HETATM 1 C ACE A 0 -7.092 -2.710 1.866 1.00 0.00 C HETATM 2 O ACE A 0 -7.528 -3.837 1.631 1.00 0.00 O HETATM 3 CH3 ACE A 0 -7.612 -1.904 3.034 1.00 0.00 C HETATM 4 H1 ACE A 0 -6.787 -1.552 3.680 1.00 0.00 H HETATM 5 H2 ACE A 0 -8.159 -1.013 2.677 1.00 0.00 H HETATM 6 H3 ACE A 0 -8.301 -2.505 3.651 1.00 0.00 H ATOM 7 N CYS A 1 -6.158 -2.108 1.146 1.00 0.00 N ATOM 8 CA CYS A 1 -5.562 -2.729 -0.088 1.00 0.00 C ATOM 9 C CYS A 1 -4.046 -3.166 -0.020 1.00 0.00 C ATOM 10 O CYS A 1 -3.542 -3.678 -1.027 1.00 0.00 O ATOM 11 CB CYS A 1 -5.708 -1.620 -1.156 1.00 0.00 C ATOM 12 SG CYS A 1 -7.417 -1.322 -1.650 1.00 0.00 S ATOM 13 H CYS A 1 -5.913 -1.150 1.512 1.00 0.00 H ATOM 14 HA CYS A 1 -6.123 -3.633 -0.473 1.00 0.00 H ATOM 15 HB2 CYS A 1 -5.263 -0.671 -0.801 1.00 0.00 H ATOM 16 HB3 CYS A 1 -5.152 -1.901 -2.068 1.00 0.00 H ATOM 17 N GLY A 2 -3.284 -2.991 1.082 1.00 0.00 N ATOM 18 CA GLY A 2 -1.822 -3.160 1.064 1.00 0.00 C ATOM 19 C GLY A 2 -1.220 -2.894 2.457 1.00 0.00 C ATOM 20 O GLY A 2 -1.070 -1.742 2.851 1.00 0.00 O ATOM 21 H GLY A 2 -3.747 -2.820 1.979 1.00 0.00 H ATOM 22 HA2 GLY A 2 -1.539 -4.143 0.649 1.00 0.00 H ATOM 23 HA3 GLY A 2 -1.403 -2.414 0.356 1.00 0.00 H ATOM 24 N ALA A 3 -0.843 -3.928 3.221 1.00 0.00 N ATOM 25 CA ALA A 3 -0.045 -3.739 4.470 1.00 0.00 C ATOM 26 C ALA A 3 1.410 -3.187 4.283 1.00 0.00 C ATOM 27 O ALA A 3 1.915 -2.470 5.148 1.00 0.00 O ATOM 28 CB ALA A 3 -0.098 -5.056 5.226 1.00 0.00 C ATOM 29 H ALA A 3 -1.231 -4.834 2.969 1.00 0.00 H ATOM 30 HA ALA A 3 -0.568 -2.992 5.098 1.00 0.00 H ATOM 31 HB1 ALA A 3 0.416 -4.943 6.197 1.00 0.00 H ATOM 32 HB2 ALA A 3 -1.143 -5.348 5.430 1.00 0.00 H ATOM 33 HB3 ALA A 3 0.403 -5.859 4.658 1.00 0.00 H ATOM 34 N GLU A 4 2.084 -3.516 3.170 1.00 0.00 N ATOM 35 CA GLU A 4 3.327 -2.798 2.750 1.00 0.00 C ATOM 36 C GLU A 4 3.086 -1.267 2.444 1.00 0.00 C ATOM 37 O GLU A 4 3.848 -0.399 2.882 1.00 0.00 O ATOM 38 CB GLU A 4 3.947 -3.523 1.553 1.00 0.00 C ATOM 39 CG GLU A 4 4.861 -4.742 1.869 1.00 0.00 C ATOM 40 CD GLU A 4 6.113 -4.412 2.662 1.00 0.00 C ATOM 41 OE1 GLU A 4 7.079 -3.865 2.100 1.00 0.00 O ATOM 42 OE2 GLU A 4 6.135 -4.643 3.887 1.00 0.00 O ATOM 43 H GLU A 4 1.630 -4.255 2.618 1.00 0.00 H ATOM 44 HA GLU A 4 4.071 -2.855 3.549 1.00 0.00 H ATOM 45 HB2 GLU A 4 3.120 -3.789 0.873 1.00 0.00 H ATOM 46 HB3 GLU A 4 4.557 -2.770 1.028 1.00 0.00 H ATOM 47 HG2 GLU A 4 4.310 -5.522 2.420 1.00 0.00 H ATOM 48 HG3 GLU A 4 5.203 -5.216 0.933 1.00 0.00 H ATOM 49 N ALA A 5 2.011 -0.938 1.696 1.00 0.00 N ATOM 50 CA ALA A 5 1.502 0.462 1.578 1.00 0.00 C ATOM 51 C ALA A 5 1.186 1.118 2.962 1.00 0.00 C ATOM 52 O ALA A 5 1.630 2.241 3.158 1.00 0.00 O ATOM 53 CB ALA A 5 0.222 0.395 0.735 1.00 0.00 C ATOM 54 H ALA A 5 1.461 -1.783 1.477 1.00 0.00 H ATOM 55 HA ALA A 5 2.234 1.144 1.060 1.00 0.00 H ATOM 56 HB1 ALA A 5 -0.194 1.399 0.582 1.00 0.00 H ATOM 57 HB2 ALA A 5 -0.577 -0.167 1.250 1.00 0.00 H ATOM 58 HB3 ALA A 5 0.388 -0.092 -0.238 1.00 0.00 H ATOM 59 N ALA A 6 0.464 0.466 3.896 1.00 0.00 N ATOM 60 CA ALA A 6 0.329 0.933 5.307 1.00 0.00 C ATOM 61 C ALA A 6 1.664 1.145 6.114 1.00 0.00 C ATOM 62 O ALA A 6 1.771 2.134 6.843 1.00 0.00 O ATOM 63 CB ALA A 6 -0.459 -0.170 5.991 1.00 0.00 C ATOM 64 H ALA A 6 0.092 -0.459 3.604 1.00 0.00 H ATOM 65 HA ALA A 6 -0.316 1.853 5.351 1.00 0.00 H ATOM 66 HB1 ALA A 6 -1.392 -0.400 5.452 1.00 0.00 H ATOM 67 HB2 ALA A 6 0.152 -1.087 6.059 1.00 0.00 H ATOM 68 HB3 ALA A 6 -0.692 0.135 7.024 1.00 0.00 H ATOM 69 N LYS A 7 2.667 0.240 5.987 1.00 0.00 N ATOM 70 CA LYS A 7 4.052 0.469 6.516 1.00 0.00 C ATOM 71 C LYS A 7 4.733 1.774 5.952 1.00 0.00 C ATOM 72 O LYS A 7 5.266 2.583 6.719 1.00 0.00 O ATOM 73 CB LYS A 7 4.764 -0.884 6.234 1.00 0.00 C ATOM 74 CG LYS A 7 6.249 -1.029 6.631 1.00 0.00 C ATOM 75 CD LYS A 7 6.689 -2.519 6.587 1.00 0.00 C ATOM 76 CE LYS A 7 8.093 -2.792 6.017 1.00 0.00 C ATOM 77 NZ LYS A 7 8.033 -2.765 4.529 1.00 0.00 N ATOM 78 H LYS A 7 2.436 -0.613 5.427 1.00 0.00 H ATOM 79 HA LYS A 7 3.991 0.625 7.618 1.00 0.00 H ATOM 80 HB2 LYS A 7 4.182 -1.682 6.740 1.00 0.00 H ATOM 81 HB3 LYS A 7 4.683 -1.126 5.155 1.00 0.00 H ATOM 82 HG2 LYS A 7 6.860 -0.394 5.958 1.00 0.00 H ATOM 83 HG3 LYS A 7 6.419 -0.613 7.645 1.00 0.00 H ATOM 84 HD2 LYS A 7 6.631 -2.918 7.619 1.00 0.00 H ATOM 85 HD3 LYS A 7 5.948 -3.149 6.045 1.00 0.00 H ATOM 86 HE2 LYS A 7 8.840 -2.075 6.425 1.00 0.00 H ATOM 87 HE3 LYS A 7 8.432 -3.797 6.361 1.00 0.00 H ATOM 88 HZ1 LYS A 7 7.655 -1.909 4.109 1.00 0.00 H ATOM 89 HZ2 LYS A 7 8.878 -3.019 4.004 1.00 0.00 H ATOM 90 HZ3 LYS A 7 7.348 -3.474 4.152 1.00 0.00 H ATOM 91 N ALA A 8 4.668 2.003 4.628 1.00 0.00 N ATOM 92 CA ALA A 8 4.995 3.314 4.014 1.00 0.00 C ATOM 93 C ALA A 8 4.106 4.519 4.496 1.00 0.00 C ATOM 94 O ALA A 8 4.631 5.608 4.697 1.00 0.00 O ATOM 95 CB ALA A 8 4.802 3.152 2.522 1.00 0.00 C ATOM 96 H ALA A 8 4.337 1.198 4.082 1.00 0.00 H ATOM 97 HA ALA A 8 6.072 3.538 4.128 1.00 0.00 H ATOM 98 HB1 ALA A 8 5.104 4.094 2.031 1.00 0.00 H ATOM 99 HB2 ALA A 8 3.744 2.955 2.291 1.00 0.00 H ATOM 100 HB3 ALA A 8 5.425 2.325 2.149 1.00 0.00 H ATOM 101 N HIS A 9 2.773 4.345 4.642 1.00 0.00 N ATOM 102 CA HIS A 9 1.865 5.333 5.302 1.00 0.00 C ATOM 103 C HIS A 9 2.284 5.743 6.764 1.00 0.00 C ATOM 104 O HIS A 9 2.370 6.947 7.001 1.00 0.00 O ATOM 105 CB HIS A 9 0.433 4.778 5.099 1.00 0.00 C ATOM 106 CG HIS A 9 -0.143 4.540 3.680 1.00 0.00 C ATOM 107 ND1 HIS A 9 -1.077 3.523 3.445 1.00 0.00 N ATOM 108 CD2 HIS A 9 0.217 5.140 2.480 1.00 0.00 C ATOM 109 CE1 HIS A 9 -1.320 3.642 2.069 1.00 0.00 C ATOM 110 NE2 HIS A 9 -0.595 4.647 1.528 1.00 0.00 N ATOM 111 H HIS A 9 2.432 3.392 4.391 1.00 0.00 H ATOM 112 HA HIS A 9 1.916 6.306 4.787 1.00 0.00 H ATOM 113 HB2 HIS A 9 0.401 3.826 5.652 1.00 0.00 H ATOM 114 HB3 HIS A 9 -0.259 5.438 5.636 1.00 0.00 H ATOM 115 HD1 HIS A 9 -1.634 2.974 4.114 1.00 0.00 H ATOM 116 HD2 HIS A 9 0.995 5.869 2.302 1.00 0.00 H ATOM 117 HE1 HIS A 9 -2.005 2.971 1.556 1.00 0.00 H ATOM 118 N ALA A 10 2.569 4.816 7.703 1.00 0.00 N ATOM 119 CA ALA A 10 3.264 5.132 8.977 1.00 0.00 C ATOM 120 C ALA A 10 4.640 5.885 8.842 1.00 0.00 C ATOM 121 O ALA A 10 4.783 6.986 9.389 1.00 0.00 O ATOM 122 CB ALA A 10 3.399 3.738 9.640 1.00 0.00 C ATOM 123 H ALA A 10 1.894 4.048 7.798 1.00 0.00 H ATOM 124 HA ALA A 10 2.619 5.776 9.599 1.00 0.00 H ATOM 125 HB1 ALA A 10 4.010 3.045 9.025 1.00 0.00 H ATOM 126 HB2 ALA A 10 3.904 3.803 10.620 1.00 0.00 H ATOM 127 HB3 ALA A 10 2.426 3.239 9.804 1.00 0.00 H ATOM 128 N LYS A 11 5.594 5.340 8.049 1.00 0.00 N ATOM 129 CA LYS A 11 6.887 6.058 7.745 1.00 0.00 C ATOM 130 C LYS A 11 6.742 7.518 7.173 1.00 0.00 C ATOM 131 O LYS A 11 7.518 8.431 7.465 1.00 0.00 O ATOM 132 CB LYS A 11 7.716 5.126 6.809 1.00 0.00 C ATOM 133 CG LYS A 11 9.173 5.586 6.495 1.00 0.00 C ATOM 134 CD LYS A 11 9.463 5.996 5.026 1.00 0.00 C ATOM 135 CE LYS A 11 8.701 7.253 4.567 1.00 0.00 C ATOM 136 NZ LYS A 11 9.038 7.656 3.181 1.00 0.00 N ATOM 137 H LYS A 11 5.185 4.616 7.423 1.00 0.00 H ATOM 138 HA LYS A 11 7.454 6.163 8.694 1.00 0.00 H ATOM 139 HB2 LYS A 11 7.770 4.128 7.287 1.00 0.00 H ATOM 140 HB3 LYS A 11 7.150 4.943 5.874 1.00 0.00 H ATOM 141 HG2 LYS A 11 9.479 6.399 7.192 1.00 0.00 H ATOM 142 HG3 LYS A 11 9.863 4.764 6.770 1.00 0.00 H ATOM 143 HD2 LYS A 11 10.553 6.166 4.927 1.00 0.00 H ATOM 144 HD3 LYS A 11 9.237 5.144 4.355 1.00 0.00 H ATOM 145 HE2 LYS A 11 7.610 7.047 4.601 1.00 0.00 H ATOM 146 HE3 LYS A 11 8.856 8.094 5.283 1.00 0.00 H ATOM 147 HZ1 LYS A 11 8.788 6.941 2.469 1.00 0.00 H ATOM 148 HZ2 LYS A 11 9.968 8.029 2.983 1.00 0.00 H ATOM 149 HZ3 LYS A 11 8.328 8.329 2.805 1.00 0.00 H ATOM 150 N ALA A 12 5.752 7.704 6.297 1.00 0.00 N ATOM 151 CA ALA A 12 5.300 9.016 5.811 1.00 0.00 C ATOM 152 C ALA A 12 4.651 9.875 6.943 1.00 0.00 C ATOM 153 O ALA A 12 5.276 10.822 7.384 1.00 0.00 O ATOM 154 CB ALA A 12 4.451 8.720 4.572 1.00 0.00 C ATOM 155 H ALA A 12 5.280 6.824 6.073 1.00 0.00 H ATOM 156 HA ALA A 12 6.192 9.559 5.458 1.00 0.00 H ATOM 157 HB1 ALA A 12 4.157 9.642 4.048 1.00 0.00 H ATOM 158 HB2 ALA A 12 5.031 8.130 3.847 1.00 0.00 H ATOM 159 HB3 ALA A 12 3.532 8.159 4.816 1.00 0.00 H ATOM 160 N ALA A 13 3.473 9.581 7.486 1.00 0.00 N ATOM 161 CA ALA A 13 2.923 10.219 8.738 1.00 0.00 C ATOM 162 C ALA A 13 3.920 10.648 9.903 1.00 0.00 C ATOM 163 O ALA A 13 3.680 11.605 10.640 1.00 0.00 O ATOM 164 CB ALA A 13 1.847 9.214 9.169 1.00 0.00 C ATOM 165 H ALA A 13 2.935 9.023 6.826 1.00 0.00 H ATOM 166 HA ALA A 13 2.415 11.156 8.446 1.00 0.00 H ATOM 167 HB1 ALA A 13 1.112 9.029 8.360 1.00 0.00 H ATOM 168 HB2 ALA A 13 1.291 9.577 10.047 1.00 0.00 H ATOM 169 HB3 ALA A 13 2.301 8.238 9.427 1.00 0.00 H ATOM 170 N GLU A 14 5.021 9.898 9.998 1.00 0.00 N ATOM 171 CA GLU A 14 6.261 10.238 10.763 1.00 0.00 C ATOM 172 C GLU A 14 7.105 11.375 10.032 1.00 0.00 C ATOM 173 O GLU A 14 7.091 12.526 10.477 1.00 0.00 O ATOM 174 CB GLU A 14 6.993 8.866 10.942 1.00 0.00 C ATOM 175 CG GLU A 14 8.460 8.850 11.468 1.00 0.00 C ATOM 176 CD GLU A 14 9.285 7.659 10.991 1.00 0.00 C ATOM 177 OE1 GLU A 14 9.570 7.572 9.774 1.00 0.00 O ATOM 178 OE2 GLU A 14 9.645 6.804 11.822 1.00 0.00 O ATOM 179 H GLU A 14 4.984 9.250 9.192 1.00 0.00 H ATOM 180 HA GLU A 14 5.991 10.621 11.765 1.00 0.00 H ATOM 181 HB2 GLU A 14 6.380 8.206 11.586 1.00 0.00 H ATOM 182 HB3 GLU A 14 6.997 8.348 9.965 1.00 0.00 H ATOM 183 HG2 GLU A 14 9.027 9.737 11.144 1.00 0.00 H ATOM 184 HG3 GLU A 14 8.486 8.868 12.570 1.00 0.00 H ATOM 185 N ALA A 15 7.836 11.076 8.930 1.00 0.00 N ATOM 186 CA ALA A 15 8.628 12.079 8.141 1.00 0.00 C ATOM 187 C ALA A 15 7.948 12.713 6.856 1.00 0.00 C ATOM 188 O ALA A 15 8.082 13.913 6.603 1.00 0.00 O ATOM 189 CB ALA A 15 9.961 11.368 7.826 1.00 0.00 C ATOM 190 H ALA A 15 7.902 10.056 8.780 1.00 0.00 H ATOM 191 HA ALA A 15 8.872 12.942 8.793 1.00 0.00 H ATOM 192 HB1 ALA A 15 10.663 12.040 7.301 1.00 0.00 H ATOM 193 HB2 ALA A 15 10.470 11.026 8.748 1.00 0.00 H ATOM 194 HB3 ALA A 15 9.814 10.475 7.191 1.00 0.00 H ATOM 195 N GLY A 16 7.301 11.895 6.009 1.00 0.00 N ATOM 196 CA GLY A 16 6.390 12.346 4.910 1.00 0.00 C ATOM 197 C GLY A 16 4.994 12.849 5.364 1.00 0.00 C ATOM 198 O GLY A 16 4.894 13.786 6.158 1.00 0.00 O ATOM 199 H GLY A 16 7.030 11.070 6.562 1.00 0.00 H ATOM 200 HA2 GLY A 16 6.842 13.114 4.285 1.00 0.00 H ATOM 201 HA3 GLY A 16 6.217 11.456 4.268 1.00 0.00 H ATOM 202 N CYS A 17 3.911 12.215 4.866 1.00 0.00 N ATOM 203 CA CYS A 17 2.551 12.410 5.417 1.00 0.00 C ATOM 204 C CYS A 17 1.532 11.293 5.036 1.00 0.00 C ATOM 205 O CYS A 17 1.790 10.091 4.902 1.00 0.00 O ATOM 206 CB CYS A 17 2.019 13.751 4.849 1.00 0.00 C ATOM 207 SG CYS A 17 1.762 13.557 3.060 1.00 0.00 S ATOM 208 H CYS A 17 4.078 11.571 4.094 1.00 0.00 H ATOM 209 HA CYS A 17 2.668 12.342 6.537 1.00 0.00 H ATOM 210 HB2 CYS A 17 1.059 14.026 5.319 1.00 0.00 H ATOM 211 HB3 CYS A 17 2.714 14.590 5.036 1.00 0.00 H HETATM 212 N NH2 A 18 0.312 11.758 4.868 1.00 0.00 N HETATM 213 HN1 NH2 A 18 0.124 12.759 4.985 1.00 0.00 H HETATM 214 HN2 NH2 A 18 -0.450 11.118 4.619 1.00 0.00 H TER 215 NH2 A 18 HETATM 216 C ACE B 0 -3.735 -1.919 -5.027 1.00 0.00 C HETATM 217 O ACE B 0 -2.873 -1.762 -4.175 1.00 0.00 O HETATM 218 CH3 ACE B 0 -3.377 -2.626 -6.329 1.00 0.00 C HETATM 219 H1 ACE B 0 -2.296 -2.851 -6.358 1.00 0.00 H HETATM 220 H2 ACE B 0 -3.603 -1.990 -7.203 1.00 0.00 H HETATM 221 H3 ACE B 0 -3.922 -3.579 -6.430 1.00 0.00 H ATOM 222 N CYS B 1 -4.952 -1.452 -4.755 1.00 0.00 N ATOM 223 CA CYS B 1 -6.146 -1.602 -5.656 1.00 0.00 C ATOM 224 C CYS B 1 -6.203 -0.614 -6.883 1.00 0.00 C ATOM 225 O CYS B 1 -6.539 -1.082 -7.975 1.00 0.00 O ATOM 226 CB CYS B 1 -7.402 -1.641 -4.750 1.00 0.00 C ATOM 227 SG CYS B 1 -7.422 -0.392 -3.437 1.00 0.00 S ATOM 228 H CYS B 1 -4.932 -0.956 -3.847 1.00 0.00 H ATOM 229 HA CYS B 1 -6.131 -2.607 -6.158 1.00 0.00 H ATOM 230 HB2 CYS B 1 -8.333 -1.572 -5.342 1.00 0.00 H ATOM 231 HB3 CYS B 1 -7.457 -2.628 -4.249 1.00 0.00 H ATOM 232 N GLY B 2 -5.884 0.692 -6.775 1.00 0.00 N ATOM 233 CA GLY B 2 -5.689 1.570 -7.965 1.00 0.00 C ATOM 234 C GLY B 2 -6.277 2.988 -7.874 1.00 0.00 C ATOM 235 O GLY B 2 -5.535 3.962 -7.942 1.00 0.00 O ATOM 236 H GLY B 2 -5.715 1.042 -5.829 1.00 0.00 H ATOM 237 HA2 GLY B 2 -4.596 1.677 -8.122 1.00 0.00 H ATOM 238 HA3 GLY B 2 -6.042 1.107 -8.905 1.00 0.00 H ATOM 239 N ALA B 3 -7.605 3.119 -7.786 1.00 0.00 N ATOM 240 CA ALA B 3 -8.285 4.446 -7.828 1.00 0.00 C ATOM 241 C ALA B 3 -8.386 5.235 -6.484 1.00 0.00 C ATOM 242 O ALA B 3 -8.173 6.450 -6.504 1.00 0.00 O ATOM 243 CB ALA B 3 -9.647 4.157 -8.455 1.00 0.00 C ATOM 244 H ALA B 3 -8.112 2.244 -7.629 1.00 0.00 H ATOM 245 HA ALA B 3 -7.726 5.121 -8.520 1.00 0.00 H ATOM 246 HB1 ALA B 3 -9.534 3.687 -9.450 1.00 0.00 H ATOM 247 HB2 ALA B 3 -10.209 5.097 -8.589 1.00 0.00 H ATOM 248 HB3 ALA B 3 -10.248 3.484 -7.816 1.00 0.00 H ATOM 249 N GLU B 4 -8.694 4.590 -5.338 1.00 0.00 N ATOM 250 CA GLU B 4 -8.543 5.224 -3.986 1.00 0.00 C ATOM 251 C GLU B 4 -7.066 5.697 -3.712 1.00 0.00 C ATOM 252 O GLU B 4 -6.816 6.859 -3.371 1.00 0.00 O ATOM 253 CB GLU B 4 -9.138 4.246 -2.930 1.00 0.00 C ATOM 254 CG GLU B 4 -9.631 4.883 -1.602 1.00 0.00 C ATOM 255 CD GLU B 4 -8.671 5.799 -0.876 1.00 0.00 C ATOM 256 OE1 GLU B 4 -7.559 5.364 -0.510 1.00 0.00 O ATOM 257 OE2 GLU B 4 -8.994 6.997 -0.717 1.00 0.00 O ATOM 258 H GLU B 4 -9.119 3.666 -5.450 1.00 0.00 H ATOM 259 HA GLU B 4 -9.132 6.153 -3.992 1.00 0.00 H ATOM 260 HB2 GLU B 4 -10.005 3.696 -3.349 1.00 0.00 H ATOM 261 HB3 GLU B 4 -8.398 3.457 -2.696 1.00 0.00 H ATOM 262 HG2 GLU B 4 -10.560 5.456 -1.769 1.00 0.00 H ATOM 263 HG3 GLU B 4 -9.905 4.096 -0.879 1.00 0.00 H ATOM 264 N ALA B 5 -6.087 4.815 -4.015 1.00 0.00 N ATOM 265 CA ALA B 5 -4.655 5.213 -4.124 1.00 0.00 C ATOM 266 C ALA B 5 -4.444 6.441 -5.046 1.00 0.00 C ATOM 267 O ALA B 5 -3.877 7.423 -4.577 1.00 0.00 O ATOM 268 CB ALA B 5 -3.906 4.040 -4.778 1.00 0.00 C ATOM 269 H ALA B 5 -6.517 4.024 -4.518 1.00 0.00 H ATOM 270 HA ALA B 5 -4.201 5.477 -3.134 1.00 0.00 H ATOM 271 HB1 ALA B 5 -4.320 3.825 -5.783 1.00 0.00 H ATOM 272 HB2 ALA B 5 -2.848 4.295 -4.976 1.00 0.00 H ATOM 273 HB3 ALA B 5 -3.963 3.118 -4.196 1.00 0.00 H ATOM 274 N ALA B 6 -4.912 6.410 -6.310 1.00 0.00 N ATOM 275 CA ALA B 6 -4.659 7.499 -7.253 1.00 0.00 C ATOM 276 C ALA B 6 -5.211 8.907 -6.804 1.00 0.00 C ATOM 277 O ALA B 6 -4.477 9.894 -6.781 1.00 0.00 O ATOM 278 CB ALA B 6 -5.339 7.083 -8.546 1.00 0.00 C ATOM 279 H ALA B 6 -5.488 5.599 -6.595 1.00 0.00 H ATOM 280 HA ALA B 6 -3.560 7.435 -7.403 1.00 0.00 H ATOM 281 HB1 ALA B 6 -6.428 6.971 -8.383 1.00 0.00 H ATOM 282 HB2 ALA B 6 -5.188 7.865 -9.306 1.00 0.00 H ATOM 283 HB3 ALA B 6 -4.927 6.132 -8.913 1.00 0.00 H ATOM 284 N LYS B 7 -6.501 8.943 -6.398 1.00 0.00 N ATOM 285 CA LYS B 7 -7.160 10.102 -5.742 1.00 0.00 C ATOM 286 C LYS B 7 -6.461 10.649 -4.450 1.00 0.00 C ATOM 287 O LYS B 7 -6.320 11.860 -4.310 1.00 0.00 O ATOM 288 CB LYS B 7 -8.634 9.678 -5.472 1.00 0.00 C ATOM 289 CG LYS B 7 -9.569 10.896 -5.308 1.00 0.00 C ATOM 290 CD LYS B 7 -10.951 10.518 -4.735 1.00 0.00 C ATOM 291 CE LYS B 7 -11.966 11.678 -4.714 1.00 0.00 C ATOM 292 NZ LYS B 7 -11.507 12.787 -3.820 1.00 0.00 N ATOM 293 H LYS B 7 -6.961 8.024 -6.476 1.00 0.00 H ATOM 294 HA LYS B 7 -7.147 10.935 -6.478 1.00 0.00 H ATOM 295 HB2 LYS B 7 -9.027 9.035 -6.287 1.00 0.00 H ATOM 296 HB3 LYS B 7 -8.665 9.011 -4.580 1.00 0.00 H ATOM 297 HG2 LYS B 7 -9.081 11.642 -4.648 1.00 0.00 H ATOM 298 HG3 LYS B 7 -9.671 11.400 -6.291 1.00 0.00 H ATOM 299 HD2 LYS B 7 -11.371 9.689 -5.342 1.00 0.00 H ATOM 300 HD3 LYS B 7 -10.830 10.072 -3.724 1.00 0.00 H ATOM 301 HE2 LYS B 7 -12.137 12.042 -5.755 1.00 0.00 H ATOM 302 HE3 LYS B 7 -12.959 11.286 -4.393 1.00 0.00 H ATOM 303 HZ1 LYS B 7 -11.314 12.467 -2.862 1.00 0.00 H ATOM 304 HZ2 LYS B 7 -10.618 13.200 -4.142 1.00 0.00 H ATOM 305 HZ3 LYS B 7 -12.160 13.579 -3.745 1.00 0.00 H ATOM 306 N ALA B 8 -6.043 9.788 -3.507 1.00 0.00 N ATOM 307 CA ALA B 8 -5.146 10.183 -2.387 1.00 0.00 C ATOM 308 C ALA B 8 -3.719 10.722 -2.783 1.00 0.00 C ATOM 309 O ALA B 8 -3.144 11.586 -2.114 1.00 0.00 O ATOM 310 CB ALA B 8 -4.912 8.906 -1.608 1.00 0.00 C ATOM 311 H ALA B 8 -6.323 8.807 -3.660 1.00 0.00 H ATOM 312 HA ALA B 8 -5.669 10.859 -1.679 1.00 0.00 H ATOM 313 HB1 ALA B 8 -5.860 8.468 -1.260 1.00 0.00 H ATOM 314 HB2 ALA B 8 -4.380 8.159 -2.225 1.00 0.00 H ATOM 315 HB3 ALA B 8 -4.278 9.150 -0.742 1.00 0.00 H ATOM 316 N HIS B 9 -3.108 10.111 -3.816 1.00 0.00 N ATOM 317 CA HIS B 9 -1.754 10.493 -4.315 1.00 0.00 C ATOM 318 C HIS B 9 -1.791 11.910 -5.014 1.00 0.00 C ATOM 319 O HIS B 9 -0.992 12.794 -4.671 1.00 0.00 O ATOM 320 CB HIS B 9 -1.275 9.222 -5.061 1.00 0.00 C ATOM 321 CG HIS B 9 -1.031 7.938 -4.215 1.00 0.00 C ATOM 322 ND1 HIS B 9 -0.902 6.704 -4.852 1.00 0.00 N ATOM 323 CD2 HIS B 9 -1.136 7.762 -2.825 1.00 0.00 C ATOM 324 CE1 HIS B 9 -0.859 5.812 -3.767 1.00 0.00 C ATOM 325 NE2 HIS B 9 -0.955 6.447 -2.577 1.00 0.00 N ATOM 326 H HIS B 9 -3.734 9.506 -4.400 1.00 0.00 H ATOM 327 HA HIS B 9 -1.050 10.608 -3.468 1.00 0.00 H ATOM 328 HB2 HIS B 9 -2.019 8.988 -5.852 1.00 0.00 H ATOM 329 HB3 HIS B 9 -0.353 9.470 -5.605 1.00 0.00 H ATOM 330 HD1 HIS B 9 -0.710 6.483 -5.839 1.00 0.00 H ATOM 331 HD2 HIS B 9 -1.333 8.541 -2.089 1.00 0.00 H ATOM 332 HE1 HIS B 9 -0.765 4.745 -3.928 1.00 0.00 H ATOM 333 N ALA B 10 -2.785 12.133 -5.903 1.00 0.00 N ATOM 334 CA ALA B 10 -3.189 13.474 -6.376 1.00 0.00 C ATOM 335 C ALA B 10 -3.566 14.452 -5.209 1.00 0.00 C ATOM 336 O ALA B 10 -2.929 15.490 -5.137 1.00 0.00 O ATOM 337 CB ALA B 10 -4.381 13.214 -7.321 1.00 0.00 C ATOM 338 H ALA B 10 -3.129 11.325 -6.429 1.00 0.00 H ATOM 339 HA ALA B 10 -2.367 13.938 -6.949 1.00 0.00 H ATOM 340 HB1 ALA B 10 -5.229 12.733 -6.793 1.00 0.00 H ATOM 341 HB2 ALA B 10 -4.113 12.566 -8.175 1.00 0.00 H ATOM 342 HB3 ALA B 10 -4.771 14.162 -7.735 1.00 0.00 H ATOM 343 N LYS B 11 -4.466 14.093 -4.256 1.00 0.00 N ATOM 344 CA LYS B 11 -4.735 14.895 -2.995 1.00 0.00 C ATOM 345 C LYS B 11 -3.470 15.555 -2.329 1.00 0.00 C ATOM 346 O LYS B 11 -3.419 16.776 -2.113 1.00 0.00 O ATOM 347 CB LYS B 11 -5.552 14.009 -2.016 1.00 0.00 C ATOM 348 CG LYS B 11 -5.849 14.602 -0.608 1.00 0.00 C ATOM 349 CD LYS B 11 -5.635 13.581 0.538 1.00 0.00 C ATOM 350 CE LYS B 11 -6.922 12.966 1.108 1.00 0.00 C ATOM 351 NZ LYS B 11 -7.394 13.870 2.191 1.00 0.00 N ATOM 352 H LYS B 11 -4.644 13.081 -4.337 1.00 0.00 H ATOM 353 HA LYS B 11 -5.424 15.717 -3.240 1.00 0.00 H ATOM 354 HB2 LYS B 11 -6.502 13.727 -2.505 1.00 0.00 H ATOM 355 HB3 LYS B 11 -5.001 13.065 -1.914 1.00 0.00 H ATOM 356 HG2 LYS B 11 -5.172 15.456 -0.401 1.00 0.00 H ATOM 357 HG3 LYS B 11 -6.844 15.086 -0.598 1.00 0.00 H ATOM 358 HD2 LYS B 11 -4.949 12.767 0.218 1.00 0.00 H ATOM 359 HD3 LYS B 11 -5.006 14.044 1.330 1.00 0.00 H ATOM 360 HE2 LYS B 11 -7.673 12.788 0.307 1.00 0.00 H ATOM 361 HE3 LYS B 11 -6.676 11.954 1.512 1.00 0.00 H ATOM 362 HZ1 LYS B 11 -6.660 13.953 2.912 1.00 0.00 H ATOM 363 HZ2 LYS B 11 -7.525 14.833 1.854 1.00 0.00 H ATOM 364 HZ3 LYS B 11 -8.249 13.569 2.672 1.00 0.00 H ATOM 365 N ALA B 12 -2.449 14.720 -2.048 1.00 0.00 N ATOM 366 CA ALA B 12 -1.100 15.192 -1.670 1.00 0.00 C ATOM 367 C ALA B 12 -0.515 16.220 -2.709 1.00 0.00 C ATOM 368 O ALA B 12 -0.606 17.426 -2.469 1.00 0.00 O ATOM 369 CB ALA B 12 -0.265 13.926 -1.392 1.00 0.00 C ATOM 370 H ALA B 12 -2.702 13.726 -2.126 1.00 0.00 H ATOM 371 HA ALA B 12 -1.208 15.731 -0.719 1.00 0.00 H ATOM 372 HB1 ALA B 12 -0.685 13.345 -0.548 1.00 0.00 H ATOM 373 HB2 ALA B 12 -0.212 13.259 -2.271 1.00 0.00 H ATOM 374 HB3 ALA B 12 0.772 14.185 -1.119 1.00 0.00 H ATOM 375 N ALA B 13 -0.052 15.795 -3.894 1.00 0.00 N ATOM 376 CA ALA B 13 0.280 16.706 -5.038 1.00 0.00 C ATOM 377 C ALA B 13 -0.738 17.824 -5.528 1.00 0.00 C ATOM 378 O ALA B 13 -0.425 18.572 -6.458 1.00 0.00 O ATOM 379 CB ALA B 13 0.565 15.697 -6.171 1.00 0.00 C ATOM 380 H ALA B 13 -0.194 14.792 -4.034 1.00 0.00 H ATOM 381 HA ALA B 13 1.217 17.242 -4.798 1.00 0.00 H ATOM 382 HB1 ALA B 13 -0.344 15.121 -6.436 1.00 0.00 H ATOM 383 HB2 ALA B 13 0.891 16.211 -7.093 1.00 0.00 H ATOM 384 HB3 ALA B 13 1.353 14.966 -5.911 1.00 0.00 H ATOM 385 N GLU B 14 -1.910 17.945 -4.890 1.00 0.00 N ATOM 386 CA GLU B 14 -2.986 18.945 -5.201 1.00 0.00 C ATOM 387 C GLU B 14 -2.798 20.131 -4.213 1.00 0.00 C ATOM 388 O GLU B 14 -2.457 21.245 -4.623 1.00 0.00 O ATOM 389 CB GLU B 14 -4.340 18.161 -5.178 1.00 0.00 C ATOM 390 CG GLU B 14 -5.710 18.836 -4.871 1.00 0.00 C ATOM 391 CD GLU B 14 -6.794 17.856 -4.401 1.00 0.00 C ATOM 392 OE1 GLU B 14 -7.468 17.233 -5.249 1.00 0.00 O ATOM 393 OE2 GLU B 14 -6.966 17.682 -3.173 1.00 0.00 O ATOM 394 H GLU B 14 -1.979 17.291 -4.063 1.00 0.00 H ATOM 395 HA GLU B 14 -2.858 19.356 -6.221 1.00 0.00 H ATOM 396 HB2 GLU B 14 -4.412 17.619 -6.142 1.00 0.00 H ATOM 397 HB3 GLU B 14 -4.246 17.371 -4.422 1.00 0.00 H ATOM 398 HG2 GLU B 14 -5.610 19.591 -4.073 1.00 0.00 H ATOM 399 HG3 GLU B 14 -6.093 19.376 -5.753 1.00 0.00 H ATOM 400 N ALA B 15 -2.947 19.872 -2.904 1.00 0.00 N ATOM 401 CA ALA B 15 -2.522 20.824 -1.854 1.00 0.00 C ATOM 402 C ALA B 15 -1.138 20.400 -1.253 1.00 0.00 C ATOM 403 O ALA B 15 -0.985 20.385 -0.031 1.00 0.00 O ATOM 404 CB ALA B 15 -3.654 20.700 -0.840 1.00 0.00 C ATOM 405 H ALA B 15 -3.278 18.913 -2.695 1.00 0.00 H ATOM 406 HA ALA B 15 -2.473 21.870 -2.218 1.00 0.00 H ATOM 407 HB1 ALA B 15 -3.710 19.663 -0.452 1.00 0.00 H ATOM 408 HB2 ALA B 15 -3.450 21.372 0.008 1.00 0.00 H ATOM 409 HB3 ALA B 15 -4.621 20.968 -1.296 1.00 0.00 H ATOM 410 N GLY B 16 -0.102 20.254 -2.109 1.00 0.00 N ATOM 411 CA GLY B 16 1.208 19.539 -1.810 1.00 0.00 C ATOM 412 C GLY B 16 1.517 19.111 -0.350 1.00 0.00 C ATOM 413 O GLY B 16 2.259 19.671 0.453 1.00 0.00 O ATOM 414 H GLY B 16 -0.720 19.730 -2.762 1.00 0.00 H ATOM 415 HA2 GLY B 16 1.354 18.688 -2.516 1.00 0.00 H ATOM 416 HA3 GLY B 16 2.035 20.192 -2.126 1.00 0.00 H ATOM 417 N CYS B 17 0.769 18.026 -0.167 1.00 0.00 N ATOM 418 CA CYS B 17 0.405 17.325 1.092 1.00 0.00 C ATOM 419 C CYS B 17 0.205 18.181 2.403 1.00 0.00 C ATOM 420 O CYS B 17 0.915 18.087 3.402 1.00 0.00 O ATOM 421 CB CYS B 17 1.352 16.128 1.316 1.00 0.00 C ATOM 422 SG CYS B 17 0.486 14.908 2.327 1.00 0.00 S ATOM 423 H CYS B 17 0.321 17.850 -1.089 1.00 0.00 H ATOM 424 HA CYS B 17 -0.618 16.917 0.831 1.00 0.00 H ATOM 425 HB2 CYS B 17 1.657 15.644 0.372 1.00 0.00 H ATOM 426 HB3 CYS B 17 2.286 16.443 1.819 1.00 0.00 H HETATM 427 N NH2 B 18 -0.791 19.033 2.485 1.00 0.00 N HETATM 428 HN1 NH2 B 18 -0.712 19.574 3.348 1.00 0.00 H HETATM 429 HN2 NH2 B 18 -1.059 19.410 1.566 1.00 0.00 H TER 430 NH2 B 18 HETATM 431 CO3 PC3 A 20 -0.778 5.472 -0.552 1.00 0.00 CO HETATM 432 C PC3 A 20 1.765 2.405 -2.353 1.00 0.00 C HETATM 433 C1 PC3 A 20 2.782 3.343 -1.917 1.00 0.00 C HETATM 434 C2A PC3 A 20 2.052 4.436 -1.358 1.00 0.00 C HETATM 435 N2B PC3 A 20 0.688 4.238 -1.311 1.00 0.00 N HETATM 436 C2C PC3 A 20 0.536 3.007 -1.919 1.00 0.00 C HETATM 437 CA PC3 A 20 2.657 5.660 -0.878 1.00 0.00 C HETATM 438 C4C PC3 A 20 2.045 6.827 -0.278 1.00 0.00 C HETATM 439 C2 PC3 A 20 2.764 7.983 0.169 1.00 0.00 C HETATM 440 C3 PC3 A 20 1.735 8.874 0.674 1.00 0.00 C HETATM 441 C4A PC3 A 20 0.519 8.146 0.503 1.00 0.00 C HETATM 442 N4B PC3 A 20 0.678 6.903 -0.088 1.00 0.00 N HETATM 443 CB PC3 A 20 -0.787 8.627 0.900 1.00 0.00 C HETATM 444 C6C PC3 A 20 -2.056 7.948 0.842 1.00 0.00 C HETATM 445 C4 PC3 A 20 -3.252 8.493 1.345 1.00 0.00 C HETATM 446 C5 PC3 A 20 -4.241 7.470 1.130 1.00 0.00 C HETATM 447 C6A PC3 A 20 -3.545 6.444 0.463 1.00 0.00 C HETATM 448 N6B PC3 A 20 -2.202 6.694 0.291 1.00 0.00 N HETATM 449 CC PC3 A 20 -4.167 5.234 -0.001 1.00 0.00 C HETATM 450 C8C PC3 A 20 -3.566 4.096 -0.662 1.00 0.00 C HETATM 451 C6 PC3 A 20 -4.273 2.919 -1.045 1.00 0.00 C HETATM 452 C7 PC3 A 20 -3.275 2.128 -1.739 1.00 0.00 C HETATM 453 C8A PC3 A 20 -2.066 2.865 -1.613 1.00 0.00 C HETATM 454 N8B PC3 A 20 -2.219 4.072 -0.973 1.00 0.00 N HETATM 455 CD PC3 A 20 -0.775 2.416 -2.096 1.00 0.00 C HETATM 456 C8 PC3 A 20 1.959 10.255 1.306 1.00 0.00 C HETATM 457 C9 PC3 A 20 4.279 3.264 -2.218 1.00 0.00 C HETATM 458 C10 PC3 A 20 -3.472 0.780 -2.415 1.00 0.00 C HETATM 459 C11 PC3 A 20 -5.694 7.430 1.554 1.00 0.00 C HETATM 460 C12 PC3 A 20 4.285 8.229 0.218 1.00 0.00 C HETATM 461 CX5 PC3 A 20 5.044 7.233 1.131 1.00 0.00 C HETATM 462 C14 PC3 A 20 1.927 1.402 -3.520 1.00 0.00 C HETATM 463 C15 PC3 A 20 2.047 2.073 -4.931 1.00 0.00 C HETATM 464 C16 PC3 A 20 -5.723 2.497 -0.702 1.00 0.00 C HETATM 465 C17 PC3 A 20 -6.136 2.468 0.802 1.00 0.00 C HETATM 466 C18 PC3 A 20 -3.389 9.815 2.058 1.00 0.00 C HETATM 467 C19 PC3 A 20 -2.204 10.744 1.743 1.00 0.00 C HETATM 468 C21 PC3 A 20 1.078 3.221 -5.231 1.00 0.00 C HETATM 469 O1 PC3 A 20 1.468 4.383 -4.983 1.00 0.00 O HETATM 470 O2 PC3 A 20 -0.133 2.975 -5.414 1.00 0.00 O HETATM 471 C22 PC3 A 20 6.486 7.598 1.467 1.00 0.00 C HETATM 472 O3 PC3 A 20 6.744 8.671 2.046 1.00 0.00 O HETATM 473 O22 PC3 A 20 7.369 6.752 1.223 1.00 0.00 O HETATM 474 C23 PC3 A 20 -2.208 12.029 2.559 1.00 0.00 C HETATM 475 O23 PC3 A 20 -3.218 12.762 2.504 1.00 0.00 O HETATM 476 O4 PC3 A 20 -1.206 12.285 3.251 1.00 0.00 O HETATM 477 C24 PC3 A 20 -5.168 1.823 1.792 1.00 0.00 C HETATM 478 O5 PC3 A 20 -5.283 0.613 2.073 1.00 0.00 O HETATM 479 O6 PC3 A 20 -4.200 2.515 2.191 1.00 0.00 O HETATM 480 HA PC3 A 20 3.732 5.717 -1.006 1.00 0.00 H HETATM 481 HB PC3 A 20 -0.814 9.613 1.350 1.00 0.00 H HETATM 482 HC PC3 A 20 -5.230 5.157 0.191 1.00 0.00 H HETATM 483 HD PC3 A 20 -0.783 1.466 -2.616 1.00 0.00 H HETATM 484 H81 PC3 A 20 2.409 10.965 0.586 1.00 0.00 H HETATM 485 H82 PC3 A 20 2.656 10.196 2.164 1.00 0.00 H HETATM 486 H83 PC3 A 20 1.042 10.738 1.692 1.00 0.00 H HETATM 487 H91 PC3 A 20 4.603 2.234 -2.456 1.00 0.00 H HETATM 488 H92 PC3 A 20 4.542 3.888 -3.094 1.00 0.00 H HETATM 489 H93 PC3 A 20 4.902 3.605 -1.370 1.00 0.00 H HETATM 490 H101 PC3 A 20 -4.525 0.619 -2.703 1.00 0.00 H HETATM 491 H102 PC3 A 20 -3.178 -0.056 -1.751 1.00 0.00 H HETATM 492 H103 PC3 A 20 -2.878 0.687 -3.344 1.00 0.00 H HETATM 493 H111 PC3 A 20 -5.906 6.559 2.202 1.00 0.00 H HETATM 494 H112 PC3 A 20 -6.380 7.334 0.689 1.00 0.00 H HETATM 495 H113 PC3 A 20 -5.995 8.336 2.110 1.00 0.00 H HETATM 496 H121 PC3 A 20 4.720 8.208 -0.800 1.00 0.00 H HETATM 497 H122 PC3 A 20 4.488 9.258 0.578 1.00 0.00 H HETATM 498 H221 PC3 A 20 4.513 7.093 2.085 1.00 0.00 H HETATM 499 H222 PC3 A 20 5.070 6.231 0.674 1.00 0.00 H HETATM 500 H141 PC3 A 20 2.813 0.763 -3.347 1.00 0.00 H HETATM 501 H142 PC3 A 20 1.081 0.691 -3.544 1.00 0.00 H HETATM 502 H151 PC3 A 20 1.925 1.315 -5.726 1.00 0.00 H HETATM 503 H152 PC3 A 20 3.070 2.467 -5.072 1.00 0.00 H HETATM 504 H161 PC3 A 20 -5.928 1.497 -1.118 1.00 0.00 H HETATM 505 H162 PC3 A 20 -6.425 3.164 -1.239 1.00 0.00 H HETATM 506 H171 PC3 A 20 -6.345 3.490 1.162 1.00 0.00 H HETATM 507 H172 PC3 A 20 -7.108 1.953 0.905 1.00 0.00 H HETATM 508 H181 PC3 A 20 -4.338 10.309 1.775 1.00 0.00 H HETATM 509 H182 PC3 A 20 -3.462 9.646 3.150 1.00 0.00 H HETATM 510 H192 PC3 A 20 -1.251 10.227 1.942 1.00 0.00 H HETATM 511 H191 PC3 A 20 -2.196 11.033 0.678 1.00 0.00 H