HETATM 1 C ACE A 1 4.171 -1.442 12.363 1.00 0.00 C HETATM 2 O ACE A 1 3.068 -1.883 12.615 1.00 0.00 O HETATM 3 CH3 ACE A 1 4.949 -0.617 13.390 1.00 0.00 C HETATM 4 H1 ACE A 1 4.282 -0.301 14.178 1.00 0.00 H HETATM 5 H2 ACE A 1 5.375 0.251 12.909 1.00 0.00 H HETATM 6 H3 ACE A 1 5.740 -1.221 13.810 1.00 0.00 H ATOM 7 N CYS A 2 4.744 -1.656 11.206 1.00 0.00 N ATOM 8 CA CYS A 2 4.050 -2.461 10.152 1.00 0.00 C ATOM 9 C CYS A 2 2.652 -1.897 9.870 1.00 0.00 C ATOM 10 O CYS A 2 1.650 -2.531 10.139 1.00 0.00 O ATOM 11 CB CYS A 2 3.955 -3.877 10.729 1.00 0.00 C ATOM 12 SG CYS A 2 5.315 -4.888 10.087 1.00 0.00 S ATOM 13 H CYS A 2 5.637 -1.292 11.031 1.00 0.00 H ATOM 14 HA CYS A 2 4.635 -2.472 9.246 1.00 0.00 H ATOM 15 HB2 CYS A 2 4.019 -3.833 11.805 1.00 0.00 H ATOM 16 HB3 CYS A 2 3.012 -4.319 10.442 1.00 0.00 H ATOM 17 N ARG A 3 2.579 -0.710 9.329 1.00 0.00 N ATOM 18 CA ARG A 3 1.249 -0.100 9.022 1.00 0.00 C ATOM 19 C ARG A 3 1.060 0.020 7.505 1.00 0.00 C ATOM 20 O ARG A 3 2.004 -0.073 6.746 1.00 0.00 O ATOM 21 CB ARG A 3 1.286 1.276 9.685 1.00 0.00 C ATOM 22 CG ARG A 3 1.370 1.098 11.203 1.00 0.00 C ATOM 23 CD ARG A 3 0.989 2.408 11.893 1.00 0.00 C ATOM 24 NE ARG A 3 0.712 2.029 13.305 1.00 0.00 N ATOM 25 CZ ARG A 3 1.662 2.097 14.197 1.00 0.00 C ATOM 26 NH1 ARG A 3 2.009 3.254 14.691 1.00 0.00 N ATOM 27 NH2 ARG A 3 2.266 1.011 14.592 1.00 0.00 N ATOM 28 H ARG A 3 3.401 -0.219 9.119 1.00 0.00 H ATOM 29 HA ARG A 3 0.457 -0.693 9.450 1.00 0.00 H ATOM 30 HB2 ARG A 3 2.150 1.823 9.335 1.00 0.00 H ATOM 31 HB3 ARG A 3 0.388 1.820 9.437 1.00 0.00 H ATOM 32 HG2 ARG A 3 0.690 0.315 11.511 1.00 0.00 H ATOM 33 HG3 ARG A 3 2.378 0.827 11.478 1.00 0.00 H ATOM 34 HD2 ARG A 3 1.810 3.109 11.841 1.00 0.00 H ATOM 35 HD3 ARG A 3 0.104 2.827 11.441 1.00 0.00 H ATOM 36 HE ARG A 3 -0.183 1.727 13.565 1.00 0.00 H ATOM 37 HH11 ARG A 3 1.546 4.087 14.387 1.00 0.00 H ATOM 38 HH12 ARG A 3 2.736 3.308 15.375 1.00 0.00 H ATOM 39 HH21 ARG A 3 2.000 0.125 14.212 1.00 0.00 H ATOM 40 HH22 ARG A 3 2.994 1.064 15.276 1.00 0.00 H ATOM 41 N TRP A 4 -0.156 0.218 7.059 1.00 0.00 N ATOM 42 CA TRP A 4 -0.415 0.337 5.582 1.00 0.00 C ATOM 43 C TRP A 4 -1.224 1.604 5.286 1.00 0.00 C ATOM 44 O TRP A 4 -2.223 1.567 4.596 1.00 0.00 O ATOM 45 CB TRP A 4 -1.243 -0.908 5.217 1.00 0.00 C ATOM 46 CG TRP A 4 -0.961 -1.312 3.808 1.00 0.00 C ATOM 47 CD1 TRP A 4 -0.777 -0.456 2.775 1.00 0.00 C ATOM 48 CD2 TRP A 4 -0.829 -2.656 3.259 1.00 0.00 C ATOM 49 NE1 TRP A 4 -0.525 -1.189 1.631 1.00 0.00 N ATOM 50 CE2 TRP A 4 -0.549 -2.548 1.877 1.00 0.00 C ATOM 51 CE3 TRP A 4 -0.919 -3.947 3.818 1.00 0.00 C ATOM 52 CZ2 TRP A 4 -0.364 -3.675 1.078 1.00 0.00 C ATOM 53 CZ3 TRP A 4 -0.734 -5.085 3.014 1.00 0.00 C ATOM 54 CH2 TRP A 4 -0.456 -4.948 1.647 1.00 0.00 C ATOM 55 H TRP A 4 -0.901 0.282 7.693 1.00 0.00 H ATOM 56 HA TRP A 4 0.513 0.346 5.027 1.00 0.00 H ATOM 57 HB2 TRP A 4 -0.986 -1.722 5.879 1.00 0.00 H ATOM 58 HB3 TRP A 4 -2.294 -0.681 5.318 1.00 0.00 H ATOM 59 HD1 TRP A 4 -0.812 0.622 2.839 1.00 0.00 H ATOM 60 HE1 TRP A 4 -0.351 -0.810 0.746 1.00 0.00 H ATOM 61 HE3 TRP A 4 -1.134 -4.064 4.869 1.00 0.00 H ATOM 62 HZ2 TRP A 4 -0.148 -3.566 0.024 1.00 0.00 H ATOM 63 HZ3 TRP A 4 -0.807 -6.071 3.449 1.00 0.00 H ATOM 64 HH2 TRP A 4 -0.317 -5.824 1.034 1.00 0.00 H ATOM 65 N LEU A 5 -0.799 2.723 5.802 1.00 0.00 N ATOM 66 CA LEU A 5 -1.541 3.996 5.554 1.00 0.00 C ATOM 67 C LEU A 5 -0.875 4.822 4.445 1.00 0.00 C ATOM 68 O LEU A 5 -0.053 4.334 3.688 1.00 0.00 O ATOM 69 CB LEU A 5 -1.511 4.725 6.895 1.00 0.00 C ATOM 70 CG LEU A 5 -2.690 4.242 7.741 1.00 0.00 C ATOM 71 CD1 LEU A 5 -2.548 4.750 9.177 1.00 0.00 C ATOM 72 CD2 LEU A 5 -3.994 4.768 7.139 1.00 0.00 C ATOM 73 H LEU A 5 0.011 2.729 6.352 1.00 0.00 H ATOM 74 HA LEU A 5 -2.564 3.788 5.285 1.00 0.00 H ATOM 75 HB2 LEU A 5 -0.583 4.503 7.403 1.00 0.00 H ATOM 76 HB3 LEU A 5 -1.593 5.789 6.737 1.00 0.00 H ATOM 77 HG LEU A 5 -2.707 3.162 7.745 1.00 0.00 H ATOM 78 HD11 LEU A 5 -3.464 4.560 9.717 1.00 0.00 H ATOM 79 HD12 LEU A 5 -2.350 5.811 9.168 1.00 0.00 H ATOM 80 HD13 LEU A 5 -1.731 4.236 9.661 1.00 0.00 H ATOM 81 HD21 LEU A 5 -4.726 4.899 7.924 1.00 0.00 H ATOM 82 HD22 LEU A 5 -4.368 4.060 6.415 1.00 0.00 H ATOM 83 HD23 LEU A 5 -3.811 5.716 6.655 1.00 0.00 H ATOM 84 N ARG A 6 -1.227 6.076 4.347 1.00 0.00 N ATOM 85 CA ARG A 6 -0.631 6.942 3.285 1.00 0.00 C ATOM 86 C ARG A 6 0.859 7.129 3.557 1.00 0.00 C ATOM 87 O ARG A 6 1.650 7.296 2.651 1.00 0.00 O ATOM 88 CB ARG A 6 -1.367 8.284 3.394 1.00 0.00 C ATOM 89 CG ARG A 6 -1.182 8.862 4.803 1.00 0.00 C ATOM 90 CD ARG A 6 -2.249 9.928 5.070 1.00 0.00 C ATOM 91 NE ARG A 6 -2.442 9.913 6.550 1.00 0.00 N ATOM 92 CZ ARG A 6 -1.639 10.596 7.323 1.00 0.00 C ATOM 93 NH1 ARG A 6 -0.546 10.047 7.778 1.00 0.00 N ATOM 94 NH2 ARG A 6 -1.933 11.827 7.644 1.00 0.00 N ATOM 95 H ARG A 6 -1.889 6.443 4.966 1.00 0.00 H ATOM 96 HA ARG A 6 -0.790 6.510 2.309 1.00 0.00 H ATOM 97 HB2 ARG A 6 -0.964 8.975 2.667 1.00 0.00 H ATOM 98 HB3 ARG A 6 -2.420 8.136 3.203 1.00 0.00 H ATOM 99 HG2 ARG A 6 -1.275 8.072 5.531 1.00 0.00 H ATOM 100 HG3 ARG A 6 -0.204 9.310 4.881 1.00 0.00 H ATOM 101 HD2 ARG A 6 -1.901 10.897 4.741 1.00 0.00 H ATOM 102 HD3 ARG A 6 -3.174 9.670 4.575 1.00 0.00 H ATOM 103 HE ARG A 6 -3.170 9.390 6.942 1.00 0.00 H ATOM 104 HH11 ARG A 6 -0.321 9.104 7.536 1.00 0.00 H ATOM 105 HH12 ARG A 6 0.068 10.572 8.369 1.00 0.00 H ATOM 106 HH21 ARG A 6 -2.772 12.247 7.299 1.00 0.00 H ATOM 107 HH22 ARG A 6 -1.319 12.350 8.236 1.00 0.00 H ATOM 108 N GLY A 7 1.246 7.078 4.799 1.00 0.00 N ATOM 109 CA GLY A 7 2.687 7.236 5.149 1.00 0.00 C ATOM 110 C GLY A 7 3.302 5.851 5.371 1.00 0.00 C ATOM 111 O GLY A 7 4.103 5.659 6.264 1.00 0.00 O ATOM 112 H GLY A 7 0.586 6.929 5.508 1.00 0.00 H ATOM 113 HA2 GLY A 7 3.211 7.749 4.349 1.00 0.00 H ATOM 114 HA3 GLY A 7 2.771 7.812 6.059 1.00 0.00 H ATOM 115 N ASP A 8 2.930 4.882 4.573 1.00 0.00 N ATOM 116 CA ASP A 8 3.495 3.508 4.756 1.00 0.00 C ATOM 117 C ASP A 8 4.821 3.349 4.001 1.00 0.00 C ATOM 118 O ASP A 8 5.022 2.392 3.279 1.00 0.00 O ATOM 119 CB ASP A 8 2.433 2.569 4.181 1.00 0.00 C ATOM 120 CG ASP A 8 2.225 2.857 2.687 1.00 0.00 C ATOM 121 OD1 ASP A 8 2.612 3.925 2.245 1.00 0.00 O ATOM 122 OD2 ASP A 8 1.677 2.000 2.013 1.00 0.00 O ATOM 123 H ASP A 8 2.272 5.051 3.861 1.00 0.00 H ATOM 124 HA ASP A 8 3.636 3.297 5.805 1.00 0.00 H ATOM 125 HB2 ASP A 8 2.755 1.546 4.308 1.00 0.00 H ATOM 126 HB3 ASP A 8 1.503 2.720 4.706 1.00 0.00 H ATOM 127 N TRP A 9 5.728 4.274 4.165 1.00 0.00 N ATOM 128 CA TRP A 9 7.040 4.168 3.461 1.00 0.00 C ATOM 129 C TRP A 9 8.140 3.614 4.388 1.00 0.00 C ATOM 130 O TRP A 9 9.281 3.491 3.991 1.00 0.00 O ATOM 131 CB TRP A 9 7.369 5.591 3.024 1.00 0.00 C ATOM 132 CG TRP A 9 7.939 5.528 1.641 1.00 0.00 C ATOM 133 CD1 TRP A 9 9.246 5.345 1.366 1.00 0.00 C ATOM 134 CD2 TRP A 9 7.259 5.601 0.346 1.00 0.00 C ATOM 135 NE1 TRP A 9 9.423 5.333 -0.001 1.00 0.00 N ATOM 136 CE2 TRP A 9 8.232 5.484 -0.676 1.00 0.00 C ATOM 137 CE3 TRP A 9 5.915 5.763 -0.041 1.00 0.00 C ATOM 138 CZ2 TRP A 9 7.892 5.530 -2.025 1.00 0.00 C ATOM 139 CZ3 TRP A 9 5.567 5.806 -1.402 1.00 0.00 C ATOM 140 CH2 TRP A 9 6.554 5.690 -2.393 1.00 0.00 C ATOM 141 H TRP A 9 5.551 5.035 4.755 1.00 0.00 H ATOM 142 HA TRP A 9 6.951 3.548 2.584 1.00 0.00 H ATOM 143 HB2 TRP A 9 6.474 6.195 3.031 1.00 0.00 H ATOM 144 HB3 TRP A 9 8.096 6.021 3.700 1.00 0.00 H ATOM 145 HD1 TRP A 9 10.026 5.228 2.095 1.00 0.00 H ATOM 146 HE1 TRP A 9 10.282 5.229 -0.456 1.00 0.00 H ATOM 147 HE3 TRP A 9 5.147 5.844 0.711 1.00 0.00 H ATOM 148 HZ2 TRP A 9 8.657 5.438 -2.780 1.00 0.00 H ATOM 149 HZ3 TRP A 9 4.532 5.930 -1.687 1.00 0.00 H ATOM 150 HH2 TRP A 9 6.282 5.720 -3.438 1.00 0.00 H ATOM 151 N ARG A 10 7.819 3.294 5.619 1.00 0.00 N ATOM 152 CA ARG A 10 8.863 2.765 6.559 1.00 0.00 C ATOM 153 C ARG A 10 8.818 1.231 6.672 1.00 0.00 C ATOM 154 O ARG A 10 7.764 0.628 6.635 1.00 0.00 O ATOM 155 CB ARG A 10 8.538 3.410 7.901 1.00 0.00 C ATOM 156 CG ARG A 10 7.171 2.924 8.394 1.00 0.00 C ATOM 157 CD ARG A 10 7.363 2.030 9.620 1.00 0.00 C ATOM 158 NE ARG A 10 8.050 2.896 10.621 1.00 0.00 N ATOM 159 CZ ARG A 10 9.044 2.422 11.323 1.00 0.00 C ATOM 160 NH1 ARG A 10 8.976 1.216 11.817 1.00 0.00 N ATOM 161 NH2 ARG A 10 10.106 3.153 11.532 1.00 0.00 N ATOM 162 H ARG A 10 6.896 3.405 5.926 1.00 0.00 H ATOM 163 HA ARG A 10 9.847 3.082 6.239 1.00 0.00 H ATOM 164 HB2 ARG A 10 9.300 3.142 8.621 1.00 0.00 H ATOM 165 HB3 ARG A 10 8.518 4.483 7.787 1.00 0.00 H ATOM 166 HG2 ARG A 10 6.557 3.774 8.658 1.00 0.00 H ATOM 167 HG3 ARG A 10 6.685 2.358 7.614 1.00 0.00 H ATOM 168 HD2 ARG A 10 6.405 1.699 9.999 1.00 0.00 H ATOM 169 HD3 ARG A 10 7.986 1.184 9.375 1.00 0.00 H ATOM 170 HE ARG A 10 7.759 3.823 10.749 1.00 0.00 H ATOM 171 HH11 ARG A 10 8.163 0.656 11.656 1.00 0.00 H ATOM 172 HH12 ARG A 10 9.735 0.853 12.355 1.00 0.00 H ATOM 173 HH21 ARG A 10 10.161 4.077 11.154 1.00 0.00 H ATOM 174 HH22 ARG A 10 10.866 2.788 12.071 1.00 0.00 H ATOM 175 N GLN A 11 9.958 0.599 6.830 1.00 0.00 N ATOM 176 CA GLN A 11 9.989 -0.892 6.972 1.00 0.00 C ATOM 177 C GLN A 11 9.709 -1.310 8.419 1.00 0.00 C ATOM 178 O GLN A 11 9.733 -0.499 9.325 1.00 0.00 O ATOM 179 CB GLN A 11 11.402 -1.301 6.566 1.00 0.00 C ATOM 180 CG GLN A 11 11.467 -1.424 5.044 1.00 0.00 C ATOM 181 CD GLN A 11 12.397 -2.574 4.660 1.00 0.00 C ATOM 182 OE1 GLN A 11 13.364 -2.377 3.952 1.00 0.00 O ATOM 183 NE2 GLN A 11 12.144 -3.777 5.099 1.00 0.00 N ATOM 184 H GLN A 11 10.794 1.109 6.873 1.00 0.00 H ATOM 185 HA GLN A 11 9.271 -1.348 6.306 1.00 0.00 H ATOM 186 HB2 GLN A 11 12.104 -0.552 6.901 1.00 0.00 H ATOM 187 HB3 GLN A 11 11.644 -2.254 7.013 1.00 0.00 H ATOM 188 HG2 GLN A 11 10.476 -1.617 4.657 1.00 0.00 H ATOM 189 HG3 GLN A 11 11.843 -0.502 4.625 1.00 0.00 H ATOM 190 HE21 GLN A 11 11.364 -3.935 5.672 1.00 0.00 H ATOM 191 HE22 GLN A 11 12.732 -4.520 4.857 1.00 0.00 H ATOM 192 N CYS A 12 9.452 -2.576 8.641 1.00 0.00 N ATOM 193 CA CYS A 12 9.181 -3.057 10.030 1.00 0.00 C ATOM 194 C CYS A 12 10.489 -3.436 10.730 1.00 0.00 C ATOM 195 O CYS A 12 10.574 -3.424 11.942 1.00 0.00 O ATOM 196 CB CYS A 12 8.279 -4.286 9.870 1.00 0.00 C ATOM 197 SG CYS A 12 6.939 -4.221 11.089 1.00 0.00 S ATOM 198 H CYS A 12 9.447 -3.210 7.895 1.00 0.00 H ATOM 199 HA CYS A 12 8.666 -2.294 10.594 1.00 0.00 H ATOM 200 HB2 CYS A 12 7.859 -4.298 8.876 1.00 0.00 H ATOM 201 HB3 CYS A 12 8.862 -5.180 10.027 1.00 0.00 H HETATM 202 N NH2 A 13 11.521 -3.789 10.011 1.00 0.00 N HETATM 203 HN1 NH2 A 13 11.456 -3.798 9.034 1.00 0.00 H HETATM 204 HN2 NH2 A 13 12.360 -4.041 10.449 1.00 0.00 H TER 205 NH2 A 13