1.00 O ATOM 730 CB CYS A 51 -11.579 10.246 5.901 1.00 1.00 C ATOM 731 SG CYS A 51 -11.128 8.947 4.694 1.00 1.00 S ATOM 732 H CYS A 51 -10.901 13.161 7.061 1.00 99.99 H ATOM 733 HA CYS A 51 -9.916 11.377 5.209 1.00 99.99 H ATOM 734 HB2 CYS A 51 -11.358 9.882 6.905 1.00 99.99 H ATOM 735 HB3 CYS A 51 -12.656 10.411 5.851 1.00 99.99 H ATOM 736 N LYS A 52 -12.968 12.681 5.247 1.00 1.00 N ATOM 737 CA LYS A 52 -13.881 13.568 4.546 1.00 1.00 C ATOM 738 C LYS A 52 -13.729 14.987 5.096 1.00 1.00 C ATOM 739 O LYS A 52 -13.529 15.934 4.336 1.00 1.00 O ATOM 740 CB LYS A 52 -15.311 13.029 4.617 1.00 1.00 C ATOM 741 CG LYS A 52 -16.279 13.946 3.865 1.00 1.00 C ATOM 742 CD LYS A 52 -17.240 14.640 4.834 1.00 1.00 C ATOM 743 CE LYS A 52 -18.688 14.231 4.556 1.00 1.00 C ATOM 744 NZ LYS A 52 -19.110 13.159 5.484 1.00 1.00 N ATOM 745 H LYS A 52 -13.367 12.192 6.023 1.00 99.99 H ATOM 746 HA LYS A 52 -13.589 13.571 3.495 1.00 99.99 H ATOM 747 HB2 LYS A 52 -15.349 12.027 4.190 1.00 99.99 H ATOM 748 HB3 LYS A 52 -15.620 12.944 5.659 1.00 99.99 H ATOM 749 HG2 LYS A 52 -15.717 14.694 3.307 1.00 99.99 H ATOM 750 HG3 LYS A 52 -16.847 13.364 3.139 1.00 99.99 H ATOM 751 HD2 LYS A 52 -16.977 14.383 5.859 1.00 99.99 H ATOM 752 HD3 LYS A 52 -17.139 15.721 4.740 1.00 99.99 H ATOM 753 HE2 LYS A 52 -19.344 15.094 4.665 1.00 99.99 H ATOM 754 HE3 LYS A 52 -18.784 13.886 3.526 1.00 99.99 H ATOM 755 HZ1 LYS A 52 -20.066 13.285 5.801 1.00 99.99 H ATOM 756 HZ2 LYS A 52 -19.063 12.242 5.053 1.00 99.99 H ATOM 757 N GLY A 53 -13.831 15.092 6.413 1.00 1.00 N ATOM 758 CA GLY A 53 -13.708 16.379 7.074 1.00 1.00 C ATOM 759 C GLY A 53 -12.693 17.271 6.353 1.00 1.00 C ATOM 760 O GLY A 53 -13.033 18.361 5.897 1.00 1.00 O ATOM 761 H GLY A 53 -13.993 14.317 7.024 1.00 99.99 H ATOM 762 HA2 GLY A 53 -14.678 16.874 7.097 1.00 99.99 H ATOM 763 HA3 GLY A 53 -13.400 16.234 8.108 1.00 99.99 H ATOM 764 N CYS A 54 -11.468 16.772 6.274 1.00 1.00 N ATOM 765 CA CYS A 54 -10.402 17.510 5.617 1.00 1.00 C ATOM 766 C CYS A 54 -10.953 18.094 4.316 1.00 1.00 C ATOM 767 O CYS A 54 -11.071 19.309 4.170 1.00 1.00 O ATOM 768 CB CYS A 54 -9.174 16.630 5.373 1.00 1.00 C ATOM 769 SG CYS A 54 -7.733 17.672 4.939 1.00 1.00 S ATOM 770 H CYS A 54 -11.200 15.884 6.647 1.00 99.99 H ATOM 771 HA CYS A 54 -10.102 18.303 6.301 1.00 99.99 H ATOM 772 HB2 CYS A 54 -8.953 16.044 6.265 1.00 99.99 H ATOM 773 HB3 CYS A 54 -9.376 15.922 4.569 1.00 99.99 H ATOM 774 N HIS A 55 -11.280 17.194 3.387 1.00 1.00 N ATOM 775 CA HIS A 55 -11.821 17.562 2.084 1.00 1.00 C ATOM 776 C HIS A 55 -12.860 18.687 2.250 1.00 1.00 C ATOM 777 O HIS A 55 -12.834 19.666 1.506 1.00 1.00 O ATOM 778 CB HIS A 55 -12.361 16.300 1.396 1.00 1.00 C ATOM 779 CG HIS A 55 -11.421 15.120 1.306 1.00 1.00 C ATOM 780 ND1 HIS A 55 -11.811 13.868 1.565 1.00 1.00 N ATOM 781 CD2 HIS A 55 -10.089 15.044 0.975 1.00 1.00 C ATOM 782 CE1 HIS A 55 -10.762 13.045 1.401 1.00 1.00 C ATOM 783 NE2 HIS A 55 -9.674 13.720 1.038 1.00 1.00 N ATOM 784 H HIS A 55 -11.148 16.215 3.595 1.00 99.99 H ATOM 785 HA HIS A 55 -10.986 17.958 1.465 1.00 99.99 H ATOM 786 HB2 HIS A 55 -13.266 15.966 1.955 1.00 99.99 H ATOM 787 HB3 HIS A 55 -12.655 16.576 0.358 1.00 99.99 H ATOM 788 HD1 HIS A 55 -12.756 13.606 1.839 1.00 99.99 H ATOM 789 HD2 HIS A 55 -9.452 15.901 0.703 1.00 99.99 H ATOM 790 HE1 HIS A 55 -10.799 11.954 1.550 1.00 99.99 H ATOM 791 N GLU A 56 -13.739 18.506 3.224 1.00 1.00 N ATOM 792 CA GLU A 56 -14.774 19.491 3.490 1.00 1.00 C ATOM 793 C GLU A 56 -14.144 20.828 3.884 1.00 1.00 C ATOM 794 O GLU A 56 -14.655 21.889 3.526 1.00 1.00 O ATOM 795 CB GLU A 56 -15.735 18.998 4.573 1.00 1.00 C ATOM 796 CG GLU A 56 -16.755 20.079 4.935 1.00 1.00 C ATOM 797 CD GLU A 56 -18.099 19.817 4.251 1.00 1.00 C ATOM 798 OE1 GLU A 56 -18.320 20.279 3.122 1.00 1.00 O ATOM 799 OE2 GLU A 56 -18.928 19.104 4.934 1.00 1.00 O ATOM 800 H GLU A 56 -13.754 17.706 3.824 1.00 99.99 H ATOM 801 HA GLU A 56 -15.318 19.600 2.551 1.00 99.99 H ATOM 802 HB2 GLU A 56 -16.255 18.105 4.224 1.00 99.99 H ATOM 803 HB3 GLU A 56 -15.173 18.712 5.462 1.00 99.99 H ATOM 804 HG2 GLU A 56 -16.893 20.108 6.015 1.00 99.99 H ATOM 805 HG3 GLU A 56 -16.375 21.056 4.637 1.00 99.99 H ATOM 806 HE2 GLU A 56 -19.834 19.136 4.513 1.00 99.99 H ATOM 807 N GLU A 57 -13.044 20.735 4.616 1.00 1.00 N ATOM 808 CA GLU A 57 -12.339 21.925 5.062 1.00 1.00 C ATOM 809 C GLU A 57 -11.436 22.457 3.947 1.00 1.00 C ATOM 810 O GLU A 57 -11.570 23.606 3.529 1.00 1.00 O ATOM 811 CB GLU A 57 -11.535 21.642 6.331 1.00 1.00 C ATOM 812 CG GLU A 57 -11.021 22.941 6.957 1.00 1.00 C ATOM 813 CD GLU A 57 -11.403 23.025 8.437 1.00 1.00 C ATOM 814 OE1 GLU A 57 -12.427 23.634 8.778 1.00 1.00 O ATOM 815 OE2 GLU A 57 -10.592 22.429 9.243 1.00 1.00 O ATOM 816 H GLU A 57 -12.635 19.869 4.902 1.00 99.99 H ATOM 817 HA GLU A 57 -13.117 22.655 5.287 1.00 99.99 H ATOM 818 HB2 GLU A 57 -12.157 21.110 7.051 1.00 99.99 H ATOM 819 HB3 GLU A 57 -10.692 20.991 6.095 1.00 99.99 H ATOM 820 HG2 GLU A 57 -9.937 22.995 6.853 1.00 99.99 H ATOM 821 HG3 GLU A 57 -11.436 23.795 6.422 1.00 99.99 H ATOM 822 HE2 GLU A 57 -10.711 21.438 9.177 1.00 99.99 H ATOM 823 N MET A 58 -10.535 21.595 3.498 1.00 1.00 N ATOM 824 CA MET A 58 -9.610 21.963 2.440 1.00 1.00 C ATOM 825 C MET A 58 -10.354 22.237 1.131 1.00 1.00 C ATOM 826 O MET A 58 -9.777 22.769 0.184 1.00 1.00 O ATOM 827 CB MET A 58 -8.601 20.833 2.227 1.00 1.00 C ATOM 828 CG MET A 58 -7.177 21.381 2.118 1.00 1.00 C ATOM 829 SD MET A 58 -6.421 21.436 3.735 1.00 1.00 S ATOM 830 CE MET A 58 -5.319 20.037 3.608 1.00 1.00 C ATOM 831 H MET A 58 -10.432 20.663 3.843 1.00 99.99 H ATOM 832 HA MET A 58 -9.119 22.873 2.784 1.00 99.99 H ATOM 833 HB2 MET A 58 -8.662 20.126 3.055 1.00 99.99 H ATOM 834 HB3 MET A 58 -8.853 20.282 1.320 1.00 99.99 H ATOM 835 HG2 MET A 58 -6.586 20.753 1.452 1.00 99.99 H ATOM 836 HG3 MET A 58 -7.195 22.380 1.683 1.00 99.99 H ATOM 837 HE1 MET A 58 -5.372 19.622 2.602 1.00 99.99 H ATOM 838 HE2 MET A 58 -4.298 20.357 3.816 1.00 99.99 H ATOM 839 HE3 MET A 58 -5.614 19.276 4.331 1.00 99.99 H ATOM 840 N LYS A 59 -11.624 21.861 1.120 1.00 1.00 N ATOM 841 CA LYS A 59 -12.454 22.059 -0.056 1.00 1.00 C ATOM 842 C LYS A 59 -11.820 21.338 -1.248 1.00 1.00 C ATOM 843 O LYS A 59 -12.153 21.623 -2.398 1.00 1.00 O ATOM 844 CB LYS A 59 -12.695 23.551 -0.297 1.00 1.00 C ATOM 845 CG LYS A 59 -13.435 24.184 0.883 1.00 1.00 C ATOM 846 CD LYS A 59 -13.643 25.683 0.660 1.00 1.00 C ATOM 847 CE LYS A 59 -14.244 26.345 1.902 1.00 1.00 C ATOM 848 NZ LYS A 59 -15.122 27.472 1.515 1.00 1.00 N ATOM 849 H LYS A 59 -12.086 21.429 1.895 1.00 99.99 H ATOM 850 HA LYS A 59 -13.423 21.605 0.147 1.00 99.99 H ATOM 851 HB2 LYS A 59 -11.742 24.058 -0.447 1.00 99.99 H ATOM 852 HB3 LYS A 59 -13.274 23.687 -1.209 1.00 99.99 H ATOM 853 HG2 LYS A 59 -14.400 23.695 1.016 1.00 99.99 H ATOM 854 HG3 LYS A 59 -12.868 24.025 1.800 1.00 99.99 H ATOM 855 HD2 LYS A 59 -12.690 26.155 0.418 1.00 99.99 H ATOM 856 HD3 LYS A 59 -14.301 25.839 -0.195 1.00 99.99 H ATOM 857 HE2 LYS A 59 -14.814 25.611 2.472 1.00 99.99 H ATOM 858 HE3 LYS A 59 -13.446 26.704 2.551 1.00 99.99 H ATOM 859 HZ1 LYS A 59 -16.100 27.202 1.496 1.00 99.99 H ATOM 860 HZ2 LYS A 59 -15.044 28.252 2.157 1.00 99.99 H ATOM 861 N LYS A 60 -10.919 20.420 -0.933 1.00 1.00 N ATOM 862 CA LYS A 60 -10.236 19.656 -1.964 1.00 1.00 C ATOM 863 C LYS A 60 -10.513 18.166 -1.757 1.00 1.00 C ATOM 864 O LYS A 60 -10.629 17.705 -0.622 1.00 1.00 O ATOM 865 CB LYS A 60 -8.747 20.008 -1.993 1.00 1.00 C ATOM 866 CG LYS A 60 -8.390 20.775 -3.268 1.00 1.00 C ATOM 867 CD LYS A 60 -7.363 21.872 -2.977 1.00 1.00 C ATOM 868 CE LYS A 60 -7.629 23.111 -3.833 1.00 1.00 C ATOM 869 NZ LYS A 60 -6.365 23.626 -4.405 1.00 1.00 N ATOM 870 H LYS A 60 -10.655 20.195 0.004 1.00 99.99 H ATOM 871 HA LYS A 60 -10.657 19.956 -2.924 1.00 99.99 H ATOM 872 HB2 LYS A 60 -8.494 20.608 -1.119 1.00 99.99 H ATOM 873 HB3 LYS A 60 -8.154 19.095 -1.935 1.00 99.99 H ATOM 874 HG2 LYS A 60 -7.990 20.086 -4.011 1.00 99.99 H ATOM 875 HG3 LYS A 60 -9.290 21.217 -3.694 1.00 99.99 H ATOM 876 HD2 LYS A 60 -7.402 22.140 -1.921 1.00 99.99 H ATOM 877 HD3 LYS A 60 -6.360 21.497 -3.174 1.00 99.99 H ATOM 878 HE2 LYS A 60 -8.325 22.865 -4.634 1.00 99.99 H ATOM 879 HE3 LYS A 60 -8.102 23.885 -3.227 1.00 99.99 H ATOM 880 HZ1 LYS A 60 -5.938 22.963 -5.042 1.00 99.99 H ATOM 881 HZ2 LYS A 60 -6.507 24.484 -4.928 1.00 99.99 H ATOM 882 N GLY A 61 -10.612 17.455 -2.870 1.00 1.00 N ATOM 883 CA GLY A 61 -10.874 16.026 -2.824 1.00 1.00 C ATOM 884 C GLY A 61 -12.363 15.735 -3.023 1.00 1.00 C ATOM 885 O GLY A 61 -13.198 16.632 -3.107 1.00 1.00 O ATOM 886 H GLY A 61 -10.517 17.838 -3.789 1.00 99.99 H ATOM 887 HA2 GLY A 61 -10.295 15.523 -3.598 1.00 99.99 H ATOM 888 HA3 GLY A 61 -10.545 15.623 -1.867 1.00 99.99 H ATOM 889 N PRO A 62 -12.679 14.440 -3.095 1.00 1.00 N ATOM 890 CA PRO A 62 -14.024 13.938 -3.278 1.00 1.00 C ATOM 891 C PRO A 62 -14.747 13.914 -1.940 1.00 1.00 C ATOM 892 O PRO A 62 -14.101 13.682 -0.919 1.00 1.00 O ATOM 893 CB PRO A 62 -13.843 12.524 -3.827 1.00 1.00 C ATOM 894 CG PRO A 62 -12.245 12.284 -3.951 1.00 1.00 C ATOM 895 CD PRO A 62 -11.722 13.359 -3.000 1.00 1.00 C ATOM 896 HA PRO A 62 -14.578 14.552 -3.987 1.00 99.99 H ATOM 897 HB2 PRO A 62 -14.327 11.772 -3.204 1.00 99.99 H ATOM 898 HB3 PRO A 62 -14.224 12.483 -4.847 1.00 99.99 H ATOM 899 HG2 PRO A 62 -12.345 11.343 -3.409 1.00 99.99 H ATOM 900 HG3 PRO A 62 -11.608 12.160 -4.826 1.00 99.99 H ATOM 901 HD2 PRO A 62 -11.650 12.975 -1.982 1.00 99.99 H ATOM 902 HD3 PRO A 62 -10.749 13.712 -3.341 1.00 99.99 H ATOM 903 N THR A 63 -16.050 14.154 -1.964 1.00 1.00 N ATOM 904 CA THR A 63 -16.833 14.156 -0.740 1.00 1.00 C ATOM 905 C THR A 63 -18.017 13.194 -0.862 1.00 1.00 C ATOM 906 O THR A 63 -18.767 13.004 0.094 1.00 1.00 O ATOM 907 CB THR A 63 -17.251 15.599 -0.450 1.00 1.00 C ATOM 908 OG1 THR A 63 -16.618 16.357 -1.477 1.00 1.00 O ATOM 909 CG2 THR A 63 -16.636 16.138 0.844 1.00 1.00 C ATOM 910 H THR A 63 -16.568 14.342 -2.797 1.00 99.99 H ATOM 911 HA THR A 63 -16.205 13.789 0.071 1.00 99.99 H ATOM 912 HB THR A 63 -18.336 15.694 -0.434 1.00 99.99 H ATOM 913 HG1 THR A 63 -15.625 16.260 -1.411 1.00 99.99 H ATOM 914 HG21 THR A 63 -16.997 17.151 1.023 1.00 99.99 H ATOM 915 N LYS A 64 -18.145 12.611 -2.045 1.00 1.00 N ATOM 916 CA LYS A 64 -19.223 11.674 -2.305 1.00 1.00 C ATOM 917 C LYS A 64 -18.809 10.281 -1.825 1.00 1.00 C ATOM 918 O LYS A 64 -17.622 10.001 -1.672 1.00 1.00 O ATOM 919 CB LYS A 64 -19.633 11.721 -3.778 1.00 1.00 C ATOM 920 CG LYS A 64 -20.392 13.010 -4.096 1.00 1.00 C ATOM 921 CD LYS A 64 -19.783 13.721 -5.305 1.00 1.00 C ATOM 922 CE LYS A 64 -20.756 14.752 -5.882 1.00 1.00 C ATOM 923 NZ LYS A 64 -20.179 15.395 -7.083 1.00 1.00 N ATOM 924 H LYS A 64 -17.529 12.771 -2.817 1.00 99.99 H ATOM 925 HA LYS A 64 -20.085 11.997 -1.721 1.00 99.99 H ATOM 926 HB2 LYS A 64 -18.745 11.653 -4.407 1.00 99.99 H ATOM 927 HB3 LYS A 64 -20.257 10.859 -4.014 1.00 99.99 H ATOM 928 HG2 LYS A 64 -21.440 12.779 -4.294 1.00 99.99 H ATOM 929 HG3 LYS A 64 -20.370 13.672 -3.231 1.00 99.99 H ATOM 930 HD2 LYS A 64 -18.856 14.213 -5.014 1.00 99.99 H ATOM 931 HD3 LYS A 64 -19.528 12.989 -6.072 1.00 99.99 H ATOM 932 HE2 LYS A 64 -21.699 14.269 -6.137 1.00 99.99 H ATOM 933 HE3 LYS A 64 -20.979 15.510 -5.130 1.00 99.99 H ATOM 934 HZ1 LYS A 64 -20.660 16.254 -7.324 1.00 99.99 H ATOM 935 HZ2 LYS A 64 -19.201 15.632 -6.955 1.00 99.99 H ATOM 936 N CYS A 65 -19.812 9.445 -1.602 1.00 1.00 N ATOM 937 CA CYS A 65 -19.566 8.087 -1.143 1.00 1.00 C ATOM 938 C CYS A 65 -18.898 7.310 -2.278 1.00 1.00 C ATOM 939 O CYS A 65 -17.748 6.889 -2.155 1.00 1.00 O ATOM 940 CB CYS A 65 -20.853 7.410 -0.668 1.00 1.00 C ATOM 941 SG CYS A 65 -22.147 8.556 -0.066 1.00 1.00 S ATOM 942 H CYS A 65 -20.776 9.679 -1.729 1.00 99.99 H ATOM 943 HA CYS A 65 -18.902 8.163 -0.283 1.00 99.99 H ATOM 944 HB2 CYS A 65 -21.262 6.821 -1.488 1.00 99.99 H ATOM 945 HB3 CYS A 65 -20.605 6.712 0.133 1.00 99.99 H ATOM 946 N GLY A 66 -19.646 7.144 -3.359 1.00 1.00 N ATOM 947 CA GLY A 66 -19.140 6.424 -4.516 1.00 1.00 C ATOM 948 C GLY A 66 -17.696 6.823 -4.822 1.00 1.00 C ATOM 949 O GLY A 66 -16.947 6.051 -5.418 1.00 1.00 O ATOM 950 H GLY A 66 -20.580 7.490 -3.452 1.00 99.99 H ATOM 951 HA2 GLY A 66 -19.194 5.351 -4.333 1.00 99.99 H ATOM 952 HA3 GLY A 66 -19.770 6.631 -5.381 1.00 99.99 H ATOM 953 N GLU A 67 -17.347 8.030 -4.399 1.00 1.00 N ATOM 954 CA GLU A 67 -16.005 8.541 -4.621 1.00 1.00 C ATOM 955 C GLU A 67 -15.009 7.833 -3.701 1.00 1.00 C ATOM 956 O GLU A 67 -13.907 7.486 -4.123 1.00 1.00 O ATOM 957 CB GLU A 67 -15.956 10.058 -4.418 1.00 1.00 C ATOM 958 CG GLU A 67 -16.786 10.780 -5.481 1.00 1.00 C ATOM 959 CD GLU A 67 -16.086 10.743 -6.841 1.00 1.00 C ATOM 960 OE1 GLU A 67 -15.477 11.741 -7.253 1.00 1.00 O ATOM 961 OE2 GLU A 67 -16.191 9.626 -7.478 1.00 1.00 O ATOM 962 H GLU A 67 -17.963 8.652 -3.915 1.00 99.99 H ATOM 963 HA GLU A 67 -15.775 8.313 -5.661 1.00 99.99 H ATOM 964 HB2 GLU A 67 -16.332 10.307 -3.426 1.00 99.99 H ATOM 965 HB3 GLU A 67 -14.922 10.401 -4.463 1.00 99.99 H ATOM 966 HG2 GLU A 67 -17.768 10.314 -5.560 1.00 99.99 H ATOM 967 HG3 GLU A 67 -16.948 11.814 -5.180 1.00 99.99 H ATOM 968 HE2 GLU A 67 -17.072 9.199 -7.277 1.00 99.99 H ATOM 969 N CYS A 68 -15.432 7.639 -2.460 1.00 1.00 N ATOM 970 CA CYS A 68 -14.590 6.978 -1.478 1.00 1.00 C ATOM 971 C CYS A 68 -14.895 5.479 -1.514 1.00 1.00 C ATOM 972 O CYS A 68 -13.987 4.652 -1.556 1.00 1.00 O ATOM 973 CB CYS A 68 -14.786 7.566 -0.078 1.00 1.00 C ATOM 974 SG CYS A 68 -13.472 8.790 0.276 1.00 1.00 S ATOM 975 H CYS A 68 -16.330 7.924 -2.124 1.00 99.99 H ATOM 976 HA CYS A 68 -13.558 7.170 -1.768 1.00 99.99 H ATOM 977 HB2 CYS A 68 -15.765 8.040 -0.007 1.00 99.99 H ATOM 978 HB3 CYS A 68 -14.763 6.770 0.666 1.00 99.99 H ATOM 979 N HIS A 69 -16.191 5.167 -1.498 1.00 1.00 N ATOM 980 CA HIS A 69 -16.675 3.791 -1.527 1.00 1.00 C ATOM 981 C HIS A 69 -16.962 3.371 -2.981 1.00 1.00 C ATOM 982 O HIS A 69 -16.993 4.217 -3.873 1.00 1.00 O ATOM 983 CB HIS A 69 -17.881 3.668 -0.585 1.00 1.00 C ATOM 984 CG HIS A 69 -17.633 3.960 0.878 1.00 1.00 C ATOM 985 ND1 HIS A 69 -16.876 3.175 1.650 1.00 1.00 N ATOM 986 CD2 HIS A 69 -18.070 4.984 1.684 1.00 1.00 C ATOM 987 CE1 HIS A 69 -16.843 3.689 2.890 1.00 1.00 C ATOM 988 NE2 HIS A 69 -17.565 4.807 2.966 1.00 1.00 N ATOM 989 H HIS A 69 -16.870 5.915 -1.462 1.00 99.99 H ATOM 990 HA HIS A 69 -15.865 3.134 -1.136 1.00 99.99 H ATOM 991 HB2 HIS A 69 -18.666 4.374 -0.940 1.00 99.99 H ATOM 992 HB3 HIS A 69 -18.267 2.625 -0.659 1.00 99.99 H ATOM 993 HD1 HIS A 69 -16.410 2.329 1.327 1.00 99.99 H ATOM 994 HD2 HIS A 69 -18.720 5.813 1.364 1.00 99.99 H ATOM 995 HE1 HIS A 69 -16.292 3.245 3.733 1.00 99.99 H ATOM 996 N LYS A 70 -17.164 2.076 -3.167 1.00 1.00 N ATOM 997 CA LYS A 70 -17.446 1.545 -4.490 1.00 1.00 C ATOM 998 C LYS A 70 -16.188 1.645 -5.354 1.00 1.00 C ATOM 999 O LYS A 70 -15.827 2.730 -5.809 1.00 1.00 O ATOM 1000 CB LYS A 70 -18.666 2.241 -5.098 1.00 1.00 C ATOM 1001 CG LYS A 70 -19.956 1.505 -4.731 1.00 1.00 C ATOM 1002 CD LYS A 70 -21.179 2.224 -5.302 1.00 1.00 C ATOM 1003 CE LYS A 70 -22.285 1.228 -5.659 1.00 1.00 C ATOM 1004 NZ LYS A 70 -22.047 0.649 -7.000 1.00 1.00 N ATOM 1005 H LYS A 70 -17.138 1.395 -2.436 1.00 99.99 H ATOM 1006 HA LYS A 70 -17.701 0.491 -4.372 1.00 99.99 H ATOM 1007 HB2 LYS A 70 -18.717 3.270 -4.743 1.00 99.99 H ATOM 1008 HB3 LYS A 70 -18.562 2.283 -6.182 1.00 99.99 H ATOM 1009 HG2 LYS A 70 -19.919 0.484 -5.114 1.00 99.99 H ATOM 1010 HG3 LYS A 70 -20.044 1.435 -3.647 1.00 99.99 H ATOM 1011 HD2 LYS A 70 -21.554 2.945 -4.575 1.00 99.99 H ATOM 1012 HD3 LYS A 70 -20.893 2.789 -6.189 1.00 99.99 H ATOM 1013 HE2 LYS A 70 -22.321 0.434 -4.914 1.00 99.99 H ATOM 1014 HE3 LYS A 70 -23.253 1.728 -5.639 1.00 99.99 H ATOM 1015 HZ1 LYS A 70 -22.721 0.979 -7.682 1.00 99.99 H ATOM 1016 HZ2 LYS A 70 -21.128 0.885 -7.358 1.00 99.99 H ATOM 1017 N LYS A 71 -15.553 0.500 -5.554 1.00 1.00 N ATOM 1018 CA LYS A 71 -14.343 0.445 -6.356 1.00 1.00 C ATOM 1019 C LYS A 71 -14.718 0.433 -7.839 1.00 1.00 C ATOM 1020 O LYS A 71 -15.044 1.473 -8.408 1.00 1.00 O ATOM 1021 CB LYS A 71 -13.473 -0.741 -5.932 1.00 1.00 C ATOM 1022 CG LYS A 71 -14.202 -2.066 -6.164 1.00 1.00 C ATOM 1023 CD LYS A 71 -13.703 -2.752 -7.437 1.00 1.00 C ATOM 1024 CE LYS A 71 -14.760 -3.703 -8.000 1.00 1.00 C ATOM 1025 NZ LYS A 71 -14.296 -4.303 -9.270 1.00 1.00 N ATOM 1026 H LYS A 71 -15.853 -0.379 -5.181 1.00 99.99 H ATOM 1027 HA LYS A 71 -13.773 1.351 -6.151 1.00 99.99 H ATOM 1028 HB2 LYS A 71 -12.540 -0.732 -6.495 1.00 99.99 H ATOM 1029 HB3 LYS A 71 -13.210 -0.646 -4.879 1.00 99.99 H ATOM 1030 HG2 LYS A 71 -14.048 -2.724 -5.308 1.00 99.99 H ATOM 1031 HG3 LYS A 71 -15.274 -1.887 -6.240 1.00 99.99 H ATOM 1032 HD2 LYS A 71 -13.451 -1.999 -8.185 1.00 99.99 H ATOM 1033 HD3 LYS A 71 -12.788 -3.305 -7.222 1.00 99.99 H ATOM 1034 HE2 LYS A 71 -14.972 -4.489 -7.275 1.00 99.99 H ATOM 1035 HE3 LYS A 71 -15.692 -3.163 -8.166 1.00 99.99 H ATOM 1036 HZ1 LYS A 71 -15.016 -4.288 -9.983 1.00 99.99 H ATOM 1037 HZ2 LYS A 71 -13.495 -3.812 -9.651 1.00 99.99 H TER 1038 LYS A 71 HETATM 1039 FE HEC A 101 0.243 7.951 6.487 1.00 1.00 FE HETATM 1040 CHA HEC A 101 -0.535 4.684 7.571 1.00 1.00 C HETATM 1041 CHB HEC A 101 3.570 7.250 7.040 1.00 1.00 C HETATM 1042 CHC HEC A 101 1.009 11.101 5.512 1.00 1.00 C HETATM 1043 CHD HEC A 101 -3.154 8.634 6.450 1.00 1.00 C HETATM 1044 NA HEC A 101 1.284 6.316 7.235 1.00 1.00 N HETATM 1045 C1A HEC A 101 0.807 5.043 7.494 1.00 1.00 C HETATM 1046 C2A HEC A 101 1.905 4.123 7.677 1.00 1.00 C HETATM 1047 C3A HEC A 101 3.045 4.832 7.530 1.00 1.00 C HETATM 1048 C4A HEC A 101 2.663 6.197 7.256 1.00 1.00 C HETATM 1049 CMA HEC A 101 4.459 4.337 7.627 1.00 1.00 C HETATM 1050 CAA HEC A 101 1.759 2.659 7.974 1.00 1.00 C HETATM 1051 CBA HEC A 101 1.439 1.806 6.749 1.00 1.00 C HETATM 1052 CGA HEC A 101 1.345 0.332 7.117 1.00 1.00 C HETATM 1053 O1A HEC A 101 0.327 -0.032 7.745 1.00 1.00 O HETATM 1054 O2A HEC A 101 2.292 -0.402 6.763 1.00 1.00 O HETATM 1055 NB HEC A 101 1.946 8.928 6.241 1.00 1.00 N HETATM 1056 C1B HEC A 101 3.208 8.538 6.658 1.00 1.00 C HETATM 1057 C2B HEC A 101 4.110 9.665 6.642 1.00 1.00 C HETATM 1058 C3B HEC A 101 3.403 10.734 6.219 1.00 1.00 C HETATM 1059 C4B HEC A 101 2.056 10.279 5.968 1.00 1.00 C HETATM 1060 CMB HEC A 101 5.558 9.610 7.033 1.00 1.00 C HETATM 1061 CAB HEC A 101 3.884 12.143 6.031 1.00 1.00 C HETATM 1062 CBB HEC A 101 5.162 12.471 6.796 1.00 1.00 C HETATM 1063 NC HEC A 101 -0.907 9.487 5.852 1.00 1.00 N HETATM 1064 C1C HEC A 101 -0.412 10.761 5.627 1.00 1.00 C HETATM 1065 C2C HEC A 101 -1.460 11.741 5.790 1.00 1.00 C HETATM 1066 C3C HEC A 101 -2.586 11.069 6.111 1.00 1.00 C HETATM 1067 C4C HEC A 101 -2.247 9.666 6.150 1.00 1.00 C HETATM 1068 CMC HEC A 101 -1.284 13.223 5.623 1.00 1.00 C HETATM 1069 CAC HEC A 101 -3.951 11.630 6.383 1.00 1.00 C HETATM 1070 CBC HEC A 101 -4.598 12.304 5.177 1.00 1.00 C HETATM 1071 ND HEC A 101 -1.488 6.884 6.952 1.00 1.00 N HETATM 1072 C1D HEC A 101 -2.787 7.341 6.811 1.00 1.00 C HETATM 1073 C2D HEC A 101 -3.726 6.281 7.092 1.00 1.00 C HETATM 1074 C3D HEC A 101 -3.003 5.184 7.404 1.00 1.00 C HETATM 1075 C4D HEC A 101 -1.610 5.555 7.317 1.00 1.00 C HETATM 1076 CMD HEC A 101 -5.219 6.417 7.036 1.00 1.00 C HETATM 1077 CAD HEC A 101 -3.507 3.819 7.773 1.00 1.00 C HETATM 1078 CBD HEC A 101 -3.698 3.614 9.273 1.00 1.00 C HETATM 1079 CGD HEC A 101 -4.416 2.303 9.560 1.00 1.00 C HETATM 1080 O1D HEC A 101 -3.893 1.540 10.400 1.00 1.00 O HETATM 1081 O2D HEC A 101 -5.477 2.088 8.932 1.00 1.00 O HETATM 1082 FE HEC A 102 -7.837 13.020 0.657 1.00 1.00 FE HETATM 1083 CHA HEC A 102 -7.923 14.305 -2.503 1.00 1.00 C HETATM 1084 CHB HEC A 102 -9.349 10.085 -0.532 1.00 1.00 C HETATM 1085 CHC HEC A 102 -7.934 11.651 3.858 1.00 1.00 C HETATM 1086 CHD HEC A 102 -6.470 15.885 1.869 1.00 1.00 C HETATM 1087 NA HEC A 102 -8.512 12.337 -1.136 1.00 1.00 N HETATM 1088 C1A HEC A 102 -8.431 13.020 -2.337 1.00 1.00 C HETATM 1089 C2A HEC A 102 -8.950 12.208 -3.411 1.00 1.00 C HETATM 1090 C3A HEC A 102 -9.346 11.037 -2.868 1.00 1.00 C HETATM 1091 C4A HEC A 102 -9.077 11.114 -1.452 1.00 1.00 C HETATM 1092 CMA HEC A 102 -9.957 9.856 -3.564 1.00 1.00 C HETATM 1093 CAA HEC A 102 -9.019 12.629 -4.851 1.00 1.00 C HETATM 1094 CBA HEC A 102 -7.667 12.635 -5.559 1.00 1.00 C HETATM 1095 CGA HEC A 102 -7.825 12.963 -7.037 1.00 1.00 C HETATM 1096 O1A HEC A 102 -8.434 14.016 -7.323 1.00 1.00 O HETATM 1097 O2A HEC A 102 -7.335 12.154 -7.853 1.00 1.00 O HETATM 1098 NB HEC A 102 -8.486 11.220 1.482 1.00 1.00 N HETATM 1099 C1B HEC A 102 -9.115 10.170 0.838 1.00 1.00 C HETATM 1100 C2B HEC A 102 -9.504 9.157 1.791 1.00 1.00 C HETATM 1101 C3B HEC A 102 -9.112 9.588 3.009 1.00 1.00 C HETATM 1102 C4B HEC A 102 -8.479 10.872 2.821 1.00 1.00 C HETATM 1103 CMB HEC A 102 -10.209 7.878 1.446 1.00 1.00 C HETATM 1104 CAB HEC A 102 -9.282 8.899 4.332 1.00 1.00 C HETATM 1105 CBB HEC A 102 -8.603 7.535 4.413 1.00 1.00 C HETATM 1106 NC HEC A 102 -7.261 13.628 2.511 1.00 1.00 N HETATM 1107 C1C HEC A 102 -7.524 13.034 3.733 1.00 1.00 C HETATM 1108 C2C HEC A 102 -7.265 13.965 4.807 1.00 1.00 C HETATM 1109 C3C HEC A 102 -6.849 15.118 4.242 1.00 1.00 C HETATM 1110 C4C HEC A 102 -6.845 14.912 2.813 1.00 1.00 C HETATM 1111 CMC HEC A 102 -7.442 13.662 6.267 1.00 1.00 C HETATM 1112 CAC HEC A 102 -6.454 16.393 4.928 1.00 1.00 C HETATM 1113 CBC HEC A 102 -6.087 16.218 6.399 1.00 1.00 C HETATM 1114 ND HEC A 102 -7.383 14.762 -0.129 1.00 1.00 N HETATM 1115 C1D HEC A 102 -6.684 15.779 0.499 1.00 1.00 C HETATM 1116 C2D HEC A 102 -6.200 16.728 -0.475 1.00 1.00 C HETATM 1117 C3D HEC A 102 -6.602 16.294 -1.688 1.00 1.00 C HETATM 1118 C4D HEC A 102 -7.338 15.070 -1.478 1.00 1.00 C HETATM 1119 CMD HEC A 102 -5.402 17.959 -0.152 1.00 1.00 C HETATM 1120 CAD HEC A 102 -6.354 16.927 -3.026 1.00 1.00 C HETATM 1121 CBD HEC A 102 -5.594 16.036 -4.004 1.00 1.00 C HETATM 1122 CGD HEC A 102 -5.464 16.702 -5.366 1.00 1.00 C HETATM 1123 O1D HEC A 102 -4.926 17.831 -5.396 1.00 1.00 O HETATM 1124 O2D HEC A 102 -5.904 16.072 -6.351 1.00 1.00 O HETATM 1125 FE HEC A 103 -17.873 5.991 4.551 1.00 1.00 FE HETATM 1126 CHA HEC A 103 -16.896 3.504 6.644 1.00 1.00 C HETATM 1127 CHB HEC A 103 -21.156 5.024 4.839 1.00 1.00 C HETATM 1128 CHC HEC A 103 -18.865 8.460 2.257 1.00 1.00 C HETATM 1129 CHD HEC A 103 -14.556 6.850 3.989 1.00 1.00 C HETATM 1130 NA HEC A 103 -18.816 4.518 5.474 1.00 1.00 N HETATM 1131 C1A HEC A 103 -18.257 3.670 6.414 1.00 1.00 C HETATM 1132 C2A HEC A 103 -19.294 2.970 7.135 1.00 1.00 C HETATM 1133 C3A HEC A 103 -20.476 3.390 6.638 1.00 1.00 C HETATM 1134 C4A HEC A 103 -20.184 4.353 5.603 1.00 1.00 C HETATM 1135 CMA HEC A 103 -21.856 2.964 7.050 1.00 1.00 C HETATM 1136 CAA HEC A 103 -19.054 1.970 8.229 1.00 1.00 C HETATM 1137 CBA HEC A 103 -18.330 0.708 7.768 1.00 1.00 C HETATM 1138 CGA HEC A 103 -18.988 -0.540 8.339 1.00 1.00 C HETATM 1139 O1A HEC A 103 -18.231 -1.470 8.689 1.00 1.00 O HETATM 1140 O2A HEC A 103 -20.236 -0.540 8.414 1.00 1.00 O HETATM 1141 NB HEC A 103 -19.638 6.593 3.690 1.00 1.00 N HETATM 1142 C1B HEC A 103 -20.895 6.102 4.000 1.00 1.00 C HETATM 1143 C2B HEC A 103 -21.914 6.872 3.326 1.00 1.00 C HETATM 1144 C3B HEC A 103 -21.282 7.825 2.609 1.00 1.00 C HETATM 1145 C4B HEC A 103 -19.866 7.656 2.833 1.00 1.00 C HETATM 1146 CMB HEC A 103 -23.390 6.622 3.433 1.00 1.00 C HETATM 1147 CAB HEC A 103 -21.893 8.880 1.734 1.00 1.00 C HETATM 1148 CBB HEC A 103 -23.088 9.592 2.362 1.00 1.00 C HETATM 1149 NC HEC A 103 -16.900 7.509 3.531 1.00 1.00 N HETATM 1150 C1C HEC A 103 -17.463 8.483 2.725 1.00 1.00 C HETATM 1151 C2C HEC A 103 -16.432 9.228 2.043 1.00 1.00 C HETATM 1152 C3C HEC A 103 -15.246 8.711 2.431 1.00 1.00 C HETATM 1153 C4C HEC A 103 -15.533 7.641 3.358 1.00 1.00 C HETATM 1154 CMC HEC A 103 -16.678 10.360 1.088 1.00 1.00 C HETATM 1155 CAC HEC A 103 -13.871 9.135 2.008 1.00 1.00 C HETATM 1156 CBC HEC A 103 -13.607 10.630 2.160 1.00 1.00 C HETATM 1157 ND HEC A 103 -16.096 5.348 5.197 1.00 1.00 N HETATM 1158 C1D HEC A 103 -14.832 5.774 4.826 1.00 1.00 C HETATM 1159 C2D HEC A 103 -13.824 4.937 5.433 1.00 1.00 C HETATM 1160 C3D HEC A 103 -14.470 4.009 6.170 1.00 1.00 C HETATM 1161 C4D HEC A 103 -15.884 4.261 6.026 1.00 1.00 C HETATM 1162 CMD HEC A 103 -12.344 5.108 5.250 1.00 1.00 C HETATM 1163 CAD HEC A 103 -13.873 2.906 6.995 1.00 1.00 C HETATM 1164 CBD HEC A 103 -13.459 1.680 6.188 1.00 1.00 C HETATM 1165 CGD HEC A 103 -12.677 0.696 7.047 1.00 1.00 C HETATM 1166 O1D HEC A 103 -11.481 0.972 7.279 1.00 1.00 O HETATM 1167 O2D HEC A 103 -13.290 -0.313 7.456 1.00 1.00 O