HETATM 1 C ACE A 0 0.617 15.904 -0.438 1.00 0.00 C HETATM 2 O ACE A 0 0.653 15.814 -1.674 1.00 0.00 O HETATM 3 CH3 ACE A 0 1.522 16.879 0.276 1.00 0.00 C HETATM 4 H1 ACE A 0 2.175 16.344 0.965 1.00 0.00 H HETATM 5 H2 ACE A 0 0.926 17.598 0.838 1.00 0.00 H HETATM 6 H3 ACE A 0 2.120 17.414 -0.463 1.00 0.00 H ATOM 7 N LYS A 1 -0.188 15.184 0.365 1.00 0.00 N ATOM 8 CA LYS A 1 -1.120 14.201 -0.161 1.00 0.00 C ATOM 9 C LYS A 1 -0.808 12.886 0.514 1.00 0.00 C ATOM 10 O LYS A 1 0.231 12.322 0.209 1.00 0.00 O ATOM 11 CB LYS A 1 -1.029 14.135 -1.710 1.00 0.00 C ATOM 12 CG LYS A 1 -1.863 12.949 -2.259 1.00 0.00 C ATOM 13 CD LYS A 1 -2.139 13.004 -3.786 1.00 0.00 C ATOM 14 CE LYS A 1 -3.009 14.221 -4.192 1.00 0.00 C ATOM 15 NZ LYS A 1 -3.838 13.922 -5.385 1.00 1.00 N ATOM 16 H LYS A 1 -0.155 15.320 1.375 1.00 0.00 H ATOM 17 HA LYS A 1 -2.154 14.517 0.055 1.00 0.00 H ATOM 18 HB2 LYS A 1 -1.411 15.091 -2.100 1.00 0.00 H ATOM 19 HB3 LYS A 1 0.012 14.022 -2.044 1.00 0.00 H ATOM 20 HG2 LYS A 1 -1.305 12.021 -2.066 1.00 0.00 H ATOM 21 HG3 LYS A 1 -2.829 12.901 -1.730 1.00 0.00 H ATOM 22 HD2 LYS A 1 -1.190 13.012 -4.348 1.00 0.00 H ATOM 23 HD3 LYS A 1 -2.685 12.080 -4.037 1.00 0.00 H ATOM 24 HE2 LYS A 1 -3.696 14.493 -3.374 1.00 0.00 H ATOM 25 HE3 LYS A 1 -2.353 15.079 -4.407 1.00 0.00 H ATOM 26 HZ1 LYS A 1 -3.221 13.573 -6.202 1.00 0.00 H ATOM 27 HZ2 LYS A 1 -4.358 14.814 -5.706 1.00 0.00 H ATOM 28 HZ3 LYS A 1 -4.583 13.169 -5.167 1.00 0.00 H ATOM 29 N PHE A 2 -1.686 12.402 1.430 1.00 0.00 N ATOM 30 CA PHE A 2 -1.472 11.122 2.111 1.00 0.00 C ATOM 31 C PHE A 2 -2.501 10.144 1.596 1.00 0.00 C ATOM 32 O PHE A 2 -3.168 9.471 2.363 1.00 0.00 O ATOM 33 CB PHE A 2 -1.511 11.302 3.656 1.00 0.00 C ATOM 34 CG PHE A 2 -2.679 12.187 4.113 1.00 0.00 C ATOM 35 CD1 PHE A 2 -3.948 11.650 4.356 1.00 0.00 C ATOM 36 CD2 PHE A 2 -2.481 13.559 4.294 1.00 0.00 C ATOM 37 CE1 PHE A 2 -5.023 12.484 4.660 1.00 0.00 C ATOM 38 CE2 PHE A 2 -3.551 14.395 4.623 1.00 0.00 C ATOM 39 CZ PHE A 2 -4.829 13.860 4.789 1.00 0.00 C ATOM 40 H PHE A 2 -2.541 12.886 1.624 1.00 0.00 H ATOM 41 HA PHE A 2 -0.491 10.689 1.863 1.00 0.00 H ATOM 42 HB2 PHE A 2 -1.555 10.323 4.155 1.00 0.00 H ATOM 43 HB3 PHE A 2 -0.570 11.783 3.961 1.00 0.00 H ATOM 44 HD1 PHE A 2 -4.112 10.580 4.315 1.00 0.00 H ATOM 45 HD2 PHE A 2 -1.493 13.991 4.177 1.00 0.00 H ATOM 46 HE1 PHE A 2 -6.015 12.065 4.797 1.00 0.00 H ATOM 47 HE2 PHE A 2 -3.389 15.460 4.750 1.00 0.00 H ATOM 48 HZ PHE A 2 -5.667 14.511 5.018 1.00 0.00 H ATOM 49 N GLU A 3 -2.627 10.064 0.257 1.00 0.00 N ATOM 50 CA GLU A 3 -3.625 9.197 -0.358 1.00 0.00 C ATOM 51 C GLU A 3 -3.170 7.760 -0.245 1.00 0.00 C ATOM 52 O GLU A 3 -2.663 7.200 -1.203 1.00 0.00 O ATOM 53 CB GLU A 3 -3.819 9.675 -1.821 1.00 0.00 C ATOM 54 CG GLU A 3 -4.991 8.977 -2.549 1.00 0.00 C ATOM 55 CD GLU A 3 -5.152 9.644 -3.893 1.00 0.00 C ATOM 56 OE1 GLU A 3 -5.598 10.824 -3.926 1.00 -0.50 O ATOM 57 OE2 GLU A 3 -4.830 8.999 -4.926 1.00 -0.50 O ATOM 58 H GLU A 3 -2.027 10.598 -0.332 1.00 0.00 H ATOM 59 HA GLU A 3 -4.591 9.331 0.155 1.00 0.00 H ATOM 60 HB2 GLU A 3 -4.053 10.750 -1.783 1.00 0.00 H ATOM 61 HB3 GLU A 3 -2.892 9.534 -2.399 1.00 0.00 H ATOM 62 HG2 GLU A 3 -4.779 7.903 -2.671 1.00 0.00 H ATOM 63 HG3 GLU A 3 -5.920 9.088 -1.969 1.00 0.00 H ATOM 64 N ASP A 4 -3.356 7.165 0.953 1.00 0.00 N ATOM 65 CA ASP A 4 -2.959 5.777 1.182 1.00 0.00 C ATOM 66 C ASP A 4 -3.580 4.832 0.177 1.00 0.00 C ATOM 67 O ASP A 4 -4.475 5.244 -0.542 1.00 0.00 O ATOM 68 CB ASP A 4 -3.333 5.389 2.639 1.00 0.00 C ATOM 69 CG ASP A 4 -4.768 5.702 2.971 1.00 0.00 C ATOM 70 OD1 ASP A 4 -5.646 5.510 2.089 1.00 -0.50 O ATOM 71 OD2 ASP A 4 -5.029 6.145 4.122 1.00 -0.50 O ATOM 72 H ASP A 4 -3.748 7.684 1.715 1.00 0.00 H ATOM 73 HA ASP A 4 -1.866 5.709 1.078 1.00 0.00 H ATOM 74 HB2 ASP A 4 -3.168 4.319 2.815 1.00 0.00 H ATOM 75 HB3 ASP A 4 -2.682 5.950 3.326 1.00 0.00 H ATOM 76 N TRP A 5 -3.100 3.567 0.121 1.00 0.00 N ATOM 77 CA TRP A 5 -3.587 2.611 -0.872 1.00 0.00 C ATOM 78 C TRP A 5 -3.804 1.290 -0.190 1.00 0.00 C ATOM 79 O TRP A 5 -3.449 1.185 0.972 1.00 0.00 O ATOM 80 CB TRP A 5 -2.576 2.479 -2.038 1.00 0.00 C ATOM 81 CG TRP A 5 -1.199 2.108 -1.564 1.00 0.00 C ATOM 82 CD1 TRP A 5 -0.317 2.968 -1.036 1.00 0.00 C ATOM 83 CD2 TRP A 5 -0.530 0.758 -1.599 1.00 0.00 C ATOM 84 NE1 TRP A 5 0.793 2.342 -0.754 1.00 0.00 N ATOM 85 CE2 TRP A 5 0.722 1.038 -1.085 1.00 0.00 C ATOM 86 CE3 TRP A 5 -0.889 -0.528 -2.008 1.00 0.00 C ATOM 87 CZ2 TRP A 5 1.704 0.060 -0.957 1.00 0.00 C ATOM 88 CZ3 TRP A 5 0.119 -1.496 -1.965 1.00 0.00 C ATOM 89 CH2 TRP A 5 1.385 -1.214 -1.436 1.00 0.00 C ATOM 90 H TRP A 5 -2.378 3.260 0.743 1.00 0.00 H ATOM 91 HA TRP A 5 -4.561 2.921 -1.283 1.00 0.00 H ATOM 92 HB2 TRP A 5 -2.910 1.751 -2.790 1.00 0.00 H ATOM 93 HB3 TRP A 5 -2.509 3.464 -2.524 1.00 0.00 H ATOM 94 HD1 TRP A 5 -0.542 4.019 -0.884 1.00 0.00 H ATOM 95 HE1 TRP A 5 1.620 2.791 -0.333 1.00 0.00 H ATOM 96 HE3 TRP A 5 -1.891 -0.753 -2.352 1.00 0.00 H ATOM 97 HZ2 TRP A 5 2.669 0.279 -0.513 1.00 0.00 H ATOM 98 HZ3 TRP A 5 -0.054 -2.490 -2.356 1.00 0.00 H ATOM 99 HH2 TRP A 5 2.127 -2.000 -1.419 1.00 0.00 H ATOM 100 N LEU A 6 -4.399 0.298 -0.894 1.00 0.00 N ATOM 101 CA LEU A 6 -4.776 -0.951 -0.244 1.00 0.00 C ATOM 102 C LEU A 6 -4.268 -2.098 -1.091 1.00 0.00 C ATOM 103 O LEU A 6 -4.829 -2.341 -2.148 1.00 0.00 O ATOM 104 CB LEU A 6 -6.314 -0.872 -0.042 1.00 0.00 C ATOM 105 CG LEU A 6 -6.846 -1.743 1.132 1.00 0.00 C ATOM 106 CD1 LEU A 6 -8.351 -1.456 1.374 1.00 0.00 C ATOM 107 CD2 LEU A 6 -6.627 -3.252 0.870 1.00 0.00 C ATOM 108 H LEU A 6 -4.673 0.414 -1.850 1.00 0.00 H ATOM 109 HA LEU A 6 -4.315 -1.015 0.744 1.00 0.00 H ATOM 110 HB2 LEU A 6 -6.545 0.175 0.214 1.00 0.00 H ATOM 111 HB3 LEU A 6 -6.836 -1.118 -0.981 1.00 0.00 H ATOM 112 HG LEU A 6 -6.319 -1.479 2.062 1.00 0.00 H ATOM 113 HD11 LEU A 6 -8.944 -1.742 0.490 1.00 0.00 H ATOM 114 HD12 LEU A 6 -8.506 -0.384 1.579 1.00 0.00 H ATOM 115 HD13 LEU A 6 -8.709 -2.029 2.245 1.00 0.00 H ATOM 116 HD21 LEU A 6 -5.549 -3.471 0.814 1.00 0.00 H ATOM 117 HD22 LEU A 6 -7.109 -3.549 -0.076 1.00 0.00 H ATOM 118 HD23 LEU A 6 -7.062 -3.837 1.697 1.00 0.00 H ATOM 119 N CYS A 7 -3.197 -2.796 -0.637 1.00 0.00 N ATOM 120 CA CYS A 7 -2.598 -3.851 -1.448 1.00 0.00 C ATOM 121 C CYS A 7 -3.665 -4.809 -1.911 1.00 0.00 C ATOM 122 O CYS A 7 -4.410 -5.291 -1.075 1.00 0.00 O ATOM 123 CB CYS A 7 -1.481 -4.549 -0.621 1.00 0.00 C ATOM 124 SG CYS A 7 -0.530 -5.821 -1.513 1.00 -1.00 S ATOM 125 H CYS A 7 -2.762 -2.573 0.239 1.00 0.00 H ATOM 126 HA CYS A 7 -2.144 -3.377 -2.325 1.00 0.00 H ATOM 127 HB2 CYS A 7 -0.760 -3.797 -0.263 1.00 0.00 H ATOM 128 HB3 CYS A 7 -1.937 -5.040 0.245 1.00 0.00 H ATOM 129 N ASN A 8 -3.767 -5.083 -3.232 1.00 0.00 N ATOM 130 CA ASN A 8 -4.814 -5.979 -3.714 1.00 0.00 C ATOM 131 C ASN A 8 -4.399 -7.429 -3.578 1.00 0.00 C ATOM 132 O ASN A 8 -5.224 -8.288 -3.849 1.00 0.00 O ATOM 133 CB ASN A 8 -5.170 -5.658 -5.194 1.00 0.00 C ATOM 134 CG ASN A 8 -6.659 -5.567 -5.409 1.00 0.00 C ATOM 135 OD1 ASN A 8 -7.149 -4.498 -5.739 1.00 0.00 O ATOM 136 ND2 ASN A 8 -7.411 -6.670 -5.227 1.00 0.00 N ATOM 137 H ASN A 8 -3.103 -4.727 -3.892 1.00 0.00 H ATOM 138 HA ASN A 8 -5.723 -5.821 -3.114 1.00 0.00 H ATOM 139 HB2 ASN A 8 -4.760 -4.680 -5.488 1.00 0.00 H ATOM 140 HB3 ASN A 8 -4.739 -6.415 -5.867 1.00 0.00 H ATOM 141 HD21 ASN A 8 -6.993 -7.537 -4.959 1.00 0.00 H ATOM 142 HD22 ASN A 8 -8.403 -6.617 -5.360 1.00 0.00 H ATOM 143 N LYS A 9 -3.140 -7.716 -3.173 1.00 0.00 N ATOM 144 CA LYS A 9 -2.661 -9.091 -3.080 1.00 0.00 C ATOM 145 C LYS A 9 -2.984 -9.624 -1.703 1.00 0.00 C ATOM 146 O LYS A 9 -3.525 -10.716 -1.631 1.00 0.00 O ATOM 147 CB LYS A 9 -1.146 -9.071 -3.448 1.00 0.00 C ATOM 148 CG LYS A 9 -0.602 -10.398 -4.051 1.00 0.00 C ATOM 149 CD LYS A 9 -0.101 -11.406 -2.985 1.00 0.00 C ATOM 150 CE LYS A 9 1.390 -11.154 -2.632 1.00 0.00 C ATOM 151 NZ LYS A 9 1.866 -12.122 -1.623 1.00 1.00 N ATOM 152 H LYS A 9 -2.492 -7.003 -2.928 1.00 0.00 H ATOM 153 HA LYS A 9 -3.194 -9.695 -3.832 1.00 0.00 H ATOM 154 HB2 LYS A 9 -1.036 -8.324 -4.253 1.00 0.00 H ATOM 155 HB3 LYS A 9 -0.538 -8.741 -2.593 1.00 0.00 H ATOM 156 HG2 LYS A 9 -1.379 -10.874 -4.668 1.00 0.00 H ATOM 157 HG3 LYS A 9 0.244 -10.172 -4.720 1.00 0.00 H ATOM 158 HD2 LYS A 9 -0.731 -11.352 -2.083 1.00 0.00 H ATOM 159 HD3 LYS A 9 -0.175 -12.421 -3.409 1.00 0.00 H ATOM 160 HE2 LYS A 9 2.010 -11.268 -3.536 1.00 0.00 H ATOM 161 HE3 LYS A 9 1.518 -10.129 -2.252 1.00 0.00 H ATOM 162 HZ1 LYS A 9 1.771 -13.137 -1.981 1.00 0.00 H ATOM 163 HZ2 LYS A 9 1.309 -12.039 -0.700 1.00 0.00 H ATOM 164 HZ3 LYS A 9 2.916 -11.968 -1.420 1.00 0.00 H ATOM 165 N CYS A 10 -2.681 -8.865 -0.621 1.00 0.00 N ATOM 166 CA CYS A 10 -3.043 -9.291 0.733 1.00 0.00 C ATOM 167 C CYS A 10 -4.139 -8.465 1.375 1.00 0.00 C ATOM 168 O CYS A 10 -4.476 -8.743 2.515 1.00 0.00 O ATOM 169 CB CYS A 10 -1.783 -9.199 1.618 1.00 0.00 C ATOM 170 SG CYS A 10 -1.456 -7.462 2.041 1.00 -1.00 S ATOM 171 H CYS A 10 -2.208 -7.990 -0.717 1.00 0.00 H ATOM 172 HA CYS A 10 -3.370 -10.343 0.736 1.00 0.00 H ATOM 173 HB2 CYS A 10 -1.949 -9.743 2.553 1.00 0.00 H ATOM 174 HB3 CYS A 10 -0.925 -9.643 1.091 1.00 0.00 H ATOM 175 N CYS A 11 -4.714 -7.453 0.691 1.00 0.00 N ATOM 176 CA CYS A 11 -5.832 -6.717 1.272 1.00 0.00 C ATOM 177 C CYS A 11 -5.483 -6.012 2.567 1.00 0.00 C ATOM 178 O CYS A 11 -6.222 -6.167 3.526 1.00 0.00 O ATOM 179 CB CYS A 11 -7.048 -7.672 1.409 1.00 0.00 C ATOM 180 SG CYS A 11 -8.604 -6.716 1.389 1.00 0.00 S ATOM 181 H CYS A 11 -4.438 -7.211 -0.240 1.00 0.00 H ATOM 182 HA CYS A 11 -6.133 -5.942 0.555 1.00 0.00 H ATOM 183 HB2 CYS A 11 -7.066 -8.361 0.551 1.00 0.00 H ATOM 184 HB3 CYS A 11 -6.994 -8.268 2.334 1.00 0.00 H ATOM 185 HG CYS A 11 -8.591 -6.440 0.419 1.00 0.00 H ATOM 186 N LEU A 12 -4.373 -5.230 2.603 1.00 0.00 N ATOM 187 CA LEU A 12 -3.985 -4.500 3.814 1.00 0.00 C ATOM 188 C LEU A 12 -3.762 -3.047 3.455 1.00 0.00 C ATOM 189 O LEU A 12 -3.264 -2.788 2.372 1.00 0.00 O ATOM 190 CB LEU A 12 -2.706 -5.162 4.387 1.00 0.00 C ATOM 191 CG LEU A 12 -2.227 -4.682 5.790 1.00 0.00 C ATOM 192 CD1 LEU A 12 -1.599 -3.259 5.817 1.00 0.00 C ATOM 193 CD2 LEU A 12 -3.294 -4.836 6.903 1.00 0.00 C ATOM 194 H LEU A 12 -3.792 -5.140 1.795 1.00 0.00 H ATOM 195 HA LEU A 12 -4.782 -4.574 4.566 1.00 0.00 H ATOM 196 HB2 LEU A 12 -2.916 -6.241 4.465 1.00 0.00 H ATOM 197 HB3 LEU A 12 -1.889 -5.032 3.662 1.00 0.00 H ATOM 198 HG LEU A 12 -1.430 -5.392 6.058 1.00 0.00 H ATOM 199 HD11 LEU A 12 -1.325 -2.900 4.821 1.00 0.00 H ATOM 200 HD12 LEU A 12 -0.693 -3.261 6.443 1.00 0.00 H ATOM 201 HD13 LEU A 12 -2.298 -2.540 6.257 1.00 0.00 H ATOM 202 HD21 LEU A 12 -2.815 -4.778 7.892 1.00 0.00 H ATOM 203 HD22 LEU A 12 -3.797 -5.804 6.812 1.00 0.00 H ATOM 204 HD23 LEU A 12 -4.064 -4.056 6.846 1.00 0.00 H ATOM 205 N ASN A 13 -4.140 -2.097 4.342 1.00 0.00 N ATOM 206 CA ASN A 13 -4.062 -0.681 3.996 1.00 0.00 C ATOM 207 C ASN A 13 -2.671 -0.157 4.265 1.00 0.00 C ATOM 208 O ASN A 13 -2.242 -0.227 5.405 1.00 0.00 O ATOM 209 CB ASN A 13 -5.185 0.082 4.744 1.00 0.00 C ATOM 210 CG ASN A 13 -5.699 1.241 3.930 1.00 0.00 C ATOM 211 OD1 ASN A 13 -6.695 1.073 3.245 1.00 0.00 O ATOM 212 ND2 ASN A 13 -5.055 2.423 3.972 1.00 0.00 N ATOM 213 H ASN A 13 -4.498 -2.337 5.243 1.00 0.00 H ATOM 214 HA ASN A 13 -4.301 -0.573 2.936 1.00 0.00 H ATOM 215 HB2 ASN A 13 -6.051 -0.584 4.874 1.00 0.00 H ATOM 216 HB3 ASN A 13 -4.845 0.392 5.743 1.00 0.00 H ATOM 217 HD21 ASN A 13 -4.238 2.549 4.527 1.00 0.00 H ATOM 218 HD22 ASN A 13 -5.417 3.186 3.437 1.00 0.00 H ATOM 219 N ASN A 14 -1.956 0.347 3.229 1.00 0.00 N ATOM 220 CA ASN A 14 -0.550 0.725 3.380 1.00 0.00 C ATOM 221 C ASN A 14 -0.455 2.219 3.231 1.00 0.00 C ATOM 222 O ASN A 14 -1.322 2.765 2.568 1.00 0.00 O ATOM 223 CB ASN A 14 0.278 0.084 2.235 1.00 0.00 C ATOM 224 CG ASN A 14 -0.434 -1.149 1.746 1.00 0.00 C ATOM 225 OD1 ASN A 14 -1.119 -1.056 0.740 1.00 0.00 O ATOM 226 ND2 ASN A 14 -0.327 -2.295 2.444 1.00 0.00 N ATOM 227 H ASN A 14 -2.364 0.471 2.321 1.00 0.00 H ATOM 228 HA ASN A 14 -0.132 0.376 4.336 1.00 0.00 H ATOM 229 HB2 ASN A 14 0.345 0.823 1.423 1.00 0.00 H ATOM 230 HB3 ASN A 14 1.310 -0.142 2.561 1.00 0.00 H ATOM 231 HD21 ASN A 14 0.267 -2.333 3.248 1.00 0.00 H ATOM 232 HD22 ASN A 14 -0.848 -3.109 2.179 1.00 0.00 H ATOM 233 N PHE A 15 0.567 2.897 3.798 1.00 0.00 N ATOM 234 CA PHE A 15 0.631 4.345 3.618 1.00 0.00 C ATOM 235 C PHE A 15 1.065 4.684 2.216 1.00 0.00 C ATOM 236 O PHE A 15 1.641 3.848 1.538 1.00 0.00 O ATOM 237 CB PHE A 15 1.579 5.050 4.624 1.00 0.00 C ATOM 238 CG PHE A 15 0.880 5.261 5.969 1.00 0.00 C ATOM 239 CD1 PHE A 15 -0.183 6.165 6.055 1.00 0.00 C ATOM 240 CD2 PHE A 15 1.292 4.577 7.116 1.00 0.00 C ATOM 241 CE1 PHE A 15 -0.875 6.331 7.253 1.00 0.00 C ATOM 242 CE2 PHE A 15 0.608 4.750 8.319 1.00 0.00 C ATOM 243 CZ PHE A 15 -0.488 5.612 8.386 1.00 0.00 C ATOM 244 H PHE A 15 1.285 2.430 4.313 1.00 0.00 H ATOM 245 HA PHE A 15 -0.391 4.737 3.752 1.00 0.00 H ATOM 246 HB2 PHE A 15 2.508 4.473 4.729 1.00 0.00 H ATOM 247 HB3 PHE A 15 1.851 6.050 4.258 1.00 0.00 H ATOM 248 HD1 PHE A 15 -0.476 6.746 5.187 1.00 0.00 H ATOM 249 HD2 PHE A 15 2.151 3.917 7.077 1.00 0.00 H ATOM 250 HE1 PHE A 15 -1.713 7.018 7.306 1.00 0.00 H ATOM 251 HE2 PHE A 15 0.923 4.214 9.208 1.00 0.00 H ATOM 252 HZ PHE A 15 -1.036 5.728 9.315 1.00 0.00 H ATOM 253 N ARG A 16 0.791 5.933 1.778 1.00 0.00 N ATOM 254 CA ARG A 16 1.241 6.361 0.460 1.00 0.00 C ATOM 255 C ARG A 16 2.745 6.386 0.433 1.00 0.00 C ATOM 256 O ARG A 16 3.329 5.915 -0.530 1.00 0.00 O ATOM 257 CB ARG A 16 0.695 7.767 0.101 1.00 0.00 C ATOM 258 CG ARG A 16 0.861 8.045 -1.415 1.00 0.00 C ATOM 259 CD ARG A 16 0.971 9.566 -1.676 1.00 0.00 C ATOM 260 NE ARG A 16 1.005 9.870 -3.105 1.00 0.00 N ATOM 261 CZ ARG A 16 1.338 11.047 -3.585 1.00 1.00 C ATOM 262 NH1 ARG A 16 1.636 12.075 -2.826 1.00 0.00 N ATOM 263 NH2 ARG A 16 1.377 11.207 -4.887 1.00 0.00 N ATOM 264 H ARG A 16 0.309 6.596 2.356 1.00 0.00 H ATOM 265 HA ARG A 16 0.883 5.653 -0.293 1.00 0.00 H ATOM 266 HB2 ARG A 16 -0.377 7.837 0.342 1.00 0.00 H ATOM 267 HB3 ARG A 16 1.233 8.510 0.705 1.00 0.00 H ATOM 268 HG2 ARG A 16 1.782 7.584 -1.804 1.00 0.00 H ATOM 269 HG3 ARG A 16 0.001 7.616 -1.953 1.00 0.00 H ATOM 270 HD2 ARG A 16 0.115 10.074 -1.213 1.00 0.00 H ATOM 271 HD3 ARG A 16 1.907 9.883 -1.188 1.00 0.00 H ATOM 272 HE ARG A 16 0.781 9.103 -3.757 1.00 0.00 H ATOM 273 HH11 ARG A 16 1.597 12.021 -1.801 1.00 0.00 H ATOM 274 HH12 ARG A 16 1.912 12.973 -3.247 1.00 0.00 H ATOM 275 HH21 ARG A 16 1.150 10.429 -5.525 1.00 0.00 H ATOM 276 HH22 ARG A 16 1.633 12.113 -5.303 1.00 0.00 H ATOM 277 N LYS A 17 3.381 6.936 1.491 1.00 0.00 N ATOM 278 CA LYS A 17 4.837 7.034 1.501 1.00 0.00 C ATOM 279 C LYS A 17 5.467 5.720 1.101 1.00 0.00 C ATOM 280 O LYS A 17 6.497 5.736 0.449 1.00 0.00 O ATOM 281 CB LYS A 17 5.376 7.514 2.880 1.00 0.00 C ATOM 282 CG LYS A 17 5.447 6.362 3.913 1.00 0.00 C ATOM 283 CD LYS A 17 5.715 6.850 5.359 1.00 0.00 C ATOM 284 CE LYS A 17 6.118 5.636 6.237 1.00 0.00 C ATOM 285 NZ LYS A 17 6.080 5.913 7.686 1.00 1.00 N ATOM 286 H LYS A 17 2.863 7.314 2.260 1.00 0.00 H ATOM 287 HA LYS A 17 5.106 7.797 0.752 1.00 0.00 H ATOM 288 HB2 LYS A 17 6.399 7.900 2.745 1.00 0.00 H ATOM 289 HB3 LYS A 17 4.751 8.336 3.266 1.00 0.00 H ATOM 290 HG2 LYS A 17 4.495 5.816 3.924 1.00 0.00 H ATOM 291 HG3 LYS A 17 6.257 5.679 3.612 1.00 0.00 H ATOM 292 HD2 LYS A 17 6.529 7.593 5.374 1.00 0.00 H ATOM 293 HD3 LYS A 17 4.800 7.318 5.755 1.00 0.00 H ATOM 294 HE2 LYS A 17 5.437 4.797 6.025 1.00 0.00 H ATOM 295 HE3 LYS A 17 7.144 5.343 5.966 1.00 0.00 H ATOM 296 HZ1 LYS A 17 6.711 6.762 7.915 1.00 0.00 H ATOM 297 HZ2 LYS A 17 6.451 5.064 8.243 1.00 0.00 H ATOM 298 HZ3 LYS A 17 5.077 6.134 8.021 1.00 0.00 H ATOM 299 N ARG A 18 4.857 4.574 1.481 1.00 0.00 N ATOM 300 CA ARG A 18 5.429 3.284 1.118 1.00 0.00 C ATOM 301 C ARG A 18 5.066 2.956 -0.312 1.00 0.00 C ATOM 302 O ARG A 18 3.885 2.787 -0.574 1.00 0.00 O ATOM 303 CB ARG A 18 4.832 2.172 2.019 1.00 0.00 C ATOM 304 CG ARG A 18 5.302 2.255 3.497 1.00 0.00 C ATOM 305 CD ARG A 18 6.493 1.300 3.787 1.00 0.00 C ATOM 306 NE ARG A 18 7.643 1.590 2.936 1.00 0.00 N ATOM 307 CZ ARG A 18 8.529 2.530 3.182 1.00 1.00 C ATOM 308 NH1 ARG A 18 8.470 3.333 4.217 1.00 0.00 N ATOM 309 NH2 ARG A 18 9.531 2.677 2.348 1.00 0.00 N ATOM 310 H ARG A 18 3.990 4.583 1.981 1.00 0.00 H ATOM 311 HA ARG A 18 6.519 3.298 1.262 1.00 0.00 H ATOM 312 HB2 ARG A 18 3.733 2.221 1.984 1.00 0.00 H ATOM 313 HB3 ARG A 18 5.125 1.200 1.609 1.00 0.00 H ATOM 314 HG2 ARG A 18 5.555 3.290 3.759 1.00 0.00 H ATOM 315 HG3 ARG A 18 4.458 1.950 4.133 1.00 0.00 H ATOM 316 HD2 ARG A 18 6.749 1.278 4.856 1.00 0.00 H ATOM 317 HD3 ARG A 18 6.166 0.277 3.549 1.00 0.00 H ATOM 318 HE ARG A 18 7.767 0.990 2.104 1.00 0.00 H ATOM 319 HH11 ARG A 18 7.715 3.270 4.904 1.00 0.00 H ATOM 320 HH12 ARG A 18 9.192 4.054 4.367 1.00 0.00 H ATOM 321 HH21 ARG A 18 9.627 2.075 1.516 1.00 0.00 H ATOM 322 HH22 ARG A 18 10.250 3.400 2.503 1.00 0.00 H ATOM 323 N LEU A 19 6.044 2.827 -1.241 1.00 0.00 N ATOM 324 CA LEU A 19 5.706 2.295 -2.561 1.00 0.00 C ATOM 325 C LEU A 19 5.384 0.818 -2.490 1.00 0.00 C ATOM 326 O LEU A 19 4.869 0.325 -3.483 1.00 0.00 O ATOM 327 CB LEU A 19 6.822 2.441 -3.643 1.00 0.00 C ATOM 328 CG LEU A 19 6.700 3.726 -4.513 1.00 0.00 C ATOM 329 CD1 LEU A 19 7.301 4.951 -3.782 1.00 0.00 C ATOM 330 CD2 LEU A 19 7.402 3.518 -5.880 1.00 0.00 C ATOM 331 H LEU A 19 7.008 2.992 -1.021 1.00 0.00 H ATOM 332 HA LEU A 19 4.793 2.789 -2.921 1.00 0.00 H ATOM 333 HB2 LEU A 19 7.820 2.367 -3.184 1.00 0.00 H ATOM 334 HB3 LEU A 19 6.739 1.603 -4.349 1.00 0.00 H ATOM 335 HG LEU A 19 5.643 3.932 -4.747 1.00 0.00 H ATOM 336 HD11 LEU A 19 6.812 5.087 -2.805 1.00 0.00 H ATOM 337 HD12 LEU A 19 7.146 5.859 -4.387 1.00 0.00 H ATOM 338 HD13 LEU A 19 8.385 4.811 -3.627 1.00 0.00 H ATOM 339 HD21 LEU A 19 6.900 2.715 -6.445 1.00 0.00 H ATOM 340 HD22 LEU A 19 8.458 3.244 -5.733 1.00 0.00 H ATOM 341 HD23 LEU A 19 7.347 4.439 -6.479 1.00 0.00 H ATOM 342 N LYS A 20 5.678 0.092 -1.386 1.00 0.00 N ATOM 343 CA LYS A 20 5.506 -1.358 -1.384 1.00 0.00 C ATOM 344 C LYS A 20 4.738 -1.787 -0.166 1.00 0.00 C ATOM 345 O LYS A 20 4.675 -1.044 0.799 1.00 0.00 O ATOM 346 CB LYS A 20 6.875 -2.078 -1.494 1.00 0.00 C ATOM 347 CG LYS A 20 7.865 -1.624 -0.386 1.00 0.00 C ATOM 348 CD LYS A 20 9.230 -2.358 -0.440 1.00 0.00 C ATOM 349 CE LYS A 20 9.969 -2.137 -1.786 1.00 0.00 C ATOM 350 NZ LYS A 20 11.437 -2.158 -1.608 1.00 1.00 N ATOM 351 H LYS A 20 6.048 0.507 -0.557 1.00 0.00 H ATOM 352 HA LYS A 20 4.885 -1.666 -2.237 1.00 0.00 H ATOM 353 HB2 LYS A 20 6.728 -3.167 -1.423 1.00 0.00 H ATOM 354 HB3 LYS A 20 7.292 -1.848 -2.487 1.00 0.00 H ATOM 355 HG2 LYS A 20 8.085 -0.549 -0.484 1.00 0.00 H ATOM 356 HG3 LYS A 20 7.411 -1.799 0.603 1.00 0.00 H ATOM 357 HD2 LYS A 20 9.841 -1.945 0.379 1.00 0.00 H ATOM 358 HD3 LYS A 20 9.092 -3.436 -0.257 1.00 0.00 H ATOM 359 HE2 LYS A 20 9.673 -2.928 -2.493 1.00 0.00 H ATOM 360 HE3 LYS A 20 9.703 -1.160 -2.218 1.00 0.00 H ATOM 361 HZ1 LYS A 20 11.760 -1.298 -1.035 1.00 0.00 H ATOM 362 HZ2 LYS A 20 11.937 -2.108 -2.567 1.00 0.00 H ATOM 363 HZ3 LYS A 20 11.765 -3.049 -1.093 1.00 0.00 H ATOM 364 N CYS A 21 4.117 -2.982 -0.205 1.00 0.00 N ATOM 365 CA CYS A 21 3.222 -3.339 0.882 1.00 0.00 C ATOM 366 C CYS A 21 4.047 -3.604 2.114 1.00 0.00 C ATOM 367 O CYS A 21 5.109 -4.191 1.983 1.00 0.00 O ATOM 368 CB CYS A 21 2.370 -4.569 0.500 1.00 0.00 C ATOM 369 SG CYS A 21 1.178 -4.899 1.828 1.00 -1.00 S ATOM 370 H CYS A 21 4.220 -3.613 -0.975 1.00 0.00 H ATOM 371 HA CYS A 21 2.517 -2.506 1.041 1.00 0.00 H ATOM 372 HB2 CYS A 21 1.809 -4.359 -0.422 1.00 0.00 H ATOM 373 HB3 CYS A 21 3.009 -5.447 0.333 1.00 0.00 H ATOM 374 N PHE A 22 3.565 -3.178 3.304 1.00 0.00 N ATOM 375 CA PHE A 22 4.291 -3.427 4.547 1.00 0.00 C ATOM 376 C PHE A 22 3.692 -4.601 5.284 1.00 0.00 C ATOM 377 O PHE A 22 3.675 -4.596 6.504 1.00 0.00 O ATOM 378 CB PHE A 22 4.254 -2.116 5.370 1.00 0.00 C ATOM 379 CG PHE A 22 5.038 -2.191 6.689 1.00 0.00 C ATOM 380 CD1 PHE A 22 6.419 -2.409 6.675 1.00 0.00 C ATOM 381 CD2 PHE A 22 4.380 -2.033 7.910 1.00 0.00 C ATOM 382 CE1 PHE A 22 7.125 -2.518 7.873 1.00 0.00 C ATOM 383 CE2 PHE A 22 5.090 -2.115 9.114 1.00 0.00 C ATOM 384 CZ PHE A 22 6.464 -2.370 9.094 1.00 0.00 C ATOM 385 H PHE A 22 2.679 -2.719 3.366 1.00 0.00 H ATOM 386 HA PHE A 22 5.346 -3.668 4.346 1.00 0.00 H ATOM 387 HB2 PHE A 22 4.695 -1.323 4.748 1.00 0.00 H ATOM 388 HB3 PHE A 22 3.205 -1.854 5.577 1.00 0.00 H ATOM 389 HD1 PHE A 22 6.952 -2.493 5.733 1.00 0.00 H ATOM 390 HD2 PHE A 22 3.312 -1.845 7.948 1.00 0.00 H ATOM 391 HE1 PHE A 22 8.193 -2.717 7.858 1.00 0.00 H ATOM 392 HE2 PHE A 22 4.576 -1.981 10.057 1.00 0.00 H ATOM 393 HZ PHE A 22 7.011 -2.452 10.024 1.00 0.00 H ATOM 394 N ARG A 23 3.215 -5.622 4.535 1.00 0.00 N ATOM 395 CA ARG A 23 2.708 -6.850 5.139 1.00 0.00 C ATOM 396 C ARG A 23 3.223 -7.992 4.286 1.00 0.00 C ATOM 397 O ARG A 23 4.021 -8.764 4.793 1.00 0.00 O ATOM 398 CB ARG A 23 1.160 -6.854 5.300 1.00 0.00 C ATOM 399 CG ARG A 23 0.706 -8.063 6.176 1.00 0.00 C ATOM 400 CD ARG A 23 -0.568 -8.823 5.699 1.00 0.00 C ATOM 401 NE ARG A 23 -1.836 -8.437 6.322 1.00 0.00 N ATOM 402 CZ ARG A 23 -2.960 -9.097 6.125 1.00 1.00 C ATOM 403 NH1 ARG A 23 -3.064 -10.122 5.311 1.00 0.00 N ATOM 404 NH2 ARG A 23 -4.039 -8.733 6.778 1.00 0.00 N ATOM 405 H ARG A 23 3.229 -5.579 3.544 1.00 0.00 H ATOM 406 HA ARG A 23 3.142 -6.962 6.148 1.00 0.00 H ATOM 407 HB2 ARG A 23 0.893 -5.912 5.800 1.00 0.00 H ATOM 408 HB3 ARG A 23 0.674 -6.853 4.314 1.00 0.00 H ATOM 409 HG2 ARG A 23 1.517 -8.808 6.149 1.00 0.00 H ATOM 410 HG3 ARG A 23 0.597 -7.751 7.226 1.00 0.00 H ATOM 411 HD2 ARG A 23 -0.642 -8.780 4.602 1.00 0.00 H ATOM 412 HD3 ARG A 23 -0.406 -9.869 6.004 1.00 0.00 H ATOM 413 HE ARG A 23 -1.828 -7.637 6.970 1.00 0.00 H ATOM 414 HH11 ARG A 23 -2.260 -10.479 4.786 1.00 0.00 H ATOM 415 HH12 ARG A 23 -3.963 -10.608 5.186 1.00 0.00 H ATOM 416 HH21 ARG A 23 -4.011 -7.973 7.467 1.00 0.00 H ATOM 417 HH22 ARG A 23 -4.936 -9.223 6.641 1.00 0.00 H ATOM 418 N CYS A 24 2.811 -8.111 3.000 1.00 0.00 N ATOM 419 CA CYS A 24 3.365 -9.149 2.137 1.00 0.00 C ATOM 420 C CYS A 24 4.645 -8.739 1.446 1.00 0.00 C ATOM 421 O CYS A 24 5.319 -9.627 0.948 1.00 0.00 O ATOM 422 CB CYS A 24 2.332 -9.608 1.081 1.00 0.00 C ATOM 423 SG CYS A 24 1.863 -8.305 -0.110 1.00 -1.00 S ATOM 424 H CYS A 24 2.152 -7.481 2.596 1.00 0.00 H ATOM 425 HA CYS A 24 3.589 -10.042 2.743 1.00 0.00 H ATOM 426 HB2 CYS A 24 2.768 -10.441 0.516 1.00 0.00 H ATOM 427 HB3 CYS A 24 1.427 -9.966 1.593 1.00 0.00 H ATOM 428 N GLY A 25 5.020 -7.440 1.383 1.00 0.00 N ATOM 429 CA GLY A 25 6.250 -7.055 0.691 1.00 0.00 C ATOM 430 C GLY A 25 6.040 -6.737 -0.768 1.00 0.00 C ATOM 431 O GLY A 25 6.756 -5.890 -1.276 1.00 0.00 O ATOM 432 H GLY A 25 4.468 -6.709 1.780 1.00 0.00 H ATOM 433 HA2 GLY A 25 6.668 -6.164 1.189 1.00 0.00 H ATOM 434 HA3 GLY A 25 7.011 -7.850 0.770 1.00 0.00 H ATOM 435 N ALA A 26 5.098 -7.408 -1.468 1.00 0.00 N ATOM 436 CA ALA A 26 4.947 -7.164 -2.901 1.00 0.00 C ATOM 437 C ALA A 26 4.734 -5.706 -3.205 1.00 0.00 C ATOM 438 O ALA A 26 4.308 -4.974 -2.327 1.00 0.00 O ATOM 439 CB ALA A 26 3.756 -7.964 -3.487 1.00 0.00 C ATOM 440 H ALA A 26 4.535 -8.117 -1.044 1.00 0.00 H ATOM 441 HA ALA A 26 5.868 -7.519 -3.399 1.00 0.00 H ATOM 442 HB1 ALA A 26 3.896 -9.042 -3.303 1.00 0.00 H ATOM 443 HB2 ALA A 26 2.822 -7.632 -3.011 1.00 0.00 H ATOM 444 HB3 ALA A 26 3.677 -7.801 -4.574 1.00 0.00 H ATOM 445 N ASP A 27 5.051 -5.276 -4.449 1.00 0.00 N ATOM 446 CA ASP A 27 4.931 -3.859 -4.772 1.00 0.00 C ATOM 447 C ASP A 27 3.492 -3.538 -5.087 1.00 0.00 C ATOM 448 O ASP A 27 2.705 -4.454 -5.266 1.00 0.00 O ATOM 449 CB ASP A 27 5.857 -3.506 -5.965 1.00 0.00 C ATOM 450 CG ASP A 27 6.017 -2.017 -6.115 1.00 0.00 C ATOM 451 OD1 ASP A 27 6.830 -1.424 -5.354 1.00 -0.50 O ATOM 452 OD2 ASP A 27 5.325 -1.422 -6.984 1.00 -0.50 O ATOM 453 H ASP A 27 5.356 -5.913 -5.166 1.00 0.00 H ATOM 454 HA ASP A 27 5.275 -3.276 -3.908 1.00 0.00 H ATOM 455 HB2 ASP A 27 6.855 -3.933 -5.778 1.00 0.00 H ATOM 456 HB3 ASP A 27 5.453 -3.944 -6.890 1.00 0.00 H ATOM 457 N LYS A 28 3.147 -2.237 -5.169 1.00 0.00 N ATOM 458 CA LYS A 28 1.801 -1.856 -5.586 1.00 0.00 C ATOM 459 C LYS A 28 1.486 -2.463 -6.929 1.00 0.00 C ATOM 460 O LYS A 28 0.342 -2.835 -7.136 1.00 0.00 O ATOM 461 CB LYS A 28 1.695 -0.313 -5.707 1.00 0.00 C ATOM 462 CG LYS A 28 1.739 0.325 -4.292 1.00 0.00 C ATOM 463 CD LYS A 28 2.225 1.795 -4.261 1.00 0.00 C ATOM 464 CE LYS A 28 1.131 2.791 -4.729 1.00 0.00 C ATOM 465 NZ LYS A 28 1.723 3.854 -5.568 1.00 1.00 N ATOM 466 H LYS A 28 3.817 -1.517 -4.981 1.00 0.00 H ATOM 467 HA LYS A 28 1.067 -2.219 -4.847 1.00 0.00 H ATOM 468 HB2 LYS A 28 2.522 0.049 -6.337 1.00 0.00 H ATOM 469 HB3 LYS A 28 0.746 -0.045 -6.202 1.00 0.00 H ATOM 470 HG2 LYS A 28 0.731 0.271 -3.869 1.00 0.00 H ATOM 471 HG3 LYS A 28 2.416 -0.253 -3.646 1.00 0.00 H ATOM 472 HD2 LYS A 28 2.499 2.050 -3.224 1.00 0.00 H ATOM 473 HD3 LYS A 28 3.136 1.875 -4.874 1.00 0.00 H ATOM 474 HE2 LYS A 28 0.348 2.289 -5.320 1.00 0.00 H ATOM 475 HE3 LYS A 28 0.650 3.240 -3.844 1.00 0.00 H ATOM 476 HZ1 LYS A 28 2.553 4.336 -5.071 1.00 0.00 H ATOM 477 HZ2 LYS A 28 0.986 4.614 -5.786 1.00 0.00 H ATOM 478 HZ3 LYS A 28 2.074 3.446 -6.509 1.00 0.00 H ATOM 479 N PHE A 29 2.483 -2.570 -7.838 1.00 0.00 N ATOM 480 CA PHE A 29 2.232 -3.127 -9.164 1.00 0.00 C ATOM 481 C PHE A 29 2.750 -4.543 -9.271 1.00 0.00 C ATOM 482 O PHE A 29 3.121 -4.944 -10.361 1.00 0.00 O ATOM 483 CB PHE A 29 2.892 -2.177 -10.200 1.00 0.00 C ATOM 484 CG PHE A 29 1.979 -1.938 -11.407 1.00 0.00 C ATOM 485 CD1 PHE A 29 0.875 -1.092 -11.260 1.00 0.00 C ATOM 486 CD2 PHE A 29 2.234 -2.532 -12.645 1.00 0.00 C ATOM 487 CE1 PHE A 29 0.062 -0.796 -12.355 1.00 0.00 C ATOM 488 CE2 PHE A 29 1.423 -2.234 -13.743 1.00 0.00 C ATOM 489 CZ PHE A 29 0.344 -1.360 -13.601 1.00 0.00 C ATOM 490 H PHE A 29 3.420 -2.283 -7.626 1.00 0.00 H ATOM 491 HA PHE A 29 1.152 -3.162 -9.373 1.00 0.00 H ATOM 492 HB2 PHE A 29 3.038 -1.184 -9.747 1.00 0.00 H ATOM 493 HB3 PHE A 29 3.884 -2.546 -10.502 1.00 0.00 H ATOM 494 HD1 PHE A 29 0.645 -0.657 -10.293 1.00 0.00 H ATOM 495 HD2 PHE A 29 3.064 -3.220 -12.762 1.00 0.00 H ATOM 496 HE1 PHE A 29 -0.785 -0.130 -12.238 1.00 0.00 H ATOM 497 HE2 PHE A 29 1.632 -2.679 -14.709 1.00 0.00 H ATOM 498 HZ PHE A 29 -0.279 -1.120 -14.457 1.00 0.00 H ATOM 499 N ASP A 30 2.783 -5.311 -8.155 1.00 0.00 N ATOM 500 CA ASP A 30 3.302 -6.679 -8.171 1.00 0.00 C ATOM 501 C ASP A 30 4.823 -6.693 -8.334 1.00 0.00 C ATOM 502 O ASP A 30 5.542 -7.111 -7.427 1.00 0.00 O ATOM 503 CB ASP A 30 2.571 -7.609 -9.178 1.00 0.00 C ATOM 504 CG ASP A 30 2.834 -9.071 -8.925 1.00 0.00 C ATOM 505 OD1 ASP A 30 3.730 -9.408 -8.102 1.00 -0.50 O ATOM 506 OD2 ASP A 30 2.133 -9.906 -9.558 1.00 -0.50 O ATOM 507 H ASP A 30 2.461 -4.961 -7.277 1.00 0.00 H ATOM 508 HA ASP A 30 3.085 -7.102 -7.174 1.00 0.00 H ATOM 509 HB2 ASP A 30 1.489 -7.434 -9.076 1.00 0.00 H ATOM 510 HB3 ASP A 30 2.861 -7.394 -10.217 1.00 0.00 H HETATM 511 N NH2 A 31 5.363 -6.241 -9.487 1.00 0.00 N HETATM 512 HN1 NH2 A 31 6.356 -6.245 -9.603 1.00 0.00 H HETATM 513 HN2 NH2 A 31 4.800 -5.900 -10.238 1.00 0.00 H TER 514 NH2 A 31 HETATM 515 C1 AQN A 32 1.984 1.315 7.681 1.00 0.00 C HETATM 516 C2 AQN A 32 0.770 1.488 8.352 1.00 0.00 C HETATM 517 C3 AQN A 32 -0.490 1.757 7.568 1.00 0.00 C HETATM 518 O3 AQN A 32 -0.427 1.961 6.367 1.00 0.00 O HETATM 519 C4 AQN A 32 -1.821 1.792 8.280 1.00 0.00 C HETATM 520 C5 AQN A 32 -2.985 1.968 7.537 1.00 0.00 C HETATM 521 C6 AQN A 32 -4.235 1.964 8.161 1.00 0.00 C HETATM 522 C7 AQN A 32 -4.309 1.818 9.548 1.00 0.00 C HETATM 523 C8 AQN A 32 -3.141 1.672 10.299 1.00 0.00 C HETATM 524 C9 AQN A 32 -1.896 1.655 9.666 1.00 0.00 C HETATM 525 C10 AQN A 32 -0.620 1.494 10.458 1.00 0.00 C HETATM 526 O10 AQN A 32 -0.678 1.424 11.675 1.00 0.00 O HETATM 527 C11 AQN A 32 0.714 1.428 9.746 1.00 0.00 C HETATM 528 C12 AQN A 32 1.905 1.306 10.465 1.00 0.00 C HETATM 529 C13 AQN A 32 3.131 1.249 9.801 1.00 0.00 C HETATM 530 C14 AQN A 32 3.178 1.260 8.406 1.00 0.00 C HETATM 531 S15 AQN A 32 4.743 1.270 7.565 1.00 0.00 S HETATM 532 OS1 AQN A 32 4.547 0.723 6.240 1.00 0.00 O HETATM 533 OS2 AQN A 32 4.984 2.746 7.452 1.00 -1.00 O HETATM 534 OS3 AQN A 32 5.753 0.701 8.434 1.00 0.00 O HETATM 535 H1 AQN A 32 2.005 1.242 6.597 1.00 0.00 H HETATM 536 H5 AQN A 32 -2.892 2.106 6.471 1.00 0.00 H HETATM 537 H6 AQN A 32 -5.142 2.073 7.579 1.00 0.00 H HETATM 538 H7 AQN A 32 -5.271 1.819 10.048 1.00 0.00 H HETATM 539 H8 AQN A 32 -3.210 1.581 11.378 1.00 0.00 H HETATM 540 H12 AQN A 32 1.884 1.255 11.547 1.00 0.00 H HETATM 541 H13 AQN A 32 4.048 1.191 10.373 1.00 0.00 H HETATM 542 ZN ZN A 33 0.243 -6.697 0.565 1.00 2.00 ZN