HETATM 1 C ACE A 0 -0.350 15.255 2.351 1.00 0.00 C HETATM 2 O ACE A 0 -1.190 15.047 3.238 1.00 0.00 O HETATM 3 CH3 ACE A 0 0.849 16.129 2.636 1.00 0.00 C HETATM 4 H1 ACE A 0 0.853 16.985 1.962 1.00 0.00 H HETATM 5 H2 ACE A 0 1.766 15.559 2.492 1.00 0.00 H HETATM 6 H3 ACE A 0 0.801 16.469 3.670 1.00 0.00 H ATOM 7 N LYS A 1 -0.405 14.756 1.103 1.00 0.00 N ATOM 8 CA LYS A 1 -1.514 13.897 0.700 1.00 0.00 C ATOM 9 C LYS A 1 -1.128 12.466 0.992 1.00 0.00 C ATOM 10 O LYS A 1 -0.481 11.853 0.158 1.00 0.00 O ATOM 11 CB LYS A 1 -1.859 14.136 -0.795 1.00 0.00 C ATOM 12 CG LYS A 1 -2.956 13.152 -1.275 1.00 0.00 C ATOM 13 CD LYS A 1 -3.706 13.666 -2.533 1.00 0.00 C ATOM 14 CE LYS A 1 -4.787 12.637 -2.960 1.00 0.00 C ATOM 15 NZ LYS A 1 -5.669 13.131 -4.036 1.00 1.00 N ATOM 16 H LYS A 1 0.332 14.932 0.449 1.00 0.00 H ATOM 17 HA LYS A 1 -2.424 14.166 1.261 1.00 0.00 H ATOM 18 HB2 LYS A 1 -2.218 15.173 -0.886 1.00 0.00 H ATOM 19 HB3 LYS A 1 -0.971 14.018 -1.432 1.00 0.00 H ATOM 20 HG2 LYS A 1 -2.482 12.186 -1.505 1.00 0.00 H ATOM 21 HG3 LYS A 1 -3.694 13.006 -0.473 1.00 0.00 H ATOM 22 HD2 LYS A 1 -4.199 14.622 -2.294 1.00 0.00 H ATOM 23 HD3 LYS A 1 -2.994 13.832 -3.356 1.00 0.00 H ATOM 24 HE2 LYS A 1 -4.289 11.715 -3.301 1.00 0.00 H ATOM 25 HE3 LYS A 1 -5.426 12.407 -2.093 1.00 0.00 H ATOM 26 HZ1 LYS A 1 -6.376 12.368 -4.331 1.00 0.00 H ATOM 27 HZ2 LYS A 1 -5.092 13.406 -4.908 1.00 0.00 H ATOM 28 HZ3 LYS A 1 -6.230 13.999 -3.720 1.00 0.00 H ATOM 29 N PHE A 2 -1.524 11.924 2.168 1.00 0.00 N ATOM 30 CA PHE A 2 -1.236 10.525 2.480 1.00 0.00 C ATOM 31 C PHE A 2 -2.386 9.688 1.973 1.00 0.00 C ATOM 32 O PHE A 2 -3.100 9.096 2.767 1.00 0.00 O ATOM 33 CB PHE A 2 -1.026 10.306 4.002 1.00 0.00 C ATOM 34 CG PHE A 2 0.319 10.882 4.463 1.00 0.00 C ATOM 35 CD1 PHE A 2 0.459 12.255 4.683 1.00 0.00 C ATOM 36 CD2 PHE A 2 1.416 10.041 4.675 1.00 0.00 C ATOM 37 CE1 PHE A 2 1.683 12.782 5.110 1.00 0.00 C ATOM 38 CE2 PHE A 2 2.629 10.560 5.135 1.00 0.00 C ATOM 39 CZ PHE A 2 2.762 11.936 5.350 1.00 0.00 C ATOM 40 H PHE A 2 -2.080 12.442 2.817 1.00 0.00 H ATOM 41 HA PHE A 2 -0.313 10.191 1.986 1.00 0.00 H ATOM 42 HB2 PHE A 2 -1.846 10.758 4.582 1.00 0.00 H ATOM 43 HB3 PHE A 2 -1.025 9.226 4.213 1.00 0.00 H ATOM 44 HD1 PHE A 2 -0.379 12.922 4.529 1.00 0.00 H ATOM 45 HD2 PHE A 2 1.340 8.973 4.488 1.00 0.00 H ATOM 46 HE1 PHE A 2 1.788 13.852 5.256 1.00 0.00 H ATOM 47 HE2 PHE A 2 3.466 9.898 5.326 1.00 0.00 H ATOM 48 HZ PHE A 2 3.705 12.340 5.702 1.00 0.00 H ATOM 49 N GLU A 3 -2.577 9.625 0.636 1.00 0.00 N ATOM 50 CA GLU A 3 -3.658 8.816 0.079 1.00 0.00 C ATOM 51 C GLU A 3 -3.216 7.373 0.062 1.00 0.00 C ATOM 52 O GLU A 3 -2.847 6.865 -0.985 1.00 0.00 O ATOM 53 CB GLU A 3 -4.005 9.332 -1.340 1.00 0.00 C ATOM 54 CG GLU A 3 -5.308 8.727 -1.923 1.00 0.00 C ATOM 55 CD GLU A 3 -6.398 9.767 -1.923 1.00 0.00 C ATOM 56 OE1 GLU A 3 -6.953 10.050 -0.828 1.00 -0.50 O ATOM 57 OE2 GLU A 3 -6.696 10.319 -3.019 1.00 -0.50 O ATOM 58 H GLU A 3 -1.963 10.107 0.013 1.00 0.00 H ATOM 59 HA GLU A 3 -4.566 8.925 0.696 1.00 0.00 H ATOM 60 HB2 GLU A 3 -4.137 10.417 -1.257 1.00 0.00 H ATOM 61 HB3 GLU A 3 -3.176 9.147 -2.036 1.00 0.00 H ATOM 62 HG2 GLU A 3 -5.130 8.422 -2.966 1.00 0.00 H ATOM 63 HG3 GLU A 3 -5.631 7.839 -1.357 1.00 0.00 H ATOM 64 N ASP A 4 -3.250 6.709 1.239 1.00 0.00 N ATOM 65 CA ASP A 4 -2.850 5.305 1.333 1.00 0.00 C ATOM 66 C ASP A 4 -3.515 4.436 0.287 1.00 0.00 C ATOM 67 O ASP A 4 -4.492 4.878 -0.296 1.00 0.00 O ATOM 68 CB ASP A 4 -3.178 4.801 2.765 1.00 0.00 C ATOM 69 CG ASP A 4 -4.596 5.111 3.163 1.00 0.00 C ATOM 70 OD1 ASP A 4 -5.491 5.092 2.277 1.00 -0.50 O ATOM 71 OD2 ASP A 4 -4.826 5.378 4.373 1.00 -0.50 O ATOM 72 H ASP A 4 -3.522 7.190 2.073 1.00 0.00 H ATOM 73 HA ASP A 4 -1.762 5.252 1.179 1.00 0.00 H ATOM 74 HB2 ASP A 4 -3.028 3.718 2.861 1.00 0.00 H ATOM 75 HB3 ASP A 4 -2.504 5.306 3.473 1.00 0.00 H ATOM 76 N TRP A 5 -2.992 3.209 0.034 1.00 0.00 N ATOM 77 CA TRP A 5 -3.515 2.364 -1.041 1.00 0.00 C ATOM 78 C TRP A 5 -3.748 0.951 -0.573 1.00 0.00 C ATOM 79 O TRP A 5 -3.000 0.501 0.278 1.00 0.00 O ATOM 80 CB TRP A 5 -2.513 2.318 -2.220 1.00 0.00 C ATOM 81 CG TRP A 5 -1.077 2.086 -1.815 1.00 0.00 C ATOM 82 CD1 TRP A 5 -0.181 3.051 -1.563 1.00 0.00 C ATOM 83 CD2 TRP A 5 -0.351 0.775 -1.642 1.00 0.00 C ATOM 84 NE1 TRP A 5 0.979 2.522 -1.279 1.00 0.00 N ATOM 85 CE2 TRP A 5 0.938 1.174 -1.341 1.00 0.00 C ATOM 86 CE3 TRP A 5 -0.690 -0.576 -1.732 1.00 0.00 C ATOM 87 CZ2 TRP A 5 1.972 0.256 -1.164 1.00 0.00 C ATOM 88 CZ3 TRP A 5 0.342 -1.506 -1.579 1.00 0.00 C ATOM 89 CH2 TRP A 5 1.659 -1.097 -1.336 1.00 0.00 C ATOM 90 H TRP A 5 -2.207 2.866 0.547 1.00 0.00 H ATOM 91 HA TRP A 5 -4.471 2.758 -1.420 1.00 0.00 H ATOM 92 HB2 TRP A 5 -2.826 1.538 -2.931 1.00 0.00 H ATOM 93 HB3 TRP A 5 -2.563 3.291 -2.733 1.00 0.00 H ATOM 94 HD1 TRP A 5 -0.407 4.114 -1.605 1.00 0.00 H ATOM 95 HE1 TRP A 5 1.824 3.065 -1.051 1.00 0.00 H ATOM 96 HE3 TRP A 5 -1.706 -0.880 -1.921 1.00 0.00 H ATOM 97 HZ2 TRP A 5 2.979 0.563 -0.908 1.00 0.00 H ATOM 98 HZ3 TRP A 5 0.139 -2.568 -1.653 1.00 0.00 H ATOM 99 HH2 TRP A 5 2.441 -1.844 -1.284 1.00 0.00 H ATOM 100 N LEU A 6 -4.764 0.241 -1.128 1.00 0.00 N ATOM 101 CA LEU A 6 -4.991 -1.142 -0.719 1.00 0.00 C ATOM 102 C LEU A 6 -4.096 -2.052 -1.522 1.00 0.00 C ATOM 103 O LEU A 6 -3.966 -1.850 -2.718 1.00 0.00 O ATOM 104 CB LEU A 6 -6.455 -1.655 -0.842 1.00 0.00 C ATOM 105 CG LEU A 6 -7.290 -1.436 0.454 1.00 0.00 C ATOM 106 CD1 LEU A 6 -7.525 0.068 0.739 1.00 0.00 C ATOM 107 CD2 LEU A 6 -8.649 -2.177 0.336 1.00 0.00 C ATOM 108 H LEU A 6 -5.340 0.619 -1.855 1.00 0.00 H ATOM 109 HA LEU A 6 -4.724 -1.230 0.338 1.00 0.00 H ATOM 110 HB2 LEU A 6 -6.956 -1.198 -1.711 1.00 0.00 H ATOM 111 HB3 LEU A 6 -6.407 -2.744 -1.008 1.00 0.00 H ATOM 112 HG LEU A 6 -6.758 -1.886 1.311 1.00 0.00 H ATOM 113 HD11 LEU A 6 -8.070 0.178 1.687 1.00 0.00 H ATOM 114 HD12 LEU A 6 -8.117 0.520 -0.070 1.00 0.00 H ATOM 115 HD13 LEU A 6 -6.567 0.600 0.821 1.00 0.00 H ATOM 116 HD21 LEU A 6 -9.239 -2.038 1.258 1.00 0.00 H ATOM 117 HD22 LEU A 6 -8.478 -3.257 0.195 1.00 0.00 H ATOM 118 HD23 LEU A 6 -9.227 -1.792 -0.521 1.00 0.00 H ATOM 119 N CYS A 7 -3.489 -3.067 -0.864 1.00 0.00 N ATOM 120 CA CYS A 7 -2.629 -4.002 -1.584 1.00 0.00 C ATOM 121 C CYS A 7 -3.508 -4.890 -2.421 1.00 0.00 C ATOM 122 O CYS A 7 -4.686 -4.982 -2.112 1.00 0.00 O ATOM 123 CB CYS A 7 -1.822 -4.817 -0.539 1.00 0.00 C ATOM 124 SG CYS A 7 -0.595 -5.983 -1.187 1.00 -1.00 S ATOM 125 H CYS A 7 -3.644 -3.223 0.115 1.00 0.00 H ATOM 126 HA CYS A 7 -1.942 -3.452 -2.245 1.00 0.00 H ATOM 127 HB2 CYS A 7 -1.261 -4.119 0.090 1.00 0.00 H ATOM 128 HB3 CYS A 7 -2.512 -5.400 0.079 1.00 0.00 H ATOM 129 N ASN A 8 -2.946 -5.539 -3.470 1.00 0.00 N ATOM 130 CA ASN A 8 -3.739 -6.452 -4.292 1.00 0.00 C ATOM 131 C ASN A 8 -3.332 -7.870 -3.962 1.00 0.00 C ATOM 132 O ASN A 8 -3.220 -8.704 -4.847 1.00 0.00 O ATOM 133 CB ASN A 8 -3.539 -6.066 -5.782 1.00 0.00 C ATOM 134 CG ASN A 8 -4.852 -6.115 -6.520 1.00 0.00 C ATOM 135 OD1 ASN A 8 -5.075 -7.031 -7.296 1.00 0.00 O ATOM 136 ND2 ASN A 8 -5.744 -5.128 -6.286 1.00 0.00 N ATOM 137 H ASN A 8 -1.970 -5.446 -3.687 1.00 0.00 H ATOM 138 HA ASN A 8 -4.810 -6.369 -4.055 1.00 0.00 H ATOM 139 HB2 ASN A 8 -3.175 -5.028 -5.845 1.00 0.00 H ATOM 140 HB3 ASN A 8 -2.786 -6.705 -6.266 1.00 0.00 H ATOM 141 HD21 ASN A 8 -5.541 -4.389 -5.640 1.00 0.00 H ATOM 142 HD22 ASN A 8 -6.624 -5.133 -6.762 1.00 0.00 H ATOM 143 N LYS A 9 -3.103 -8.138 -2.657 1.00 0.00 N ATOM 144 CA LYS A 9 -2.617 -9.441 -2.220 1.00 0.00 C ATOM 145 C LYS A 9 -3.163 -9.702 -0.829 1.00 0.00 C ATOM 146 O LYS A 9 -3.886 -10.674 -0.677 1.00 0.00 O ATOM 147 CB LYS A 9 -1.066 -9.414 -2.324 1.00 0.00 C ATOM 148 CG LYS A 9 -0.428 -10.770 -2.720 1.00 0.00 C ATOM 149 CD LYS A 9 -0.518 -11.835 -1.599 1.00 0.00 C ATOM 150 CE LYS A 9 0.115 -13.165 -2.085 1.00 0.00 C ATOM 151 NZ LYS A 9 0.223 -14.146 -0.987 1.00 1.00 N ATOM 152 H LYS A 9 -3.203 -7.423 -1.973 1.00 0.00 H ATOM 153 HA LYS A 9 -3.013 -10.217 -2.894 1.00 0.00 H ATOM 154 HB2 LYS A 9 -0.796 -8.702 -3.122 1.00 0.00 H ATOM 155 HB3 LYS A 9 -0.617 -9.055 -1.390 1.00 0.00 H ATOM 156 HG2 LYS A 9 -0.900 -11.145 -3.642 1.00 0.00 H ATOM 157 HG3 LYS A 9 0.641 -10.593 -2.931 1.00 0.00 H ATOM 158 HD2 LYS A 9 0.023 -11.471 -0.711 1.00 0.00 H ATOM 159 HD3 LYS A 9 -1.569 -12.013 -1.328 1.00 0.00 H ATOM 160 HE2 LYS A 9 -0.508 -13.586 -2.891 1.00 0.00 H ATOM 161 HE3 LYS A 9 1.124 -12.976 -2.484 1.00 0.00 H ATOM 162 HZ1 LYS A 9 0.898 -13.798 -0.218 1.00 0.00 H ATOM 163 HZ2 LYS A 9 0.610 -15.083 -1.365 1.00 0.00 H ATOM 164 HZ3 LYS A 9 -0.740 -14.343 -0.538 1.00 0.00 H ATOM 165 N CYS A 10 -2.861 -8.838 0.175 1.00 0.00 N ATOM 166 CA CYS A 10 -3.469 -8.950 1.504 1.00 0.00 C ATOM 167 C CYS A 10 -4.473 -7.849 1.804 1.00 0.00 C ATOM 168 O CYS A 10 -4.928 -7.767 2.934 1.00 0.00 O ATOM 169 CB CYS A 10 -2.344 -8.932 2.566 1.00 0.00 C ATOM 170 SG CYS A 10 -1.541 -7.301 2.511 1.00 -1.00 S ATOM 171 H CYS A 10 -2.238 -8.073 0.020 1.00 0.00 H ATOM 172 HA CYS A 10 -3.993 -9.910 1.613 1.00 0.00 H ATOM 173 HB2 CYS A 10 -2.755 -9.105 3.571 1.00 0.00 H ATOM 174 HB3 CYS A 10 -1.600 -9.713 2.345 1.00 0.00 H ATOM 175 N CYS A 11 -4.860 -6.994 0.830 1.00 0.00 N ATOM 176 CA CYS A 11 -5.911 -6.008 1.070 1.00 0.00 C ATOM 177 C CYS A 11 -5.661 -5.064 2.228 1.00 0.00 C ATOM 178 O CYS A 11 -6.619 -4.535 2.772 1.00 0.00 O ATOM 179 CB CYS A 11 -7.255 -6.781 1.189 1.00 0.00 C ATOM 180 SG CYS A 11 -8.469 -6.161 -0.020 1.00 0.00 S ATOM 181 H CYS A 11 -4.507 -7.057 -0.097 1.00 0.00 H ATOM 182 HA CYS A 11 -5.957 -5.345 0.192 1.00 0.00 H ATOM 183 HB2 CYS A 11 -7.099 -7.848 0.968 1.00 0.00 H ATOM 184 HB3 CYS A 11 -7.683 -6.705 2.199 1.00 0.00 H ATOM 185 HG CYS A 11 -7.987 -6.448 -0.859 1.00 0.00 H ATOM 186 N LEU A 12 -4.388 -4.822 2.606 1.00 0.00 N ATOM 187 CA LEU A 12 -4.095 -3.919 3.717 1.00 0.00 C ATOM 188 C LEU A 12 -3.933 -2.520 3.170 1.00 0.00 C ATOM 189 O LEU A 12 -3.463 -2.397 2.052 1.00 0.00 O ATOM 190 CB LEU A 12 -2.836 -4.458 4.449 1.00 0.00 C ATOM 191 CG LEU A 12 -2.377 -3.627 5.678 1.00 0.00 C ATOM 192 CD1 LEU A 12 -1.526 -4.530 6.612 1.00 0.00 C ATOM 193 CD2 LEU A 12 -1.561 -2.366 5.279 1.00 0.00 C ATOM 194 H LEU A 12 -3.621 -5.229 2.118 1.00 0.00 H ATOM 195 HA LEU A 12 -4.926 -3.935 4.442 1.00 0.00 H ATOM 196 HB2 LEU A 12 -3.120 -5.470 4.782 1.00 0.00 H ATOM 197 HB3 LEU A 12 -1.985 -4.543 3.758 1.00 0.00 H ATOM 198 HG LEU A 12 -3.279 -3.308 6.226 1.00 0.00 H ATOM 199 HD11 LEU A 12 -1.036 -5.325 6.035 1.00 0.00 H ATOM 200 HD12 LEU A 12 -2.175 -4.989 7.368 1.00 0.00 H ATOM 201 HD13 LEU A 12 -0.735 -3.979 7.137 1.00 0.00 H ATOM 202 HD21 LEU A 12 -0.478 -2.541 5.323 1.00 0.00 H ATOM 203 HD22 LEU A 12 -1.825 -1.551 5.965 1.00 0.00 H ATOM 204 HD23 LEU A 12 -1.792 -2.035 4.268 1.00 0.00 H ATOM 205 N ASN A 13 -4.305 -1.473 3.949 1.00 0.00 N ATOM 206 CA ASN A 13 -4.218 -0.101 3.449 1.00 0.00 C ATOM 207 C ASN A 13 -2.841 0.448 3.755 1.00 0.00 C ATOM 208 O ASN A 13 -2.622 0.888 4.872 1.00 0.00 O ATOM 209 CB ASN A 13 -5.351 0.722 4.115 1.00 0.00 C ATOM 210 CG ASN A 13 -5.650 2.024 3.416 1.00 0.00 C ATOM 211 OD1 ASN A 13 -5.099 2.301 2.362 1.00 0.00 O ATOM 212 ND2 ASN A 13 -6.554 2.840 3.995 1.00 0.00 N ATOM 213 H ASN A 13 -4.629 -1.615 4.887 1.00 0.00 H ATOM 214 HA ASN A 13 -4.429 -0.095 2.372 1.00 0.00 H ATOM 215 HB2 ASN A 13 -6.276 0.126 4.057 1.00 0.00 H ATOM 216 HB3 ASN A 13 -5.122 0.896 5.178 1.00 0.00 H ATOM 217 HD21 ASN A 13 -6.985 2.590 4.863 1.00 0.00 H ATOM 218 HD22 ASN A 13 -6.811 3.697 3.551 1.00 0.00 H ATOM 219 N ASN A 14 -1.897 0.414 2.782 1.00 0.00 N ATOM 220 CA ASN A 14 -0.509 0.787 3.061 1.00 0.00 C ATOM 221 C ASN A 14 -0.288 2.249 2.792 1.00 0.00 C ATOM 222 O ASN A 14 -0.993 2.804 1.967 1.00 0.00 O ATOM 223 CB ASN A 14 0.495 -0.011 2.195 1.00 0.00 C ATOM 224 CG ASN A 14 0.306 -1.466 2.529 1.00 0.00 C ATOM 225 OD1 ASN A 14 0.974 -1.949 3.428 1.00 0.00 O ATOM 226 ND2 ASN A 14 -0.603 -2.193 1.851 1.00 0.00 N ATOM 227 H ASN A 14 -2.134 0.144 1.853 1.00 0.00 H ATOM 228 HA ASN A 14 -0.273 0.561 4.114 1.00 0.00 H ATOM 229 HB2 ASN A 14 0.302 0.194 1.134 1.00 0.00 H ATOM 230 HB3 ASN A 14 1.528 0.310 2.419 1.00 0.00 H ATOM 231 HD21 ASN A 14 -1.123 -1.815 1.087 1.00 0.00 H ATOM 232 HD22 ASN A 14 -0.773 -3.132 2.136 1.00 0.00 H ATOM 233 N PHE A 15 0.688 2.881 3.479 1.00 0.00 N ATOM 234 CA PHE A 15 0.842 4.328 3.354 1.00 0.00 C ATOM 235 C PHE A 15 1.121 4.720 1.928 1.00 0.00 C ATOM 236 O PHE A 15 1.537 3.881 1.147 1.00 0.00 O ATOM 237 CB PHE A 15 2.017 4.869 4.207 1.00 0.00 C ATOM 238 CG PHE A 15 1.647 5.163 5.672 1.00 0.00 C ATOM 239 CD1 PHE A 15 0.767 4.355 6.400 1.00 0.00 C ATOM 240 CD2 PHE A 15 2.207 6.282 6.297 1.00 0.00 C ATOM 241 CE1 PHE A 15 0.434 4.675 7.717 1.00 0.00 C ATOM 242 CE2 PHE A 15 1.876 6.604 7.617 1.00 0.00 C ATOM 243 CZ PHE A 15 0.983 5.806 8.326 1.00 0.00 C ATOM 244 H PHE A 15 1.291 2.373 4.094 1.00 0.00 H ATOM 245 HA PHE A 15 -0.093 4.813 3.677 1.00 0.00 H ATOM 246 HB2 PHE A 15 2.840 4.149 4.146 1.00 0.00 H ATOM 247 HB3 PHE A 15 2.372 5.808 3.759 1.00 0.00 H ATOM 248 HD1 PHE A 15 0.322 3.472 5.962 1.00 0.00 H ATOM 249 HD2 PHE A 15 2.905 6.920 5.767 1.00 0.00 H ATOM 250 HE1 PHE A 15 -0.254 4.044 8.271 1.00 0.00 H ATOM 251 HE2 PHE A 15 2.314 7.478 8.084 1.00 0.00 H ATOM 252 HZ PHE A 15 0.714 6.060 9.345 1.00 0.00 H ATOM 253 N ARG A 16 0.904 6.011 1.589 1.00 0.00 N ATOM 254 CA ARG A 16 1.246 6.464 0.249 1.00 0.00 C ATOM 255 C ARG A 16 2.739 6.460 0.077 1.00 0.00 C ATOM 256 O ARG A 16 3.212 5.874 -0.883 1.00 0.00 O ATOM 257 CB ARG A 16 0.658 7.858 -0.090 1.00 0.00 C ATOM 258 CG ARG A 16 1.169 8.331 -1.481 1.00 0.00 C ATOM 259 CD ARG A 16 0.135 9.155 -2.306 1.00 0.00 C ATOM 260 NE ARG A 16 0.437 10.572 -2.510 1.00 0.00 N ATOM 261 CZ ARG A 16 -0.276 11.347 -3.299 1.00 1.00 C ATOM 262 NH1 ARG A 16 -1.350 10.942 -3.936 1.00 0.00 N ATOM 263 NH2 ARG A 16 0.104 12.591 -3.465 1.00 0.00 N ATOM 264 H ARG A 16 0.550 6.682 2.242 1.00 0.00 H ATOM 265 HA ARG A 16 0.808 5.753 -0.467 1.00 0.00 H ATOM 266 HB2 ARG A 16 -0.433 7.731 -0.055 1.00 0.00 H ATOM 267 HB3 ARG A 16 0.951 8.597 0.670 1.00 0.00 H ATOM 268 HG2 ARG A 16 2.109 8.886 -1.348 1.00 0.00 H ATOM 269 HG3 ARG A 16 1.409 7.433 -2.077 1.00 0.00 H ATOM 270 HD2 ARG A 16 0.106 8.687 -3.302 1.00 0.00 H ATOM 271 HD3 ARG A 16 -0.854 9.075 -1.847 1.00 0.00 H ATOM 272 HE ARG A 16 1.260 10.964 -2.027 1.00 0.00 H ATOM 273 HH11 ARG A 16 -1.706 9.984 -3.848 1.00 0.00 H ATOM 274 HH12 ARG A 16 -1.874 11.585 -4.550 1.00 0.00 H ATOM 275 HH21 ARG A 16 0.945 12.957 -2.994 1.00 0.00 H ATOM 276 HH22 ARG A 16 -0.421 13.231 -4.078 1.00 0.00 H ATOM 277 N LYS A 17 3.499 7.106 0.989 1.00 0.00 N ATOM 278 CA LYS A 17 4.944 7.125 0.794 1.00 0.00 C ATOM 279 C LYS A 17 5.483 5.732 0.590 1.00 0.00 C ATOM 280 O LYS A 17 6.463 5.589 -0.122 1.00 0.00 O ATOM 281 CB LYS A 17 5.730 7.852 1.918 1.00 0.00 C ATOM 282 CG LYS A 17 5.584 7.209 3.328 1.00 0.00 C ATOM 283 CD LYS A 17 6.965 6.998 4.013 1.00 0.00 C ATOM 284 CE LYS A 17 7.694 5.748 3.453 1.00 0.00 C ATOM 285 NZ LYS A 17 9.124 5.749 3.828 1.00 1.00 N ATOM 286 H LYS A 17 3.100 7.585 1.775 1.00 0.00 H ATOM 287 HA LYS A 17 5.123 7.689 -0.137 1.00 0.00 H ATOM 288 HB2 LYS A 17 6.786 7.871 1.606 1.00 0.00 H ATOM 289 HB3 LYS A 17 5.387 8.899 1.969 1.00 0.00 H ATOM 290 HG2 LYS A 17 4.974 7.875 3.960 1.00 0.00 H ATOM 291 HG3 LYS A 17 5.073 6.239 3.283 1.00 0.00 H ATOM 292 HD2 LYS A 17 7.573 7.906 3.873 1.00 0.00 H ATOM 293 HD3 LYS A 17 6.819 6.855 5.094 1.00 0.00 H ATOM 294 HE2 LYS A 17 7.221 4.840 3.861 1.00 0.00 H ATOM 295 HE3 LYS A 17 7.628 5.707 2.356 1.00 0.00 H ATOM 296 HZ1 LYS A 17 9.258 5.828 4.897 1.00 0.00 H ATOM 297 HZ2 LYS A 17 9.643 6.568 3.350 1.00 0.00 H ATOM 298 HZ3 LYS A 17 9.591 4.831 3.497 1.00 0.00 H ATOM 299 N ARG A 18 4.856 4.691 1.181 1.00 0.00 N ATOM 300 CA ARG A 18 5.378 3.351 0.965 1.00 0.00 C ATOM 301 C ARG A 18 5.118 2.947 -0.464 1.00 0.00 C ATOM 302 O ARG A 18 3.961 2.891 -0.847 1.00 0.00 O ATOM 303 CB ARG A 18 4.684 2.291 1.859 1.00 0.00 C ATOM 304 CG ARG A 18 5.117 2.362 3.345 1.00 0.00 C ATOM 305 CD ARG A 18 6.451 1.625 3.644 1.00 0.00 C ATOM 306 NE ARG A 18 6.322 0.181 3.445 1.00 0.00 N ATOM 307 CZ ARG A 18 7.340 -0.648 3.466 1.00 1.00 C ATOM 308 NH1 ARG A 18 8.569 -0.271 3.722 1.00 0.00 N ATOM 309 NH2 ARG A 18 7.119 -1.917 3.219 1.00 0.00 N ATOM 310 H ARG A 18 4.030 4.800 1.736 1.00 0.00 H ATOM 311 HA ARG A 18 6.454 3.350 1.193 1.00 0.00 H ATOM 312 HB2 ARG A 18 3.591 2.401 1.781 1.00 0.00 H ATOM 313 HB3 ARG A 18 4.950 1.310 1.459 1.00 0.00 H ATOM 314 HG2 ARG A 18 5.224 3.420 3.608 1.00 0.00 H ATOM 315 HG3 ARG A 18 4.329 1.919 3.971 1.00 0.00 H ATOM 316 HD2 ARG A 18 7.226 2.045 2.986 1.00 0.00 H ATOM 317 HD3 ARG A 18 6.723 1.819 4.694 1.00 0.00 H ATOM 318 HE ARG A 18 5.376 -0.191 3.262 1.00 0.00 H ATOM 319 HH11 ARG A 18 8.799 0.706 3.941 1.00 0.00 H ATOM 320 HH12 ARG A 18 9.341 -0.954 3.720 1.00 0.00 H ATOM 321 HH21 ARG A 18 6.175 -2.257 3.001 1.00 0.00 H ATOM 322 HH22 ARG A 18 7.888 -2.605 3.227 1.00 0.00 H ATOM 323 N LEU A 19 6.175 2.642 -1.249 1.00 0.00 N ATOM 324 CA LEU A 19 5.958 1.979 -2.528 1.00 0.00 C ATOM 325 C LEU A 19 5.629 0.520 -2.297 1.00 0.00 C ATOM 326 O LEU A 19 4.956 -0.028 -3.158 1.00 0.00 O ATOM 327 CB LEU A 19 7.226 2.097 -3.415 1.00 0.00 C ATOM 328 CG LEU A 19 7.415 3.554 -3.938 1.00 0.00 C ATOM 329 CD1 LEU A 19 8.857 4.065 -3.695 1.00 0.00 C ATOM 330 CD2 LEU A 19 7.067 3.644 -5.448 1.00 0.00 C ATOM 331 H LEU A 19 7.120 2.764 -0.932 1.00 0.00 H ATOM 332 HA LEU A 19 5.112 2.439 -3.066 1.00 0.00 H ATOM 333 HB2 LEU A 19 8.102 1.756 -2.844 1.00 0.00 H ATOM 334 HB3 LEU A 19 7.116 1.414 -4.269 1.00 0.00 H ATOM 335 HG LEU A 19 6.743 4.238 -3.393 1.00 0.00 H ATOM 336 HD11 LEU A 19 8.966 5.090 -4.082 1.00 0.00 H ATOM 337 HD12 LEU A 19 9.585 3.415 -4.202 1.00 0.00 H ATOM 338 HD13 LEU A 19 9.072 4.078 -2.616 1.00 0.00 H ATOM 339 HD21 LEU A 19 7.134 4.686 -5.796 1.00 0.00 H ATOM 340 HD22 LEU A 19 6.044 3.282 -5.624 1.00 0.00 H ATOM 341 HD23 LEU A 19 7.769 3.035 -6.039 1.00 0.00 H ATOM 342 N LYS A 20 6.072 -0.116 -1.180 1.00 0.00 N ATOM 343 CA LYS A 20 5.802 -1.538 -0.969 1.00 0.00 C ATOM 344 C LYS A 20 4.891 -1.820 0.193 1.00 0.00 C ATOM 345 O LYS A 20 4.778 -1.018 1.100 1.00 0.00 O ATOM 346 CB LYS A 20 7.109 -2.355 -0.807 1.00 0.00 C ATOM 347 CG LYS A 20 7.725 -2.670 -2.193 1.00 0.00 C ATOM 348 CD LYS A 20 9.060 -3.441 -2.045 1.00 0.00 C ATOM 349 CE LYS A 20 9.566 -3.910 -3.432 1.00 0.00 C ATOM 350 NZ LYS A 20 10.856 -4.617 -3.317 1.00 1.00 N ATOM 351 H LYS A 20 6.606 0.355 -0.476 1.00 0.00 H ATOM 352 HA LYS A 20 5.249 -1.939 -1.820 1.00 0.00 H ATOM 353 HB2 LYS A 20 7.818 -1.795 -0.175 1.00 0.00 H ATOM 354 HB3 LYS A 20 6.889 -3.311 -0.309 1.00 0.00 H ATOM 355 HG2 LYS A 20 7.021 -3.304 -2.753 1.00 0.00 H ATOM 356 HG3 LYS A 20 7.886 -1.734 -2.751 1.00 0.00 H ATOM 357 HD2 LYS A 20 9.808 -2.783 -1.576 1.00 0.00 H ATOM 358 HD3 LYS A 20 8.909 -4.323 -1.404 1.00 0.00 H ATOM 359 HE2 LYS A 20 8.827 -4.596 -3.876 1.00 0.00 H ATOM 360 HE3 LYS A 20 9.685 -3.037 -4.094 1.00 0.00 H ATOM 361 HZ1 LYS A 20 11.187 -4.959 -4.289 1.00 0.00 H ATOM 362 HZ2 LYS A 20 10.774 -5.480 -2.672 1.00 0.00 H ATOM 363 HZ3 LYS A 20 11.619 -3.962 -2.917 1.00 0.00 H ATOM 364 N CYS A 21 4.214 -2.990 0.160 1.00 0.00 N ATOM 365 CA CYS A 21 3.245 -3.290 1.203 1.00 0.00 C ATOM 366 C CYS A 21 3.993 -3.567 2.479 1.00 0.00 C ATOM 367 O CYS A 21 5.119 -4.029 2.379 1.00 0.00 O ATOM 368 CB CYS A 21 2.422 -4.527 0.785 1.00 0.00 C ATOM 369 SG CYS A 21 1.242 -4.963 2.079 1.00 -1.00 S ATOM 370 H CYS A 21 4.354 -3.667 -0.567 1.00 0.00 H ATOM 371 HA CYS A 21 2.562 -2.435 1.317 1.00 0.00 H ATOM 372 HB2 CYS A 21 1.873 -4.330 -0.146 1.00 0.00 H ATOM 373 HB3 CYS A 21 3.093 -5.383 0.648 1.00 0.00 H ATOM 374 N PHE A 22 3.395 -3.300 3.666 1.00 0.00 N ATOM 375 CA PHE A 22 4.080 -3.556 4.930 1.00 0.00 C ATOM 376 C PHE A 22 3.465 -4.796 5.538 1.00 0.00 C ATOM 377 O PHE A 22 3.083 -4.798 6.696 1.00 0.00 O ATOM 378 CB PHE A 22 3.962 -2.282 5.812 1.00 0.00 C ATOM 379 CG PHE A 22 5.172 -2.028 6.732 1.00 0.00 C ATOM 380 CD1 PHE A 22 5.970 -3.063 7.236 1.00 0.00 C ATOM 381 CD2 PHE A 22 5.490 -0.707 7.062 1.00 0.00 C ATOM 382 CE1 PHE A 22 7.122 -2.771 7.971 1.00 0.00 C ATOM 383 CE2 PHE A 22 6.624 -0.414 7.824 1.00 0.00 C ATOM 384 CZ PHE A 22 7.453 -1.445 8.263 1.00 0.00 C ATOM 385 H PHE A 22 2.462 -2.944 3.717 1.00 0.00 H ATOM 386 HA PHE A 22 5.149 -3.749 4.751 1.00 0.00 H ATOM 387 HB2 PHE A 22 3.927 -1.432 5.115 1.00 0.00 H ATOM 388 HB3 PHE A 22 3.031 -2.272 6.397 1.00 0.00 H ATOM 389 HD1 PHE A 22 5.710 -4.101 7.068 1.00 0.00 H ATOM 390 HD2 PHE A 22 4.857 0.107 6.729 1.00 0.00 H ATOM 391 HE1 PHE A 22 7.763 -3.573 8.319 1.00 0.00 H ATOM 392 HE2 PHE A 22 6.857 0.615 8.073 1.00 0.00 H ATOM 393 HZ PHE A 22 8.351 -1.220 8.829 1.00 0.00 H ATOM 394 N ARG A 23 3.386 -5.866 4.716 1.00 0.00 N ATOM 395 CA ARG A 23 2.865 -7.152 5.174 1.00 0.00 C ATOM 396 C ARG A 23 3.441 -8.237 4.285 1.00 0.00 C ATOM 397 O ARG A 23 4.102 -9.121 4.805 1.00 0.00 O ATOM 398 CB ARG A 23 1.308 -7.224 5.174 1.00 0.00 C ATOM 399 CG ARG A 23 0.787 -8.051 6.386 1.00 0.00 C ATOM 400 CD ARG A 23 -0.616 -8.704 6.213 1.00 0.00 C ATOM 401 NE ARG A 23 -1.786 -7.908 6.585 1.00 0.00 N ATOM 402 CZ ARG A 23 -2.180 -7.709 7.825 1.00 1.00 C ATOM 403 NH1 ARG A 23 -1.496 -8.104 8.874 1.00 0.00 N ATOM 404 NH2 ARG A 23 -3.318 -7.089 8.034 1.00 0.00 N ATOM 405 H ARG A 23 3.715 -5.793 3.782 1.00 0.00 H ATOM 406 HA ARG A 23 3.244 -7.297 6.200 1.00 0.00 H ATOM 407 HB2 ARG A 23 0.924 -6.197 5.225 1.00 0.00 H ATOM 408 HB3 ARG A 23 0.962 -7.667 4.230 1.00 0.00 H ATOM 409 HG2 ARG A 23 1.483 -8.892 6.518 1.00 0.00 H ATOM 410 HG3 ARG A 23 0.821 -7.420 7.285 1.00 0.00 H ATOM 411 HD2 ARG A 23 -0.724 -9.005 5.160 1.00 0.00 H ATOM 412 HD3 ARG A 23 -0.667 -9.646 6.782 1.00 0.00 H ATOM 413 HE ARG A 23 -2.374 -7.562 5.814 1.00 0.00 H ATOM 414 HH11 ARG A 23 -0.598 -8.590 8.785 1.00 0.00 H ATOM 415 HH12 ARG A 23 -1.846 -7.926 9.829 1.00 0.00 H ATOM 416 HH21 ARG A 23 -3.904 -6.771 7.246 1.00 0.00 H ATOM 417 HH22 ARG A 23 -3.661 -6.908 8.991 1.00 0.00 H ATOM 418 N CYS A 24 3.200 -8.165 2.949 1.00 0.00 N ATOM 419 CA CYS A 24 3.760 -9.133 2.005 1.00 0.00 C ATOM 420 C CYS A 24 4.766 -8.521 1.048 1.00 0.00 C ATOM 421 O CYS A 24 5.150 -9.192 0.103 1.00 0.00 O ATOM 422 CB CYS A 24 2.581 -9.786 1.236 1.00 0.00 C ATOM 423 SG CYS A 24 1.633 -8.526 0.315 1.00 -1.00 S ATOM 424 H CYS A 24 2.638 -7.433 2.565 1.00 0.00 H ATOM 425 HA CYS A 24 4.279 -9.943 2.540 1.00 0.00 H ATOM 426 HB2 CYS A 24 2.955 -10.544 0.533 1.00 0.00 H ATOM 427 HB3 CYS A 24 1.896 -10.276 1.947 1.00 0.00 H ATOM 428 N GLY A 25 5.232 -7.264 1.242 1.00 0.00 N ATOM 429 CA GLY A 25 6.237 -6.699 0.342 1.00 0.00 C ATOM 430 C GLY A 25 5.800 -6.507 -1.091 1.00 0.00 C ATOM 431 O GLY A 25 6.641 -6.122 -1.889 1.00 0.00 O ATOM 432 H GLY A 25 4.938 -6.698 2.009 1.00 0.00 H ATOM 433 HA2 GLY A 25 6.551 -5.712 0.722 1.00 0.00 H ATOM 434 HA3 GLY A 25 7.122 -7.355 0.351 1.00 0.00 H ATOM 435 N ALA A 26 4.527 -6.761 -1.462 1.00 0.00 N ATOM 436 CA ALA A 26 4.137 -6.637 -2.860 1.00 0.00 C ATOM 437 C ALA A 26 4.068 -5.183 -3.266 1.00 0.00 C ATOM 438 O ALA A 26 3.279 -4.456 -2.685 1.00 0.00 O ATOM 439 CB ALA A 26 2.752 -7.301 -3.066 1.00 0.00 C ATOM 440 H ALA A 26 3.832 -7.048 -0.807 1.00 0.00 H ATOM 441 HA ALA A 26 4.855 -7.202 -3.478 1.00 0.00 H ATOM 442 HB1 ALA A 26 1.986 -6.796 -2.458 1.00 0.00 H ATOM 443 HB2 ALA A 26 2.445 -7.255 -4.121 1.00 0.00 H ATOM 444 HB3 ALA A 26 2.807 -8.358 -2.764 1.00 0.00 H ATOM 445 N ASP A 27 4.880 -4.740 -4.254 1.00 0.00 N ATOM 446 CA ASP A 27 4.768 -3.362 -4.729 1.00 0.00 C ATOM 447 C ASP A 27 3.391 -3.086 -5.282 1.00 0.00 C ATOM 448 O ASP A 27 2.675 -4.025 -5.588 1.00 0.00 O ATOM 449 CB ASP A 27 5.854 -3.044 -5.792 1.00 0.00 C ATOM 450 CG ASP A 27 6.035 -1.560 -5.965 1.00 0.00 C ATOM 451 OD1 ASP A 27 5.263 -0.944 -6.747 1.00 -0.50 O ATOM 452 OD2 ASP A 27 6.958 -0.999 -5.316 1.00 -0.50 O ATOM 453 H ASP A 27 5.558 -5.339 -4.686 1.00 0.00 H ATOM 454 HA ASP A 27 4.934 -2.692 -3.884 1.00 0.00 H ATOM 455 HB2 ASP A 27 6.821 -3.455 -5.463 1.00 0.00 H ATOM 456 HB3 ASP A 27 5.585 -3.509 -6.752 1.00 0.00 H ATOM 457 N LYS A 28 3.009 -1.796 -5.420 1.00 0.00 N ATOM 458 CA LYS A 28 1.735 -1.472 -6.058 1.00 0.00 C ATOM 459 C LYS A 28 1.496 -2.317 -7.284 1.00 0.00 C ATOM 460 O LYS A 28 0.371 -2.760 -7.458 1.00 0.00 O ATOM 461 CB LYS A 28 1.692 0.016 -6.510 1.00 0.00 C ATOM 462 CG LYS A 28 1.063 0.922 -5.421 1.00 0.00 C ATOM 463 CD LYS A 28 -0.474 0.699 -5.318 1.00 0.00 C ATOM 464 CE LYS A 28 -1.307 1.990 -5.531 1.00 0.00 C ATOM 465 NZ LYS A 28 -1.180 2.559 -6.892 1.00 1.00 N ATOM 466 H LYS A 28 3.582 -1.049 -5.080 1.00 0.00 H ATOM 467 HA LYS A 28 0.927 -1.685 -5.341 1.00 0.00 H ATOM 468 HB2 LYS A 28 2.709 0.362 -6.750 1.00 0.00 H ATOM 469 HB3 LYS A 28 1.092 0.130 -7.428 1.00 0.00 H ATOM 470 HG2 LYS A 28 1.550 0.711 -4.452 1.00 0.00 H ATOM 471 HG3 LYS A 28 1.280 1.970 -5.676 1.00 0.00 H ATOM 472 HD2 LYS A 28 -0.823 -0.053 -6.045 1.00 0.00 H ATOM 473 HD3 LYS A 28 -0.709 0.308 -4.316 1.00 0.00 H ATOM 474 HE2 LYS A 28 -2.366 1.725 -5.378 1.00 0.00 H ATOM 475 HE3 LYS A 28 -1.025 2.747 -4.781 1.00 0.00 H ATOM 476 HZ1 LYS A 28 -0.263 3.112 -7.034 1.00 0.00 H ATOM 477 HZ2 LYS A 28 -1.981 3.262 -7.068 1.00 0.00 H ATOM 478 HZ3 LYS A 28 -1.236 1.798 -7.656 1.00 0.00 H ATOM 479 N PHE A 29 2.529 -2.547 -8.129 1.00 0.00 N ATOM 480 CA PHE A 29 2.326 -3.300 -9.367 1.00 0.00 C ATOM 481 C PHE A 29 2.880 -4.698 -9.197 1.00 0.00 C ATOM 482 O PHE A 29 3.695 -5.132 -9.996 1.00 0.00 O ATOM 483 CB PHE A 29 2.957 -2.486 -10.534 1.00 0.00 C ATOM 484 CG PHE A 29 2.032 -2.446 -11.758 1.00 0.00 C ATOM 485 CD1 PHE A 29 1.777 -3.612 -12.485 1.00 0.00 C ATOM 486 CD2 PHE A 29 1.435 -1.246 -12.156 1.00 0.00 C ATOM 487 CE1 PHE A 29 0.948 -3.573 -13.609 1.00 0.00 C ATOM 488 CE2 PHE A 29 0.613 -1.204 -13.284 1.00 0.00 C ATOM 489 CZ PHE A 29 0.369 -2.371 -14.014 1.00 0.00 C ATOM 490 H PHE A 29 3.451 -2.207 -7.927 1.00 0.00 H ATOM 491 HA PHE A 29 1.254 -3.400 -9.592 1.00 0.00 H ATOM 492 HB2 PHE A 29 3.111 -1.450 -10.198 1.00 0.00 H ATOM 493 HB3 PHE A 29 3.944 -2.874 -10.825 1.00 0.00 H ATOM 494 HD1 PHE A 29 2.222 -4.551 -12.182 1.00 0.00 H ATOM 495 HD2 PHE A 29 1.600 -0.330 -11.600 1.00 0.00 H ATOM 496 HE1 PHE A 29 0.750 -4.482 -14.170 1.00 0.00 H ATOM 497 HE2 PHE A 29 0.164 -0.266 -13.594 1.00 0.00 H ATOM 498 HZ PHE A 29 -0.270 -2.338 -14.890 1.00 0.00 H ATOM 499 N ASP A 30 2.436 -5.421 -8.140 1.00 0.00 N ATOM 500 CA ASP A 30 2.944 -6.765 -7.880 1.00 0.00 C ATOM 501 C ASP A 30 1.814 -7.598 -7.273 1.00 0.00 C ATOM 502 O ASP A 30 0.818 -7.049 -6.804 1.00 0.00 O ATOM 503 CB ASP A 30 4.111 -6.635 -6.872 1.00 0.00 C ATOM 504 CG ASP A 30 4.818 -7.927 -6.571 1.00 0.00 C ATOM 505 OD1 ASP A 30 4.228 -8.782 -5.856 1.00 -0.50 O ATOM 506 OD2 ASP A 30 5.979 -8.090 -7.038 1.00 -0.50 O ATOM 507 H ASP A 30 1.781 -5.041 -7.485 1.00 0.00 H ATOM 508 HA ASP A 30 3.300 -7.247 -8.804 1.00 0.00 H ATOM 509 HB2 ASP A 30 4.839 -5.907 -7.259 1.00 0.00 H ATOM 510 HB3 ASP A 30 3.697 -6.255 -5.934 1.00 0.00 H HETATM 511 N NH2 A 31 1.931 -8.944 -7.265 1.00 0.00 N HETATM 512 HN1 NH2 A 31 1.200 -9.501 -6.869 1.00 0.00 H HETATM 513 HN2 NH2 A 31 2.735 -9.402 -7.646 1.00 0.00 H TER 514 NH2 A 31 HETATM 515 C1 AQN A 32 3.665 2.857 7.278 1.00 0.00 C HETATM 516 C2 AQN A 32 3.009 1.986 8.149 1.00 0.00 C HETATM 517 C3 AQN A 32 2.025 0.977 7.605 1.00 0.00 C HETATM 518 O3 AQN A 32 1.823 0.904 6.401 1.00 0.00 O HETATM 519 C4 AQN A 32 1.289 0.068 8.563 1.00 0.00 C HETATM 520 C5 AQN A 32 0.275 -0.762 8.089 1.00 0.00 C HETATM 521 C6 AQN A 32 -0.362 -1.659 8.949 1.00 0.00 C HETATM 522 C7 AQN A 32 0.031 -1.740 10.286 1.00 0.00 C HETATM 523 C8 AQN A 32 1.004 -0.868 10.776 1.00 0.00 C HETATM 524 C9 AQN A 32 1.609 0.058 9.921 1.00 0.00 C HETATM 525 C10 AQN A 32 2.602 1.063 10.455 1.00 0.00 C HETATM 526 O10 AQN A 32 2.857 1.083 11.649 1.00 0.00 O HETATM 527 C11 AQN A 32 3.264 2.050 9.519 1.00 0.00 C HETATM 528 C12 AQN A 32 4.140 3.020 10.014 1.00 0.00 C HETATM 529 C13 AQN A 32 4.771 3.911 9.146 1.00 0.00 C HETATM 530 C14 AQN A 32 4.543 3.824 7.773 1.00 0.00 C HETATM 531 S15 AQN A 32 5.396 4.920 6.681 1.00 0.00 S HETATM 532 OS1 AQN A 32 6.813 4.624 6.765 1.00 0.00 O HETATM 533 OS2 AQN A 32 4.726 4.912 5.402 1.00 0.00 O HETATM 534 OS3 AQN A 32 5.142 6.240 7.338 1.00 -1.00 O HETATM 535 H1 AQN A 32 3.490 2.779 6.214 1.00 0.00 H HETATM 536 H5 AQN A 32 -0.011 -0.695 7.048 1.00 0.00 H HETATM 537 H6 AQN A 32 -1.161 -2.295 8.595 1.00 0.00 H HETATM 538 H7 AQN A 32 -0.426 -2.475 10.939 1.00 0.00 H HETATM 539 H8 AQN A 32 1.272 -0.912 11.829 1.00 0.00 H HETATM 540 H12 AQN A 32 4.340 3.084 11.076 1.00 0.00 H HETATM 541 H13 AQN A 32 5.446 4.662 9.535 1.00 0.00 H HETATM 542 ZN ZN A 33 0.160 -6.758 0.935 1.00 2.00 ZN