HETATM 1 C ACE A 0 6.789 1.753 -7.998 1.00 0.00 C HETATM 2 O ACE A 0 7.680 1.157 -7.368 1.00 0.00 O HETATM 3 CH3 ACE A 0 6.758 1.650 -9.510 1.00 0.00 C HETATM 4 H1 ACE A 0 6.928 0.625 -9.798 1.00 0.00 H HETATM 5 H2 ACE A 0 7.527 2.278 -9.935 1.00 0.00 H HETATM 6 H3 ACE A 0 5.797 1.975 -9.871 1.00 0.00 H ATOM 7 N GLU A 1 5.775 2.503 -7.430 1.00 0.00 N ATOM 8 CA GLU A 1 5.616 2.711 -5.972 1.00 0.00 C ATOM 9 C GLU A 1 5.118 1.413 -5.294 1.00 0.00 C ATOM 10 O GLU A 1 3.898 1.132 -5.251 1.00 0.00 O ATOM 11 CB GLU A 1 4.704 3.933 -5.664 1.00 0.00 C ATOM 12 CG GLU A 1 5.360 5.312 -5.864 1.00 0.00 C ATOM 13 CD GLU A 1 6.528 5.593 -4.926 1.00 0.00 C ATOM 14 OE1 GLU A 1 7.527 4.846 -4.986 1.00 0.00 O ATOM 15 OE2 GLU A 1 6.447 6.569 -4.158 1.00 0.00 O ATOM 16 H GLU A 1 5.118 2.899 -8.033 1.00 0.00 H ATOM 17 HA GLU A 1 6.606 2.927 -5.585 1.00 0.00 H ATOM 18 HB2 GLU A 1 3.836 3.882 -6.313 1.00 0.00 H ATOM 19 HB3 GLU A 1 4.376 3.862 -4.640 1.00 0.00 H ATOM 20 HG2 GLU A 1 5.720 5.376 -6.868 1.00 0.00 H ATOM 21 HG3 GLU A 1 4.614 6.080 -5.705 1.00 0.00 H ATOM 22 N LYS A 2 6.134 0.609 -4.811 1.00 0.00 N ATOM 23 CA LYS A 2 5.919 -0.705 -4.154 1.00 0.00 C ATOM 24 C LYS A 2 5.396 -0.585 -2.711 1.00 0.00 C ATOM 25 O LYS A 2 4.378 -1.227 -2.372 1.00 0.00 O ATOM 26 CB LYS A 2 7.219 -1.539 -4.191 1.00 0.00 C ATOM 27 CG LYS A 2 7.024 -3.042 -3.987 1.00 0.00 C ATOM 28 CD LYS A 2 8.347 -3.792 -4.066 1.00 0.00 C ATOM 29 CE LYS A 2 8.165 -5.281 -3.807 1.00 0.00 C ATOM 30 NZ LYS A 2 9.458 -6.009 -3.789 1.00 0.00 N ATOM 31 H LYS A 2 7.053 0.918 -4.929 1.00 0.00 H ATOM 32 HA LYS A 2 5.166 -1.217 -4.734 1.00 0.00 H ATOM 33 HB2 LYS A 2 7.702 -1.395 -5.152 1.00 0.00 H ATOM 34 HB3 LYS A 2 7.880 -1.187 -3.419 1.00 0.00 H ATOM 35 HG2 LYS A 2 6.591 -3.208 -3.016 1.00 0.00 H ATOM 36 HG3 LYS A 2 6.360 -3.418 -4.750 1.00 0.00 H ATOM 37 HD2 LYS A 2 8.771 -3.657 -5.051 1.00 0.00 H ATOM 38 HD3 LYS A 2 9.020 -3.391 -3.326 1.00 0.00 H ATOM 39 HE2 LYS A 2 7.684 -5.408 -2.852 1.00 0.00 H ATOM 40 HE3 LYS A 2 7.540 -5.698 -4.587 1.00 0.00 H ATOM 41 HZ1 LYS A 2 9.962 -5.821 -2.896 1.00 0.00 H ATOM 42 HZ2 LYS A 2 10.054 -5.700 -4.582 1.00 0.00 H ATOM 43 HZ3 LYS A 2 9.288 -7.028 -3.873 1.00 0.00 H ATOM 44 N HIS A 3 6.109 0.254 -1.865 1.00 0.00 N ATOM 45 CA HIS A 3 5.790 0.453 -0.428 1.00 0.00 C ATOM 46 C HIS A 3 4.507 1.267 -0.243 1.00 0.00 C ATOM 47 O HIS A 3 3.751 0.937 0.689 1.00 0.00 O ATOM 48 CB HIS A 3 6.981 1.143 0.271 1.00 0.00 C ATOM 49 CG HIS A 3 6.976 1.021 1.780 1.00 0.00 C ATOM 50 ND1 HIS A 3 6.987 -0.187 2.434 1.00 0.00 N ATOM 51 CD2 HIS A 3 6.927 1.965 2.754 1.00 0.00 C ATOM 52 CE1 HIS A 3 6.942 0.017 3.741 1.00 0.00 C ATOM 53 NE2 HIS A 3 6.907 1.309 3.958 1.00 0.00 N ATOM 54 H HIS A 3 6.891 0.708 -2.220 1.00 0.00 H ATOM 55 HA HIS A 3 5.636 -0.513 0.019 1.00 0.00 H ATOM 56 HB2 HIS A 3 7.912 0.717 -0.090 1.00 0.00 H ATOM 57 HB3 HIS A 3 6.950 2.190 0.018 1.00 0.00 H ATOM 58 HD1 HIS A 3 7.011 -1.066 2.004 1.00 0.00 H ATOM 59 HD2 HIS A 3 6.896 3.035 2.610 1.00 0.00 H ATOM 60 HE1 HIS A 3 6.913 -0.744 4.504 1.00 0.00 H ATOM 61 HE2 HIS A 3 6.836 1.727 4.837 1.00 0.00 H ATOM 62 N LYS A 4 4.243 2.259 -1.173 1.00 0.00 N ATOM 63 CA LYS A 4 3.014 3.095 -1.147 1.00 0.00 C ATOM 64 C LYS A 4 1.746 2.277 -1.435 1.00 0.00 C ATOM 65 O LYS A 4 0.739 2.434 -0.705 1.00 0.00 O ATOM 66 CB LYS A 4 3.122 4.261 -2.127 1.00 0.00 C ATOM 67 CG LYS A 4 4.126 5.321 -1.689 1.00 0.00 C ATOM 68 CD LYS A 4 3.954 6.614 -2.470 1.00 0.00 C ATOM 69 CE LYS A 4 4.852 7.711 -1.919 1.00 0.00 C ATOM 70 NZ LYS A 4 4.711 8.993 -2.670 1.00 0.00 N ATOM 71 H LYS A 4 4.882 2.396 -1.906 1.00 0.00 H ATOM 72 HA LYS A 4 2.922 3.497 -0.143 1.00 0.00 H ATOM 73 HB2 LYS A 4 3.417 3.877 -3.094 1.00 0.00 H ATOM 74 HB3 LYS A 4 2.152 4.738 -2.216 1.00 0.00 H ATOM 75 HG2 LYS A 4 3.975 5.524 -0.638 1.00 0.00 H ATOM 76 HG3 LYS A 4 5.132 4.947 -1.846 1.00 0.00 H ATOM 77 HD2 LYS A 4 4.199 6.441 -3.500 1.00 0.00 H ATOM 78 HD3 LYS A 4 2.928 6.933 -2.390 1.00 0.00 H ATOM 79 HE2 LYS A 4 4.586 7.884 -0.893 1.00 0.00 H ATOM 80 HE3 LYS A 4 5.883 7.384 -1.978 1.00 0.00 H ATOM 81 HZ1 LYS A 4 5.384 9.695 -2.305 1.00 0.00 H ATOM 82 HZ2 LYS A 4 3.742 9.372 -2.567 1.00 0.00 H ATOM 83 HZ3 LYS A 4 4.896 8.839 -3.678 1.00 0.00 H ATOM 84 N ILE A 5 1.808 1.377 -2.495 1.00 0.00 N ATOM 85 CA ILE A 5 0.661 0.535 -2.932 1.00 0.00 C ATOM 86 C ILE A 5 0.264 -0.505 -1.851 1.00 0.00 C ATOM 87 O ILE A 5 -0.945 -0.707 -1.635 1.00 0.00 O ATOM 88 CB ILE A 5 0.932 -0.096 -4.368 1.00 0.00 C ATOM 89 CG1 ILE A 5 -0.336 -0.732 -4.981 1.00 0.00 C ATOM 90 CG2 ILE A 5 2.098 -1.090 -4.398 1.00 0.00 C ATOM 91 CD1 ILE A 5 -1.246 0.271 -5.670 1.00 0.00 C ATOM 92 H ILE A 5 2.639 1.316 -3.003 1.00 0.00 H ATOM 93 HA ILE A 5 -0.177 1.217 -3.034 1.00 0.00 H ATOM 94 HB ILE A 5 1.222 0.725 -5.011 1.00 0.00 H ATOM 95 HG12 ILE A 5 -0.045 -1.473 -5.708 1.00 0.00 H ATOM 96 HG13 ILE A 5 -0.906 -1.213 -4.192 1.00 0.00 H ATOM 97 HG21 ILE A 5 1.756 -2.029 -4.810 1.00 0.00 H ATOM 98 HG22 ILE A 5 2.475 -1.256 -3.398 1.00 0.00 H ATOM 99 HG23 ILE A 5 2.882 -0.694 -5.015 1.00 0.00 H ATOM 100 HD11 ILE A 5 -2.061 -0.250 -6.149 1.00 0.00 H ATOM 101 HD12 ILE A 5 -0.675 0.810 -6.413 1.00 0.00 H ATOM 102 HD13 ILE A 5 -1.634 0.973 -4.945 1.00 0.00 H ATOM 103 N LEU A 6 1.296 -1.110 -1.164 1.00 0.00 N ATOM 104 CA LEU A 6 1.101 -2.114 -0.089 1.00 0.00 C ATOM 105 C LEU A 6 0.383 -1.499 1.130 1.00 0.00 C ATOM 106 O LEU A 6 -0.604 -2.063 1.606 1.00 0.00 O ATOM 107 CB LEU A 6 2.485 -2.712 0.345 1.00 0.00 C ATOM 108 CG LEU A 6 2.573 -4.049 1.176 1.00 0.00 C ATOM 109 CD1 LEU A 6 1.919 -3.966 2.567 1.00 0.00 C ATOM 110 CD2 LEU A 6 2.042 -5.274 0.415 1.00 0.00 C ATOM 111 H LEU A 6 2.214 -0.872 -1.404 1.00 0.00 H ATOM 112 HA LEU A 6 0.482 -2.904 -0.485 1.00 0.00 H ATOM 113 HB2 LEU A 6 3.046 -2.872 -0.554 1.00 0.00 H ATOM 114 HB3 LEU A 6 2.993 -1.948 0.923 1.00 0.00 H ATOM 115 HG LEU A 6 3.622 -4.236 1.349 1.00 0.00 H ATOM 116 HD11 LEU A 6 0.848 -4.073 2.474 1.00 0.00 H ATOM 117 HD12 LEU A 6 2.146 -3.012 3.018 1.00 0.00 H ATOM 118 HD13 LEU A 6 2.302 -4.758 3.198 1.00 0.00 H ATOM 119 HD21 LEU A 6 1.306 -4.956 -0.312 1.00 0.00 H ATOM 120 HD22 LEU A 6 1.588 -5.953 1.114 1.00 0.00 H ATOM 121 HD23 LEU A 6 2.857 -5.765 -0.085 1.00 0.00 H HETATM 122 C MK8 A 7 -1.217 0.730 2.603 1.00 0.00 C HETATM 123 N MK8 A 7 0.890 -0.306 1.621 1.00 0.00 N HETATM 124 O MK8 A 7 -1.999 0.718 3.582 1.00 0.00 O HETATM 125 CA MK8 A 7 0.346 0.463 2.793 1.00 0.00 C HETATM 126 CB MK8 A 7 1.178 1.820 2.878 1.00 0.00 C HETATM 127 CD MK8 A 7 0.536 2.789 5.219 1.00 0.00 C HETATM 128 CE MK8 A 7 -0.282 3.791 6.085 1.00 0.00 C HETATM 129 CG MK8 A 7 0.652 3.045 3.718 1.00 0.00 C HETATM 130 CB1 MK8 A 7 0.686 -0.348 4.082 1.00 0.00 C HETATM 131 HN MK8 A 7 1.649 0.070 1.156 1.00 0.00 H HETATM 132 HB MK8 A 7 1.329 2.156 1.855 1.00 0.00 H HETATM 133 HBA MK8 A 7 2.145 1.579 3.287 1.00 0.00 H HETATM 134 HD MK8 A 7 1.543 2.744 5.612 1.00 0.00 H HETATM 135 HDA MK8 A 7 0.086 1.826 5.354 1.00 0.00 H HETATM 136 HE MK8 A 7 0.289 4.468 6.685 1.00 0.00 H HETATM 137 HG MK8 A 7 -0.316 3.325 3.344 1.00 0.00 H HETATM 138 HGA MK8 A 7 1.334 3.865 3.581 1.00 0.00 H HETATM 139 HB1 MK8 A 7 -0.213 -0.479 4.672 1.00 0.00 H HETATM 140 HB1A MK8 A 7 1.417 0.193 4.655 1.00 0.00 H HETATM 141 HB1B MK8 A 7 1.082 -1.313 3.806 1.00 0.00 H ATOM 142 N ARG A 8 -1.620 1.075 1.314 1.00 0.00 N ATOM 143 CA ARG A 8 -3.019 1.472 0.944 1.00 0.00 C ATOM 144 C ARG A 8 -3.994 0.298 0.844 1.00 0.00 C ATOM 145 O ARG A 8 -5.172 0.488 1.220 1.00 0.00 O ATOM 146 CB ARG A 8 -3.014 2.253 -0.378 1.00 0.00 C ATOM 147 CG ARG A 8 -2.263 3.575 -0.291 1.00 0.00 C ATOM 148 CD ARG A 8 -2.461 4.383 -1.563 1.00 0.00 C ATOM 149 NE ARG A 8 -1.748 5.682 -1.520 1.00 0.00 N ATOM 150 CZ ARG A 8 -1.771 6.657 -2.499 1.00 0.00 C ATOM 151 NH1 ARG A 8 -2.477 6.527 -3.636 1.00 0.00 N ATOM 152 NH2 ARG A 8 -1.088 7.774 -2.304 1.00 0.00 N ATOM 153 H ARG A 8 -0.933 1.150 0.629 1.00 0.00 H ATOM 154 HA ARG A 8 -3.376 2.132 1.723 1.00 0.00 H ATOM 155 HB2 ARG A 8 -2.544 1.652 -1.148 1.00 0.00 H ATOM 156 HB3 ARG A 8 -4.037 2.461 -0.671 1.00 0.00 H ATOM 157 HG2 ARG A 8 -2.634 4.147 0.557 1.00 0.00 H ATOM 158 HG3 ARG A 8 -1.210 3.372 -0.163 1.00 0.00 H ATOM 159 HD2 ARG A 8 -2.098 3.814 -2.411 1.00 0.00 H ATOM 160 HD3 ARG A 8 -3.518 4.576 -1.688 1.00 0.00 H ATOM 161 HE ARG A 8 -1.217 5.866 -0.716 1.00 0.00 H ATOM 162 HH11 ARG A 8 -3.015 5.699 -3.796 1.00 0.00 H ATOM 163 HH12 ARG A 8 -2.469 7.256 -4.319 1.00 0.00 H ATOM 164 HH21 ARG A 8 -0.561 7.898 -1.459 1.00 0.00 H ATOM 165 HH22 ARG A 8 -1.106 8.496 -2.996 1.00 0.00 H ATOM 166 N LEU A 9 -3.496 -0.891 0.354 1.00 0.00 N ATOM 167 CA LEU A 9 -4.312 -2.122 0.197 1.00 0.00 C ATOM 168 C LEU A 9 -4.654 -2.735 1.571 1.00 0.00 C ATOM 169 O LEU A 9 -5.732 -3.349 1.704 1.00 0.00 O ATOM 170 CB LEU A 9 -3.565 -3.137 -0.692 1.00 0.00 C ATOM 171 CG LEU A 9 -4.387 -4.351 -1.193 1.00 0.00 C ATOM 172 CD1 LEU A 9 -5.195 -3.995 -2.444 1.00 0.00 C ATOM 173 CD2 LEU A 9 -3.463 -5.530 -1.466 1.00 0.00 C ATOM 174 H LEU A 9 -2.564 -0.924 0.071 1.00 0.00 H ATOM 175 HA LEU A 9 -5.235 -1.834 -0.285 1.00 0.00 H ATOM 176 HB2 LEU A 9 -3.187 -2.610 -1.561 1.00 0.00 H ATOM 177 HB3 LEU A 9 -2.721 -3.508 -0.129 1.00 0.00 H ATOM 178 HG LEU A 9 -5.086 -4.648 -0.426 1.00 0.00 H ATOM 179 HD11 LEU A 9 -6.246 -3.967 -2.204 1.00 0.00 H ATOM 180 HD12 LEU A 9 -5.028 -4.734 -3.208 1.00 0.00 H ATOM 181 HD13 LEU A 9 -4.883 -3.024 -2.803 1.00 0.00 H ATOM 182 HD21 LEU A 9 -2.508 -5.351 -0.989 1.00 0.00 H ATOM 183 HD22 LEU A 9 -3.311 -5.627 -2.531 1.00 0.00 H ATOM 184 HD23 LEU A 9 -3.901 -6.442 -1.073 1.00 0.00 H ATOM 185 N LEU A 10 -3.716 -2.564 2.579 1.00 0.00 N ATOM 186 CA LEU A 10 -3.871 -3.091 3.964 1.00 0.00 C ATOM 187 C LEU A 10 -4.843 -2.243 4.823 1.00 0.00 C ATOM 188 O LEU A 10 -5.871 -2.769 5.263 1.00 0.00 O ATOM 189 CB LEU A 10 -2.492 -3.207 4.651 1.00 0.00 C ATOM 190 CG LEU A 10 -2.449 -4.079 5.920 1.00 0.00 C ATOM 191 CD1 LEU A 10 -1.068 -4.674 6.109 1.00 0.00 C ATOM 192 CD2 LEU A 10 -2.829 -3.283 7.159 1.00 0.00 C ATOM 193 H LEU A 10 -2.885 -2.087 2.365 1.00 0.00 H ATOM 194 HA LEU A 10 -4.289 -4.080 3.880 1.00 0.00 H ATOM 195 HB2 LEU A 10 -1.801 -3.625 3.935 1.00 0.00 H ATOM 196 HB3 LEU A 10 -2.156 -2.212 4.901 1.00 0.00 H ATOM 197 HG LEU A 10 -3.156 -4.887 5.806 1.00 0.00 H ATOM 198 HD11 LEU A 10 -0.834 -5.309 5.271 1.00 0.00 H ATOM 199 HD12 LEU A 10 -1.053 -5.251 7.024 1.00 0.00 H ATOM 200 HD13 LEU A 10 -0.342 -3.878 6.179 1.00 0.00 H ATOM 201 HD21 LEU A 10 -2.023 -2.611 7.411 1.00 0.00 H ATOM 202 HD22 LEU A 10 -3.009 -3.961 7.979 1.00 0.00 H ATOM 203 HD23 LEU A 10 -3.724 -2.718 6.956 1.00 0.00 H HETATM 204 C MK8 A 11 -6.770 0.125 5.331 1.00 0.00 C HETATM 205 N MK8 A 11 -4.489 -0.921 5.060 1.00 0.00 N HETATM 206 O MK8 A 11 -7.665 0.741 5.983 1.00 0.00 O HETATM 207 CA MK8 A 11 -5.310 0.052 5.897 1.00 0.00 C HETATM 208 CB MK8 A 11 -4.727 1.521 5.815 1.00 0.00 C HETATM 209 CD MK8 A 11 -2.759 3.086 5.448 1.00 0.00 C HETATM 210 CE MK8 A 11 -1.666 3.912 6.181 1.00 0.00 C HETATM 211 CG MK8 A 11 -3.213 1.764 6.053 1.00 0.00 C HETATM 212 CB1 MK8 A 11 -5.355 -0.403 7.395 1.00 0.00 C HETATM 213 HN MK8 A 11 -3.653 -0.609 4.665 1.00 0.00 H HETATM 214 HB MK8 A 11 -5.260 2.124 6.541 1.00 0.00 H HETATM 215 HBA MK8 A 11 -4.951 1.912 4.843 1.00 0.00 H HETATM 216 HD MK8 A 11 -3.628 3.711 5.354 1.00 0.00 H HETATM 217 HDA MK8 A 11 -2.403 2.885 4.452 1.00 0.00 H HETATM 218 HE MK8 A 11 -2.036 4.681 6.852 1.00 0.00 H HETATM 219 HG MK8 A 11 -2.645 0.973 5.604 1.00 0.00 H HETATM 220 HGA MK8 A 11 -3.021 1.783 7.118 1.00 0.00 H HETATM 221 HB1 MK8 A 11 -5.437 -1.477 7.445 1.00 0.00 H HETATM 222 HB1A MK8 A 11 -6.213 0.043 7.879 1.00 0.00 H HETATM 223 HB1B MK8 A 11 -4.452 -0.082 7.898 1.00 0.00 H ATOM 224 N ASP A 12 -6.986 -0.478 4.099 1.00 0.00 N ATOM 225 CA ASP A 12 -8.294 -0.493 3.404 1.00 0.00 C ATOM 226 C ASP A 12 -9.308 -1.346 4.174 1.00 0.00 C ATOM 227 O ASP A 12 -10.478 -0.938 4.295 1.00 0.00 O ATOM 228 CB ASP A 12 -8.138 -0.982 1.959 1.00 0.00 C ATOM 229 CG ASP A 12 -9.424 -0.895 1.152 1.00 0.00 C ATOM 230 OD1 ASP A 12 -9.966 0.223 1.017 1.00 0.00 O ATOM 231 OD2 ASP A 12 -9.877 -1.944 0.658 1.00 0.00 O ATOM 232 H ASP A 12 -6.230 -0.912 3.658 1.00 0.00 H ATOM 233 HA ASP A 12 -8.656 0.521 3.381 1.00 0.00 H ATOM 234 HB2 ASP A 12 -7.389 -0.381 1.462 1.00 0.00 H ATOM 235 HB3 ASP A 12 -7.815 -2.010 1.978 1.00 0.00 H ATOM 236 N SER A 13 -8.823 -2.538 4.676 1.00 0.00 N ATOM 237 CA SER A 13 -9.640 -3.510 5.446 1.00 0.00 C ATOM 238 C SER A 13 -9.889 -3.009 6.863 1.00 0.00 C ATOM 239 O SER A 13 -11.002 -3.076 7.371 1.00 0.00 O ATOM 240 CB SER A 13 -8.947 -4.881 5.499 1.00 0.00 C ATOM 241 OG SER A 13 -9.721 -5.816 6.234 1.00 0.00 O ATOM 242 H SER A 13 -7.878 -2.756 4.513 1.00 0.00 H ATOM 243 HA SER A 13 -10.592 -3.613 4.947 1.00 0.00 H ATOM 244 HB2 SER A 13 -8.812 -5.250 4.491 1.00 0.00 H ATOM 245 HB3 SER A 13 -7.980 -4.775 5.982 1.00 0.00 H ATOM 246 HG SER A 13 -10.255 -6.343 5.631 1.00 0.00 H HETATM 247 N NH2 A 14 -8.823 -2.612 7.537 1.00 0.00 N HETATM 248 HN1 NH2 A 14 -7.949 -2.662 7.091 1.00 0.00 H HETATM 249 HN2 NH2 A 14 -8.953 -2.288 8.453 1.00 0.00 H TER 250 NH2 A 14