HETATM 1 C ACE A 0 -2.757 -2.786 7.770 1.00 0.00 C HETATM 2 O ACE A 0 -3.527 -3.395 6.998 1.00 0.00 O HETATM 3 CH3 ACE A 0 -2.176 -3.521 8.956 1.00 0.00 C HETATM 4 H1 ACE A 0 -1.370 -4.154 8.631 1.00 0.00 H HETATM 5 H2 ACE A 0 -2.952 -4.119 9.412 1.00 0.00 H HETATM 6 H3 ACE A 0 -1.805 -2.809 9.681 1.00 0.00 H ATOM 7 N HIS A 1 -2.386 -1.462 7.655 1.00 0.00 N ATOM 8 CA HIS A 1 -2.862 -0.564 6.587 1.00 0.00 C ATOM 9 C HIS A 1 -1.792 -0.348 5.522 1.00 0.00 C ATOM 10 O HIS A 1 -2.134 -0.046 4.369 1.00 0.00 O ATOM 11 CB HIS A 1 -3.244 0.800 7.182 1.00 0.00 C ATOM 12 CG HIS A 1 -4.233 1.606 6.390 1.00 0.00 C ATOM 13 ND1 HIS A 1 -5.587 1.332 6.344 1.00 0.00 N ATOM 14 CD2 HIS A 1 -4.046 2.709 5.630 1.00 0.00 C ATOM 15 CE1 HIS A 1 -6.188 2.238 5.593 1.00 0.00 C ATOM 16 NE2 HIS A 1 -5.271 3.084 5.144 1.00 0.00 N ATOM 17 H HIS A 1 -1.777 -1.094 8.329 1.00 0.00 H ATOM 18 HA HIS A 1 -3.731 -1.015 6.133 1.00 0.00 H ATOM 19 HB2 HIS A 1 -3.657 0.655 8.160 1.00 0.00 H ATOM 20 HB3 HIS A 1 -2.347 1.393 7.269 1.00 0.00 H ATOM 21 HD1 HIS A 1 -6.036 0.588 6.788 1.00 0.00 H ATOM 22 HD2 HIS A 1 -3.108 3.197 5.431 1.00 0.00 H ATOM 23 HE1 HIS A 1 -7.251 2.292 5.393 1.00 0.00 H ATOM 24 HE2 HIS A 1 -5.453 3.910 4.643 1.00 0.00 H HETATM 25 C MK8 A 2 0.534 -1.034 3.674 1.00 0.00 C HETATM 26 N MK8 A 2 -0.461 -0.460 5.939 1.00 0.00 N HETATM 27 O MK8 A 2 1.005 -0.627 2.587 1.00 0.00 O HETATM 28 CA MK8 A 2 0.726 -0.233 5.035 1.00 0.00 C HETATM 29 CB MK8 A 2 2.069 -0.617 5.774 1.00 0.00 C HETATM 30 CD MK8 A 2 3.079 -2.675 4.727 1.00 0.00 C HETATM 31 CE MK8 A 2 2.818 -4.161 4.362 1.00 0.00 C HETATM 32 CG MK8 A 2 2.437 -2.104 5.987 1.00 0.00 C HETATM 33 CB1 MK8 A 2 0.854 1.295 4.803 1.00 0.00 C HETATM 34 HN MK8 A 2 -0.289 -0.669 6.878 1.00 0.00 H HETATM 35 HB MK8 A 2 2.058 -0.145 6.748 1.00 0.00 H HETATM 36 HBA MK8 A 2 2.877 -0.183 5.211 1.00 0.00 H HETATM 37 HD MK8 A 2 4.143 -2.537 4.815 1.00 0.00 H HETATM 38 HDA MK8 A 2 2.743 -2.081 3.897 1.00 0.00 H HETATM 39 HE MK8 A 2 2.538 -4.819 5.171 1.00 0.00 H HETATM 40 HG MK8 A 2 1.554 -2.666 6.222 1.00 0.00 H HETATM 41 HGA MK8 A 2 3.139 -2.171 6.802 1.00 0.00 H HETATM 42 HB1 MK8 A 2 0.019 1.649 4.223 1.00 0.00 H HETATM 43 HB1A MK8 A 2 1.769 1.495 4.272 1.00 0.00 H HETATM 44 HB1B MK8 A 2 0.878 1.801 5.762 1.00 0.00 H ATOM 45 N ILE A 3 -0.129 -2.240 3.824 1.00 0.00 N ATOM 46 CA ILE A 3 -0.384 -3.215 2.726 1.00 0.00 C ATOM 47 C ILE A 3 -0.962 -2.563 1.475 1.00 0.00 C ATOM 48 O ILE A 3 -0.330 -2.650 0.398 1.00 0.00 O ATOM 49 CB ILE A 3 -1.321 -4.433 3.110 1.00 0.00 C ATOM 50 CG1 ILE A 3 -1.493 -4.766 4.656 1.00 0.00 C ATOM 51 CG2 ILE A 3 -0.898 -5.670 2.314 1.00 0.00 C ATOM 52 CD1 ILE A 3 -0.242 -5.028 5.527 1.00 0.00 C ATOM 53 H ILE A 3 -0.419 -2.498 4.721 1.00 0.00 H ATOM 54 HA ILE A 3 0.571 -3.624 2.457 1.00 0.00 H ATOM 55 HB ILE A 3 -2.298 -4.176 2.724 1.00 0.00 H ATOM 56 HG12 ILE A 3 -2.022 -3.949 5.109 1.00 0.00 H ATOM 57 HG13 ILE A 3 -2.111 -5.643 4.728 1.00 0.00 H ATOM 58 HG21 ILE A 3 -1.702 -6.394 2.313 1.00 0.00 H ATOM 59 HG22 ILE A 3 -0.022 -6.106 2.769 1.00 0.00 H ATOM 60 HG23 ILE A 3 -0.675 -5.380 1.295 1.00 0.00 H ATOM 61 HD11 ILE A 3 -0.550 -5.224 6.545 1.00 0.00 H ATOM 62 HD12 ILE A 3 0.402 -4.165 5.510 1.00 0.00 H ATOM 63 HD13 ILE A 3 0.288 -5.885 5.144 1.00 0.00 H ATOM 64 N LEU A 4 -2.187 -1.935 1.628 1.00 0.00 N ATOM 65 CA LEU A 4 -2.922 -1.268 0.517 1.00 0.00 C ATOM 66 C LEU A 4 -2.045 -0.207 -0.147 1.00 0.00 C ATOM 67 O LEU A 4 -2.158 0.024 -1.364 1.00 0.00 O ATOM 68 CB LEU A 4 -4.269 -0.673 1.007 1.00 0.00 C ATOM 69 CG LEU A 4 -4.230 0.382 2.125 1.00 0.00 C ATOM 70 CD1 LEU A 4 -3.883 1.764 1.593 1.00 0.00 C ATOM 71 CD2 LEU A 4 -5.569 0.420 2.822 1.00 0.00 C ATOM 72 H LEU A 4 -2.597 -1.941 2.514 1.00 0.00 H ATOM 73 HA LEU A 4 -3.135 -2.035 -0.216 1.00 0.00 H ATOM 74 HB2 LEU A 4 -4.763 -0.227 0.160 1.00 0.00 H ATOM 75 HB3 LEU A 4 -4.876 -1.494 1.357 1.00 0.00 H ATOM 76 HG LEU A 4 -3.486 0.108 2.848 1.00 0.00 H ATOM 77 HD11 LEU A 4 -2.817 1.902 1.629 1.00 0.00 H ATOM 78 HD12 LEU A 4 -4.369 2.516 2.197 1.00 0.00 H ATOM 79 HD13 LEU A 4 -4.222 1.846 0.572 1.00 0.00 H ATOM 80 HD21 LEU A 4 -5.810 1.442 3.070 1.00 0.00 H ATOM 81 HD22 LEU A 4 -5.526 -0.170 3.721 1.00 0.00 H ATOM 82 HD23 LEU A 4 -6.323 0.021 2.160 1.00 0.00 H ATOM 83 N HIS A 5 -1.173 0.415 0.712 1.00 0.00 N ATOM 84 CA HIS A 5 -0.222 1.458 0.321 1.00 0.00 C ATOM 85 C HIS A 5 0.930 0.882 -0.505 1.00 0.00 C ATOM 86 O HIS A 5 1.370 1.531 -1.458 1.00 0.00 O ATOM 87 CB HIS A 5 0.322 2.141 1.564 1.00 0.00 C ATOM 88 CG HIS A 5 -0.207 3.519 1.766 1.00 0.00 C ATOM 89 ND1 HIS A 5 0.147 4.592 0.975 1.00 0.00 N ATOM 90 CD2 HIS A 5 -1.080 3.996 2.683 1.00 0.00 C ATOM 91 CE1 HIS A 5 -0.482 5.666 1.402 1.00 0.00 C ATOM 92 NE2 HIS A 5 -1.234 5.331 2.435 1.00 0.00 N ATOM 93 H HIS A 5 -1.187 0.148 1.654 1.00 0.00 H ATOM 94 HA HIS A 5 -0.751 2.189 -0.273 1.00 0.00 H ATOM 95 HB2 HIS A 5 0.051 1.558 2.424 1.00 0.00 H ATOM 96 HB3 HIS A 5 1.395 2.199 1.499 1.00 0.00 H ATOM 97 HD1 HIS A 5 0.759 4.569 0.208 1.00 0.00 H ATOM 98 HD2 HIS A 5 -1.571 3.428 3.460 1.00 0.00 H ATOM 99 HE1 HIS A 5 -0.388 6.654 0.985 1.00 0.00 H ATOM 100 HE2 HIS A 5 -1.880 5.922 2.877 1.00 0.00 H HETATM 101 C MK8 A 6 2.182 -1.264 -2.297 1.00 0.00 C HETATM 102 N MK8 A 6 1.431 -0.357 -0.105 1.00 0.00 N HETATM 103 O MK8 A 6 3.063 -1.448 -3.182 1.00 0.00 O HETATM 104 CA MK8 A 6 2.562 -1.077 -0.786 1.00 0.00 C HETATM 105 CB MK8 A 6 2.761 -2.516 -0.202 1.00 0.00 C HETATM 106 CD MK8 A 6 3.266 -4.082 1.729 1.00 0.00 C HETATM 107 CE MK8 A 6 2.895 -4.744 3.104 1.00 0.00 C HETATM 108 CG MK8 A 6 2.676 -2.724 1.328 1.00 0.00 C HETATM 109 CB1 MK8 A 6 3.898 -0.292 -0.614 1.00 0.00 C HETATM 110 HN MK8 A 6 1.025 -0.781 0.671 1.00 0.00 H HETATM 111 HB MK8 A 6 3.732 -2.870 -0.524 1.00 0.00 H HETATM 112 HBA MK8 A 6 2.014 -3.161 -0.646 1.00 0.00 H HETATM 113 HD MK8 A 6 4.345 -3.985 1.689 1.00 0.00 H HETATM 114 HDA MK8 A 6 2.973 -4.784 0.968 1.00 0.00 H HETATM 115 HE MK8 A 6 2.674 -5.800 3.066 1.00 0.00 H HETATM 116 HG MK8 A 6 1.640 -2.689 1.629 1.00 0.00 H HETATM 117 HGA MK8 A 6 3.228 -1.941 1.825 1.00 0.00 H HETATM 118 HB1 MK8 A 6 4.607 -0.633 -1.349 1.00 0.00 H HETATM 119 HB1A MK8 A 6 4.288 -0.470 0.376 1.00 0.00 H HETATM 120 HB1B MK8 A 6 3.719 0.767 -0.744 1.00 0.00 H ATOM 121 N LEU A 7 0.824 -1.278 -2.549 1.00 0.00 N ATOM 122 CA LEU A 7 0.213 -1.490 -3.884 1.00 0.00 C ATOM 123 C LEU A 7 0.171 -0.198 -4.716 1.00 0.00 C ATOM 124 O LEU A 7 0.413 -0.253 -5.941 1.00 0.00 O ATOM 125 CB LEU A 7 -1.218 -2.050 -3.721 1.00 0.00 C ATOM 126 CG LEU A 7 -1.866 -2.661 -4.977 1.00 0.00 C ATOM 127 CD1 LEU A 7 -1.446 -4.113 -5.169 1.00 0.00 C ATOM 128 CD2 LEU A 7 -3.376 -2.554 -4.903 1.00 0.00 C ATOM 129 H LEU A 7 0.219 -1.181 -1.788 1.00 0.00 H ATOM 130 HA LEU A 7 0.812 -2.226 -4.406 1.00 0.00 H ATOM 131 HB2 LEU A 7 -1.197 -2.811 -2.956 1.00 0.00 H ATOM 132 HB3 LEU A 7 -1.851 -1.246 -3.384 1.00 0.00 H ATOM 133 HG LEU A 7 -1.537 -2.101 -5.841 1.00 0.00 H ATOM 134 HD11 LEU A 7 -0.432 -4.238 -4.827 1.00 0.00 H ATOM 135 HD12 LEU A 7 -1.512 -4.375 -6.215 1.00 0.00 H ATOM 136 HD13 LEU A 7 -2.104 -4.750 -4.596 1.00 0.00 H ATOM 137 HD21 LEU A 7 -3.786 -2.531 -5.904 1.00 0.00 H ATOM 138 HD22 LEU A 7 -3.648 -1.653 -4.380 1.00 0.00 H ATOM 139 HD23 LEU A 7 -3.774 -3.414 -4.377 1.00 0.00 H ATOM 140 N LEU A 8 -0.180 0.944 -4.020 1.00 0.00 N ATOM 141 CA LEU A 8 -0.325 2.273 -4.642 1.00 0.00 C ATOM 142 C LEU A 8 1.023 2.896 -4.946 1.00 0.00 C ATOM 143 O LEU A 8 1.160 3.595 -5.968 1.00 0.00 O ATOM 144 CB LEU A 8 -1.142 3.222 -3.729 1.00 0.00 C ATOM 145 CG LEU A 8 -2.505 2.700 -3.217 1.00 0.00 C ATOM 146 CD1 LEU A 8 -2.930 3.485 -1.991 1.00 0.00 C ATOM 147 CD2 LEU A 8 -3.609 2.787 -4.280 1.00 0.00 C ATOM 148 H LEU A 8 -0.381 0.860 -3.070 1.00 0.00 H ATOM 149 HA LEU A 8 -0.861 2.138 -5.564 1.00 0.00 H ATOM 150 HB2 LEU A 8 -0.538 3.462 -2.865 1.00 0.00 H ATOM 151 HB3 LEU A 8 -1.318 4.136 -4.283 1.00 0.00 H ATOM 152 HG LEU A 8 -2.394 1.666 -2.925 1.00 0.00 H ATOM 153 HD11 LEU A 8 -3.873 3.099 -1.640 1.00 0.00 H ATOM 154 HD12 LEU A 8 -3.043 4.525 -2.253 1.00 0.00 H ATOM 155 HD13 LEU A 8 -2.185 3.382 -1.211 1.00 0.00 H ATOM 156 HD21 LEU A 8 -4.359 2.037 -4.079 1.00 0.00 H ATOM 157 HD22 LEU A 8 -3.180 2.614 -5.257 1.00 0.00 H ATOM 158 HD23 LEU A 8 -4.057 3.768 -4.254 1.00 0.00 H ATOM 159 N GLN A 9 1.997 2.631 -4.023 1.00 0.00 N ATOM 160 CA GLN A 9 3.374 3.145 -4.088 1.00 0.00 C ATOM 161 C GLN A 9 4.197 2.428 -5.155 1.00 0.00 C ATOM 162 O GLN A 9 5.003 3.083 -5.852 1.00 0.00 O ATOM 163 CB GLN A 9 4.051 3.009 -2.718 1.00 0.00 C ATOM 164 CG GLN A 9 3.361 3.802 -1.615 1.00 0.00 C ATOM 165 CD GLN A 9 4.022 3.632 -0.259 1.00 0.00 C ATOM 166 OE1 GLN A 9 4.078 2.534 0.280 1.00 0.00 O ATOM 167 NE2 GLN A 9 4.512 4.728 0.306 1.00 0.00 N ATOM 168 H GLN A 9 1.759 2.073 -3.257 1.00 0.00 H ATOM 169 HA GLN A 9 3.307 4.193 -4.339 1.00 0.00 H ATOM 170 HB2 GLN A 9 4.057 1.966 -2.432 1.00 0.00 H ATOM 171 HB3 GLN A 9 5.069 3.357 -2.798 1.00 0.00 H ATOM 172 HG2 GLN A 9 3.370 4.854 -1.879 1.00 0.00 H ATOM 173 HG3 GLN A 9 2.339 3.460 -1.543 1.00 0.00 H ATOM 174 HE21 GLN A 9 4.422 5.574 -0.173 1.00 0.00 H ATOM 175 HE22 GLN A 9 4.931 4.646 1.187 1.00 0.00 H ATOM 176 N ASP A 10 3.977 1.066 -5.262 1.00 0.00 N ATOM 177 CA ASP A 10 4.666 0.189 -6.231 1.00 0.00 C ATOM 178 C ASP A 10 4.182 0.494 -7.642 1.00 0.00 C ATOM 179 O ASP A 10 5.004 0.575 -8.576 1.00 0.00 O ATOM 180 CB ASP A 10 4.398 -1.276 -5.898 1.00 0.00 C ATOM 181 CG ASP A 10 5.247 -2.238 -6.722 1.00 0.00 C ATOM 182 OD1 ASP A 10 5.105 -2.249 -7.964 1.00 0.00 O ATOM 183 OD2 ASP A 10 6.063 -2.972 -6.132 1.00 0.00 O ATOM 184 H ASP A 10 3.323 0.655 -4.660 1.00 0.00 H ATOM 185 HA ASP A 10 5.722 0.386 -6.171 1.00 0.00 H ATOM 186 HB2 ASP A 10 4.608 -1.438 -4.852 1.00 0.00 H ATOM 187 HB3 ASP A 10 3.356 -1.489 -6.088 1.00 0.00 H ATOM 188 N SER A 11 2.826 0.676 -7.754 1.00 0.00 N ATOM 189 CA SER A 11 2.126 0.992 -9.015 1.00 0.00 C ATOM 190 C SER A 11 2.603 2.321 -9.589 1.00 0.00 C ATOM 191 O SER A 11 2.503 2.555 -10.790 1.00 0.00 O ATOM 192 CB SER A 11 0.608 1.028 -8.790 1.00 0.00 C ATOM 193 OG SER A 11 0.115 -0.259 -8.496 1.00 0.00 O ATOM 194 H SER A 11 2.283 0.599 -6.939 1.00 0.00 H ATOM 195 HA SER A 11 2.359 0.214 -9.722 1.00 0.00 H ATOM 196 HB2 SER A 11 0.372 1.682 -7.964 1.00 0.00 H ATOM 197 HB3 SER A 11 0.124 1.390 -9.683 1.00 0.00 H ATOM 198 HG SER A 11 -0.377 -0.584 -9.246 1.00 0.00 H HETATM 199 N NH2 A 12 2.949 3.251 -8.709 1.00 0.00 N HETATM 200 HN1 NH2 A 12 2.878 3.038 -7.769 1.00 0.00 H HETATM 201 HN2 NH2 A 12 3.255 4.115 -9.040 1.00 0.00 H TER 202 NH2 A 12