HETATM 1 C ACE A 1 0.453 -20.531 11.708 1.00 0.00 C HETATM 2 O ACE A 1 1.661 -20.761 11.656 1.00 0.00 O HETATM 3 CH3 ACE A 1 -0.133 -19.668 12.821 1.00 0.00 C HETATM 4 H1 ACE A 1 -0.981 -20.173 13.258 1.00 0.00 H HETATM 5 H2 ACE A 1 -0.448 -18.719 12.414 1.00 0.00 H HETATM 6 H3 ACE A 1 0.618 -19.503 13.581 1.00 0.00 H ATOM 7 N PRO A 2 -0.383 -21.006 10.825 1.00 0.00 N ATOM 8 CA PRO A 2 0.042 -21.867 9.689 1.00 0.00 C ATOM 9 C PRO A 2 1.297 -21.331 9.005 1.00 0.00 C ATOM 10 O PRO A 2 1.647 -20.161 9.155 1.00 0.00 O ATOM 11 CB PRO A 2 -1.155 -21.848 8.725 1.00 0.00 C ATOM 12 CG PRO A 2 -2.206 -20.975 9.348 1.00 0.00 C ATOM 13 CD PRO A 2 -1.826 -20.774 10.813 1.00 0.00 C ATOM 14 HA PRO A 2 0.208 -22.875 10.032 1.00 0.00 H ATOM 15 HB2 PRO A 2 -0.853 -21.440 7.770 1.00 0.00 H ATOM 16 HB3 PRO A 2 -1.541 -22.848 8.595 1.00 0.00 H ATOM 17 HG2 PRO A 2 -2.239 -20.023 8.839 1.00 0.00 H ATOM 18 HG3 PRO A 2 -3.169 -21.460 9.288 1.00 0.00 H ATOM 19 HD2 PRO A 2 -2.055 -19.765 11.128 1.00 0.00 H ATOM 20 HD3 PRO A 2 -2.326 -21.495 11.440 1.00 0.00 H ATOM 21 N PRO A 3 1.971 -22.167 8.263 1.00 0.00 N ATOM 22 CA PRO A 3 3.210 -21.784 7.536 1.00 0.00 C ATOM 23 C PRO A 3 3.066 -20.438 6.831 1.00 0.00 C ATOM 24 O PRO A 3 2.555 -20.362 5.714 1.00 0.00 O ATOM 25 CB PRO A 3 3.423 -22.916 6.518 1.00 0.00 C ATOM 26 CG PRO A 3 2.299 -23.892 6.704 1.00 0.00 C ATOM 27 CD PRO A 3 1.625 -23.569 8.036 1.00 0.00 C ATOM 28 HA PRO A 3 4.044 -21.757 8.217 1.00 0.00 H ATOM 29 HB2 PRO A 3 3.404 -22.516 5.513 1.00 0.00 H ATOM 30 HB3 PRO A 3 4.367 -23.406 6.702 1.00 0.00 H ATOM 31 HG2 PRO A 3 1.588 -23.792 5.896 1.00 0.00 H ATOM 32 HG3 PRO A 3 2.687 -24.898 6.730 1.00 0.00 H ATOM 33 HD2 PRO A 3 0.554 -23.691 7.958 1.00 0.00 H ATOM 34 HD3 PRO A 3 2.026 -24.186 8.826 1.00 0.00 H ATOM 35 N THR A 4 3.524 -19.380 7.492 1.00 0.00 N ATOM 36 CA THR A 4 3.459 -18.042 6.914 1.00 0.00 C ATOM 37 C THR A 4 4.666 -17.212 7.340 1.00 0.00 C ATOM 38 O THR A 4 5.433 -17.615 8.213 1.00 0.00 O ATOM 39 CB THR A 4 2.174 -17.341 7.361 1.00 0.00 C ATOM 40 OG1 THR A 4 2.142 -17.314 8.772 1.00 0.00 O ATOM 41 CG2 THR A 4 0.957 -18.119 6.856 1.00 0.00 C ATOM 42 H THR A 4 3.912 -19.501 8.383 1.00 0.00 H ATOM 43 HA THR A 4 3.453 -18.125 5.838 1.00 0.00 H ATOM 44 HB THR A 4 2.149 -16.338 6.967 1.00 0.00 H ATOM 45 HG21 THR A 4 0.101 -17.461 6.814 1.00 0.00 H ATOM 46 HG22 THR A 4 0.749 -18.938 7.528 1.00 0.00 H ATOM 47 HG23 THR A 4 1.162 -18.507 5.869 1.00 0.00 H ATOM 48 N THR A 5 4.825 -16.050 6.715 1.00 0.00 N ATOM 49 CA THR A 5 5.941 -15.166 7.034 1.00 0.00 C ATOM 50 C THR A 5 5.460 -13.725 7.177 1.00 0.00 C ATOM 51 O THR A 5 4.600 -13.269 6.422 1.00 0.00 O ATOM 52 CB THR A 5 7.010 -15.259 5.941 1.00 0.00 C ATOM 53 OG1 THR A 5 6.470 -14.729 4.749 1.00 0.00 O ATOM 54 CG2 THR A 5 7.381 -16.724 5.703 1.00 0.00 C ATOM 55 H THR A 5 4.181 -15.781 6.028 1.00 0.00 H ATOM 56 HA THR A 5 6.376 -15.482 7.971 1.00 0.00 H ATOM 57 HB THR A 5 7.885 -14.708 6.236 1.00 0.00 H ATOM 58 HG21 THR A 5 7.189 -17.294 6.600 1.00 0.00 H ATOM 59 HG22 THR A 5 8.428 -16.793 5.450 1.00 0.00 H ATOM 60 HG23 THR A 5 6.788 -17.119 4.892 1.00 0.00 H ATOM 61 N THR A 6 6.029 -13.012 8.146 1.00 0.00 N ATOM 62 CA THR A 6 5.662 -11.618 8.382 1.00 0.00 C ATOM 63 C THR A 6 6.740 -10.674 7.860 1.00 0.00 C ATOM 64 O THR A 6 7.889 -11.074 7.669 1.00 0.00 O ATOM 65 CB THR A 6 5.456 -11.381 9.880 1.00 0.00 C ATOM 66 OG1 THR A 6 6.703 -11.501 10.530 1.00 0.00 O ATOM 67 CG2 THR A 6 4.502 -12.434 10.446 1.00 0.00 C ATOM 68 H THR A 6 6.713 -13.430 8.710 1.00 0.00 H ATOM 69 HA THR A 6 4.736 -11.408 7.868 1.00 0.00 H ATOM 70 HB THR A 6 5.044 -10.398 10.041 1.00 0.00 H ATOM 71 HG21 THR A 6 3.747 -12.667 9.710 1.00 0.00 H ATOM 72 HG22 THR A 6 4.029 -12.048 11.337 1.00 0.00 H ATOM 73 HG23 THR A 6 5.056 -13.328 10.690 1.00 0.00 H ATOM 74 N THR A 7 6.363 -9.420 7.632 1.00 0.00 N ATOM 75 CA THR A 7 7.304 -8.424 7.132 1.00 0.00 C ATOM 76 C THR A 7 7.093 -7.087 7.835 1.00 0.00 C ATOM 77 O THR A 7 5.978 -6.755 8.238 1.00 0.00 O ATOM 78 CB THR A 7 7.122 -8.243 5.623 1.00 0.00 C ATOM 79 OG1 THR A 7 5.801 -7.813 5.376 1.00 0.00 O ATOM 80 CG2 THR A 7 7.347 -9.577 4.908 1.00 0.00 C ATOM 81 H THR A 7 5.433 -9.160 7.803 1.00 0.00 H ATOM 82 HA THR A 7 8.311 -8.766 7.323 1.00 0.00 H ATOM 83 HB THR A 7 7.827 -7.515 5.254 1.00 0.00 H ATOM 84 HG21 THR A 7 8.082 -10.155 5.447 1.00 0.00 H ATOM 85 HG22 THR A 7 7.699 -9.392 3.904 1.00 0.00 H ATOM 86 HG23 THR A 7 6.417 -10.124 4.866 1.00 0.00 H ATOM 87 N LYS A 8 8.171 -6.323 7.977 1.00 0.00 N ATOM 88 CA LYS A 8 8.095 -5.023 8.631 1.00 0.00 C ATOM 89 C LYS A 8 7.299 -5.119 9.929 1.00 0.00 C ATOM 90 O LYS A 8 7.331 -6.142 10.613 1.00 0.00 O ATOM 91 CB LYS A 8 7.430 -4.008 7.698 1.00 0.00 C ATOM 92 CG LYS A 8 7.938 -2.602 8.025 1.00 0.00 C ATOM 93 CD LYS A 8 9.220 -2.324 7.237 1.00 0.00 C ATOM 94 CE LYS A 8 8.863 -1.718 5.879 1.00 0.00 C ATOM 95 NZ LYS A 8 10.079 -1.679 5.018 1.00 0.00 N ATOM 96 H LYS A 8 9.033 -6.639 7.633 1.00 0.00 H ATOM 97 HA LYS A 8 9.096 -4.684 8.857 1.00 0.00 H ATOM 98 HB2 LYS A 8 7.674 -4.250 6.673 1.00 0.00 H ATOM 99 HB3 LYS A 8 6.360 -4.042 7.832 1.00 0.00 H ATOM 100 HG2 LYS A 8 7.184 -1.876 7.756 1.00 0.00 H ATOM 101 HG3 LYS A 8 8.145 -2.531 9.082 1.00 0.00 H ATOM 102 HD2 LYS A 8 9.840 -1.633 7.790 1.00 0.00 H ATOM 103 HD3 LYS A 8 9.757 -3.248 7.086 1.00 0.00 H ATOM 104 HE2 LYS A 8 8.104 -2.322 5.404 1.00 0.00 H ATOM 105 HE3 LYS A 8 8.490 -0.715 6.019 1.00 0.00 H ATOM 106 HZ1 LYS A 8 10.657 -2.525 5.195 1.00 0.00 H ATOM 107 HZ2 LYS A 8 10.633 -0.827 5.239 1.00 0.00 H ATOM 108 HZ3 LYS A 8 9.796 -1.659 4.018 1.00 0.00 H ATOM 109 N LYS A 9 6.586 -4.049 10.262 1.00 0.00 N ATOM 110 CA LYS A 9 5.786 -4.024 11.481 1.00 0.00 C ATOM 111 C LYS A 9 6.293 -5.064 12.475 1.00 0.00 C ATOM 112 O LYS A 9 5.567 -5.985 12.852 1.00 0.00 O ATOM 113 CB LYS A 9 4.319 -4.305 11.149 1.00 0.00 C ATOM 114 CG LYS A 9 3.429 -3.765 12.270 1.00 0.00 C ATOM 115 CD LYS A 9 1.967 -4.100 11.967 1.00 0.00 C ATOM 116 CE LYS A 9 1.360 -4.855 13.150 1.00 0.00 C ATOM 117 NZ LYS A 9 1.385 -3.986 14.360 1.00 0.00 N ATOM 118 H LYS A 9 6.596 -3.261 9.677 1.00 0.00 H ATOM 119 HA LYS A 9 5.860 -3.046 11.930 1.00 0.00 H ATOM 120 HB2 LYS A 9 4.063 -3.819 10.218 1.00 0.00 H ATOM 121 HB3 LYS A 9 4.169 -5.369 11.053 1.00 0.00 H ATOM 122 HG2 LYS A 9 3.717 -4.220 13.207 1.00 0.00 H ATOM 123 HG3 LYS A 9 3.545 -2.695 12.338 1.00 0.00 H ATOM 124 HD2 LYS A 9 1.416 -3.185 11.801 1.00 0.00 H ATOM 125 HD3 LYS A 9 1.914 -4.717 11.083 1.00 0.00 H ATOM 126 HE2 LYS A 9 0.339 -5.123 12.921 1.00 0.00 H ATOM 127 HE3 LYS A 9 1.934 -5.750 13.338 1.00 0.00 H ATOM 128 HZ1 LYS A 9 1.802 -3.065 14.118 1.00 0.00 H ATOM 129 HZ2 LYS A 9 1.955 -4.442 15.102 1.00 0.00 H ATOM 130 HZ3 LYS A 9 0.415 -3.843 14.705 1.00 0.00 H ATOM 131 N PRO A 10 7.519 -4.930 12.901 1.00 0.00 N ATOM 132 CA PRO A 10 8.149 -5.867 13.869 1.00 0.00 C ATOM 133 C PRO A 10 7.215 -6.201 15.029 1.00 0.00 C ATOM 134 O PRO A 10 6.767 -7.340 15.159 1.00 0.00 O ATOM 135 CB PRO A 10 9.396 -5.123 14.369 1.00 0.00 C ATOM 136 CG PRO A 10 9.425 -3.795 13.670 1.00 0.00 C ATOM 137 CD PRO A 10 8.441 -3.868 12.505 1.00 0.00 C ATOM 138 HA PRO A 10 8.449 -6.772 13.365 1.00 0.00 H ATOM 139 HB2 PRO A 10 9.334 -4.977 15.439 1.00 0.00 H ATOM 140 HB3 PRO A 10 10.284 -5.684 14.124 1.00 0.00 H ATOM 141 HG2 PRO A 10 9.129 -3.014 14.357 1.00 0.00 H ATOM 142 HG3 PRO A 10 10.416 -3.599 13.295 1.00 0.00 H ATOM 143 HD2 PRO A 10 7.918 -2.927 12.392 1.00 0.00 H ATOM 144 HD3 PRO A 10 8.950 -4.135 11.593 1.00 0.00 H HETATM 145 N NH2 A 11 6.897 -5.270 15.887 1.00 0.00 N HETATM 146 HN1 NH2 A 11 7.566 -4.943 16.526 1.00 0.00 H HETATM 147 HN2 NH2 A 11 5.984 -4.917 15.911 1.00 0.00 H TER 148 NH2 A 11 HETATM 149 O A2G A 101 1.010 -15.294 9.062 1.00 0.00 O HETATM 150 C1 A2G A 101 2.208 -16.003 9.286 1.00 0.00 C HETATM 151 C2 A2G A 101 2.436 -16.091 10.797 1.00 0.00 C HETATM 152 N2 A2G A 101 3.672 -16.812 11.076 1.00 0.00 N HETATM 153 C3 A2G A 101 1.249 -16.811 11.441 1.00 0.00 C HETATM 154 O3 A2G A 101 1.390 -16.783 12.854 1.00 0.00 O HETATM 155 C4 A2G A 101 -0.051 -16.107 11.045 1.00 0.00 C HETATM 156 O4 A2G A 101 -0.078 -14.807 11.617 1.00 0.00 O HETATM 157 C5 A2G A 101 -0.125 -15.995 9.521 1.00 0.00 C HETATM 158 C6 A2G A 101 -1.380 -15.214 9.122 1.00 0.00 C HETATM 159 O6 A2G A 101 -2.372 -15.370 10.124 1.00 0.00 O HETATM 160 C7 A2G A 101 4.664 -16.239 11.748 1.00 0.00 C HETATM 161 O7 A2G A 101 4.608 -15.084 12.172 1.00 0.00 O HETATM 162 C8 A2G A 101 5.881 -17.114 12.028 1.00 0.00 C HETATM 163 H1 A2G A 101 3.033 -15.474 8.832 1.00 0.00 H HETATM 164 H2 A2G A 101 2.508 -15.094 11.203 1.00 0.00 H HETATM 165 HN2 A2G A 101 3.771 -17.736 10.765 1.00 0.00 H HETATM 166 H3 A2G A 101 1.221 -17.836 11.102 1.00 0.00 H HETATM 167 HO3 A2G A 101 0.513 -16.846 13.240 1.00 0.00 H HETATM 168 H4 A2G A 101 -0.894 -16.678 11.406 1.00 0.00 H HETATM 169 HO4 A2G A 101 0.520 -14.801 12.367 1.00 0.00 H HETATM 170 H5 A2G A 101 -0.156 -16.982 9.084 1.00 0.00 H HETATM 171 H6 A2G A 101 -1.134 -14.169 9.017 1.00 0.00 H HETATM 172 H8 A2G A 101 5.720 -17.675 12.936 1.00 0.00 H HETATM 173 H8A A2G A 101 6.755 -16.490 12.142 1.00 0.00 H HETATM 174 H8B A2G A 101 6.031 -17.797 11.205 1.00 0.00 H HETATM 175 H14 A2G A 101 -1.754 -15.593 8.181 1.00 0.00 H HETATM 176 H15 A2G A 101 -2.982 -16.053 9.835 1.00 0.00 H HETATM 177 O A2G A 102 8.543 -14.060 3.851 1.00 0.00 O HETATM 178 C1 A2G A 102 7.227 -13.666 4.202 1.00 0.00 C HETATM 179 C2 A2G A 102 6.507 -13.146 2.952 1.00 0.00 C HETATM 180 N2 A2G A 102 5.129 -12.799 3.278 1.00 0.00 N HETATM 181 C3 A2G A 102 6.532 -14.213 1.858 1.00 0.00 C HETATM 182 O3 A2G A 102 5.974 -13.682 0.665 1.00 0.00 O HETATM 183 C4 A2G A 102 7.975 -14.634 1.602 1.00 0.00 C HETATM 184 O4 A2G A 102 8.711 -13.527 1.104 1.00 0.00 O HETATM 185 C5 A2G A 102 8.595 -15.113 2.914 1.00 0.00 C HETATM 186 C6 A2G A 102 10.061 -15.487 2.681 1.00 0.00 C HETATM 187 O6 A2G A 102 10.306 -15.598 1.288 1.00 0.00 O HETATM 188 C7 A2G A 102 4.691 -11.548 3.169 1.00 0.00 C HETATM 189 O7 A2G A 102 5.405 -10.619 2.794 1.00 0.00 O HETATM 190 C8 A2G A 102 3.267 -11.292 3.650 1.00 0.00 C HETATM 191 H1 A2G A 102 7.281 -12.866 4.925 1.00 0.00 H HETATM 192 H2 A2G A 102 7.017 -12.263 2.595 1.00 0.00 H HETATM 193 HN2 A2G A 102 4.524 -13.493 3.612 1.00 0.00 H HETATM 194 H3 A2G A 102 5.957 -15.069 2.175 1.00 0.00 H HETATM 195 HO3 A2G A 102 5.219 -13.140 0.905 1.00 0.00 H HETATM 196 H4 A2G A 102 7.993 -15.435 0.877 1.00 0.00 H HETATM 197 HO4 A2G A 102 9.587 -13.552 1.498 1.00 0.00 H HETATM 198 H5 A2G A 102 8.056 -15.971 3.282 1.00 0.00 H HETATM 199 H6 A2G A 102 10.698 -14.722 3.099 1.00 0.00 H HETATM 200 H8 A2G A 102 2.572 -11.524 2.856 1.00 0.00 H HETATM 201 H8A A2G A 102 3.162 -10.254 3.928 1.00 0.00 H HETATM 202 H8B A2G A 102 3.057 -11.917 4.506 1.00 0.00 H HETATM 203 H14 A2G A 102 10.271 -16.432 3.160 1.00 0.00 H HETATM 204 H15 A2G A 102 11.255 -15.544 1.148 1.00 0.00 H HETATM 205 O A2G A 103 6.430 -9.750 12.047 1.00 0.00 O HETATM 206 C1 A2G A 103 7.198 -10.260 10.980 1.00 0.00 C HETATM 207 C2 A2G A 103 8.630 -10.467 11.478 1.00 0.00 C HETATM 208 N2 A2G A 103 9.464 -10.988 10.401 1.00 0.00 N HETATM 209 C3 A2G A 103 8.616 -11.445 12.654 1.00 0.00 C HETATM 210 O3 A2G A 103 9.922 -11.542 13.204 1.00 0.00 O HETATM 211 C4 A2G A 103 7.647 -10.940 13.726 1.00 0.00 C HETATM 212 O4 A2G A 103 8.146 -9.733 14.283 1.00 0.00 O HETATM 213 C5 A2G A 103 6.278 -10.682 13.095 1.00 0.00 C HETATM 214 C6 A2G A 103 5.330 -10.094 14.141 1.00 0.00 C HETATM 215 O6 A2G A 103 5.770 -10.464 15.441 1.00 0.00 O HETATM 216 C7 A2G A 103 10.529 -10.318 9.973 1.00 0.00 C HETATM 217 O7 A2G A 103 10.876 -9.235 10.445 1.00 0.00 O HETATM 218 C8 A2G A 103 11.307 -10.954 8.825 1.00 0.00 C HETATM 219 H1 A2G A 103 7.203 -9.552 10.165 1.00 0.00 H HETATM 220 H2 A2G A 103 9.030 -9.520 11.809 1.00 0.00 H HETATM 221 HN2 A2G A 103 9.236 -11.845 9.987 1.00 0.00 H HETATM 222 H3 A2G A 103 8.297 -12.417 12.310 1.00 0.00 H HETATM 223 HO3 A2G A 103 10.337 -12.329 12.845 1.00 0.00 H HETATM 224 H4 A2G A 103 7.552 -11.683 14.503 1.00 0.00 H HETATM 225 HO4 A2G A 103 7.687 -9.001 13.867 1.00 0.00 H HETATM 226 H5 A2G A 103 5.872 -11.608 12.714 1.00 0.00 H HETATM 227 H6 A2G A 103 5.324 -9.017 14.057 1.00 0.00 H HETATM 228 H8 A2G A 103 12.080 -11.594 9.224 1.00 0.00 H HETATM 229 H8A A2G A 103 11.758 -10.178 8.224 1.00 0.00 H HETATM 230 H8B A2G A 103 10.635 -11.538 8.214 1.00 0.00 H HETATM 231 H14 A2G A 103 4.333 -10.473 13.978 1.00 0.00 H HETATM 232 H15 A2G A 103 5.732 -11.421 15.504 1.00 0.00 H HETATM 233 O A2G A 104 6.291 -6.272 3.695 1.00 0.00 O HETATM 234 C1 A2G A 104 5.738 -6.462 4.977 1.00 0.00 C HETATM 235 C2 A2G A 104 4.271 -6.050 4.922 1.00 0.00 C HETATM 236 N2 A2G A 104 3.661 -6.182 6.239 1.00 0.00 N HETATM 237 C3 A2G A 104 3.550 -6.940 3.910 1.00 0.00 C HETATM 238 O3 A2G A 104 2.205 -6.507 3.767 1.00 0.00 O HETATM 239 C4 A2G A 104 4.262 -6.847 2.557 1.00 0.00 C HETATM 240 O4 A2G A 104 4.109 -5.536 2.033 1.00 0.00 O HETATM 241 C5 A2G A 104 5.752 -7.155 2.736 1.00 0.00 C HETATM 242 C6 A2G A 104 6.484 -6.941 1.409 1.00 0.00 C HETATM 243 O6 A2G A 104 5.542 -6.929 0.346 1.00 0.00 O HETATM 244 C7 A2G A 104 3.118 -5.135 6.853 1.00 0.00 C HETATM 245 O7 A2G A 104 3.097 -4.009 6.358 1.00 0.00 O HETATM 246 C8 A2G A 104 2.332 -5.440 8.125 1.00 0.00 C HETATM 247 H1 A2G A 104 6.256 -5.844 5.696 1.00 0.00 H HETATM 248 H2 A2G A 104 4.202 -5.021 4.602 1.00 0.00 H HETATM 249 HN2 A2G A 104 3.648 -7.058 6.679 1.00 0.00 H HETATM 250 H3 A2G A 104 3.565 -7.964 4.254 1.00 0.00 H HETATM 251 HO3 A2G A 104 1.680 -6.938 4.445 1.00 0.00 H HETATM 252 H4 A2G A 104 3.827 -7.560 1.873 1.00 0.00 H HETATM 253 HO4 A2G A 104 4.975 -5.120 2.017 1.00 0.00 H HETATM 254 H5 A2G A 104 5.876 -8.178 3.060 1.00 0.00 H HETATM 255 H6 A2G A 104 7.008 -5.997 1.436 1.00 0.00 H HETATM 256 H8 A2G A 104 1.304 -5.655 7.870 1.00 0.00 H HETATM 257 H8A A2G A 104 2.368 -4.585 8.783 1.00 0.00 H HETATM 258 H8B A2G A 104 2.767 -6.295 8.621 1.00 0.00 H HETATM 259 H14 A2G A 104 7.192 -7.742 1.255 1.00 0.00 H HETATM 260 H15 A2G A 104 5.958 -7.328 -0.421 1.00 0.00 H