HETATM 1 C ACE A 1 -0.502 -22.761 6.649 1.00 0.00 C HETATM 2 O ACE A 1 -0.147 -21.603 6.429 1.00 0.00 O HETATM 3 CH3 ACE A 1 -1.364 -23.520 5.646 1.00 0.00 C HETATM 4 H1 ACE A 1 -0.758 -24.253 5.132 1.00 0.00 H HETATM 5 H2 ACE A 1 -1.774 -22.826 4.927 1.00 0.00 H HETATM 6 H3 ACE A 1 -2.168 -24.018 6.166 1.00 0.00 H ATOM 7 N PRO A 2 -0.165 -23.395 7.739 1.00 0.00 N ATOM 8 CA PRO A 2 0.670 -22.782 8.808 1.00 0.00 C ATOM 9 C PRO A 2 1.868 -22.030 8.236 1.00 0.00 C ATOM 10 O PRO A 2 2.082 -20.857 8.540 1.00 0.00 O ATOM 11 CB PRO A 2 1.131 -23.972 9.664 1.00 0.00 C ATOM 12 CG PRO A 2 0.545 -25.209 9.048 1.00 0.00 C ATOM 13 CD PRO A 2 -0.544 -24.766 8.073 1.00 0.00 C ATOM 14 HA PRO A 2 0.071 -22.120 9.410 1.00 0.00 H ATOM 15 HB2 PRO A 2 2.210 -24.033 9.660 1.00 0.00 H ATOM 16 HB3 PRO A 2 0.770 -23.863 10.675 1.00 0.00 H ATOM 17 HG2 PRO A 2 1.314 -25.755 8.519 1.00 0.00 H ATOM 18 HG3 PRO A 2 0.112 -25.833 9.815 1.00 0.00 H ATOM 19 HD2 PRO A 2 -0.540 -25.391 7.191 1.00 0.00 H ATOM 20 HD3 PRO A 2 -1.512 -24.781 8.550 1.00 0.00 H ATOM 21 N PRO A 3 2.645 -22.688 7.418 1.00 0.00 N ATOM 22 CA PRO A 3 3.853 -22.088 6.789 1.00 0.00 C ATOM 23 C PRO A 3 3.583 -20.683 6.256 1.00 0.00 C ATOM 24 O PRO A 3 3.160 -20.515 5.112 1.00 0.00 O ATOM 25 CB PRO A 3 4.205 -23.049 5.643 1.00 0.00 C ATOM 26 CG PRO A 3 3.185 -24.149 5.662 1.00 0.00 C ATOM 27 CD PRO A 3 2.456 -24.076 7.002 1.00 0.00 C ATOM 28 HA PRO A 3 4.665 -22.064 7.497 1.00 0.00 H ATOM 29 HB2 PRO A 3 4.167 -22.525 4.697 1.00 0.00 H ATOM 30 HB3 PRO A 3 5.191 -23.461 5.796 1.00 0.00 H ATOM 31 HG2 PRO A 3 2.483 -24.012 4.851 1.00 0.00 H ATOM 32 HG3 PRO A 3 3.674 -25.106 5.569 1.00 0.00 H ATOM 33 HD2 PRO A 3 1.406 -24.299 6.875 1.00 0.00 H ATOM 34 HD3 PRO A 3 2.906 -24.745 7.718 1.00 0.00 H ATOM 35 N THR A 4 3.829 -19.681 7.093 1.00 0.00 N ATOM 36 CA THR A 4 3.611 -18.295 6.693 1.00 0.00 C ATOM 37 C THR A 4 4.655 -17.383 7.331 1.00 0.00 C ATOM 38 O THR A 4 5.123 -17.640 8.439 1.00 0.00 O ATOM 39 CB THR A 4 2.210 -17.845 7.114 1.00 0.00 C ATOM 40 OG1 THR A 4 2.068 -18.054 8.502 1.00 0.00 O ATOM 41 CG2 THR A 4 1.155 -18.672 6.379 1.00 0.00 C ATOM 42 H THR A 4 4.163 -19.875 7.992 1.00 0.00 H ATOM 43 HA THR A 4 3.692 -18.223 5.619 1.00 0.00 H ATOM 44 HB THR A 4 2.077 -16.801 6.878 1.00 0.00 H ATOM 45 HG21 THR A 4 0.229 -18.119 6.337 1.00 0.00 H ATOM 46 HG22 THR A 4 0.996 -19.601 6.906 1.00 0.00 H ATOM 47 HG23 THR A 4 1.496 -18.881 5.376 1.00 0.00 H ATOM 48 N THR A 5 5.015 -16.318 6.621 1.00 0.00 N ATOM 49 CA THR A 5 6.005 -15.375 7.128 1.00 0.00 C ATOM 50 C THR A 5 5.330 -14.089 7.595 1.00 0.00 C ATOM 51 O THR A 5 4.382 -13.613 6.969 1.00 0.00 O ATOM 52 CB THR A 5 7.025 -15.052 6.035 1.00 0.00 C ATOM 53 OG1 THR A 5 6.349 -14.461 4.947 1.00 0.00 O ATOM 54 CG2 THR A 5 7.700 -16.339 5.557 1.00 0.00 C ATOM 55 H THR A 5 4.607 -16.164 5.744 1.00 0.00 H ATOM 56 HA THR A 5 6.520 -15.823 7.965 1.00 0.00 H ATOM 57 HB THR A 5 7.773 -14.376 6.422 1.00 0.00 H ATOM 58 HG21 THR A 5 7.216 -16.685 4.656 1.00 0.00 H ATOM 59 HG22 THR A 5 7.615 -17.095 6.323 1.00 0.00 H ATOM 60 HG23 THR A 5 8.743 -16.145 5.356 1.00 0.00 H ATOM 61 N THR A 6 5.826 -13.532 8.694 1.00 0.00 N ATOM 62 CA THR A 6 5.262 -12.300 9.234 1.00 0.00 C ATOM 63 C THR A 6 6.170 -11.114 8.922 1.00 0.00 C ATOM 64 O THR A 6 7.395 -11.227 8.972 1.00 0.00 O ATOM 65 CB THR A 6 5.087 -12.426 10.750 1.00 0.00 C ATOM 66 OG1 THR A 6 6.363 -12.463 11.350 1.00 0.00 O ATOM 67 CG2 THR A 6 4.348 -13.723 11.080 1.00 0.00 C ATOM 68 H THR A 6 6.583 -13.956 9.150 1.00 0.00 H ATOM 69 HA THR A 6 4.296 -12.128 8.785 1.00 0.00 H ATOM 70 HB THR A 6 4.523 -11.585 11.122 1.00 0.00 H ATOM 71 HG21 THR A 6 5.049 -14.545 11.084 1.00 0.00 H ATOM 72 HG22 THR A 6 3.586 -13.903 10.335 1.00 0.00 H ATOM 73 HG23 THR A 6 3.887 -13.637 12.053 1.00 0.00 H ATOM 74 N THR A 7 5.562 -9.977 8.602 1.00 0.00 N ATOM 75 CA THR A 7 6.325 -8.776 8.284 1.00 0.00 C ATOM 76 C THR A 7 6.359 -7.830 9.480 1.00 0.00 C ATOM 77 O THR A 7 5.662 -8.043 10.472 1.00 0.00 O ATOM 78 CB THR A 7 5.701 -8.062 7.083 1.00 0.00 C ATOM 79 OG1 THR A 7 4.427 -7.584 7.456 1.00 0.00 O ATOM 80 CG2 THR A 7 5.539 -9.045 5.922 1.00 0.00 C ATOM 81 H THR A 7 4.582 -9.946 8.578 1.00 0.00 H ATOM 82 HA THR A 7 7.336 -9.059 8.033 1.00 0.00 H ATOM 83 HB THR A 7 6.333 -7.244 6.776 1.00 0.00 H ATOM 84 HG21 THR A 7 5.545 -8.502 4.988 1.00 0.00 H ATOM 85 HG22 THR A 7 4.603 -9.573 6.025 1.00 0.00 H ATOM 86 HG23 THR A 7 6.355 -9.752 5.933 1.00 0.00 H ATOM 87 N LYS A 8 7.172 -6.784 9.378 1.00 0.00 N ATOM 88 CA LYS A 8 7.288 -5.811 10.457 1.00 0.00 C ATOM 89 C LYS A 8 7.848 -4.493 9.934 1.00 0.00 C ATOM 90 O LYS A 8 9.002 -4.422 9.510 1.00 0.00 O ATOM 91 CB LYS A 8 8.203 -6.357 11.556 1.00 0.00 C ATOM 92 CG LYS A 8 8.583 -5.225 12.514 1.00 0.00 C ATOM 93 CD LYS A 8 8.858 -5.802 13.903 1.00 0.00 C ATOM 94 CE LYS A 8 9.570 -4.753 14.760 1.00 0.00 C ATOM 95 NZ LYS A 8 9.202 -3.389 14.284 1.00 0.00 N ATOM 96 H LYS A 8 7.704 -6.665 8.563 1.00 0.00 H ATOM 97 HA LYS A 8 6.309 -5.634 10.877 1.00 0.00 H ATOM 98 HB2 LYS A 8 7.687 -7.132 12.102 1.00 0.00 H ATOM 99 HB3 LYS A 8 9.098 -6.763 11.110 1.00 0.00 H ATOM 100 HG2 LYS A 8 9.468 -4.726 12.147 1.00 0.00 H ATOM 101 HG3 LYS A 8 7.770 -4.516 12.574 1.00 0.00 H ATOM 102 HD2 LYS A 8 7.923 -6.076 14.371 1.00 0.00 H ATOM 103 HD3 LYS A 8 9.486 -6.675 13.813 1.00 0.00 H ATOM 104 HE2 LYS A 8 9.270 -4.867 15.791 1.00 0.00 H ATOM 105 HE3 LYS A 8 10.639 -4.886 14.679 1.00 0.00 H ATOM 106 HZ1 LYS A 8 8.190 -3.365 14.050 1.00 0.00 H ATOM 107 HZ2 LYS A 8 9.760 -3.157 13.435 1.00 0.00 H ATOM 108 HZ3 LYS A 8 9.401 -2.696 15.031 1.00 0.00 H ATOM 109 N LYS A 9 7.024 -3.451 9.965 1.00 0.00 N ATOM 110 CA LYS A 9 7.448 -2.139 9.489 1.00 0.00 C ATOM 111 C LYS A 9 8.654 -2.269 8.565 1.00 0.00 C ATOM 112 O LYS A 9 9.779 -1.947 8.944 1.00 0.00 O ATOM 113 CB LYS A 9 7.807 -1.243 10.675 1.00 0.00 C ATOM 114 CG LYS A 9 7.828 0.218 10.224 1.00 0.00 C ATOM 115 CD LYS A 9 6.447 0.842 10.441 1.00 0.00 C ATOM 116 CE LYS A 9 6.323 2.114 9.602 1.00 0.00 C ATOM 117 NZ LYS A 9 7.436 3.045 9.944 1.00 0.00 N ATOM 118 H LYS A 9 6.116 -3.565 10.315 1.00 0.00 H ATOM 119 HA LYS A 9 6.635 -1.685 8.942 1.00 0.00 H ATOM 120 HB2 LYS A 9 7.070 -1.368 11.456 1.00 0.00 H ATOM 121 HB3 LYS A 9 8.781 -1.516 11.051 1.00 0.00 H ATOM 122 HG2 LYS A 9 8.563 0.762 10.799 1.00 0.00 H ATOM 123 HG3 LYS A 9 8.082 0.268 9.175 1.00 0.00 H ATOM 124 HD2 LYS A 9 5.684 0.137 10.143 1.00 0.00 H ATOM 125 HD3 LYS A 9 6.324 1.087 11.485 1.00 0.00 H ATOM 126 HE2 LYS A 9 6.375 1.861 8.553 1.00 0.00 H ATOM 127 HE3 LYS A 9 5.377 2.592 9.811 1.00 0.00 H ATOM 128 HZ1 LYS A 9 8.040 3.186 9.109 1.00 0.00 H ATOM 129 HZ2 LYS A 9 8.002 2.639 10.717 1.00 0.00 H ATOM 130 HZ3 LYS A 9 7.044 3.960 10.242 1.00 0.00 H ATOM 131 N PRO A 10 8.435 -2.734 7.365 1.00 0.00 N ATOM 132 CA PRO A 10 9.511 -2.915 6.355 1.00 0.00 C ATOM 133 C PRO A 10 9.950 -1.588 5.744 1.00 0.00 C ATOM 134 O PRO A 10 10.548 -1.565 4.668 1.00 0.00 O ATOM 135 CB PRO A 10 8.887 -3.827 5.287 1.00 0.00 C ATOM 136 CG PRO A 10 7.487 -4.131 5.733 1.00 0.00 C ATOM 137 CD PRO A 10 7.132 -3.140 6.839 1.00 0.00 C ATOM 138 HA PRO A 10 10.357 -3.414 6.802 1.00 0.00 H ATOM 139 HB2 PRO A 10 8.871 -3.320 4.334 1.00 0.00 H ATOM 140 HB3 PRO A 10 9.453 -4.744 5.209 1.00 0.00 H ATOM 141 HG2 PRO A 10 6.806 -4.017 4.901 1.00 0.00 H ATOM 142 HG3 PRO A 10 7.433 -5.137 6.118 1.00 0.00 H ATOM 143 HD2 PRO A 10 6.601 -2.291 6.431 1.00 0.00 H ATOM 144 HD3 PRO A 10 6.550 -3.622 7.610 1.00 0.00 H HETATM 145 N NH2 A 11 9.687 -0.472 6.369 1.00 0.00 N HETATM 146 HN1 NH2 A 11 10.418 0.113 6.657 1.00 0.00 H HETATM 147 HN2 NH2 A 11 8.757 -0.218 6.546 1.00 0.00 H TER 148 NH2 A 11 HETATM 149 O A2G A 101 0.646 -16.266 8.978 1.00 0.00 O HETATM 150 C1 A2G A 101 1.908 -16.849 9.217 1.00 0.00 C HETATM 151 C2 A2G A 101 2.017 -17.161 10.711 1.00 0.00 C HETATM 152 N2 A2G A 101 3.312 -17.761 11.005 1.00 0.00 N HETATM 153 C3 A2G A 101 0.891 -18.117 11.107 1.00 0.00 C HETATM 154 O3 A2G A 101 0.905 -18.309 12.514 1.00 0.00 O HETATM 155 C4 A2G A 101 -0.456 -17.522 10.688 1.00 0.00 C HETATM 156 O4 A2G A 101 -0.712 -16.350 11.447 1.00 0.00 O HETATM 157 C5 A2G A 101 -0.415 -17.167 9.200 1.00 0.00 C HETATM 158 C6 A2G A 101 -1.727 -16.491 8.796 1.00 0.00 C HETATM 159 O6 A2G A 101 -2.726 -16.776 9.764 1.00 0.00 O HETATM 160 C7 A2G A 101 4.163 -17.181 11.845 1.00 0.00 C HETATM 161 O7 A2G A 101 3.920 -16.119 12.419 1.00 0.00 O HETATM 162 C8 A2G A 101 5.466 -17.929 12.106 1.00 0.00 C HETATM 163 H1 A2G A 101 2.687 -16.155 8.940 1.00 0.00 H HETATM 164 H2 A2G A 101 1.915 -16.243 11.271 1.00 0.00 H HETATM 165 HN2 A2G A 101 3.559 -18.607 10.577 1.00 0.00 H HETATM 166 H3 A2G A 101 1.033 -19.067 10.613 1.00 0.00 H HETATM 167 HO3 A2G A 101 0.051 -18.039 12.859 1.00 0.00 H HETATM 168 H4 A2G A 101 -1.239 -18.244 10.864 1.00 0.00 H HETATM 169 HO4 A2G A 101 -0.742 -16.598 12.375 1.00 0.00 H HETATM 170 H5 A2G A 101 -0.272 -18.064 8.615 1.00 0.00 H HETATM 171 H6 A2G A 101 -1.577 -15.423 8.735 1.00 0.00 H HETATM 172 H8 A2G A 101 5.340 -18.584 12.957 1.00 0.00 H HETATM 173 H8A A2G A 101 6.254 -17.219 12.312 1.00 0.00 H HETATM 174 H8B A2G A 101 5.726 -18.514 11.236 1.00 0.00 H HETATM 175 H14 A2G A 101 -2.042 -16.865 7.833 1.00 0.00 H HETATM 176 H15 A2G A 101 -3.583 -16.666 9.346 1.00 0.00 H HETATM 177 O A2G A 102 8.053 -12.963 4.399 1.00 0.00 O HETATM 178 C1 A2G A 102 6.699 -13.107 4.763 1.00 0.00 C HETATM 179 C2 A2G A 102 5.838 -12.539 3.634 1.00 0.00 C HETATM 180 N2 A2G A 102 4.425 -12.654 3.973 1.00 0.00 N HETATM 181 C3 A2G A 102 6.133 -13.305 2.343 1.00 0.00 C HETATM 182 O3 A2G A 102 5.443 -12.695 1.263 1.00 0.00 O HETATM 183 C4 A2G A 102 7.639 -13.279 2.063 1.00 0.00 C HETATM 184 O4 A2G A 102 8.040 -11.952 1.756 1.00 0.00 O HETATM 185 C5 A2G A 102 8.404 -13.769 3.297 1.00 0.00 C HETATM 186 C6 A2G A 102 9.910 -13.638 3.055 1.00 0.00 C HETATM 187 O6 A2G A 102 10.156 -13.510 1.662 1.00 0.00 O HETATM 188 C7 A2G A 102 3.653 -11.577 4.076 1.00 0.00 C HETATM 189 O7 A2G A 102 4.071 -10.434 3.895 1.00 0.00 O HETATM 190 C8 A2G A 102 2.204 -11.824 4.482 1.00 0.00 C HETATM 191 H1 A2G A 102 6.505 -12.555 5.671 1.00 0.00 H HETATM 192 H2 A2G A 102 6.084 -11.498 3.491 1.00 0.00 H HETATM 193 HN2 A2G A 102 4.038 -13.541 4.129 1.00 0.00 H HETATM 194 H3 A2G A 102 5.803 -14.328 2.448 1.00 0.00 H HETATM 195 HO3 A2G A 102 5.809 -11.816 1.136 1.00 0.00 H HETATM 196 H4 A2G A 102 7.860 -13.924 1.225 1.00 0.00 H HETATM 197 HO4 A2G A 102 8.916 -11.989 1.366 1.00 0.00 H HETATM 198 H5 A2G A 102 8.157 -14.801 3.495 1.00 0.00 H HETATM 199 H6 A2G A 102 10.281 -12.763 3.567 1.00 0.00 H HETATM 200 H8 A2G A 102 1.576 -11.806 3.604 1.00 0.00 H HETATM 201 H8A A2G A 102 1.886 -11.054 5.168 1.00 0.00 H HETATM 202 H8B A2G A 102 2.124 -12.789 4.961 1.00 0.00 H HETATM 203 H14 A2G A 102 10.412 -14.516 3.431 1.00 0.00 H HETATM 204 H15 A2G A 102 10.198 -14.393 1.286 1.00 0.00 H HETATM 205 O A2G A 103 5.896 -11.147 13.220 1.00 0.00 O HETATM 206 C1 A2G A 103 6.668 -11.276 12.047 1.00 0.00 C HETATM 207 C2 A2G A 103 8.142 -11.320 12.449 1.00 0.00 C HETATM 208 N2 A2G A 103 8.982 -11.439 11.262 1.00 0.00 N HETATM 209 C3 A2G A 103 8.374 -12.513 13.378 1.00 0.00 C HETATM 210 O3 A2G A 103 9.708 -12.480 13.864 1.00 0.00 O HETATM 211 C4 A2G A 103 7.401 -12.440 14.559 1.00 0.00 C HETATM 212 O4 A2G A 103 7.727 -11.322 15.372 1.00 0.00 O HETATM 213 C5 A2G A 103 5.968 -12.292 14.040 1.00 0.00 C HETATM 214 C6 A2G A 103 5.011 -12.108 15.220 1.00 0.00 C HETATM 215 O6 A2G A 103 5.681 -12.432 16.429 1.00 0.00 O HETATM 216 C7 A2G A 103 9.878 -10.506 10.960 1.00 0.00 C HETATM 217 O7 A2G A 103 10.058 -9.500 11.645 1.00 0.00 O HETATM 218 C8 A2G A 103 10.684 -10.735 9.684 1.00 0.00 C HETATM 219 H1 A2G A 103 6.499 -10.423 11.406 1.00 0.00 H HETATM 220 H2 A2G A 103 8.395 -10.410 12.971 1.00 0.00 H HETATM 221 HN2 A2G A 103 8.882 -12.219 10.678 1.00 0.00 H HETATM 222 H3 A2G A 103 8.214 -13.432 12.834 1.00 0.00 H HETATM 223 HO3 A2G A 103 9.986 -11.561 13.906 1.00 0.00 H HETATM 224 H4 A2G A 103 7.479 -13.344 15.144 1.00 0.00 H HETATM 225 HO4 A2G A 103 7.791 -11.625 16.280 1.00 0.00 H HETATM 226 H5 A2G A 103 5.688 -13.172 13.479 1.00 0.00 H HETATM 227 H6 A2G A 103 4.676 -11.082 15.256 1.00 0.00 H HETATM 228 H8 A2G A 103 11.671 -11.089 9.941 1.00 0.00 H HETATM 229 H8A A2G A 103 10.765 -9.807 9.138 1.00 0.00 H HETATM 230 H8B A2G A 103 10.185 -11.472 9.071 1.00 0.00 H HETATM 231 H14 A2G A 103 4.157 -12.761 15.097 1.00 0.00 H HETATM 232 H15 A2G A 103 6.094 -11.631 16.762 1.00 0.00 H HETATM 233 O A2G A 104 4.524 -5.539 6.334 1.00 0.00 O HETATM 234 C1 A2G A 104 4.392 -6.180 7.583 1.00 0.00 C HETATM 235 C2 A2G A 104 3.041 -5.786 8.180 1.00 0.00 C HETATM 236 N2 A2G A 104 2.866 -6.417 9.483 1.00 0.00 N HETATM 237 C3 A2G A 104 1.924 -6.224 7.230 1.00 0.00 C HETATM 238 O3 A2G A 104 0.680 -5.740 7.711 1.00 0.00 O HETATM 239 C4 A2G A 104 2.187 -5.654 5.833 1.00 0.00 C HETATM 240 O4 A2G A 104 2.054 -4.240 5.867 1.00 0.00 O HETATM 241 C5 A2G A 104 3.604 -6.021 5.381 1.00 0.00 C HETATM 242 C6 A2G A 104 3.902 -5.357 4.035 1.00 0.00 C HETATM 243 O6 A2G A 104 2.681 -5.035 3.385 1.00 0.00 O HETATM 244 C7 A2G A 104 2.704 -5.688 10.584 1.00 0.00 C HETATM 245 O7 A2G A 104 2.692 -4.457 10.576 1.00 0.00 O HETATM 246 C8 A2G A 104 2.551 -6.463 11.888 1.00 0.00 C HETATM 247 H1 A2G A 104 5.182 -5.855 8.244 1.00 0.00 H HETATM 248 H2 A2G A 104 3.005 -4.713 8.298 1.00 0.00 H HETATM 249 HN2 A2G A 104 2.867 -7.395 9.550 1.00 0.00 H HETATM 250 H3 A2G A 104 1.895 -7.302 7.181 1.00 0.00 H HETATM 251 HO3 A2G A 104 0.498 -6.170 8.549 1.00 0.00 H HETATM 252 H4 A2G A 104 1.471 -6.065 5.137 1.00 0.00 H HETATM 253 HO4 A2G A 104 1.123 -4.028 5.772 1.00 0.00 H HETATM 254 H5 A2G A 104 3.691 -7.092 5.285 1.00 0.00 H HETATM 255 H6 A2G A 104 4.474 -4.456 4.197 1.00 0.00 H HETATM 256 H8 A2G A 104 1.502 -6.582 12.115 1.00 0.00 H HETATM 257 H8A A2G A 104 3.033 -5.920 12.688 1.00 0.00 H HETATM 258 H8B A2G A 104 3.010 -7.435 11.785 1.00 0.00 H HETATM 259 H14 A2G A 104 4.471 -6.037 3.417 1.00 0.00 H HETATM 260 H15 A2G A 104 2.877 -4.415 2.678 1.00 0.00 H