HETATM 1 C ACE A 22 -8.432 -0.908 9.229 1.00 0.00 C HETATM 2 O ACE A 22 -7.533 -1.696 9.516 1.00 0.00 O HETATM 3 CH3 ACE A 22 -9.872 -1.224 9.613 1.00 0.00 C HETATM 4 H1 ACE A 22 -9.916 -2.180 10.134 1.00 0.00 H HETATM 5 H2 ACE A 22 -10.256 -0.441 10.268 1.00 0.00 H HETATM 6 H3 ACE A 22 -10.486 -1.277 8.714 1.00 0.00 H ATOM 7 N CYS A 23 -8.232 0.245 8.578 1.00 0.00 N ATOM 8 CA CYS A 23 -6.937 0.732 8.119 1.00 0.00 C ATOM 9 C CYS A 23 -6.078 1.155 9.307 1.00 0.00 C ATOM 10 O CYS A 23 -6.129 2.307 9.736 1.00 0.00 O ATOM 11 CB CYS A 23 -7.135 1.871 7.115 1.00 0.00 C ATOM 12 SG CYS A 23 -8.019 1.438 5.589 1.00 0.00 S ATOM 13 H CYS A 23 -9.034 0.828 8.386 1.00 0.00 H ATOM 14 HA CYS A 23 -6.395 -0.043 7.590 1.00 0.00 H ATOM 15 HB2 CYS A 23 -7.687 2.678 7.598 1.00 0.00 H ATOM 16 HB3 CYS A 23 -6.154 2.255 6.827 1.00 0.00 H ATOM 17 N HIS A 24 -5.288 0.207 9.824 1.00 0.00 N ATOM 18 CA HIS A 24 -4.347 0.412 10.915 1.00 0.00 C ATOM 19 C HIS A 24 -2.921 0.355 10.372 1.00 0.00 C ATOM 20 O HIS A 24 -2.647 -0.358 9.406 1.00 0.00 O ATOM 21 CB HIS A 24 -4.570 -0.639 12.008 1.00 0.00 C ATOM 22 CG HIS A 24 -4.281 -2.053 11.570 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.217 -2.838 10.918 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.157 -2.838 11.672 1.00 0.00 C ATOM 25 CE1 HIS A 24 -4.642 -4.028 10.679 1.00 0.00 C ATOM 26 NE2 HIS A 24 -3.384 -4.094 11.119 1.00 0.00 N ATOM 27 H HIS A 24 -5.312 -0.714 9.403 1.00 0.00 H ATOM 28 HA HIS A 24 -4.510 1.391 11.368 1.00 0.00 H ATOM 29 HB2 HIS A 24 -3.921 -0.406 12.852 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.604 -0.580 12.350 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.152 -2.558 10.649 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.227 -2.527 12.124 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.145 -4.844 10.182 1.00 0.00 H ATOM 34 N TRP A 25 -2.015 1.113 10.997 1.00 0.00 N ATOM 35 CA TRP A 25 -0.622 1.176 10.598 1.00 0.00 C ATOM 36 C TRP A 25 0.135 -0.027 11.155 1.00 0.00 C ATOM 37 O TRP A 25 0.358 -0.112 12.363 1.00 0.00 O ATOM 38 CB TRP A 25 -0.004 2.485 11.092 1.00 0.00 C ATOM 39 CG TRP A 25 1.446 2.655 10.765 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.460 2.678 11.658 1.00 0.00 C ATOM 41 CD2 TRP A 25 2.068 2.829 9.457 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.660 2.874 11.006 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.472 2.985 9.643 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.587 2.886 8.133 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.348 3.207 8.571 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.457 3.111 7.050 1.00 0.00 C ATOM 47 CH2 TRP A 25 3.837 3.266 7.267 1.00 0.00 C ATOM 48 H TRP A 25 -2.303 1.671 11.787 1.00 0.00 H ATOM 49 HA TRP A 25 -0.558 1.174 9.509 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.545 3.316 10.639 1.00 0.00 H ATOM 51 HB3 TRP A 25 -0.132 2.554 12.174 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.348 2.572 12.728 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.565 2.940 11.448 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.533 2.754 7.951 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.403 3.350 8.754 1.00 0.00 H ATOM 56 HZ3 TRP A 25 2.063 3.167 6.047 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.500 3.437 6.431 1.00 0.00 H ATOM 58 N ASP A 26 0.550 -0.940 10.271 1.00 0.00 N ATOM 59 CA ASP A 26 1.430 -2.042 10.619 1.00 0.00 C ATOM 60 C ASP A 26 2.867 -1.564 10.429 1.00 0.00 C ATOM 61 O ASP A 26 3.426 -1.667 9.337 1.00 0.00 O ATOM 62 CB ASP A 26 1.108 -3.266 9.759 1.00 0.00 C ATOM 63 CG ASP A 26 2.057 -4.422 10.062 1.00 0.00 C ATOM 64 OD1 ASP A 26 1.814 -5.108 11.078 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.015 -4.595 9.277 1.00 0.00 O ATOM 66 H ASP A 26 0.335 -0.807 9.292 1.00 0.00 H ATOM 67 HA ASP A 26 1.280 -2.333 11.660 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.083 -3.585 9.959 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.189 -3.003 8.707 1.00 0.00 H ATOM 70 N LEU A 27 3.455 -1.039 11.508 1.00 0.00 N ATOM 71 CA LEU A 27 4.833 -0.571 11.551 1.00 0.00 C ATOM 72 C LEU A 27 5.855 -1.680 11.270 1.00 0.00 C ATOM 73 O LEU A 27 6.949 -1.386 10.792 1.00 0.00 O ATOM 74 CB LEU A 27 5.119 0.143 12.884 1.00 0.00 C ATOM 75 CG LEU A 27 5.286 -0.757 14.124 1.00 0.00 C ATOM 76 CD1 LEU A 27 5.703 0.121 15.310 1.00 0.00 C ATOM 77 CD2 LEU A 27 4.007 -1.516 14.504 1.00 0.00 C ATOM 78 H LEU A 27 2.906 -0.951 12.352 1.00 0.00 H ATOM 79 HA LEU A 27 4.938 0.183 10.771 1.00 0.00 H ATOM 80 HB2 LEU A 27 6.048 0.698 12.753 1.00 0.00 H ATOM 81 HB3 LEU A 27 4.325 0.866 13.075 1.00 0.00 H ATOM 82 HG LEU A 27 6.086 -1.478 13.954 1.00 0.00 H ATOM 83 HD11 LEU A 27 6.630 0.645 15.076 1.00 0.00 H ATOM 84 HD12 LEU A 27 4.924 0.853 15.527 1.00 0.00 H ATOM 85 HD13 LEU A 27 5.867 -0.498 16.191 1.00 0.00 H ATOM 86 HD21 LEU A 27 4.147 -2.007 15.467 1.00 0.00 H ATOM 87 HD22 LEU A 27 3.169 -0.823 14.580 1.00 0.00 H ATOM 88 HD23 LEU A 27 3.781 -2.284 13.768 1.00 0.00 H ATOM 89 N LEU A 28 5.504 -2.940 11.567 1.00 0.00 N ATOM 90 CA LEU A 28 6.373 -4.102 11.418 1.00 0.00 C ATOM 91 C LEU A 28 6.901 -4.213 9.986 1.00 0.00 C ATOM 92 O LEU A 28 8.110 -4.294 9.782 1.00 0.00 O ATOM 93 CB LEU A 28 5.601 -5.361 11.843 1.00 0.00 C ATOM 94 CG LEU A 28 6.397 -6.669 11.696 1.00 0.00 C ATOM 95 CD1 LEU A 28 7.658 -6.678 12.567 1.00 0.00 C ATOM 96 CD2 LEU A 28 5.499 -7.846 12.091 1.00 0.00 C ATOM 97 H LEU A 28 4.583 -3.105 11.947 1.00 0.00 H ATOM 98 HA LEU A 28 7.217 -3.963 12.094 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.298 -5.247 12.886 1.00 0.00 H ATOM 100 HB3 LEU A 28 4.701 -5.440 11.235 1.00 0.00 H ATOM 101 HG LEU A 28 6.688 -6.810 10.653 1.00 0.00 H ATOM 102 HD11 LEU A 28 8.366 -5.928 12.220 1.00 0.00 H ATOM 103 HD12 LEU A 28 7.397 -6.475 13.606 1.00 0.00 H ATOM 104 HD13 LEU A 28 8.138 -7.655 12.507 1.00 0.00 H ATOM 105 HD21 LEU A 28 4.610 -7.863 11.458 1.00 0.00 H ATOM 106 HD22 LEU A 28 6.038 -8.784 11.961 1.00 0.00 H ATOM 107 HD23 LEU A 28 5.193 -7.751 13.134 1.00 0.00 H ATOM 108 N VAL A 29 5.992 -4.196 9.005 1.00 0.00 N ATOM 109 CA VAL A 29 6.334 -4.179 7.588 1.00 0.00 C ATOM 110 C VAL A 29 6.481 -2.726 7.116 1.00 0.00 C ATOM 111 O VAL A 29 7.205 -2.467 6.157 1.00 0.00 O ATOM 112 CB VAL A 29 5.264 -4.939 6.788 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.582 -4.960 5.286 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.134 -6.388 7.278 1.00 0.00 C ATOM 115 H VAL A 29 5.011 -4.154 9.248 1.00 0.00 H ATOM 116 HA VAL A 29 7.282 -4.691 7.429 1.00 0.00 H ATOM 117 HB VAL A 29 4.313 -4.434 6.930 1.00 0.00 H ATOM 118 HG11 VAL A 29 5.506 -3.958 4.865 1.00 0.00 H ATOM 119 HG12 VAL A 29 6.588 -5.346 5.122 1.00 0.00 H ATOM 120 HG13 VAL A 29 4.870 -5.601 4.765 1.00 0.00 H ATOM 121 HG21 VAL A 29 4.372 -6.906 6.695 1.00 0.00 H ATOM 122 HG22 VAL A 29 6.085 -6.906 7.159 1.00 0.00 H ATOM 123 HG23 VAL A 29 4.841 -6.421 8.327 1.00 0.00 H ATOM 124 N ARG A 30 5.812 -1.787 7.802 1.00 0.00 N ATOM 125 CA ARG A 30 5.872 -0.349 7.584 1.00 0.00 C ATOM 126 C ARG A 30 4.917 0.045 6.455 1.00 0.00 C ATOM 127 O ARG A 30 5.308 0.710 5.497 1.00 0.00 O ATOM 128 CB ARG A 30 7.325 0.129 7.400 1.00 0.00 C ATOM 129 CG ARG A 30 7.477 1.622 7.715 1.00 0.00 C ATOM 130 CD ARG A 30 8.933 2.078 7.581 1.00 0.00 C ATOM 131 NE ARG A 30 9.786 1.455 8.601 1.00 0.00 N ATOM 132 CZ ARG A 30 11.113 1.631 8.700 1.00 0.00 C ATOM 133 NH1 ARG A 30 11.767 2.428 7.843 1.00 0.00 N ATOM 134 NH2 ARG A 30 11.793 1.002 9.668 1.00 0.00 N ATOM 135 H ARG A 30 5.204 -2.087 8.553 1.00 0.00 H ATOM 136 HA ARG A 30 5.493 0.114 8.494 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.959 -0.430 8.089 1.00 0.00 H ATOM 138 HB3 ARG A 30 7.667 -0.057 6.382 1.00 0.00 H ATOM 139 HG2 ARG A 30 6.867 2.204 7.024 1.00 0.00 H ATOM 140 HG3 ARG A 30 7.145 1.813 8.735 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.298 1.824 6.585 1.00 0.00 H ATOM 142 HD3 ARG A 30 8.969 3.161 7.706 1.00 0.00 H ATOM 143 HE ARG A 30 9.329 0.850 9.268 1.00 0.00 H ATOM 144 HH11 ARG A 30 11.260 2.904 7.111 1.00 0.00 H ATOM 145 HH12 ARG A 30 12.765 2.553 7.924 1.00 0.00 H ATOM 146 HH21 ARG A 30 11.307 0.399 10.317 1.00 0.00 H ATOM 147 HH22 ARG A 30 12.791 1.127 9.751 1.00 0.00 H ATOM 148 N HIS A 31 3.653 -0.381 6.581 1.00 0.00 N ATOM 149 CA HIS A 31 2.582 -0.064 5.646 1.00 0.00 C ATOM 150 C HIS A 31 1.232 -0.042 6.361 1.00 0.00 C ATOM 151 O HIS A 31 1.112 -0.523 7.487 1.00 0.00 O ATOM 152 CB HIS A 31 2.586 -1.045 4.463 1.00 0.00 C ATOM 153 CG HIS A 31 2.374 -2.503 4.797 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.982 -2.958 6.047 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.477 -3.636 4.026 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.850 -4.293 5.969 1.00 0.00 C ATOM 157 NE2 HIS A 31 2.143 -4.770 4.760 1.00 0.00 N ATOM 158 H HIS A 31 3.404 -0.913 7.406 1.00 0.00 H ATOM 159 HA HIS A 31 2.753 0.934 5.242 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.803 -0.749 3.764 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.538 -0.950 3.944 1.00 0.00 H ATOM 162 HD1 HIS A 31 1.814 -2.386 6.863 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.766 -3.645 2.985 1.00 0.00 H ATOM 164 HE1 HIS A 31 1.555 -4.916 6.800 1.00 0.00 H ATOM 165 N TRP A 32 0.211 0.496 5.686 1.00 0.00 N ATOM 166 CA TRP A 32 -1.169 0.443 6.147 1.00 0.00 C ATOM 167 C TRP A 32 -1.776 -0.915 5.797 1.00 0.00 C ATOM 168 O TRP A 32 -1.491 -1.467 4.735 1.00 0.00 O ATOM 169 CB TRP A 32 -1.977 1.582 5.519 1.00 0.00 C ATOM 170 CG TRP A 32 -1.632 2.940 6.042 1.00 0.00 C ATOM 171 CD1 TRP A 32 -0.791 3.824 5.462 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.076 3.568 7.281 1.00 0.00 C ATOM 173 NE1 TRP A 32 -0.677 4.952 6.250 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.444 4.842 7.393 1.00 0.00 C ATOM 175 CE3 TRP A 32 -2.941 3.186 8.328 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -1.654 5.688 8.491 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.157 4.026 9.437 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.515 5.273 9.520 1.00 0.00 C ATOM 179 H TRP A 32 0.389 0.869 4.765 1.00 0.00 H ATOM 180 HA TRP A 32 -1.194 0.573 7.230 1.00 0.00 H ATOM 181 HB2 TRP A 32 -1.850 1.564 4.436 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.033 1.413 5.734 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.269 3.666 4.530 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.104 5.757 6.043 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.444 2.233 8.274 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.157 6.646 8.546 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -3.818 3.710 10.230 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.684 5.913 10.374 1.00 0.00 H ATOM 189 N VAL A 33 -2.609 -1.441 6.701 1.00 0.00 N ATOM 190 CA VAL A 33 -3.307 -2.708 6.553 1.00 0.00 C ATOM 191 C VAL A 33 -4.780 -2.458 6.868 1.00 0.00 C ATOM 192 O VAL A 33 -5.121 -2.176 8.015 1.00 0.00 O ATOM 193 CB VAL A 33 -2.694 -3.757 7.496 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.461 -5.085 7.427 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.230 -4.022 7.129 1.00 0.00 C ATOM 196 H VAL A 33 -2.774 -0.931 7.560 1.00 0.00 H ATOM 197 HA VAL A 33 -3.222 -3.076 5.530 1.00 0.00 H ATOM 198 HB VAL A 33 -2.727 -3.384 8.520 1.00 0.00 H ATOM 199 HG11 VAL A 33 -3.447 -5.470 6.407 1.00 0.00 H ATOM 200 HG12 VAL A 33 -2.991 -5.813 8.089 1.00 0.00 H ATOM 201 HG13 VAL A 33 -4.495 -4.952 7.743 1.00 0.00 H ATOM 202 HG21 VAL A 33 -0.646 -3.111 7.243 1.00 0.00 H ATOM 203 HG22 VAL A 33 -0.818 -4.784 7.790 1.00 0.00 H ATOM 204 HG23 VAL A 33 -1.160 -4.367 6.098 1.00 0.00 H ATOM 205 N CYS A 34 -5.639 -2.563 5.848 1.00 0.00 N ATOM 206 CA CYS A 34 -7.072 -2.333 5.948 1.00 0.00 C ATOM 207 C CYS A 34 -7.787 -3.677 6.058 1.00 0.00 C ATOM 208 O CYS A 34 -8.295 -4.210 5.074 1.00 0.00 O ATOM 209 CB CYS A 34 -7.548 -1.502 4.752 1.00 0.00 C ATOM 210 SG CYS A 34 -6.790 0.142 4.569 1.00 0.00 S ATOM 211 H CYS A 34 -5.277 -2.805 4.937 1.00 0.00 H ATOM 212 HA CYS A 34 -7.323 -1.777 6.843 1.00 0.00 H ATOM 213 HB2 CYS A 34 -7.331 -2.056 3.839 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.629 -1.369 4.818 1.00 0.00 H HETATM 215 N NH2 A 35 -7.825 -4.227 7.274 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -8.282 -5.117 7.409 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -7.398 -3.746 8.053 1.00 0.00 H TER 218 NH2 A 35