HETATM 1 C ACE A 0 0.423 15.494 -1.839 1.00 0.00 C HETATM 2 O ACE A 0 0.099 15.400 -3.032 1.00 0.00 O HETATM 3 CH3 ACE A 0 1.512 16.456 -1.426 1.00 0.00 C HETATM 4 H1 ACE A 0 2.328 15.911 -0.951 1.00 0.00 H HETATM 5 H2 ACE A 0 1.115 17.186 -0.722 1.00 0.00 H HETATM 6 H3 ACE A 0 1.879 16.977 -2.310 1.00 0.00 H ATOM 7 N LYS A 1 -0.126 14.791 -0.833 1.00 0.00 N ATOM 8 CA LYS A 1 -1.186 13.824 -1.058 1.00 0.00 C ATOM 9 C LYS A 1 -0.708 12.495 -0.525 1.00 0.00 C ATOM 10 O LYS A 1 -0.090 11.756 -1.276 1.00 0.00 O ATOM 11 CB LYS A 1 -1.539 13.759 -2.569 1.00 0.00 C ATOM 12 CG LYS A 1 -2.675 12.737 -2.840 1.00 0.00 C ATOM 13 CD LYS A 1 -3.376 12.936 -4.208 1.00 0.00 C ATOM 14 CE LYS A 1 -2.450 12.657 -5.417 1.00 0.00 C ATOM 15 NZ LYS A 1 -3.167 12.881 -6.691 1.00 1.00 N ATOM 16 H LYS A 1 0.200 14.930 0.124 1.00 0.00 H ATOM 17 HA LYS A 1 -2.099 14.149 -0.534 1.00 0.00 H ATOM 18 HB2 LYS A 1 -1.870 14.765 -2.875 1.00 0.00 H ATOM 19 HB3 LYS A 1 -0.648 13.488 -3.157 1.00 0.00 H ATOM 20 HG2 LYS A 1 -2.265 11.718 -2.786 1.00 0.00 H ATOM 21 HG3 LYS A 1 -3.450 12.847 -2.064 1.00 0.00 H ATOM 22 HD2 LYS A 1 -4.228 12.236 -4.257 1.00 0.00 H ATOM 23 HD3 LYS A 1 -3.771 13.962 -4.267 1.00 0.00 H ATOM 24 HE2 LYS A 1 -1.573 13.321 -5.389 1.00 0.00 H ATOM 25 HE3 LYS A 1 -2.106 11.611 -5.379 1.00 0.00 H ATOM 26 HZ1 LYS A 1 -2.513 12.671 -7.526 1.00 0.00 H ATOM 27 HZ2 LYS A 1 -3.496 13.906 -6.784 1.00 0.00 H ATOM 28 HZ3 LYS A 1 -4.028 12.233 -6.781 1.00 0.00 H ATOM 29 N PHE A 2 -0.988 12.183 0.762 1.00 0.00 N ATOM 30 CA PHE A 2 -0.588 10.892 1.322 1.00 0.00 C ATOM 31 C PHE A 2 -1.743 9.935 1.154 1.00 0.00 C ATOM 32 O PHE A 2 -2.236 9.398 2.131 1.00 0.00 O ATOM 33 CB PHE A 2 -0.076 10.995 2.788 1.00 0.00 C ATOM 34 CG PHE A 2 -0.974 11.856 3.690 1.00 0.00 C ATOM 35 CD1 PHE A 2 -2.039 11.300 4.406 1.00 0.00 C ATOM 36 CD2 PHE A 2 -0.718 13.227 3.810 1.00 0.00 C ATOM 37 CE1 PHE A 2 -2.915 12.121 5.119 1.00 0.00 C ATOM 38 CE2 PHE A 2 -1.577 14.046 4.545 1.00 0.00 C ATOM 39 CZ PHE A 2 -2.689 13.498 5.185 1.00 0.00 C ATOM 40 H PHE A 2 -1.533 12.801 1.326 1.00 0.00 H ATOM 41 HA PHE A 2 0.260 10.492 0.755 1.00 0.00 H ATOM 42 HB2 PHE A 2 0.036 9.988 3.217 1.00 0.00 H ATOM 43 HB3 PHE A 2 0.924 11.454 2.769 1.00 0.00 H ATOM 44 HD1 PHE A 2 -2.198 10.229 4.419 1.00 0.00 H ATOM 45 HD2 PHE A 2 0.147 13.667 3.329 1.00 0.00 H ATOM 46 HE1 PHE A 2 -3.771 11.689 5.626 1.00 0.00 H ATOM 47 HE2 PHE A 2 -1.379 15.111 4.619 1.00 0.00 H ATOM 48 HZ PHE A 2 -3.373 14.136 5.732 1.00 0.00 H ATOM 49 N GLU A 3 -2.202 9.707 -0.097 1.00 0.00 N ATOM 50 CA GLU A 3 -3.404 8.904 -0.289 1.00 0.00 C ATOM 51 C GLU A 3 -3.052 7.435 -0.218 1.00 0.00 C ATOM 52 O GLU A 3 -2.745 6.835 -1.236 1.00 0.00 O ATOM 53 CB GLU A 3 -4.106 9.282 -1.622 1.00 0.00 C ATOM 54 CG GLU A 3 -5.618 8.951 -1.584 1.00 0.00 C ATOM 55 CD GLU A 3 -6.346 9.962 -0.732 1.00 0.00 C ATOM 56 OE1 GLU A 3 -6.442 11.141 -1.168 1.00 -0.50 O ATOM 57 OE2 GLU A 3 -6.819 9.590 0.374 1.00 -0.50 O ATOM 58 H GLU A 3 -1.738 10.079 -0.899 1.00 0.00 H ATOM 59 HA GLU A 3 -4.117 9.164 0.509 1.00 0.00 H ATOM 60 HB2 GLU A 3 -4.027 10.367 -1.781 1.00 0.00 H ATOM 61 HB3 GLU A 3 -3.620 8.781 -2.474 1.00 0.00 H ATOM 62 HG2 GLU A 3 -6.032 9.015 -2.603 1.00 0.00 H ATOM 63 HG3 GLU A 3 -5.777 7.929 -1.205 1.00 0.00 H ATOM 64 N ASP A 4 -3.087 6.851 0.999 1.00 0.00 N ATOM 65 CA ASP A 4 -2.810 5.423 1.174 1.00 0.00 C ATOM 66 C ASP A 4 -3.473 4.533 0.141 1.00 0.00 C ATOM 67 O ASP A 4 -4.422 4.972 -0.488 1.00 0.00 O ATOM 68 CB ASP A 4 -3.263 5.016 2.601 1.00 0.00 C ATOM 69 CG ASP A 4 -4.644 5.527 2.910 1.00 0.00 C ATOM 70 OD1 ASP A 4 -5.538 5.404 2.031 1.00 -0.50 O ATOM 71 OD2 ASP A 4 -4.848 6.052 4.037 1.00 -0.50 O ATOM 72 H ASP A 4 -3.262 7.407 1.815 1.00 0.00 H ATOM 73 HA ASP A 4 -1.724 5.276 1.093 1.00 0.00 H ATOM 74 HB2 ASP A 4 -3.246 3.924 2.726 1.00 0.00 H ATOM 75 HB3 ASP A 4 -2.575 5.465 3.331 1.00 0.00 H ATOM 76 N TRP A 5 -2.974 3.284 -0.039 1.00 0.00 N ATOM 77 CA TRP A 5 -3.483 2.402 -1.092 1.00 0.00 C ATOM 78 C TRP A 5 -3.762 1.027 -0.549 1.00 0.00 C ATOM 79 O TRP A 5 -3.229 0.712 0.501 1.00 0.00 O ATOM 80 CB TRP A 5 -2.463 2.303 -2.251 1.00 0.00 C ATOM 81 CG TRP A 5 -1.061 2.030 -1.777 1.00 0.00 C ATOM 82 CD1 TRP A 5 -0.143 2.970 -1.500 1.00 0.00 C ATOM 83 CD2 TRP A 5 -0.398 0.696 -1.546 1.00 0.00 C ATOM 84 NE1 TRP A 5 0.981 2.401 -1.149 1.00 0.00 N ATOM 85 CE2 TRP A 5 0.890 1.057 -1.198 1.00 0.00 C ATOM 86 CE3 TRP A 5 -0.790 -0.640 -1.626 1.00 0.00 C ATOM 87 CZ2 TRP A 5 1.887 0.106 -0.980 1.00 0.00 C ATOM 88 CZ3 TRP A 5 0.211 -1.601 -1.442 1.00 0.00 C ATOM 89 CH2 TRP A 5 1.532 -1.233 -1.163 1.00 0.00 C ATOM 90 H TRP A 5 -2.216 2.945 0.521 1.00 0.00 H ATOM 91 HA TRP A 5 -4.433 2.783 -1.501 1.00 0.00 H ATOM 92 HB2 TRP A 5 -2.762 1.529 -2.973 1.00 0.00 H ATOM 93 HB3 TRP A 5 -2.464 3.273 -2.772 1.00 0.00 H ATOM 94 HD1 TRP A 5 -0.339 4.037 -1.575 1.00 0.00 H ATOM 95 HE1 TRP A 5 1.835 2.917 -0.889 1.00 0.00 H ATOM 96 HE3 TRP A 5 -1.817 -0.914 -1.829 1.00 0.00 H ATOM 97 HZ2 TRP A 5 2.891 0.379 -0.689 1.00 0.00 H ATOM 98 HZ3 TRP A 5 -0.021 -2.655 -1.519 1.00 0.00 H ATOM 99 HH2 TRP A 5 2.290 -2.002 -1.097 1.00 0.00 H ATOM 100 N LEU A 6 -4.595 0.223 -1.257 1.00 0.00 N ATOM 101 CA LEU A 6 -5.004 -1.080 -0.738 1.00 0.00 C ATOM 102 C LEU A 6 -4.282 -2.179 -1.477 1.00 0.00 C ATOM 103 O LEU A 6 -4.353 -2.205 -2.695 1.00 0.00 O ATOM 104 CB LEU A 6 -6.552 -1.182 -0.796 1.00 0.00 C ATOM 105 CG LEU A 6 -7.126 -2.361 0.053 1.00 0.00 C ATOM 106 CD1 LEU A 6 -8.279 -1.873 0.968 1.00 0.00 C ATOM 107 CD2 LEU A 6 -7.640 -3.499 -0.864 1.00 0.00 C ATOM 108 H LEU A 6 -4.969 0.504 -2.142 1.00 0.00 H ATOM 109 HA LEU A 6 -4.747 -1.132 0.319 1.00 0.00 H ATOM 110 HB2 LEU A 6 -6.933 -0.228 -0.396 1.00 0.00 H ATOM 111 HB3 LEU A 6 -6.882 -1.252 -1.847 1.00 0.00 H ATOM 112 HG LEU A 6 -6.352 -2.792 0.711 1.00 0.00 H ATOM 113 HD11 LEU A 6 -8.687 -2.718 1.545 1.00 0.00 H ATOM 114 HD12 LEU A 6 -9.087 -1.428 0.366 1.00 0.00 H ATOM 115 HD13 LEU A 6 -7.902 -1.120 1.678 1.00 0.00 H ATOM 116 HD21 LEU A 6 -6.831 -3.836 -1.529 1.00 0.00 H ATOM 117 HD22 LEU A 6 -8.484 -3.144 -1.478 1.00 0.00 H ATOM 118 HD23 LEU A 6 -7.979 -4.350 -0.253 1.00 0.00 H ATOM 119 N CYS A 7 -3.567 -3.078 -0.759 1.00 0.00 N ATOM 120 CA CYS A 7 -2.749 -4.069 -1.449 1.00 0.00 C ATOM 121 C CYS A 7 -3.627 -5.009 -2.228 1.00 0.00 C ATOM 122 O CYS A 7 -4.756 -5.223 -1.813 1.00 0.00 O ATOM 123 CB CYS A 7 -1.899 -4.850 -0.414 1.00 0.00 C ATOM 124 SG CYS A 7 -0.655 -5.972 -1.111 1.00 -1.00 S ATOM 125 H CYS A 7 -3.550 -3.066 0.242 1.00 0.00 H ATOM 126 HA CYS A 7 -2.078 -3.544 -2.146 1.00 0.00 H ATOM 127 HB2 CYS A 7 -1.337 -4.139 0.197 1.00 0.00 H ATOM 128 HB3 CYS A 7 -2.566 -5.440 0.223 1.00 0.00 H ATOM 129 N ASN A 8 -3.117 -5.579 -3.345 1.00 0.00 N ATOM 130 CA ASN A 8 -3.905 -6.529 -4.126 1.00 0.00 C ATOM 131 C ASN A 8 -3.431 -7.938 -3.847 1.00 0.00 C ATOM 132 O ASN A 8 -3.471 -8.765 -4.743 1.00 0.00 O ATOM 133 CB ASN A 8 -3.847 -6.165 -5.631 1.00 0.00 C ATOM 134 CG ASN A 8 -2.426 -6.109 -6.141 1.00 0.00 C ATOM 135 OD1 ASN A 8 -1.893 -7.144 -6.512 1.00 0.00 O ATOM 136 ND2 ASN A 8 -1.778 -4.923 -6.175 1.00 0.00 N ATOM 137 H ASN A 8 -2.170 -5.410 -3.620 1.00 0.00 H ATOM 138 HA ASN A 8 -4.968 -6.502 -3.841 1.00 0.00 H ATOM 139 HB2 ASN A 8 -4.419 -6.902 -6.215 1.00 0.00 H ATOM 140 HB3 ASN A 8 -4.339 -5.190 -5.765 1.00 0.00 H ATOM 141 HD21 ASN A 8 -2.223 -4.081 -5.865 1.00 0.00 H ATOM 142 HD22 ASN A 8 -0.835 -4.876 -6.510 1.00 0.00 H ATOM 143 N LYS A 9 -2.996 -8.210 -2.596 1.00 0.00 N ATOM 144 CA LYS A 9 -2.502 -9.532 -2.216 1.00 0.00 C ATOM 145 C LYS A 9 -3.054 -9.842 -0.843 1.00 0.00 C ATOM 146 O LYS A 9 -3.809 -10.794 -0.716 1.00 0.00 O ATOM 147 CB LYS A 9 -0.947 -9.542 -2.230 1.00 0.00 C ATOM 148 CG LYS A 9 -0.343 -10.759 -2.977 1.00 0.00 C ATOM 149 CD LYS A 9 -0.675 -10.742 -4.496 1.00 0.00 C ATOM 150 CE LYS A 9 0.592 -10.682 -5.383 1.00 0.00 C ATOM 151 NZ LYS A 9 0.221 -10.680 -6.814 1.00 1.00 N ATOM 152 H LYS A 9 -2.990 -7.497 -1.903 1.00 0.00 H ATOM 153 HA LYS A 9 -2.895 -10.300 -2.903 1.00 0.00 H ATOM 154 HB2 LYS A 9 -0.563 -8.623 -2.699 1.00 0.00 H ATOM 155 HB3 LYS A 9 -0.566 -9.581 -1.200 1.00 0.00 H ATOM 156 HG2 LYS A 9 0.749 -10.739 -2.833 1.00 0.00 H ATOM 157 HG3 LYS A 9 -0.726 -11.683 -2.518 1.00 0.00 H ATOM 158 HD2 LYS A 9 -1.258 -11.641 -4.752 1.00 0.00 H ATOM 159 HD3 LYS A 9 -1.276 -9.858 -4.745 1.00 0.00 H ATOM 160 HE2 LYS A 9 1.154 -9.763 -5.153 1.00 0.00 H ATOM 161 HE3 LYS A 9 1.230 -11.556 -5.176 1.00 0.00 H ATOM 162 HZ1 LYS A 9 -0.377 -9.816 -7.066 1.00 0.00 H ATOM 163 HZ2 LYS A 9 -0.342 -11.566 -7.070 1.00 0.00 H ATOM 164 HZ3 LYS A 9 1.105 -10.670 -7.434 1.00 0.00 H ATOM 165 N CYS A 10 -2.691 -9.031 0.181 1.00 0.00 N ATOM 166 CA CYS A 10 -3.203 -9.224 1.536 1.00 0.00 C ATOM 167 C CYS A 10 -4.213 -8.175 1.954 1.00 0.00 C ATOM 168 O CYS A 10 -4.580 -8.159 3.119 1.00 0.00 O ATOM 169 CB CYS A 10 -1.996 -9.213 2.502 1.00 0.00 C ATOM 170 SG CYS A 10 -1.352 -7.514 2.555 1.00 -1.00 S ATOM 171 H CYS A 10 -2.067 -8.267 0.035 1.00 0.00 H ATOM 172 HA CYS A 10 -3.678 -10.211 1.629 1.00 0.00 H ATOM 173 HB2 CYS A 10 -2.296 -9.549 3.502 1.00 0.00 H ATOM 174 HB3 CYS A 10 -1.217 -9.890 2.124 1.00 0.00 H ATOM 175 N CYS A 11 -4.684 -7.299 1.040 1.00 0.00 N ATOM 176 CA CYS A 11 -5.757 -6.369 1.374 1.00 0.00 C ATOM 177 C CYS A 11 -5.508 -5.489 2.579 1.00 0.00 C ATOM 178 O CYS A 11 -6.484 -5.096 3.201 1.00 0.00 O ATOM 179 CB CYS A 11 -7.079 -7.161 1.536 1.00 0.00 C ATOM 180 SG CYS A 11 -7.282 -8.329 0.149 1.00 0.00 S ATOM 181 H CYS A 11 -4.381 -7.316 0.090 1.00 0.00 H ATOM 182 HA CYS A 11 -5.894 -5.681 0.524 1.00 0.00 H ATOM 183 HB2 CYS A 11 -7.084 -7.728 2.478 1.00 0.00 H ATOM 184 HB3 CYS A 11 -7.936 -6.471 1.532 1.00 0.00 H ATOM 185 HG CYS A 11 -6.570 -8.990 0.409 1.00 0.00 H ATOM 186 N LEU A 12 -4.244 -5.151 2.925 1.00 0.00 N ATOM 187 CA LEU A 12 -4.001 -4.244 4.048 1.00 0.00 C ATOM 188 C LEU A 12 -3.912 -2.862 3.447 1.00 0.00 C ATOM 189 O LEU A 12 -3.255 -2.735 2.425 1.00 0.00 O ATOM 190 CB LEU A 12 -2.640 -4.565 4.733 1.00 0.00 C ATOM 191 CG LEU A 12 -2.501 -4.244 6.255 1.00 0.00 C ATOM 192 CD1 LEU A 12 -1.001 -4.089 6.620 1.00 0.00 C ATOM 193 CD2 LEU A 12 -3.228 -2.962 6.734 1.00 0.00 C ATOM 194 H LEU A 12 -3.462 -5.458 2.389 1.00 0.00 H ATOM 195 HA LEU A 12 -4.805 -4.352 4.790 1.00 0.00 H ATOM 196 HB2 LEU A 12 -2.481 -5.648 4.628 1.00 0.00 H ATOM 197 HB3 LEU A 12 -1.838 -4.061 4.179 1.00 0.00 H ATOM 198 HG LEU A 12 -2.918 -5.088 6.831 1.00 0.00 H ATOM 199 HD11 LEU A 12 -0.874 -4.078 7.714 1.00 0.00 H ATOM 200 HD12 LEU A 12 -0.612 -3.148 6.206 1.00 0.00 H ATOM 201 HD13 LEU A 12 -0.407 -4.914 6.214 1.00 0.00 H ATOM 202 HD21 LEU A 12 -4.319 -3.097 6.723 1.00 0.00 H ATOM 203 HD22 LEU A 12 -2.940 -2.110 6.102 1.00 0.00 H ATOM 204 HD23 LEU A 12 -2.943 -2.735 7.776 1.00 0.00 H ATOM 205 N ASN A 13 -4.540 -1.821 4.039 1.00 0.00 N ATOM 206 CA ASN A 13 -4.366 -0.479 3.496 1.00 0.00 C ATOM 207 C ASN A 13 -3.003 0.035 3.905 1.00 0.00 C ATOM 208 O ASN A 13 -2.822 0.239 5.094 1.00 0.00 O ATOM 209 CB ASN A 13 -5.545 0.427 3.939 1.00 0.00 C ATOM 210 CG ASN A 13 -5.863 1.470 2.898 1.00 0.00 C ATOM 211 OD1 ASN A 13 -6.190 1.105 1.778 1.00 0.00 O ATOM 212 ND2 ASN A 13 -5.807 2.776 3.215 1.00 0.00 N ATOM 213 H ASN A 13 -5.106 -1.940 4.853 1.00 0.00 H ATOM 214 HA ASN A 13 -4.427 -0.548 2.411 1.00 0.00 H ATOM 215 HB2 ASN A 13 -6.460 -0.180 4.004 1.00 0.00 H ATOM 216 HB3 ASN A 13 -5.349 0.850 4.935 1.00 0.00 H ATOM 217 HD21 ASN A 13 -5.531 3.091 4.123 1.00 0.00 H ATOM 218 HD22 ASN A 13 -6.068 3.436 2.511 1.00 0.00 H ATOM 219 N ASN A 14 -2.031 0.235 2.976 1.00 0.00 N ATOM 220 CA ASN A 14 -0.681 0.644 3.372 1.00 0.00 C ATOM 221 C ASN A 14 -0.487 2.112 3.114 1.00 0.00 C ATOM 222 O ASN A 14 -1.165 2.642 2.250 1.00 0.00 O ATOM 223 CB ASN A 14 0.418 -0.113 2.588 1.00 0.00 C ATOM 224 CG ASN A 14 0.256 -1.585 2.859 1.00 0.00 C ATOM 225 OD1 ASN A 14 0.869 -2.091 3.785 1.00 0.00 O ATOM 226 ND2 ASN A 14 -0.577 -2.295 2.074 1.00 0.00 N ATOM 227 H ASN A 14 -2.212 0.129 1.998 1.00 0.00 H ATOM 228 HA ASN A 14 -0.509 0.426 4.438 1.00 0.00 H ATOM 229 HB2 ASN A 14 0.333 0.113 1.514 1.00 0.00 H ATOM 230 HB3 ASN A 14 1.414 0.219 2.924 1.00 0.00 H ATOM 231 HD21 ASN A 14 -1.061 -1.873 1.309 1.00 0.00 H ATOM 232 HD22 ASN A 14 -0.722 -3.261 2.271 1.00 0.00 H ATOM 233 N PHE A 15 0.436 2.781 3.842 1.00 0.00 N ATOM 234 CA PHE A 15 0.591 4.215 3.641 1.00 0.00 C ATOM 235 C PHE A 15 1.034 4.525 2.235 1.00 0.00 C ATOM 236 O PHE A 15 1.576 3.667 1.556 1.00 0.00 O ATOM 237 CB PHE A 15 1.585 4.874 4.632 1.00 0.00 C ATOM 238 CG PHE A 15 1.003 4.958 6.047 1.00 0.00 C ATOM 239 CD1 PHE A 15 -0.102 5.782 6.292 1.00 0.00 C ATOM 240 CD2 PHE A 15 1.567 4.242 7.104 1.00 0.00 C ATOM 241 CE1 PHE A 15 -0.667 5.848 7.567 1.00 0.00 C ATOM 242 CE2 PHE A 15 1.029 4.338 8.390 1.00 0.00 C ATOM 243 CZ PHE A 15 -0.106 5.122 8.617 1.00 0.00 C ATOM 244 H PHE A 15 1.000 2.327 4.533 1.00 0.00 H ATOM 245 HA PHE A 15 -0.400 4.660 3.791 1.00 0.00 H ATOM 246 HB2 PHE A 15 2.529 4.313 4.619 1.00 0.00 H ATOM 247 HB3 PHE A 15 1.806 5.906 4.319 1.00 0.00 H ATOM 248 HD1 PHE A 15 -0.525 6.381 5.494 1.00 0.00 H ATOM 249 HD2 PHE A 15 2.431 3.609 6.937 1.00 0.00 H ATOM 250 HE1 PHE A 15 -1.542 6.466 7.740 1.00 0.00 H ATOM 251 HE2 PHE A 15 1.490 3.810 9.215 1.00 0.00 H ATOM 252 HZ PHE A 15 -0.545 5.168 9.607 1.00 0.00 H ATOM 253 N ARG A 16 0.801 5.781 1.797 1.00 0.00 N ATOM 254 CA ARG A 16 1.270 6.199 0.481 1.00 0.00 C ATOM 255 C ARG A 16 2.774 6.211 0.463 1.00 0.00 C ATOM 256 O ARG A 16 3.359 5.680 -0.466 1.00 0.00 O ATOM 257 CB ARG A 16 0.739 7.617 0.159 1.00 0.00 C ATOM 258 CG ARG A 16 1.363 8.248 -1.111 1.00 0.00 C ATOM 259 CD ARG A 16 1.016 7.498 -2.420 1.00 0.00 C ATOM 260 NE ARG A 16 1.692 8.183 -3.521 1.00 0.00 N ATOM 261 CZ ARG A 16 1.275 9.308 -4.063 1.00 1.00 C ATOM 262 NH1 ARG A 16 0.175 9.930 -3.715 1.00 0.00 N ATOM 263 NH2 ARG A 16 2.006 9.844 -5.014 1.00 0.00 N ATOM 264 H ARG A 16 0.328 6.450 2.374 1.00 0.00 H ATOM 265 HA ARG A 16 0.901 5.488 -0.267 1.00 0.00 H ATOM 266 HB2 ARG A 16 -0.354 7.579 0.062 1.00 0.00 H ATOM 267 HB3 ARG A 16 0.993 8.275 1.000 1.00 0.00 H ATOM 268 HG2 ARG A 16 0.992 9.279 -1.183 1.00 0.00 H ATOM 269 HG3 ARG A 16 2.458 8.306 -1.015 1.00 0.00 H ATOM 270 HD2 ARG A 16 1.438 6.483 -2.363 1.00 0.00 H ATOM 271 HD3 ARG A 16 -0.069 7.384 -2.571 1.00 0.00 H ATOM 272 HE ARG A 16 2.557 7.747 -3.871 1.00 0.00 H ATOM 273 HH11 ARG A 16 -0.457 9.555 -2.999 1.00 0.00 H ATOM 274 HH12 ARG A 16 -0.091 10.817 -4.163 1.00 0.00 H ATOM 275 HH21 ARG A 16 2.884 9.402 -5.325 1.00 0.00 H ATOM 276 HH22 ARG A 16 1.723 10.723 -5.469 1.00 0.00 H ATOM 277 N LYS A 17 3.392 6.834 1.487 1.00 0.00 N ATOM 278 CA LYS A 17 4.847 6.934 1.530 1.00 0.00 C ATOM 279 C LYS A 17 5.447 5.575 1.283 1.00 0.00 C ATOM 280 O LYS A 17 6.421 5.468 0.557 1.00 0.00 O ATOM 281 CB LYS A 17 5.297 7.439 2.924 1.00 0.00 C ATOM 282 CG LYS A 17 4.898 8.927 3.140 1.00 0.00 C ATOM 283 CD LYS A 17 4.437 9.175 4.600 1.00 0.00 C ATOM 284 CE LYS A 17 4.016 10.651 4.808 1.00 0.00 C ATOM 285 NZ LYS A 17 3.428 10.855 6.148 1.00 1.00 N ATOM 286 H LYS A 17 2.856 7.228 2.236 1.00 0.00 H ATOM 287 HA LYS A 17 5.191 7.635 0.750 1.00 0.00 H ATOM 288 HB2 LYS A 17 4.835 6.788 3.683 1.00 0.00 H ATOM 289 HB3 LYS A 17 6.389 7.343 3.021 1.00 0.00 H ATOM 290 HG2 LYS A 17 5.759 9.573 2.901 1.00 0.00 H ATOM 291 HG3 LYS A 17 4.073 9.217 2.472 1.00 0.00 H ATOM 292 HD2 LYS A 17 3.568 8.532 4.817 1.00 0.00 H ATOM 293 HD3 LYS A 17 5.254 8.918 5.293 1.00 0.00 H ATOM 294 HE2 LYS A 17 4.899 11.299 4.689 1.00 0.00 H ATOM 295 HE3 LYS A 17 3.265 10.933 4.053 1.00 0.00 H ATOM 296 HZ1 LYS A 17 3.175 11.897 6.289 1.00 0.00 H ATOM 297 HZ2 LYS A 17 4.121 10.570 6.926 1.00 0.00 H ATOM 298 HZ3 LYS A 17 2.522 10.277 6.267 1.00 0.00 H ATOM 299 N ARG A 18 4.845 4.526 1.876 1.00 0.00 N ATOM 300 CA ARG A 18 5.335 3.182 1.624 1.00 0.00 C ATOM 301 C ARG A 18 5.101 2.817 0.179 1.00 0.00 C ATOM 302 O ARG A 18 3.971 2.532 -0.181 1.00 0.00 O ATOM 303 CB ARG A 18 4.616 2.175 2.553 1.00 0.00 C ATOM 304 CG ARG A 18 4.987 2.320 4.053 1.00 0.00 C ATOM 305 CD ARG A 18 6.444 1.887 4.372 1.00 0.00 C ATOM 306 NE ARG A 18 7.444 2.929 4.157 1.00 0.00 N ATOM 307 CZ ARG A 18 8.738 2.712 4.257 1.00 1.00 C ATOM 308 NH1 ARG A 18 9.253 1.555 4.600 1.00 0.00 N ATOM 309 NH2 ARG A 18 9.558 3.704 4.002 1.00 0.00 N ATOM 310 H ARG A 18 4.043 4.650 2.463 1.00 0.00 H ATOM 311 HA ARG A 18 6.409 3.118 1.838 1.00 0.00 H ATOM 312 HB2 ARG A 18 3.527 2.273 2.437 1.00 0.00 H ATOM 313 HB3 ARG A 18 4.890 1.167 2.232 1.00 0.00 H ATOM 314 HG2 ARG A 18 4.804 3.338 4.425 1.00 0.00 H ATOM 315 HG3 ARG A 18 4.303 1.644 4.588 1.00 0.00 H ATOM 316 HD2 ARG A 18 6.517 1.644 5.440 1.00 0.00 H ATOM 317 HD3 ARG A 18 6.662 0.983 3.785 1.00 0.00 H ATOM 318 HE ARG A 18 7.108 3.874 3.921 1.00 0.00 H ATOM 319 HH11 ARG A 18 8.666 0.745 4.831 1.00 0.00 H ATOM 320 HH12 ARG A 18 10.273 1.432 4.660 1.00 0.00 H ATOM 321 HH21 ARG A 18 9.204 4.630 3.723 1.00 0.00 H ATOM 322 HH22 ARG A 18 10.579 3.579 4.068 1.00 0.00 H ATOM 323 N LEU A 19 6.166 2.802 -0.657 1.00 0.00 N ATOM 324 CA LEU A 19 6.039 2.237 -2.000 1.00 0.00 C ATOM 325 C LEU A 19 5.591 0.797 -1.911 1.00 0.00 C ATOM 326 O LEU A 19 4.798 0.396 -2.748 1.00 0.00 O ATOM 327 CB LEU A 19 7.386 2.268 -2.794 1.00 0.00 C ATOM 328 CG LEU A 19 7.430 3.412 -3.846 1.00 0.00 C ATOM 329 CD1 LEU A 19 8.894 3.806 -4.175 1.00 0.00 C ATOM 330 CD2 LEU A 19 6.712 2.974 -5.149 1.00 0.00 C ATOM 331 H LEU A 19 7.060 3.128 -0.347 1.00 0.00 H ATOM 332 HA LEU A 19 5.257 2.793 -2.539 1.00 0.00 H ATOM 333 HB2 LEU A 19 8.241 2.357 -2.108 1.00 0.00 H ATOM 334 HB3 LEU A 19 7.528 1.319 -3.333 1.00 0.00 H ATOM 335 HG LEU A 19 6.939 4.311 -3.437 1.00 0.00 H ATOM 336 HD11 LEU A 19 8.911 4.578 -4.962 1.00 0.00 H ATOM 337 HD12 LEU A 19 9.463 2.929 -4.521 1.00 0.00 H ATOM 338 HD13 LEU A 19 9.383 4.219 -3.278 1.00 0.00 H ATOM 339 HD21 LEU A 19 7.266 2.155 -5.633 1.00 0.00 H ATOM 340 HD22 LEU A 19 6.659 3.820 -5.850 1.00 0.00 H ATOM 341 HD23 LEU A 19 5.689 2.628 -4.940 1.00 0.00 H ATOM 342 N LYS A 20 6.100 0.019 -0.925 1.00 0.00 N ATOM 343 CA LYS A 20 5.788 -1.408 -0.859 1.00 0.00 C ATOM 344 C LYS A 20 4.842 -1.744 0.263 1.00 0.00 C ATOM 345 O LYS A 20 4.632 -0.927 1.142 1.00 0.00 O ATOM 346 CB LYS A 20 7.092 -2.229 -0.698 1.00 0.00 C ATOM 347 CG LYS A 20 7.829 -2.366 -2.052 1.00 0.00 C ATOM 348 CD LYS A 20 9.183 -3.085 -1.832 1.00 0.00 C ATOM 349 CE LYS A 20 9.828 -3.512 -3.173 1.00 0.00 C ATOM 350 NZ LYS A 20 11.072 -4.271 -2.927 1.00 1.00 N ATOM 351 H LYS A 20 6.712 0.401 -0.229 1.00 0.00 H ATOM 352 HA LYS A 20 5.294 -1.739 -1.779 1.00 0.00 H ATOM 353 HB2 LYS A 20 7.743 -1.754 0.053 1.00 0.00 H ATOM 354 HB3 LYS A 20 6.850 -3.243 -0.345 1.00 0.00 H ATOM 355 HG2 LYS A 20 7.200 -2.962 -2.733 1.00 0.00 H ATOM 356 HG3 LYS A 20 7.997 -1.374 -2.501 1.00 0.00 H ATOM 357 HD2 LYS A 20 9.866 -2.410 -1.290 1.00 0.00 H ATOM 358 HD3 LYS A 20 9.021 -3.986 -1.220 1.00 0.00 H ATOM 359 HE2 LYS A 20 9.128 -4.157 -3.730 1.00 0.00 H ATOM 360 HE3 LYS A 20 10.047 -2.618 -3.779 1.00 0.00 H ATOM 361 HZ1 LYS A 20 11.527 -4.568 -3.863 1.00 0.00 H ATOM 362 HZ2 LYS A 20 10.877 -5.170 -2.361 1.00 0.00 H ATOM 363 HZ3 LYS A 20 11.788 -3.675 -2.379 1.00 0.00 H ATOM 364 N CYS A 21 4.256 -2.961 0.239 1.00 0.00 N ATOM 365 CA CYS A 21 3.317 -3.333 1.289 1.00 0.00 C ATOM 366 C CYS A 21 4.079 -3.628 2.558 1.00 0.00 C ATOM 367 O CYS A 21 5.245 -3.974 2.454 1.00 0.00 O ATOM 368 CB CYS A 21 2.536 -4.587 0.830 1.00 0.00 C ATOM 369 SG CYS A 21 1.338 -5.071 2.093 1.00 -1.00 S ATOM 370 H CYS A 21 4.450 -3.625 -0.486 1.00 0.00 H ATOM 371 HA CYS A 21 2.602 -2.511 1.451 1.00 0.00 H ATOM 372 HB2 CYS A 21 1.979 -4.374 -0.092 1.00 0.00 H ATOM 373 HB3 CYS A 21 3.223 -5.426 0.654 1.00 0.00 H ATOM 374 N PHE A 22 3.433 -3.503 3.744 1.00 0.00 N ATOM 375 CA PHE A 22 4.093 -3.820 5.009 1.00 0.00 C ATOM 376 C PHE A 22 3.474 -5.070 5.585 1.00 0.00 C ATOM 377 O PHE A 22 3.060 -5.097 6.731 1.00 0.00 O ATOM 378 CB PHE A 22 3.966 -2.565 5.904 1.00 0.00 C ATOM 379 CG PHE A 22 4.839 -2.616 7.165 1.00 0.00 C ATOM 380 CD1 PHE A 22 6.233 -2.664 7.057 1.00 0.00 C ATOM 381 CD2 PHE A 22 4.256 -2.598 8.435 1.00 0.00 C ATOM 382 CE1 PHE A 22 7.031 -2.740 8.200 1.00 0.00 C ATOM 383 CE2 PHE A 22 5.056 -2.640 9.583 1.00 0.00 C ATOM 384 CZ PHE A 22 6.444 -2.724 9.466 1.00 0.00 C ATOM 385 H PHE A 22 2.480 -3.202 3.791 1.00 0.00 H ATOM 386 HA PHE A 22 5.163 -4.031 4.861 1.00 0.00 H ATOM 387 HB2 PHE A 22 4.305 -1.719 5.287 1.00 0.00 H ATOM 388 HB3 PHE A 22 2.909 -2.397 6.160 1.00 0.00 H ATOM 389 HD1 PHE A 22 6.709 -2.639 6.082 1.00 0.00 H ATOM 390 HD2 PHE A 22 3.180 -2.549 8.549 1.00 0.00 H ATOM 391 HE1 PHE A 22 8.111 -2.811 8.105 1.00 0.00 H ATOM 392 HE2 PHE A 22 4.598 -2.606 10.565 1.00 0.00 H ATOM 393 HZ PHE A 22 7.063 -2.776 10.354 1.00 0.00 H ATOM 394 N ARG A 23 3.437 -6.121 4.737 1.00 0.00 N ATOM 395 CA ARG A 23 2.918 -7.427 5.136 1.00 0.00 C ATOM 396 C ARG A 23 3.474 -8.464 4.180 1.00 0.00 C ATOM 397 O ARG A 23 4.173 -9.353 4.638 1.00 0.00 O ATOM 398 CB ARG A 23 1.362 -7.442 5.163 1.00 0.00 C ATOM 399 CG ARG A 23 0.811 -7.929 6.532 1.00 0.00 C ATOM 400 CD ARG A 23 -0.730 -7.774 6.677 1.00 0.00 C ATOM 401 NE ARG A 23 -1.491 -9.017 6.579 1.00 0.00 N ATOM 402 CZ ARG A 23 -1.476 -9.968 7.486 1.00 1.00 C ATOM 403 NH1 ARG A 23 -0.743 -9.911 8.569 1.00 0.00 N ATOM 404 NH2 ARG A 23 -2.233 -11.024 7.300 1.00 0.00 N ATOM 405 H ARG A 23 3.779 -6.006 3.810 1.00 0.00 H ATOM 406 HA ARG A 23 3.319 -7.655 6.135 1.00 0.00 H ATOM 407 HB2 ARG A 23 1.029 -6.413 4.968 1.00 0.00 H ATOM 408 HB3 ARG A 23 0.964 -8.091 4.370 1.00 0.00 H ATOM 409 HG2 ARG A 23 1.111 -8.979 6.670 1.00 0.00 H ATOM 410 HG3 ARG A 23 1.271 -7.322 7.329 1.00 0.00 H ATOM 411 HD2 ARG A 23 -0.994 -7.255 7.613 1.00 0.00 H ATOM 412 HD3 ARG A 23 -1.093 -7.138 5.859 1.00 0.00 H ATOM 413 HE ARG A 23 -2.107 -9.119 5.763 1.00 0.00 H ATOM 414 HH11 ARG A 23 -0.139 -9.105 8.770 1.00 0.00 H ATOM 415 HH12 ARG A 23 -0.756 -10.681 9.253 1.00 0.00 H ATOM 416 HH21 ARG A 23 -2.833 -11.111 6.465 1.00 0.00 H ATOM 417 HH22 ARG A 23 -2.251 -11.790 7.989 1.00 0.00 H ATOM 418 N CYS A 24 3.184 -8.346 2.861 1.00 0.00 N ATOM 419 CA CYS A 24 3.756 -9.253 1.864 1.00 0.00 C ATOM 420 C CYS A 24 4.789 -8.595 0.970 1.00 0.00 C ATOM 421 O CYS A 24 5.215 -9.233 0.019 1.00 0.00 O ATOM 422 CB CYS A 24 2.598 -9.843 1.019 1.00 0.00 C ATOM 423 SG CYS A 24 1.727 -8.519 0.120 1.00 -1.00 S ATOM 424 H CYS A 24 2.587 -7.615 2.536 1.00 0.00 H ATOM 425 HA CYS A 24 4.255 -10.105 2.353 1.00 0.00 H ATOM 426 HB2 CYS A 24 2.983 -10.577 0.297 1.00 0.00 H ATOM 427 HB3 CYS A 24 1.875 -10.344 1.682 1.00 0.00 H ATOM 428 N GLY A 25 5.225 -7.340 1.223 1.00 0.00 N ATOM 429 CA GLY A 25 6.254 -6.724 0.390 1.00 0.00 C ATOM 430 C GLY A 25 5.914 -6.570 -1.073 1.00 0.00 C ATOM 431 O GLY A 25 6.801 -6.163 -1.807 1.00 0.00 O ATOM 432 H GLY A 25 4.898 -6.811 2.000 1.00 0.00 H ATOM 433 HA2 GLY A 25 6.476 -5.714 0.771 1.00 0.00 H ATOM 434 HA3 GLY A 25 7.174 -7.323 0.472 1.00 0.00 H ATOM 435 N ALA A 26 4.677 -6.867 -1.533 1.00 0.00 N ATOM 436 CA ALA A 26 4.385 -6.720 -2.953 1.00 0.00 C ATOM 437 C ALA A 26 4.076 -5.268 -3.200 1.00 0.00 C ATOM 438 O ALA A 26 3.388 -4.679 -2.378 1.00 0.00 O ATOM 439 CB ALA A 26 3.177 -7.586 -3.377 1.00 0.00 C ATOM 440 H ALA A 26 3.931 -7.138 -0.930 1.00 0.00 H ATOM 441 HA ALA A 26 5.252 -7.054 -3.547 1.00 0.00 H ATOM 442 HB1 ALA A 26 2.267 -7.268 -2.846 1.00 0.00 H ATOM 443 HB2 ALA A 26 3.008 -7.489 -4.460 1.00 0.00 H ATOM 444 HB3 ALA A 26 3.381 -8.641 -3.139 1.00 0.00 H ATOM 445 N ASP A 27 4.570 -4.675 -4.308 1.00 0.00 N ATOM 446 CA ASP A 27 4.273 -3.271 -4.555 1.00 0.00 C ATOM 447 C ASP A 27 2.868 -3.168 -5.084 1.00 0.00 C ATOM 448 O ASP A 27 2.418 -4.112 -5.715 1.00 0.00 O ATOM 449 CB ASP A 27 5.302 -2.649 -5.533 1.00 0.00 C ATOM 450 CG ASP A 27 5.294 -1.142 -5.470 1.00 0.00 C ATOM 451 OD1 ASP A 27 4.258 -0.530 -5.838 1.00 -0.50 O ATOM 452 OD2 ASP A 27 6.329 -0.555 -5.052 1.00 -0.50 O ATOM 453 H ASP A 27 5.110 -5.185 -4.983 1.00 0.00 H ATOM 454 HA ASP A 27 4.347 -2.724 -3.608 1.00 0.00 H ATOM 455 HB2 ASP A 27 6.309 -2.996 -5.253 1.00 0.00 H ATOM 456 HB3 ASP A 27 5.095 -2.987 -6.561 1.00 0.00 H ATOM 457 N LYS A 28 2.165 -2.038 -4.858 1.00 0.00 N ATOM 458 CA LYS A 28 0.852 -1.882 -5.475 1.00 0.00 C ATOM 459 C LYS A 28 0.921 -2.081 -6.973 1.00 0.00 C ATOM 460 O LYS A 28 -0.093 -2.464 -7.535 1.00 0.00 O ATOM 461 CB LYS A 28 0.217 -0.483 -5.247 1.00 0.00 C ATOM 462 CG LYS A 28 1.177 0.690 -5.584 1.00 0.00 C ATOM 463 CD LYS A 28 0.480 1.901 -6.255 1.00 0.00 C ATOM 464 CE LYS A 28 -0.603 2.558 -5.366 1.00 0.00 C ATOM 465 NZ LYS A 28 -1.051 3.826 -5.981 1.00 1.00 N ATOM 466 H LYS A 28 2.531 -1.291 -4.301 1.00 0.00 H ATOM 467 HA LYS A 28 0.171 -2.643 -5.055 1.00 0.00 H ATOM 468 HB2 LYS A 28 -0.688 -0.425 -5.873 1.00 0.00 H ATOM 469 HB3 LYS A 28 -0.095 -0.390 -4.196 1.00 0.00 H ATOM 470 HG2 LYS A 28 1.698 1.030 -4.673 1.00 0.00 H ATOM 471 HG3 LYS A 28 1.933 0.357 -6.303 1.00 0.00 H ATOM 472 HD2 LYS A 28 1.251 2.655 -6.481 1.00 0.00 H ATOM 473 HD3 LYS A 28 0.023 1.577 -7.204 1.00 0.00 H ATOM 474 HE2 LYS A 28 -1.468 1.881 -5.264 1.00 0.00 H ATOM 475 HE3 LYS A 28 -0.187 2.763 -4.367 1.00 0.00 H ATOM 476 HZ1 LYS A 28 -1.883 4.244 -5.430 1.00 0.00 H ATOM 477 HZ2 LYS A 28 -1.368 3.688 -7.005 1.00 0.00 H ATOM 478 HZ3 LYS A 28 -0.256 4.559 -5.972 1.00 0.00 H ATOM 479 N PHE A 29 2.080 -1.830 -7.631 1.00 0.00 N ATOM 480 CA PHE A 29 2.132 -1.882 -9.089 1.00 0.00 C ATOM 481 C PHE A 29 2.652 -3.213 -9.579 1.00 0.00 C ATOM 482 O PHE A 29 3.077 -3.277 -10.721 1.00 0.00 O ATOM 483 CB PHE A 29 2.999 -0.688 -9.581 1.00 0.00 C ATOM 484 CG PHE A 29 2.349 0.057 -10.750 1.00 0.00 C ATOM 485 CD1 PHE A 29 1.196 0.811 -10.515 1.00 0.00 C ATOM 486 CD2 PHE A 29 2.895 0.018 -12.037 1.00 0.00 C ATOM 487 CE1 PHE A 29 0.618 1.563 -11.542 1.00 0.00 C ATOM 488 CE2 PHE A 29 2.323 0.775 -13.062 1.00 0.00 C ATOM 489 CZ PHE A 29 1.190 1.553 -12.816 1.00 0.00 C ATOM 490 H PHE A 29 2.931 -1.600 -7.155 1.00 0.00 H ATOM 491 HA PHE A 29 1.122 -1.759 -9.511 1.00 0.00 H ATOM 492 HB2 PHE A 29 3.082 0.072 -8.790 1.00 0.00 H ATOM 493 HB3 PHE A 29 4.018 -1.024 -9.820 1.00 0.00 H ATOM 494 HD1 PHE A 29 0.744 0.821 -9.531 1.00 0.00 H ATOM 495 HD2 PHE A 29 3.765 -0.593 -12.245 1.00 0.00 H ATOM 496 HE1 PHE A 29 -0.272 2.152 -11.349 1.00 0.00 H ATOM 497 HE2 PHE A 29 2.760 0.759 -14.055 1.00 0.00 H ATOM 498 HZ PHE A 29 0.752 2.148 -13.610 1.00 0.00 H ATOM 499 N ASP A 30 2.627 -4.287 -8.755 1.00 0.00 N ATOM 500 CA ASP A 30 3.103 -5.586 -9.221 1.00 0.00 C ATOM 501 C ASP A 30 2.511 -6.674 -8.324 1.00 0.00 C ATOM 502 O ASP A 30 1.720 -6.381 -7.429 1.00 0.00 O ATOM 503 CB ASP A 30 4.654 -5.613 -9.206 1.00 0.00 C ATOM 504 CG ASP A 30 5.221 -5.873 -7.836 1.00 0.00 C ATOM 505 OD1 ASP A 30 4.526 -5.585 -6.828 1.00 -0.50 O ATOM 506 OD2 ASP A 30 6.373 -6.375 -7.761 1.00 -0.50 O ATOM 507 H ASP A 30 2.297 -4.235 -7.812 1.00 0.00 H ATOM 508 HA ASP A 30 2.742 -5.758 -10.248 1.00 0.00 H ATOM 509 HB2 ASP A 30 5.010 -6.409 -9.880 1.00 0.00 H ATOM 510 HB3 ASP A 30 5.049 -4.655 -9.579 1.00 0.00 H HETATM 511 N NH2 A 31 2.874 -7.958 -8.541 1.00 0.00 N HETATM 512 HN1 NH2 A 31 2.509 -8.676 -7.949 1.00 0.00 H HETATM 513 HN2 NH2 A 31 3.502 -8.214 -9.276 1.00 0.00 H TER 514 NH2 A 31 HETATM 515 C1 AQN A 32 2.365 1.057 8.113 1.00 0.00 C HETATM 516 C2 AQN A 32 1.181 1.131 8.851 1.00 0.00 C HETATM 517 C3 AQN A 32 -0.158 1.197 8.149 1.00 0.00 C HETATM 518 O3 AQN A 32 -0.208 1.222 6.929 1.00 0.00 O HETATM 519 C4 AQN A 32 -1.436 1.231 8.958 1.00 0.00 C HETATM 520 C5 AQN A 32 -2.677 1.293 8.321 1.00 0.00 C HETATM 521 C6 AQN A 32 -3.857 1.259 9.065 1.00 0.00 C HETATM 522 C7 AQN A 32 -3.799 1.220 10.459 1.00 0.00 C HETATM 523 C8 AQN A 32 -2.561 1.204 11.103 1.00 0.00 C HETATM 524 C9 AQN A 32 -1.383 1.204 10.354 1.00 0.00 C HETATM 525 C10 AQN A 32 -0.045 1.175 11.056 1.00 0.00 C HETATM 526 O10 AQN A 32 0.000 1.178 12.276 1.00 0.00 O HETATM 527 C11 AQN A 32 1.231 1.143 10.249 1.00 0.00 C HETATM 528 C12 AQN A 32 2.467 1.128 10.898 1.00 0.00 C HETATM 529 C13 AQN A 32 3.648 1.071 10.159 1.00 0.00 C HETATM 530 C14 AQN A 32 3.600 1.010 8.767 1.00 0.00 C HETATM 531 S15 AQN A 32 5.111 0.925 7.840 1.00 0.00 S HETATM 532 OS1 AQN A 32 4.830 0.267 6.586 1.00 0.00 O HETATM 533 OS2 AQN A 32 5.356 2.382 7.575 1.00 -1.00 O HETATM 534 OS3 AQN A 32 6.172 0.418 8.690 1.00 0.00 O HETATM 535 H1 AQN A 32 2.327 1.032 7.027 1.00 0.00 H HETATM 536 H5 AQN A 32 -2.736 1.370 7.246 1.00 0.00 H HETATM 537 H6 AQN A 32 -4.817 1.267 8.561 1.00 0.00 H HETATM 538 H7 AQN A 32 -4.712 1.204 11.044 1.00 0.00 H HETATM 539 H8 AQN A 32 -2.522 1.191 12.188 1.00 0.00 H HETATM 540 H12 AQN A 32 2.519 1.159 11.981 1.00 0.00 H HETATM 541 H13 AQN A 32 4.603 1.071 10.670 1.00 0.00 H HETATM 542 ZN ZN A 33 0.240 -6.836 0.920 1.00 2.00 ZN