ATOM 1 N GLY A -2 -14.636 11.463 -6.516 1.00 0.00 N ATOM 2 CA GLY A -2 -15.130 11.920 -5.197 1.00 0.00 C ATOM 3 C GLY A -2 -14.002 12.403 -4.309 1.00 0.00 C ATOM 4 O GLY A -2 -12.954 12.818 -4.805 1.00 0.00 O ATOM 5 H1 GLY A -2 -14.161 12.247 -7.010 1.00 0.00 H ATOM 6 H2 GLY A -2 -15.426 11.128 -7.100 1.00 0.00 H ATOM 7 H3 GLY A -2 -13.955 10.687 -6.394 1.00 0.00 H ATOM 8 HA2 GLY A -2 -15.831 12.727 -5.344 1.00 0.00 H ATOM 9 HA3 GLY A -2 -15.634 11.100 -4.709 1.00 0.00 H ATOM 10 N PRO A -1 -14.184 12.361 -2.981 1.00 0.00 N ATOM 11 CA PRO A -1 -13.156 12.754 -2.020 1.00 0.00 C ATOM 12 C PRO A -1 -12.154 11.629 -1.757 1.00 0.00 C ATOM 13 O PRO A -1 -11.544 11.569 -0.685 1.00 0.00 O ATOM 14 CB PRO A -1 -13.953 13.065 -0.741 1.00 0.00 C ATOM 15 CG PRO A -1 -15.394 12.830 -1.079 1.00 0.00 C ATOM 16 CD PRO A -1 -15.412 11.959 -2.300 1.00 0.00 C ATOM 17 HA PRO A -1 -12.627 13.638 -2.344 1.00 0.00 H ATOM 18 HB2 PRO A -1 -13.625 12.410 0.053 1.00 0.00 H ATOM 19 HB3 PRO A -1 -13.780 14.092 -0.453 1.00 0.00 H ATOM 20 HG2 PRO A -1 -15.886 12.330 -0.257 1.00 0.00 H ATOM 21 HG3 PRO A -1 -15.879 13.774 -1.285 1.00 0.00 H ATOM 22 HD2 PRO A -1 -15.381 10.915 -2.026 1.00 0.00 H ATOM 23 HD3 PRO A -1 -16.279 12.170 -2.907 1.00 0.00 H ATOM 24 N HIS A 0 -12.003 10.742 -2.743 1.00 0.00 N ATOM 25 CA HIS A 0 -11.121 9.577 -2.643 1.00 0.00 C ATOM 26 C HIS A 0 -11.512 8.695 -1.467 1.00 0.00 C ATOM 27 O HIS A 0 -10.661 8.096 -0.810 1.00 0.00 O ATOM 28 CB HIS A 0 -9.650 9.991 -2.534 1.00 0.00 C ATOM 29 CG HIS A 0 -9.081 10.511 -3.817 1.00 0.00 C ATOM 30 ND1 HIS A 0 -8.394 9.718 -4.712 1.00 0.00 N ATOM 31 CD2 HIS A 0 -9.100 11.750 -4.356 1.00 0.00 C ATOM 32 CE1 HIS A 0 -8.018 10.448 -5.744 1.00 0.00 C ATOM 33 NE2 HIS A 0 -8.434 11.685 -5.554 1.00 0.00 N ATOM 34 H HIS A 0 -12.509 10.874 -3.574 1.00 0.00 H ATOM 35 HA HIS A 0 -11.248 9.001 -3.548 1.00 0.00 H ATOM 36 HB2 HIS A 0 -9.558 10.770 -1.792 1.00 0.00 H ATOM 37 HB3 HIS A 0 -9.063 9.137 -2.229 1.00 0.00 H ATOM 38 HD1 HIS A 0 -8.208 8.758 -4.606 1.00 0.00 H ATOM 39 HD2 HIS A 0 -9.556 12.629 -3.924 1.00 0.00 H ATOM 40 HE1 HIS A 0 -7.465 10.093 -6.600 1.00 0.00 H ATOM 41 HE2 HIS A 0 -8.438 12.387 -6.241 1.00 0.00 H ATOM 42 N MET A 1 -12.809 8.615 -1.212 1.00 0.00 N ATOM 43 CA MET A 1 -13.321 7.786 -0.135 1.00 0.00 C ATOM 44 C MET A 1 -13.508 6.364 -0.630 1.00 0.00 C ATOM 45 O MET A 1 -14.332 6.119 -1.515 1.00 0.00 O ATOM 46 CB MET A 1 -14.646 8.338 0.397 1.00 0.00 C ATOM 47 CG MET A 1 -14.519 9.691 1.076 1.00 0.00 C ATOM 48 SD MET A 1 -16.090 10.277 1.743 1.00 0.00 S ATOM 49 CE MET A 1 -15.571 11.795 2.540 1.00 0.00 C ATOM 50 H MET A 1 -13.439 9.112 -1.777 1.00 0.00 H ATOM 51 HA MET A 1 -12.592 7.786 0.660 1.00 0.00 H ATOM 52 HB2 MET A 1 -15.336 8.437 -0.427 1.00 0.00 H ATOM 53 HB3 MET A 1 -15.050 7.638 1.112 1.00 0.00 H ATOM 54 HG2 MET A 1 -13.806 9.611 1.883 1.00 0.00 H ATOM 55 HG3 MET A 1 -14.163 10.408 0.351 1.00 0.00 H ATOM 56 HE1 MET A 1 -16.425 12.269 3.000 1.00 0.00 H ATOM 57 HE2 MET A 1 -15.143 12.458 1.804 1.00 0.00 H ATOM 58 HE3 MET A 1 -14.833 11.571 3.294 1.00 0.00 H ATOM 59 N ALA A 2 -12.720 5.448 -0.070 1.00 0.00 N ATOM 60 CA ALA A 2 -12.730 4.046 -0.461 1.00 0.00 C ATOM 61 C ALA A 2 -12.039 3.858 -1.797 1.00 0.00 C ATOM 62 O ALA A 2 -11.676 4.823 -2.480 1.00 0.00 O ATOM 63 CB ALA A 2 -14.137 3.462 -0.485 1.00 0.00 C ATOM 64 H ALA A 2 -12.085 5.730 0.620 1.00 0.00 H ATOM 65 HA ALA A 2 -12.159 3.503 0.281 1.00 0.00 H ATOM 66 HB1 ALA A 2 -14.589 3.572 0.490 1.00 0.00 H ATOM 67 HB2 ALA A 2 -14.088 2.412 -0.743 1.00 0.00 H ATOM 68 HB3 ALA A 2 -14.731 3.985 -1.219 1.00 0.00 H ATOM 69 N VAL A 3 -11.869 2.605 -2.151 1.00 0.00 N ATOM 70 CA VAL A 3 -11.052 2.206 -3.273 1.00 0.00 C ATOM 71 C VAL A 3 -10.932 0.696 -3.194 1.00 0.00 C ATOM 72 O VAL A 3 -11.582 0.077 -2.349 1.00 0.00 O ATOM 73 CB VAL A 3 -9.642 2.833 -3.159 1.00 0.00 C ATOM 74 CG1 VAL A 3 -8.742 1.977 -2.305 1.00 0.00 C ATOM 75 CG2 VAL A 3 -8.996 3.063 -4.503 1.00 0.00 C ATOM 76 H VAL A 3 -12.320 1.905 -1.632 1.00 0.00 H ATOM 77 HA VAL A 3 -11.518 2.513 -4.189 1.00 0.00 H ATOM 78 HB VAL A 3 -9.745 3.793 -2.672 1.00 0.00 H ATOM 79 HG11 VAL A 3 -8.442 1.102 -2.860 1.00 0.00 H ATOM 80 HG12 VAL A 3 -9.280 1.672 -1.417 1.00 0.00 H ATOM 81 HG13 VAL A 3 -7.870 2.549 -2.027 1.00 0.00 H ATOM 82 HG21 VAL A 3 -8.007 3.468 -4.343 1.00 0.00 H ATOM 83 HG22 VAL A 3 -9.588 3.758 -5.076 1.00 0.00 H ATOM 84 HG23 VAL A 3 -8.918 2.126 -5.030 1.00 0.00 H ATOM 85 N LEU A 4 -10.120 0.099 -4.037 1.00 0.00 N ATOM 86 CA LEU A 4 -9.669 -1.240 -3.763 1.00 0.00 C ATOM 87 C LEU A 4 -8.152 -1.285 -3.732 1.00 0.00 C ATOM 88 O LEU A 4 -7.478 -0.696 -4.577 1.00 0.00 O ATOM 89 CB LEU A 4 -10.242 -2.249 -4.762 1.00 0.00 C ATOM 90 CG LEU A 4 -11.744 -2.512 -4.621 1.00 0.00 C ATOM 91 CD1 LEU A 4 -12.202 -3.544 -5.638 1.00 0.00 C ATOM 92 CD2 LEU A 4 -12.078 -2.972 -3.206 1.00 0.00 C ATOM 93 H LEU A 4 -9.829 0.557 -4.854 1.00 0.00 H ATOM 94 HA LEU A 4 -10.024 -1.478 -2.768 1.00 0.00 H ATOM 95 HB2 LEU A 4 -10.051 -1.883 -5.759 1.00 0.00 H ATOM 96 HB3 LEU A 4 -9.721 -3.186 -4.634 1.00 0.00 H ATOM 97 HG LEU A 4 -12.283 -1.596 -4.812 1.00 0.00 H ATOM 98 HD11 LEU A 4 -12.012 -3.177 -6.635 1.00 0.00 H ATOM 99 HD12 LEU A 4 -13.261 -3.725 -5.516 1.00 0.00 H ATOM 100 HD13 LEU A 4 -11.660 -4.465 -5.485 1.00 0.00 H ATOM 101 HD21 LEU A 4 -11.868 -2.171 -2.506 1.00 0.00 H ATOM 102 HD22 LEU A 4 -11.477 -3.835 -2.952 1.00 0.00 H ATOM 103 HD23 LEU A 4 -13.124 -3.234 -3.148 1.00 0.00 H ATOM 104 N CYS A 5 -7.651 -1.958 -2.703 1.00 0.00 N ATOM 105 CA CYS A 5 -6.226 -2.101 -2.423 1.00 0.00 C ATOM 106 C CYS A 5 -5.408 -2.363 -3.684 1.00 0.00 C ATOM 107 O CYS A 5 -5.672 -3.308 -4.416 1.00 0.00 O ATOM 108 CB CYS A 5 -6.062 -3.258 -1.446 1.00 0.00 C ATOM 109 SG CYS A 5 -4.382 -3.561 -0.861 1.00 0.00 S ATOM 110 H CYS A 5 -8.287 -2.381 -2.083 1.00 0.00 H ATOM 111 HA CYS A 5 -5.879 -1.193 -1.955 1.00 0.00 H ATOM 112 HB2 CYS A 5 -6.677 -3.070 -0.582 1.00 0.00 H ATOM 113 HB3 CYS A 5 -6.407 -4.164 -1.926 1.00 0.00 H ATOM 114 N GLY A 6 -4.396 -1.533 -3.905 1.00 0.00 N ATOM 115 CA GLY A 6 -3.571 -1.650 -5.095 1.00 0.00 C ATOM 116 C GLY A 6 -2.776 -2.943 -5.154 1.00 0.00 C ATOM 117 O GLY A 6 -2.318 -3.347 -6.224 1.00 0.00 O ATOM 118 H GLY A 6 -4.215 -0.814 -3.256 1.00 0.00 H ATOM 119 HA2 GLY A 6 -4.207 -1.598 -5.962 1.00 0.00 H ATOM 120 HA3 GLY A 6 -2.882 -0.819 -5.121 1.00 0.00 H ATOM 121 N VAL A 7 -2.608 -3.596 -4.014 1.00 0.00 N ATOM 122 CA VAL A 7 -1.828 -4.827 -3.959 1.00 0.00 C ATOM 123 C VAL A 7 -2.701 -6.066 -4.154 1.00 0.00 C ATOM 124 O VAL A 7 -2.537 -6.795 -5.131 1.00 0.00 O ATOM 125 CB VAL A 7 -1.051 -4.949 -2.633 1.00 0.00 C ATOM 126 CG1 VAL A 7 -0.316 -6.281 -2.555 1.00 0.00 C ATOM 127 CG2 VAL A 7 -0.074 -3.793 -2.479 1.00 0.00 C ATOM 128 H VAL A 7 -3.012 -3.243 -3.197 1.00 0.00 H ATOM 129 HA VAL A 7 -1.107 -4.788 -4.763 1.00 0.00 H ATOM 130 HB VAL A 7 -1.760 -4.905 -1.818 1.00 0.00 H ATOM 131 HG11 VAL A 7 0.393 -6.348 -3.368 1.00 0.00 H ATOM 132 HG12 VAL A 7 -1.030 -7.087 -2.632 1.00 0.00 H ATOM 133 HG13 VAL A 7 0.207 -6.349 -1.613 1.00 0.00 H ATOM 134 HG21 VAL A 7 0.630 -3.805 -3.297 1.00 0.00 H ATOM 135 HG22 VAL A 7 0.457 -3.892 -1.544 1.00 0.00 H ATOM 136 HG23 VAL A 7 -0.618 -2.860 -2.487 1.00 0.00 H ATOM 137 N CYS A 8 -3.630 -6.304 -3.230 1.00 0.00 N ATOM 138 CA CYS A 8 -4.419 -7.533 -3.260 1.00 0.00 C ATOM 139 C CYS A 8 -5.743 -7.329 -3.994 1.00 0.00 C ATOM 140 O CYS A 8 -6.352 -8.277 -4.491 1.00 0.00 O ATOM 141 CB CYS A 8 -4.667 -8.050 -1.838 1.00 0.00 C ATOM 142 SG CYS A 8 -5.721 -6.985 -0.830 1.00 0.00 S ATOM 143 H CYS A 8 -3.785 -5.647 -2.529 1.00 0.00 H ATOM 144 HA CYS A 8 -3.843 -8.272 -3.798 1.00 0.00 H ATOM 145 HB2 CYS A 8 -5.141 -9.017 -1.894 1.00 0.00 H ATOM 146 HB3 CYS A 8 -3.719 -8.150 -1.331 1.00 0.00 H ATOM 147 N GLY A 9 -6.169 -6.068 -4.048 1.00 0.00 N ATOM 148 CA GLY A 9 -7.336 -5.670 -4.820 1.00 0.00 C ATOM 149 C GLY A 9 -8.635 -6.323 -4.392 1.00 0.00 C ATOM 150 O GLY A 9 -9.490 -6.583 -5.234 1.00 0.00 O ATOM 151 H GLY A 9 -5.658 -5.382 -3.575 1.00 0.00 H ATOM 152 HA2 GLY A 9 -7.452 -4.601 -4.734 1.00 0.00 H ATOM 153 HA3 GLY A 9 -7.155 -5.911 -5.856 1.00 0.00 H ATOM 154 N ILE A 10 -8.818 -6.575 -3.099 1.00 0.00 N ATOM 155 CA ILE A 10 -10.031 -7.256 -2.658 1.00 0.00 C ATOM 156 C ILE A 10 -10.837 -6.459 -1.628 1.00 0.00 C ATOM 157 O ILE A 10 -11.976 -6.819 -1.327 1.00 0.00 O ATOM 158 CB ILE A 10 -9.736 -8.684 -2.126 1.00 0.00 C ATOM 159 CG1 ILE A 10 -8.554 -8.695 -1.152 1.00 0.00 C ATOM 160 CG2 ILE A 10 -9.472 -9.635 -3.283 1.00 0.00 C ATOM 161 CD1 ILE A 10 -8.863 -8.099 0.201 1.00 0.00 C ATOM 162 H ILE A 10 -8.133 -6.313 -2.442 1.00 0.00 H ATOM 163 HA ILE A 10 -10.651 -7.368 -3.534 1.00 0.00 H ATOM 164 HB ILE A 10 -10.618 -9.033 -1.608 1.00 0.00 H ATOM 165 HG12 ILE A 10 -8.235 -9.713 -0.998 1.00 0.00 H ATOM 166 HG13 ILE A 10 -7.739 -8.132 -1.584 1.00 0.00 H ATOM 167 HG21 ILE A 10 -8.610 -9.294 -3.839 1.00 0.00 H ATOM 168 HG22 ILE A 10 -10.333 -9.659 -3.934 1.00 0.00 H ATOM 169 HG23 ILE A 10 -9.282 -10.626 -2.899 1.00 0.00 H ATOM 170 HD11 ILE A 10 -7.970 -8.095 0.807 1.00 0.00 H ATOM 171 HD12 ILE A 10 -9.627 -8.686 0.686 1.00 0.00 H ATOM 172 HD13 ILE A 10 -9.216 -7.085 0.069 1.00 0.00 H ATOM 173 N LYS A 11 -10.271 -5.377 -1.096 1.00 0.00 N ATOM 174 CA LYS A 11 -10.989 -4.569 -0.113 1.00 0.00 C ATOM 175 C LYS A 11 -10.497 -3.128 -0.106 1.00 0.00 C ATOM 176 O LYS A 11 -9.543 -2.787 -0.815 1.00 0.00 O ATOM 177 CB LYS A 11 -10.868 -5.171 1.294 1.00 0.00 C ATOM 178 CG LYS A 11 -9.473 -5.084 1.894 1.00 0.00 C ATOM 179 CD LYS A 11 -9.418 -5.731 3.272 1.00 0.00 C ATOM 180 CE LYS A 11 -10.298 -5.001 4.276 1.00 0.00 C ATOM 181 NZ LYS A 11 -10.317 -5.676 5.600 1.00 0.00 N1+ ATOM 182 H LYS A 11 -9.376 -5.109 -1.380 1.00 0.00 H ATOM 183 HA LYS A 11 -12.029 -4.569 -0.397 1.00 0.00 H ATOM 184 HB2 LYS A 11 -11.548 -4.650 1.949 1.00 0.00 H ATOM 185 HB3 LYS A 11 -11.154 -6.212 1.250 1.00 0.00 H ATOM 186 HG2 LYS A 11 -8.777 -5.588 1.243 1.00 0.00 H ATOM 187 HG3 LYS A 11 -9.196 -4.045 1.984 1.00 0.00 H ATOM 188 HD2 LYS A 11 -9.754 -6.755 3.192 1.00 0.00 H ATOM 189 HD3 LYS A 11 -8.396 -5.715 3.625 1.00 0.00 H ATOM 190 HE2 LYS A 11 -9.921 -3.999 4.401 1.00 0.00 H ATOM 191 HE3 LYS A 11 -11.304 -4.959 3.889 1.00 0.00 H ATOM 192 HZ1 LYS A 11 -10.674 -6.649 5.502 1.00 0.00 H ATOM 193 HZ2 LYS A 11 -10.938 -5.160 6.252 1.00 0.00 H ATOM 194 HZ3 LYS A 11 -9.361 -5.708 6.001 1.00 0.00 H ATOM 195 N GLU A 12 -11.156 -2.297 0.700 1.00 0.00 N ATOM 196 CA GLU A 12 -10.836 -0.875 0.802 1.00 0.00 C ATOM 197 C GLU A 12 -9.414 -0.634 1.285 1.00 0.00 C ATOM 198 O GLU A 12 -8.807 -1.472 1.958 1.00 0.00 O ATOM 199 CB GLU A 12 -11.797 -0.180 1.761 1.00 0.00 C ATOM 200 CG GLU A 12 -13.182 0.043 1.193 1.00 0.00 C ATOM 201 CD GLU A 12 -14.113 0.682 2.200 1.00 0.00 C ATOM 202 OE1 GLU A 12 -13.969 1.896 2.468 1.00 0.00 O1- ATOM 203 OE2 GLU A 12 -14.987 -0.027 2.738 1.00 0.00 O ATOM 204 H GLU A 12 -11.891 -2.653 1.247 1.00 0.00 H ATOM 205 HA GLU A 12 -10.950 -0.439 -0.178 1.00 0.00 H ATOM 206 HB2 GLU A 12 -11.892 -0.781 2.651 1.00 0.00 H ATOM 207 HB3 GLU A 12 -11.384 0.779 2.029 1.00 0.00 H ATOM 208 HG2 GLU A 12 -13.101 0.691 0.333 1.00 0.00 H ATOM 209 HG3 GLU A 12 -13.595 -0.908 0.893 1.00 0.00 H ATOM 210 N PHE A 13 -8.897 0.530 0.931 1.00 0.00 N ATOM 211 CA PHE A 13 -7.575 0.951 1.369 1.00 0.00 C ATOM 212 C PHE A 13 -7.639 1.582 2.753 1.00 0.00 C ATOM 213 O PHE A 13 -8.677 2.095 3.171 1.00 0.00 O ATOM 214 CB PHE A 13 -6.968 1.944 0.373 1.00 0.00 C ATOM 215 CG PHE A 13 -7.389 3.384 0.567 1.00 0.00 C ATOM 216 CD1 PHE A 13 -8.556 3.875 -0.005 1.00 0.00 C ATOM 217 CD2 PHE A 13 -6.604 4.250 1.313 1.00 0.00 C ATOM 218 CE1 PHE A 13 -8.926 5.193 0.162 1.00 0.00 C ATOM 219 CE2 PHE A 13 -6.971 5.569 1.485 1.00 0.00 C ATOM 220 CZ PHE A 13 -8.132 6.042 0.906 1.00 0.00 C ATOM 221 H PHE A 13 -9.420 1.118 0.346 1.00 0.00 H ATOM 222 HA PHE A 13 -6.949 0.074 1.413 1.00 0.00 H ATOM 223 HB2 PHE A 13 -5.896 1.905 0.439 1.00 0.00 H ATOM 224 HB3 PHE A 13 -7.261 1.646 -0.619 1.00 0.00 H ATOM 225 HD1 PHE A 13 -9.178 3.210 -0.604 1.00 0.00 H ATOM 226 HD2 PHE A 13 -5.697 3.879 1.770 1.00 0.00 H ATOM 227 HE1 PHE A 13 -9.836 5.559 -0.294 1.00 0.00 H ATOM 228 HE2 PHE A 13 -6.346 6.233 2.063 1.00 0.00 H ATOM 229 HZ PHE A 13 -8.419 7.074 1.038 1.00 0.00 H ATOM 230 N LYS A 14 -6.521 1.537 3.449 1.00 0.00 N ATOM 231 CA LYS A 14 -6.392 2.155 4.757 1.00 0.00 C ATOM 232 C LYS A 14 -5.031 2.836 4.867 1.00 0.00 C ATOM 233 O LYS A 14 -4.775 3.612 5.788 1.00 0.00 O ATOM 234 CB LYS A 14 -6.567 1.088 5.842 1.00 0.00 C ATOM 235 CG LYS A 14 -6.521 1.612 7.268 1.00 0.00 C ATOM 236 CD LYS A 14 -6.843 0.510 8.265 1.00 0.00 C ATOM 237 CE LYS A 14 -6.762 0.997 9.702 1.00 0.00 C ATOM 238 NZ LYS A 14 -5.363 1.285 10.120 1.00 0.00 N1+ ATOM 239 H LYS A 14 -5.748 1.060 3.073 1.00 0.00 H ATOM 240 HA LYS A 14 -7.167 2.897 4.856 1.00 0.00 H ATOM 241 HB2 LYS A 14 -7.521 0.604 5.695 1.00 0.00 H ATOM 242 HB3 LYS A 14 -5.785 0.353 5.727 1.00 0.00 H ATOM 243 HG2 LYS A 14 -5.531 1.992 7.472 1.00 0.00 H ATOM 244 HG3 LYS A 14 -7.245 2.407 7.376 1.00 0.00 H ATOM 245 HD2 LYS A 14 -7.843 0.151 8.075 1.00 0.00 H ATOM 246 HD3 LYS A 14 -6.139 -0.299 8.129 1.00 0.00 H ATOM 247 HE2 LYS A 14 -7.346 1.899 9.796 1.00 0.00 H ATOM 248 HE3 LYS A 14 -7.172 0.237 10.350 1.00 0.00 H ATOM 249 HZ1 LYS A 14 -4.953 2.030 9.524 1.00 0.00 H ATOM 250 HZ2 LYS A 14 -4.781 0.427 10.038 1.00 0.00 H ATOM 251 HZ3 LYS A 14 -5.344 1.603 11.111 1.00 0.00 H ATOM 252 N TYR A 15 -4.162 2.538 3.912 1.00 0.00 N ATOM 253 CA TYR A 15 -2.820 3.093 3.886 1.00 0.00 C ATOM 254 C TYR A 15 -2.496 3.620 2.505 1.00 0.00 C ATOM 255 O TYR A 15 -3.246 3.402 1.551 1.00 0.00 O ATOM 256 CB TYR A 15 -1.781 2.034 4.262 1.00 0.00 C ATOM 257 CG TYR A 15 -1.915 1.506 5.664 1.00 0.00 C ATOM 258 CD1 TYR A 15 -2.925 0.619 5.992 1.00 0.00 C ATOM 259 CD2 TYR A 15 -1.030 1.894 6.656 1.00 0.00 C ATOM 260 CE1 TYR A 15 -3.055 0.130 7.277 1.00 0.00 C ATOM 261 CE2 TYR A 15 -1.149 1.412 7.943 1.00 0.00 C ATOM 262 CZ TYR A 15 -2.163 0.531 8.249 1.00 0.00 C ATOM 263 OH TYR A 15 -2.290 0.053 9.533 1.00 0.00 O ATOM 264 H TYR A 15 -4.432 1.928 3.196 1.00 0.00 H ATOM 265 HA TYR A 15 -2.775 3.906 4.596 1.00 0.00 H ATOM 266 HB2 TYR A 15 -1.875 1.197 3.586 1.00 0.00 H ATOM 267 HB3 TYR A 15 -0.794 2.460 4.160 1.00 0.00 H ATOM 268 HD1 TYR A 15 -3.623 0.315 5.220 1.00 0.00 H ATOM 269 HD2 TYR A 15 -0.237 2.586 6.406 1.00 0.00 H ATOM 270 HE1 TYR A 15 -3.847 -0.562 7.516 1.00 0.00 H ATOM 271 HE2 TYR A 15 -0.447 1.722 8.704 1.00 0.00 H ATOM 272 HH TYR A 15 -2.165 0.779 10.159 1.00 0.00 H ATOM 273 N LYS A 16 -1.365 4.287 2.402 1.00 0.00 N ATOM 274 CA LYS A 16 -0.891 4.811 1.138 1.00 0.00 C ATOM 275 C LYS A 16 0.621 4.962 1.204 1.00 0.00 C ATOM 276 O LYS A 16 1.125 5.885 1.844 1.00 0.00 O ATOM 277 CB LYS A 16 -1.561 6.159 0.845 1.00 0.00 C ATOM 278 CG LYS A 16 -1.235 6.738 -0.524 1.00 0.00 C ATOM 279 CD LYS A 16 -2.010 8.022 -0.779 1.00 0.00 C ATOM 280 CE LYS A 16 -1.736 9.060 0.298 1.00 0.00 C ATOM 281 NZ LYS A 16 -2.369 10.369 -0.012 1.00 0.00 N1+ ATOM 282 H LYS A 16 -0.827 4.438 3.210 1.00 0.00 H ATOM 283 HA LYS A 16 -1.146 4.107 0.360 1.00 0.00 H ATOM 284 HB2 LYS A 16 -2.632 6.033 0.912 1.00 0.00 H ATOM 285 HB3 LYS A 16 -1.246 6.869 1.596 1.00 0.00 H ATOM 286 HG2 LYS A 16 -0.178 6.954 -0.576 1.00 0.00 H ATOM 287 HG3 LYS A 16 -1.495 6.015 -1.283 1.00 0.00 H ATOM 288 HD2 LYS A 16 -1.717 8.426 -1.736 1.00 0.00 H ATOM 289 HD3 LYS A 16 -3.067 7.798 -0.788 1.00 0.00 H ATOM 290 HE2 LYS A 16 -2.130 8.695 1.234 1.00 0.00 H ATOM 291 HE3 LYS A 16 -0.669 9.195 0.386 1.00 0.00 H ATOM 292 HZ1 LYS A 16 -2.016 10.729 -0.923 1.00 0.00 H ATOM 293 HZ2 LYS A 16 -2.143 11.059 0.730 1.00 0.00 H ATOM 294 HZ3 LYS A 16 -3.400 10.264 -0.070 1.00 0.00 H ATOM 295 N CYS A 17 1.337 4.023 0.584 1.00 0.00 N ATOM 296 CA CYS A 17 2.799 4.044 0.583 1.00 0.00 C ATOM 297 C CYS A 17 3.332 5.421 0.201 1.00 0.00 C ATOM 298 O CYS A 17 2.957 5.971 -0.827 1.00 0.00 O ATOM 299 CB CYS A 17 3.369 2.996 -0.383 1.00 0.00 C ATOM 300 SG CYS A 17 5.179 3.036 -0.475 1.00 0.00 S ATOM 301 H CYS A 17 0.867 3.298 0.122 1.00 0.00 H ATOM 302 HA CYS A 17 3.129 3.810 1.584 1.00 0.00 H ATOM 303 HB2 CYS A 17 3.073 2.013 -0.055 1.00 0.00 H ATOM 304 HB3 CYS A 17 2.981 3.178 -1.374 1.00 0.00 H ATOM 305 N PRO A 18 4.218 5.989 1.028 1.00 0.00 N ATOM 306 CA PRO A 18 4.825 7.297 0.759 1.00 0.00 C ATOM 307 C PRO A 18 5.708 7.279 -0.486 1.00 0.00 C ATOM 308 O PRO A 18 6.061 8.323 -1.029 1.00 0.00 O ATOM 309 CB PRO A 18 5.671 7.566 2.007 1.00 0.00 C ATOM 310 CG PRO A 18 5.901 6.230 2.621 1.00 0.00 C ATOM 311 CD PRO A 18 4.686 5.412 2.299 1.00 0.00 C ATOM 312 HA PRO A 18 4.074 8.067 0.655 1.00 0.00 H ATOM 313 HB2 PRO A 18 6.603 8.028 1.717 1.00 0.00 H ATOM 314 HB3 PRO A 18 5.134 8.220 2.675 1.00 0.00 H ATOM 315 HG2 PRO A 18 6.782 5.778 2.192 1.00 0.00 H ATOM 316 HG3 PRO A 18 6.011 6.332 3.690 1.00 0.00 H ATOM 317 HD2 PRO A 18 4.954 4.372 2.176 1.00 0.00 H ATOM 318 HD3 PRO A 18 3.940 5.523 3.071 1.00 0.00 H ATOM 319 N ARG A 19 6.064 6.081 -0.932 1.00 0.00 N ATOM 320 CA ARG A 19 6.915 5.921 -2.102 1.00 0.00 C ATOM 321 C ARG A 19 6.103 5.533 -3.335 1.00 0.00 C ATOM 322 O ARG A 19 6.260 6.120 -4.405 1.00 0.00 O ATOM 323 CB ARG A 19 7.991 4.870 -1.831 1.00 0.00 C ATOM 324 CG ARG A 19 9.038 5.321 -0.821 1.00 0.00 C ATOM 325 CD ARG A 19 10.126 4.277 -0.626 1.00 0.00 C ATOM 326 NE ARG A 19 10.813 3.937 -1.871 1.00 0.00 N ATOM 327 CZ ARG A 19 11.998 3.328 -1.925 1.00 0.00 C ATOM 328 NH1 ARG A 19 12.627 2.976 -0.807 1.00 0.00 N1+ ATOM 329 NH2 ARG A 19 12.548 3.064 -3.099 1.00 0.00 N ATOM 330 H ARG A 19 5.747 5.284 -0.455 1.00 0.00 H ATOM 331 HA ARG A 19 7.395 6.869 -2.289 1.00 0.00 H ATOM 332 HB2 ARG A 19 7.515 3.979 -1.447 1.00 0.00 H ATOM 333 HB3 ARG A 19 8.485 4.631 -2.760 1.00 0.00 H ATOM 334 HG2 ARG A 19 9.492 6.237 -1.169 1.00 0.00 H ATOM 335 HG3 ARG A 19 8.550 5.499 0.131 1.00 0.00 H ATOM 336 HD2 ARG A 19 10.850 4.660 0.076 1.00 0.00 H ATOM 337 HD3 ARG A 19 9.675 3.383 -0.221 1.00 0.00 H ATOM 338 HE ARG A 19 10.364 4.174 -2.716 1.00 0.00 H ATOM 339 HH11 ARG A 19 12.210 3.162 0.090 1.00 0.00 H ATOM 340 HH12 ARG A 19 13.520 2.522 -0.852 1.00 0.00 H ATOM 341 HH21 ARG A 19 12.072 3.318 -3.947 1.00 0.00 H ATOM 342 HH22 ARG A 19 13.439 2.609 -3.150 1.00 0.00 H ATOM 343 N CYS A 20 5.226 4.549 -3.181 1.00 0.00 N ATOM 344 CA CYS A 20 4.459 4.034 -4.314 1.00 0.00 C ATOM 345 C CYS A 20 3.152 4.793 -4.493 1.00 0.00 C ATOM 346 O CYS A 20 2.543 4.771 -5.563 1.00 0.00 O ATOM 347 CB CYS A 20 4.133 2.551 -4.129 1.00 0.00 C ATOM 348 SG CYS A 20 5.557 1.470 -3.904 1.00 0.00 S ATOM 349 H CYS A 20 5.087 4.166 -2.291 1.00 0.00 H ATOM 350 HA CYS A 20 5.057 4.159 -5.198 1.00 0.00 H ATOM 351 HB2 CYS A 20 3.503 2.437 -3.262 1.00 0.00 H ATOM 352 HB3 CYS A 20 3.598 2.207 -4.997 1.00 0.00 H ATOM 353 N LEU A 21 2.729 5.445 -3.416 1.00 0.00 N ATOM 354 CA LEU A 21 1.425 6.098 -3.335 1.00 0.00 C ATOM 355 C LEU A 21 0.307 5.077 -3.505 1.00 0.00 C ATOM 356 O LEU A 21 -0.836 5.430 -3.794 1.00 0.00 O ATOM 357 CB LEU A 21 1.287 7.223 -4.369 1.00 0.00 C ATOM 358 CG LEU A 21 2.414 8.259 -4.378 1.00 0.00 C ATOM 359 CD1 LEU A 21 1.956 9.527 -5.073 1.00 0.00 C ATOM 360 CD2 LEU A 21 2.895 8.567 -2.967 1.00 0.00 C ATOM 361 H LEU A 21 3.326 5.507 -2.640 1.00 0.00 H ATOM 362 HA LEU A 21 1.343 6.526 -2.347 1.00 0.00 H ATOM 363 HB2 LEU A 21 1.234 6.773 -5.348 1.00 0.00 H ATOM 364 HB3 LEU A 21 0.357 7.740 -4.181 1.00 0.00 H ATOM 365 HG LEU A 21 3.250 7.862 -4.936 1.00 0.00 H ATOM 366 HD11 LEU A 21 1.111 9.939 -4.542 1.00 0.00 H ATOM 367 HD12 LEU A 21 1.668 9.297 -6.088 1.00 0.00 H ATOM 368 HD13 LEU A 21 2.762 10.245 -5.080 1.00 0.00 H ATOM 369 HD21 LEU A 21 3.638 9.349 -3.003 1.00 0.00 H ATOM 370 HD22 LEU A 21 3.333 7.675 -2.539 1.00 0.00 H ATOM 371 HD23 LEU A 21 2.060 8.886 -2.361 1.00 0.00 H ATOM 372 N VAL A 22 0.646 3.807 -3.301 1.00 0.00 N ATOM 373 CA VAL A 22 -0.305 2.731 -3.472 1.00 0.00 C ATOM 374 C VAL A 22 -1.200 2.620 -2.247 1.00 0.00 C ATOM 375 O VAL A 22 -0.730 2.501 -1.109 1.00 0.00 O ATOM 376 CB VAL A 22 0.388 1.372 -3.772 1.00 0.00 C ATOM 377 CG1 VAL A 22 1.253 0.904 -2.610 1.00 0.00 C ATOM 378 CG2 VAL A 22 -0.643 0.311 -4.131 1.00 0.00 C ATOM 379 H VAL A 22 1.553 3.599 -3.025 1.00 0.00 H ATOM 380 HA VAL A 22 -0.923 2.983 -4.321 1.00 0.00 H ATOM 381 HB VAL A 22 1.031 1.509 -4.627 1.00 0.00 H ATOM 382 HG11 VAL A 22 1.962 1.673 -2.354 1.00 0.00 H ATOM 383 HG12 VAL A 22 1.784 0.005 -2.893 1.00 0.00 H ATOM 384 HG13 VAL A 22 0.625 0.695 -1.757 1.00 0.00 H ATOM 385 HG21 VAL A 22 -1.331 0.184 -3.308 1.00 0.00 H ATOM 386 HG22 VAL A 22 -0.142 -0.626 -4.328 1.00 0.00 H ATOM 387 HG23 VAL A 22 -1.187 0.621 -5.011 1.00 0.00 H ATOM 388 N GLN A 23 -2.486 2.711 -2.500 1.00 0.00 N ATOM 389 CA GLN A 23 -3.497 2.598 -1.464 1.00 0.00 C ATOM 390 C GLN A 23 -3.626 1.143 -1.029 1.00 0.00 C ATOM 391 O GLN A 23 -4.225 0.319 -1.724 1.00 0.00 O ATOM 392 CB GLN A 23 -4.830 3.134 -1.995 1.00 0.00 C ATOM 393 CG GLN A 23 -4.753 4.578 -2.468 1.00 0.00 C ATOM 394 CD GLN A 23 -6.000 5.023 -3.210 1.00 0.00 C ATOM 395 OE1 GLN A 23 -6.094 4.880 -4.428 1.00 0.00 O ATOM 396 NE2 GLN A 23 -6.958 5.586 -2.491 1.00 0.00 N ATOM 397 H GLN A 23 -2.770 2.861 -3.427 1.00 0.00 H ATOM 398 HA GLN A 23 -3.183 3.189 -0.609 1.00 0.00 H ATOM 399 HB2 GLN A 23 -5.148 2.521 -2.825 1.00 0.00 H ATOM 400 HB3 GLN A 23 -5.569 3.075 -1.210 1.00 0.00 H ATOM 401 HG2 GLN A 23 -4.614 5.217 -1.609 1.00 0.00 H ATOM 402 HG3 GLN A 23 -3.904 4.678 -3.130 1.00 0.00 H ATOM 403 HE21 GLN A 23 -6.815 5.690 -1.527 1.00 0.00 H ATOM 404 HE22 GLN A 23 -7.778 5.872 -2.953 1.00 0.00 H ATOM 405 N THR A 24 -3.041 0.832 0.112 1.00 0.00 N ATOM 406 CA THR A 24 -3.018 -0.525 0.619 1.00 0.00 C ATOM 407 C THR A 24 -4.076 -0.716 1.693 1.00 0.00 C ATOM 408 O THR A 24 -4.420 0.216 2.416 1.00 0.00 O ATOM 409 CB THR A 24 -1.629 -0.875 1.178 1.00 0.00 C ATOM 410 OG1 THR A 24 -1.055 0.263 1.830 1.00 0.00 O ATOM 411 CG2 THR A 24 -0.710 -1.348 0.068 1.00 0.00 C ATOM 412 H THR A 24 -2.628 1.547 0.644 1.00 0.00 H ATOM 413 HA THR A 24 -3.231 -1.192 -0.205 1.00 0.00 H ATOM 414 HB THR A 24 -1.738 -1.674 1.897 1.00 0.00 H ATOM 415 HG1 THR A 24 -0.698 0.865 1.168 1.00 0.00 H ATOM 416 HG21 THR A 24 0.265 -1.569 0.478 1.00 0.00 H ATOM 417 HG22 THR A 24 -0.620 -0.576 -0.681 1.00 0.00 H ATOM 418 HG23 THR A 24 -1.122 -2.240 -0.379 1.00 0.00 H ATOM 419 N CYS A 25 -4.601 -1.932 1.773 1.00 0.00 N ATOM 420 CA CYS A 25 -5.692 -2.242 2.687 1.00 0.00 C ATOM 421 C CYS A 25 -5.186 -2.366 4.116 1.00 0.00 C ATOM 422 O CYS A 25 -5.907 -2.057 5.064 1.00 0.00 O ATOM 423 CB CYS A 25 -6.394 -3.535 2.258 1.00 0.00 C ATOM 424 SG CYS A 25 -5.375 -5.017 2.401 1.00 0.00 S ATOM 425 H CYS A 25 -4.250 -2.636 1.197 1.00 0.00 H ATOM 426 HA CYS A 25 -6.401 -1.429 2.643 1.00 0.00 H ATOM 427 HB2 CYS A 25 -7.273 -3.685 2.864 1.00 0.00 H ATOM 428 HB3 CYS A 25 -6.692 -3.444 1.227 1.00 0.00 H ATOM 429 N SER A 26 -3.944 -2.818 4.265 1.00 0.00 N ATOM 430 CA SER A 26 -3.346 -3.011 5.579 1.00 0.00 C ATOM 431 C SER A 26 -1.829 -3.075 5.457 1.00 0.00 C ATOM 432 O SER A 26 -1.311 -3.159 4.339 1.00 0.00 O ATOM 433 CB SER A 26 -3.877 -4.292 6.244 1.00 0.00 C ATOM 434 OG SER A 26 -5.277 -4.216 6.470 1.00 0.00 O ATOM 435 H SER A 26 -3.406 -3.015 3.464 1.00 0.00 H ATOM 436 HA SER A 26 -3.610 -2.161 6.189 1.00 0.00 H ATOM 437 HB2 SER A 26 -3.675 -5.137 5.604 1.00 0.00 H ATOM 438 HB3 SER A 26 -3.379 -4.433 7.191 1.00 0.00 H ATOM 439 HG SER A 26 -5.609 -3.371 6.128 1.00 0.00 H ATOM 440 N LEU A 27 -1.129 -3.055 6.588 1.00 0.00 N ATOM 441 CA LEU A 27 0.335 -3.091 6.591 1.00 0.00 C ATOM 442 C LEU A 27 0.860 -4.322 5.854 1.00 0.00 C ATOM 443 O LEU A 27 1.934 -4.285 5.253 1.00 0.00 O ATOM 444 CB LEU A 27 0.869 -3.071 8.025 1.00 0.00 C ATOM 445 CG LEU A 27 0.723 -1.737 8.760 1.00 0.00 C ATOM 446 CD1 LEU A 27 1.112 -1.893 10.222 1.00 0.00 C ATOM 447 CD2 LEU A 27 1.579 -0.667 8.096 1.00 0.00 C ATOM 448 H LEU A 27 -1.607 -3.016 7.447 1.00 0.00 H ATOM 449 HA LEU A 27 0.682 -2.208 6.078 1.00 0.00 H ATOM 450 HB2 LEU A 27 0.349 -3.829 8.592 1.00 0.00 H ATOM 451 HB3 LEU A 27 1.917 -3.324 7.997 1.00 0.00 H ATOM 452 HG LEU A 27 -0.308 -1.418 8.719 1.00 0.00 H ATOM 453 HD11 LEU A 27 0.467 -2.621 10.690 1.00 0.00 H ATOM 454 HD12 LEU A 27 1.008 -0.942 10.724 1.00 0.00 H ATOM 455 HD13 LEU A 27 2.139 -2.225 10.288 1.00 0.00 H ATOM 456 HD21 LEU A 27 1.244 -0.515 7.082 1.00 0.00 H ATOM 457 HD22 LEU A 27 2.612 -0.984 8.091 1.00 0.00 H ATOM 458 HD23 LEU A 27 1.489 0.258 8.647 1.00 0.00 H ATOM 459 N GLU A 28 0.082 -5.400 5.897 1.00 0.00 N ATOM 460 CA GLU A 28 0.404 -6.634 5.183 1.00 0.00 C ATOM 461 C GLU A 28 0.712 -6.348 3.715 1.00 0.00 C ATOM 462 O GLU A 28 1.676 -6.865 3.155 1.00 0.00 O ATOM 463 CB GLU A 28 -0.774 -7.605 5.281 1.00 0.00 C ATOM 464 CG GLU A 28 -0.479 -8.992 4.739 1.00 0.00 C ATOM 465 CD GLU A 28 0.536 -9.734 5.579 1.00 0.00 C ATOM 466 OE1 GLU A 28 0.170 -10.204 6.676 1.00 0.00 O1- ATOM 467 OE2 GLU A 28 1.701 -9.847 5.150 1.00 0.00 O ATOM 468 H GLU A 28 -0.731 -5.370 6.447 1.00 0.00 H ATOM 469 HA GLU A 28 1.269 -7.075 5.647 1.00 0.00 H ATOM 470 HB2 GLU A 28 -1.057 -7.703 6.316 1.00 0.00 H ATOM 471 HB3 GLU A 28 -1.607 -7.196 4.726 1.00 0.00 H ATOM 472 HG2 GLU A 28 -1.397 -9.561 4.723 1.00 0.00 H ATOM 473 HG3 GLU A 28 -0.095 -8.899 3.734 1.00 0.00 H ATOM 474 N CYS A 29 -0.102 -5.503 3.107 1.00 0.00 N ATOM 475 CA CYS A 29 0.066 -5.151 1.712 1.00 0.00 C ATOM 476 C CYS A 29 1.043 -3.995 1.551 1.00 0.00 C ATOM 477 O CYS A 29 1.674 -3.848 0.505 1.00 0.00 O ATOM 478 CB CYS A 29 -1.281 -4.796 1.106 1.00 0.00 C ATOM 479 SG CYS A 29 -2.274 -6.221 0.620 1.00 0.00 S ATOM 480 H CYS A 29 -0.831 -5.093 3.617 1.00 0.00 H ATOM 481 HA CYS A 29 0.461 -6.014 1.201 1.00 0.00 H ATOM 482 HB2 CYS A 29 -1.852 -4.236 1.832 1.00 0.00 H ATOM 483 HB3 CYS A 29 -1.130 -4.184 0.235 1.00 0.00 H ATOM 484 N SER A 30 1.167 -3.179 2.590 1.00 0.00 N ATOM 485 CA SER A 30 2.090 -2.059 2.567 1.00 0.00 C ATOM 486 C SER A 30 3.525 -2.567 2.481 1.00 0.00 C ATOM 487 O SER A 30 4.376 -1.948 1.849 1.00 0.00 O ATOM 488 CB SER A 30 1.903 -1.197 3.819 1.00 0.00 C ATOM 489 OG SER A 30 0.534 -0.876 4.017 1.00 0.00 O ATOM 490 H SER A 30 0.626 -3.334 3.394 1.00 0.00 H ATOM 491 HA SER A 30 1.877 -1.465 1.692 1.00 0.00 H ATOM 492 HB2 SER A 30 2.262 -1.739 4.681 1.00 0.00 H ATOM 493 HB3 SER A 30 2.464 -0.281 3.709 1.00 0.00 H ATOM 494 HG SER A 30 0.187 -0.437 3.231 1.00 0.00 H ATOM 495 N LYS A 31 3.776 -3.713 3.105 1.00 0.00 N ATOM 496 CA LYS A 31 5.101 -4.310 3.104 1.00 0.00 C ATOM 497 C LYS A 31 5.228 -5.369 2.012 1.00 0.00 C ATOM 498 O LYS A 31 6.328 -5.824 1.699 1.00 0.00 O ATOM 499 CB LYS A 31 5.401 -4.923 4.475 1.00 0.00 C ATOM 500 CG LYS A 31 4.503 -6.093 4.842 1.00 0.00 C ATOM 501 CD LYS A 31 4.795 -6.603 6.243 1.00 0.00 C ATOM 502 CE LYS A 31 3.892 -7.766 6.614 1.00 0.00 C ATOM 503 NZ LYS A 31 4.168 -8.269 7.984 1.00 0.00 N1+ ATOM 504 H LYS A 31 3.050 -4.160 3.593 1.00 0.00 H ATOM 505 HA LYS A 31 5.814 -3.526 2.909 1.00 0.00 H ATOM 506 HB2 LYS A 31 6.423 -5.267 4.484 1.00 0.00 H ATOM 507 HB3 LYS A 31 5.281 -4.159 5.228 1.00 0.00 H ATOM 508 HG2 LYS A 31 3.472 -5.773 4.795 1.00 0.00 H ATOM 509 HG3 LYS A 31 4.666 -6.895 4.137 1.00 0.00 H ATOM 510 HD2 LYS A 31 5.823 -6.929 6.290 1.00 0.00 H ATOM 511 HD3 LYS A 31 4.637 -5.800 6.946 1.00 0.00 H ATOM 512 HE2 LYS A 31 2.866 -7.438 6.566 1.00 0.00 H ATOM 513 HE3 LYS A 31 4.047 -8.567 5.908 1.00 0.00 H ATOM 514 HZ1 LYS A 31 5.134 -8.652 8.036 1.00 0.00 H ATOM 515 HZ2 LYS A 31 3.496 -9.020 8.233 1.00 0.00 H ATOM 516 HZ3 LYS A 31 4.077 -7.498 8.676 1.00 0.00 H ATOM 517 N LYS A 32 4.099 -5.730 1.417 1.00 0.00 N ATOM 518 CA LYS A 32 4.057 -6.781 0.405 1.00 0.00 C ATOM 519 C LYS A 32 4.895 -6.398 -0.810 1.00 0.00 C ATOM 520 O LYS A 32 5.675 -7.202 -1.319 1.00 0.00 O ATOM 521 CB LYS A 32 2.613 -7.038 -0.030 1.00 0.00 C ATOM 522 CG LYS A 32 2.444 -8.280 -0.889 1.00 0.00 C ATOM 523 CD LYS A 32 2.489 -9.542 -0.046 1.00 0.00 C ATOM 524 CE LYS A 32 2.449 -10.794 -0.906 1.00 0.00 C ATOM 525 NZ LYS A 32 3.690 -10.958 -1.710 1.00 0.00 N1+ ATOM 526 H LYS A 32 3.267 -5.279 1.665 1.00 0.00 H ATOM 527 HA LYS A 32 4.462 -7.682 0.841 1.00 0.00 H ATOM 528 HB2 LYS A 32 2.002 -7.153 0.851 1.00 0.00 H ATOM 529 HB3 LYS A 32 2.261 -6.186 -0.594 1.00 0.00 H ATOM 530 HG2 LYS A 32 1.492 -8.230 -1.396 1.00 0.00 H ATOM 531 HG3 LYS A 32 3.241 -8.315 -1.617 1.00 0.00 H ATOM 532 HD2 LYS A 32 3.400 -9.544 0.532 1.00 0.00 H ATOM 533 HD3 LYS A 32 1.638 -9.547 0.620 1.00 0.00 H ATOM 534 HE2 LYS A 32 2.332 -11.654 -0.263 1.00 0.00 H ATOM 535 HE3 LYS A 32 1.603 -10.730 -1.575 1.00 0.00 H ATOM 536 HZ1 LYS A 32 3.636 -11.825 -2.279 1.00 0.00 H ATOM 537 HZ2 LYS A 32 4.518 -11.022 -1.083 1.00 0.00 H ATOM 538 HZ3 LYS A 32 3.815 -10.145 -2.348 1.00 0.00 H ATOM 539 N HIS A 33 4.743 -5.159 -1.260 1.00 0.00 N ATOM 540 CA HIS A 33 5.452 -4.697 -2.448 1.00 0.00 C ATOM 541 C HIS A 33 6.916 -4.388 -2.129 1.00 0.00 C ATOM 542 O HIS A 33 7.738 -4.227 -3.029 1.00 0.00 O ATOM 543 CB HIS A 33 4.758 -3.461 -3.057 1.00 0.00 C ATOM 544 CG HIS A 33 4.793 -2.227 -2.194 1.00 0.00 C ATOM 545 ND1 HIS A 33 3.686 -1.501 -1.832 1.00 0.00 N ATOM 546 CD2 HIS A 33 5.847 -1.595 -1.633 1.00 0.00 C ATOM 547 CE1 HIS A 33 4.102 -0.466 -1.081 1.00 0.00 C ATOM 548 NE2 HIS A 33 5.417 -0.476 -0.938 1.00 0.00 N ATOM 549 H HIS A 33 4.141 -4.545 -0.789 1.00 0.00 H ATOM 550 HA HIS A 33 5.424 -5.498 -3.172 1.00 0.00 H ATOM 551 HB2 HIS A 33 5.239 -3.218 -3.993 1.00 0.00 H ATOM 552 HB3 HIS A 33 3.721 -3.702 -3.248 1.00 0.00 H ATOM 553 HD1 HIS A 33 2.754 -1.705 -2.077 1.00 0.00 H ATOM 554 HD2 HIS A 33 6.872 -1.902 -1.715 1.00 0.00 H ATOM 555 HE1 HIS A 33 3.446 0.255 -0.622 1.00 0.00 H ATOM 556 N LYS A 34 7.246 -4.327 -0.845 1.00 0.00 N ATOM 557 CA LYS A 34 8.579 -3.922 -0.427 1.00 0.00 C ATOM 558 C LYS A 34 9.577 -5.039 -0.675 1.00 0.00 C ATOM 559 O LYS A 34 10.718 -4.792 -1.058 1.00 0.00 O ATOM 560 CB LYS A 34 8.586 -3.528 1.052 1.00 0.00 C ATOM 561 CG LYS A 34 7.711 -2.327 1.370 1.00 0.00 C ATOM 562 CD LYS A 34 7.784 -1.961 2.843 1.00 0.00 C ATOM 563 CE LYS A 34 6.853 -0.806 3.180 1.00 0.00 C ATOM 564 NZ LYS A 34 6.766 -0.569 4.645 1.00 0.00 N1+ ATOM 565 H LYS A 34 6.586 -4.584 -0.164 1.00 0.00 H ATOM 566 HA LYS A 34 8.863 -3.065 -1.019 1.00 0.00 H ATOM 567 HB2 LYS A 34 8.235 -4.366 1.636 1.00 0.00 H ATOM 568 HB3 LYS A 34 9.598 -3.296 1.345 1.00 0.00 H ATOM 569 HG2 LYS A 34 8.044 -1.484 0.782 1.00 0.00 H ATOM 570 HG3 LYS A 34 6.687 -2.562 1.116 1.00 0.00 H ATOM 571 HD2 LYS A 34 7.509 -2.820 3.436 1.00 0.00 H ATOM 572 HD3 LYS A 34 8.798 -1.672 3.078 1.00 0.00 H ATOM 573 HE2 LYS A 34 7.223 0.089 2.701 1.00 0.00 H ATOM 574 HE3 LYS A 34 5.866 -1.031 2.799 1.00 0.00 H ATOM 575 HZ1 LYS A 34 6.139 0.236 4.842 1.00 0.00 H ATOM 576 HZ2 LYS A 34 7.707 -0.361 5.036 1.00 0.00 H ATOM 577 HZ3 LYS A 34 6.386 -1.411 5.125 1.00 0.00 H ATOM 578 N THR A 35 9.124 -6.267 -0.495 1.00 0.00 N ATOM 579 CA THR A 35 9.989 -7.425 -0.626 1.00 0.00 C ATOM 580 C THR A 35 10.230 -7.784 -2.096 1.00 0.00 C ATOM 581 O THR A 35 11.107 -8.588 -2.411 1.00 0.00 O ATOM 582 CB THR A 35 9.385 -8.636 0.120 1.00 0.00 C ATOM 583 OG1 THR A 35 10.355 -9.686 0.239 1.00 0.00 O ATOM 584 CG2 THR A 35 8.150 -9.165 -0.594 1.00 0.00 C ATOM 585 H THR A 35 8.180 -6.400 -0.256 1.00 0.00 H ATOM 586 HA THR A 35 10.936 -7.185 -0.166 1.00 0.00 H ATOM 587 HB THR A 35 9.092 -8.313 1.109 1.00 0.00 H ATOM 588 HG1 THR A 35 11.203 -9.384 -0.120 1.00 0.00 H ATOM 589 HG21 THR A 35 8.416 -9.472 -1.595 1.00 0.00 H ATOM 590 HG22 THR A 35 7.402 -8.386 -0.643 1.00 0.00 H ATOM 591 HG23 THR A 35 7.753 -10.011 -0.052 1.00 0.00 H ATOM 592 N ARG A 36 9.460 -7.176 -2.992 1.00 0.00 N ATOM 593 CA ARG A 36 9.557 -7.495 -4.414 1.00 0.00 C ATOM 594 C ARG A 36 10.061 -6.309 -5.234 1.00 0.00 C ATOM 595 O ARG A 36 10.582 -6.488 -6.336 1.00 0.00 O ATOM 596 CB ARG A 36 8.201 -7.964 -4.949 1.00 0.00 C ATOM 597 CG ARG A 36 7.049 -7.046 -4.580 1.00 0.00 C ATOM 598 CD ARG A 36 5.762 -7.451 -5.276 1.00 0.00 C ATOM 599 NE ARG A 36 5.836 -7.243 -6.722 1.00 0.00 N ATOM 600 CZ ARG A 36 4.810 -7.400 -7.556 1.00 0.00 C ATOM 601 NH1 ARG A 36 3.623 -7.785 -7.096 1.00 0.00 N1+ ATOM 602 NH2 ARG A 36 4.974 -7.170 -8.852 1.00 0.00 N ATOM 603 H ARG A 36 8.812 -6.506 -2.691 1.00 0.00 H ATOM 604 HA ARG A 36 10.265 -8.304 -4.516 1.00 0.00 H ATOM 605 HB2 ARG A 36 8.253 -8.025 -6.026 1.00 0.00 H ATOM 606 HB3 ARG A 36 7.991 -8.946 -4.550 1.00 0.00 H ATOM 607 HG2 ARG A 36 6.898 -7.088 -3.511 1.00 0.00 H ATOM 608 HG3 ARG A 36 7.301 -6.035 -4.868 1.00 0.00 H ATOM 609 HD2 ARG A 36 5.578 -8.496 -5.083 1.00 0.00 H ATOM 610 HD3 ARG A 36 4.950 -6.861 -4.877 1.00 0.00 H ATOM 611 HE ARG A 36 6.705 -6.959 -7.091 1.00 0.00 H ATOM 612 HH11 ARG A 36 3.494 -7.959 -6.116 1.00 0.00 H ATOM 613 HH12 ARG A 36 2.852 -7.908 -7.726 1.00 0.00 H ATOM 614 HH21 ARG A 36 5.870 -6.876 -9.202 1.00 0.00 H ATOM 615 HH22 ARG A 36 4.204 -7.281 -9.489 1.00 0.00 H ATOM 616 N ASP A 37 9.908 -5.103 -4.704 1.00 0.00 N ATOM 617 CA ASP A 37 10.314 -3.904 -5.430 1.00 0.00 C ATOM 618 C ASP A 37 11.336 -3.097 -4.648 1.00 0.00 C ATOM 619 O ASP A 37 11.685 -1.981 -5.036 1.00 0.00 O ATOM 620 CB ASP A 37 9.104 -3.026 -5.759 1.00 0.00 C ATOM 621 CG ASP A 37 8.380 -3.475 -7.010 1.00 0.00 C ATOM 622 OD1 ASP A 37 7.506 -4.363 -6.917 1.00 0.00 O ATOM 623 OD2 ASP A 37 8.679 -2.937 -8.098 1.00 0.00 O1- ATOM 624 H ASP A 37 9.507 -5.013 -3.816 1.00 0.00 H ATOM 625 HA ASP A 37 10.769 -4.223 -6.355 1.00 0.00 H ATOM 626 HB2 ASP A 37 8.409 -3.060 -4.933 1.00 0.00 H ATOM 627 HB3 ASP A 37 9.435 -2.009 -5.901 1.00 0.00 H ATOM 628 N ASN A 38 11.808 -3.672 -3.543 1.00 0.00 N ATOM 629 CA ASN A 38 12.824 -3.045 -2.701 1.00 0.00 C ATOM 630 C ASN A 38 12.356 -1.691 -2.188 1.00 0.00 C ATOM 631 O ASN A 38 13.110 -0.720 -2.186 1.00 0.00 O ATOM 632 CB ASN A 38 14.138 -2.884 -3.471 1.00 0.00 C ATOM 633 CG ASN A 38 14.826 -4.206 -3.749 1.00 0.00 C ATOM 634 OD1 ASN A 38 14.175 -5.239 -3.896 1.00 0.00 O ATOM 635 ND2 ASN A 38 16.148 -4.188 -3.811 1.00 0.00 N ATOM 636 H ASN A 38 11.467 -4.551 -3.289 1.00 0.00 H ATOM 637 HA ASN A 38 12.996 -3.692 -1.854 1.00 0.00 H ATOM 638 HB2 ASN A 38 13.931 -2.407 -4.417 1.00 0.00 H ATOM 639 HB3 ASN A 38 14.805 -2.263 -2.898 1.00 0.00 H ATOM 640 HD21 ASN A 38 16.608 -3.332 -3.673 1.00 0.00 H ATOM 641 HD22 ASN A 38 16.615 -5.032 -3.995 1.00 0.00 H ATOM 642 N CYS A 39 11.109 -1.630 -1.754 1.00 0.00 N ATOM 643 CA CYS A 39 10.529 -0.379 -1.300 1.00 0.00 C ATOM 644 C CYS A 39 10.561 -0.284 0.220 1.00 0.00 C ATOM 645 O CYS A 39 10.854 -1.258 0.917 1.00 0.00 O ATOM 646 CB CYS A 39 9.089 -0.240 -1.808 1.00 0.00 C ATOM 647 SG CYS A 39 8.346 1.376 -1.475 1.00 0.00 S ATOM 648 H CYS A 39 10.571 -2.446 -1.729 1.00 0.00 H ATOM 649 HA CYS A 39 11.121 0.426 -1.703 1.00 0.00 H ATOM 650 HB2 CYS A 39 9.073 -0.396 -2.876 1.00 0.00 H ATOM 651 HB3 CYS A 39 8.477 -0.987 -1.330 1.00 0.00 H ATOM 652 N SER A 40 10.267 0.904 0.712 1.00 0.00 N ATOM 653 CA SER A 40 10.167 1.166 2.124 1.00 0.00 C ATOM 654 C SER A 40 9.099 2.232 2.355 1.00 0.00 C ATOM 655 O SER A 40 8.515 2.747 1.401 1.00 0.00 O ATOM 656 CB SER A 40 11.520 1.633 2.656 1.00 0.00 C ATOM 657 OG SER A 40 12.021 2.725 1.898 1.00 0.00 O ATOM 658 H SER A 40 10.106 1.641 0.092 1.00 0.00 H ATOM 659 HA SER A 40 9.878 0.254 2.618 1.00 0.00 H ATOM 660 HB2 SER A 40 11.409 1.947 3.679 1.00 0.00 H ATOM 661 HB3 SER A 40 12.225 0.819 2.600 1.00 0.00 H ATOM 662 HG SER A 40 12.981 2.774 2.009 1.00 0.00 H ATOM 663 N GLY A 41 8.830 2.551 3.603 1.00 0.00 N ATOM 664 CA GLY A 41 7.896 3.614 3.899 1.00 0.00 C ATOM 665 C GLY A 41 8.536 4.684 4.743 1.00 0.00 C ATOM 666 O GLY A 41 8.024 5.046 5.803 1.00 0.00 O ATOM 667 H GLY A 41 9.264 2.060 4.336 1.00 0.00 H ATOM 668 HA2 GLY A 41 7.559 4.050 2.970 1.00 0.00 H ATOM 669 HA3 GLY A 41 7.050 3.209 4.423 1.00 0.00 H ATOM 670 N GLN A 42 9.667 5.188 4.269 1.00 0.00 N ATOM 671 CA GLN A 42 10.461 6.133 5.029 1.00 0.00 C ATOM 672 C GLN A 42 10.885 7.307 4.158 1.00 0.00 C ATOM 673 O GLN A 42 12.070 7.509 3.901 1.00 0.00 O ATOM 674 CB GLN A 42 11.696 5.436 5.608 1.00 0.00 C ATOM 675 CG GLN A 42 11.364 4.306 6.571 1.00 0.00 C ATOM 676 CD GLN A 42 12.600 3.652 7.149 1.00 0.00 C ATOM 677 OE1 GLN A 42 13.134 2.697 6.585 1.00 0.00 O ATOM 678 NE2 GLN A 42 13.064 4.157 8.278 1.00 0.00 N ATOM 679 H GLN A 42 9.970 4.923 3.377 1.00 0.00 H ATOM 680 HA GLN A 42 9.853 6.503 5.841 1.00 0.00 H ATOM 681 HB2 GLN A 42 12.276 5.026 4.794 1.00 0.00 H ATOM 682 HB3 GLN A 42 12.295 6.163 6.132 1.00 0.00 H ATOM 683 HG2 GLN A 42 10.774 4.704 7.383 1.00 0.00 H ATOM 684 HG3 GLN A 42 10.791 3.557 6.043 1.00 0.00 H ATOM 685 HE21 GLN A 42 12.587 4.923 8.678 1.00 0.00 H ATOM 686 HE22 GLN A 42 13.861 3.750 8.672 1.00 0.00 H ATOM 687 N THR A 43 9.913 8.068 3.685 1.00 0.00 N ATOM 688 CA THR A 43 10.201 9.273 2.925 1.00 0.00 C ATOM 689 C THR A 43 10.439 10.433 3.881 1.00 0.00 C ATOM 690 O THR A 43 11.326 11.266 3.677 1.00 0.00 O ATOM 691 CB THR A 43 9.049 9.620 1.969 1.00 0.00 C ATOM 692 OG1 THR A 43 7.807 9.593 2.683 1.00 0.00 O ATOM 693 CG2 THR A 43 8.999 8.640 0.807 1.00 0.00 C ATOM 694 H THR A 43 8.978 7.823 3.858 1.00 0.00 H ATOM 695 HA THR A 43 11.092 9.097 2.343 1.00 0.00 H ATOM 696 HB THR A 43 9.211 10.613 1.579 1.00 0.00 H ATOM 697 HG1 THR A 43 7.114 9.975 2.133 1.00 0.00 H ATOM 698 HG21 THR A 43 8.839 7.640 1.185 1.00 0.00 H ATOM 699 HG22 THR A 43 9.933 8.674 0.267 1.00 0.00 H ATOM 700 HG23 THR A 43 8.190 8.909 0.144 1.00 0.00 H ATOM 701 N HIS A 44 9.642 10.465 4.938 1.00 0.00 N ATOM 702 CA HIS A 44 9.799 11.447 5.991 1.00 0.00 C ATOM 703 C HIS A 44 10.248 10.740 7.263 1.00 0.00 C ATOM 704 O HIS A 44 9.500 10.639 8.235 1.00 0.00 O ATOM 705 CB HIS A 44 8.485 12.201 6.222 1.00 0.00 C ATOM 706 CG HIS A 44 8.621 13.390 7.125 1.00 0.00 C ATOM 707 ND1 HIS A 44 8.329 13.353 8.471 1.00 0.00 N ATOM 708 CD2 HIS A 44 9.023 14.654 6.865 1.00 0.00 C ATOM 709 CE1 HIS A 44 8.547 14.541 8.999 1.00 0.00 C ATOM 710 NE2 HIS A 44 8.969 15.348 8.046 1.00 0.00 N ATOM 711 H HIS A 44 8.922 9.800 5.010 1.00 0.00 H ATOM 712 HA HIS A 44 10.563 12.144 5.687 1.00 0.00 H ATOM 713 HB2 HIS A 44 8.105 12.549 5.273 1.00 0.00 H ATOM 714 HB3 HIS A 44 7.766 11.527 6.665 1.00 0.00 H ATOM 715 HD1 HIS A 44 8.011 12.566 8.969 1.00 0.00 H ATOM 716 HD2 HIS A 44 9.329 15.046 5.905 1.00 0.00 H ATOM 717 HE1 HIS A 44 8.407 14.807 10.037 1.00 0.00 H ATOM 718 HE2 HIS A 44 9.295 16.266 8.184 1.00 0.00 H ATOM 719 N ASP A 45 11.464 10.223 7.233 1.00 0.00 N ATOM 720 CA ASP A 45 12.010 9.482 8.359 1.00 0.00 C ATOM 721 C ASP A 45 13.128 10.276 9.009 1.00 0.00 C ATOM 722 O ASP A 45 14.196 10.418 8.378 1.00 0.00 O ATOM 723 CB ASP A 45 12.533 8.120 7.905 1.00 0.00 C ATOM 724 CG ASP A 45 13.023 7.273 9.063 1.00 0.00 C ATOM 725 OD1 ASP A 45 14.215 7.366 9.420 1.00 0.00 O ATOM 726 OD2 ASP A 45 12.220 6.500 9.621 1.00 0.00 O1- ATOM 727 OXT ASP A 45 12.925 10.771 10.136 1.00 0.00 O ATOM 728 H ASP A 45 12.020 10.354 6.437 1.00 0.00 H ATOM 729 HA ASP A 45 11.218 9.337 9.078 1.00 0.00 H ATOM 730 HB2 ASP A 45 11.737 7.587 7.407 1.00 0.00 H ATOM 731 HB3 ASP A 45 13.351 8.266 7.216 1.00 0.00 H TER 732 ASP A 45 HETATM 733 ZN ZN A 101 -4.435 -5.501 0.362 1.00 0.00 ZN HETATM 734 ZN ZN A 102 6.062 1.272 -1.672 1.00 0.00 ZN