HETATM 1 C ACE A 22 -9.643 0.564 7.722 1.00 0.00 C HETATM 2 O ACE A 22 -9.590 -0.540 7.179 1.00 0.00 O HETATM 3 CH3 ACE A 22 -10.978 1.282 7.867 1.00 0.00 C HETATM 4 H1 ACE A 22 -11.189 1.456 8.922 1.00 0.00 H HETATM 5 H2 ACE A 22 -10.938 2.238 7.344 1.00 0.00 H HETATM 6 H3 ACE A 22 -11.776 0.674 7.439 1.00 0.00 H ATOM 7 N CYS A 23 -8.570 1.200 8.211 1.00 0.00 N ATOM 8 CA CYS A 23 -7.217 0.661 8.176 1.00 0.00 C ATOM 9 C CYS A 23 -6.493 0.985 9.479 1.00 0.00 C ATOM 10 O CYS A 23 -6.862 1.927 10.179 1.00 0.00 O ATOM 11 CB CYS A 23 -6.430 1.234 6.984 1.00 0.00 C ATOM 12 SG CYS A 23 -7.272 1.301 5.376 1.00 0.00 S ATOM 13 H CYS A 23 -8.693 2.097 8.657 1.00 0.00 H ATOM 14 HA CYS A 23 -7.271 -0.422 8.106 1.00 0.00 H ATOM 15 HB2 CYS A 23 -6.159 2.262 7.225 1.00 0.00 H ATOM 16 HB3 CYS A 23 -5.506 0.666 6.871 1.00 0.00 H ATOM 17 N HIS A 24 -5.453 0.201 9.787 1.00 0.00 N ATOM 18 CA HIS A 24 -4.570 0.417 10.924 1.00 0.00 C ATOM 19 C HIS A 24 -3.124 0.276 10.459 1.00 0.00 C ATOM 20 O HIS A 24 -2.828 -0.540 9.588 1.00 0.00 O ATOM 21 CB HIS A 24 -4.897 -0.568 12.052 1.00 0.00 C ATOM 22 CG HIS A 24 -4.617 -2.010 11.710 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.512 -2.795 11.001 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.539 -2.824 11.962 1.00 0.00 C ATOM 25 CE1 HIS A 24 -4.962 -4.015 10.882 1.00 0.00 C ATOM 26 NE2 HIS A 24 -3.757 -4.099 11.449 1.00 0.00 N ATOM 27 H HIS A 24 -5.219 -0.563 9.164 1.00 0.00 H ATOM 28 HA HIS A 24 -4.709 1.426 11.313 1.00 0.00 H ATOM 29 HB2 HIS A 24 -4.295 -0.305 12.924 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.947 -0.465 12.324 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.410 -2.505 10.640 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.648 -2.520 12.491 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.445 -4.841 10.381 1.00 0.00 H ATOM 34 N TRP A 25 -2.227 1.079 11.036 1.00 0.00 N ATOM 35 CA TRP A 25 -0.821 1.064 10.676 1.00 0.00 C ATOM 36 C TRP A 25 -0.133 -0.177 11.244 1.00 0.00 C ATOM 37 O TRP A 25 -0.412 -0.583 12.371 1.00 0.00 O ATOM 38 CB TRP A 25 -0.145 2.335 11.194 1.00 0.00 C ATOM 39 CG TRP A 25 1.324 2.417 10.915 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.308 2.323 11.836 1.00 0.00 C ATOM 41 CD2 TRP A 25 1.998 2.578 9.633 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.538 2.436 11.224 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.405 2.597 9.860 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.564 2.714 8.297 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.331 2.761 8.821 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.484 2.892 7.247 1.00 0.00 C ATOM 47 CH2 TRP A 25 3.864 2.917 7.506 1.00 0.00 C ATOM 48 H TRP A 25 -2.526 1.725 11.750 1.00 0.00 H ATOM 49 HA TRP A 25 -0.738 1.059 9.589 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.622 3.198 10.729 1.00 0.00 H ATOM 51 HB3 TRP A 25 -0.301 2.403 12.272 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.156 2.185 12.897 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.431 2.408 11.693 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.508 2.682 8.084 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.388 2.780 9.034 1.00 0.00 H ATOM 56 HZ3 TRP A 25 2.126 3.011 6.235 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.563 3.059 6.696 1.00 0.00 H ATOM 58 N ASP A 26 0.780 -0.752 10.457 1.00 0.00 N ATOM 59 CA ASP A 26 1.684 -1.811 10.871 1.00 0.00 C ATOM 60 C ASP A 26 3.107 -1.356 10.558 1.00 0.00 C ATOM 61 O ASP A 26 3.513 -1.343 9.398 1.00 0.00 O ATOM 62 CB ASP A 26 1.338 -3.114 10.146 1.00 0.00 C ATOM 63 CG ASP A 26 2.370 -4.199 10.442 1.00 0.00 C ATOM 64 OD1 ASP A 26 2.270 -4.801 11.532 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.249 -4.399 9.576 1.00 0.00 O ATOM 66 H ASP A 26 0.917 -0.381 9.525 1.00 0.00 H ATOM 67 HA ASP A 26 1.594 -1.994 11.943 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.353 -3.455 10.468 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.309 -2.932 9.074 1.00 0.00 H ATOM 70 N LEU A 27 3.852 -0.987 11.606 1.00 0.00 N ATOM 71 CA LEU A 27 5.243 -0.559 11.530 1.00 0.00 C ATOM 72 C LEU A 27 6.148 -1.722 11.113 1.00 0.00 C ATOM 73 O LEU A 27 7.095 -1.510 10.358 1.00 0.00 O ATOM 74 CB LEU A 27 5.632 0.025 12.902 1.00 0.00 C ATOM 75 CG LEU A 27 7.018 0.684 13.033 1.00 0.00 C ATOM 76 CD1 LEU A 27 8.152 -0.318 13.289 1.00 0.00 C ATOM 77 CD2 LEU A 27 7.362 1.611 11.860 1.00 0.00 C ATOM 78 H LEU A 27 3.431 -1.016 12.522 1.00 0.00 H ATOM 79 HA LEU A 27 5.311 0.227 10.780 1.00 0.00 H ATOM 80 HB2 LEU A 27 4.897 0.795 13.140 1.00 0.00 H ATOM 81 HB3 LEU A 27 5.541 -0.754 13.660 1.00 0.00 H ATOM 82 HG LEU A 27 6.969 1.309 13.927 1.00 0.00 H ATOM 83 HD11 LEU A 27 8.378 -0.905 12.403 1.00 0.00 H ATOM 84 HD12 LEU A 27 9.052 0.227 13.575 1.00 0.00 H ATOM 85 HD13 LEU A 27 7.879 -0.988 14.104 1.00 0.00 H ATOM 86 HD21 LEU A 27 8.279 2.154 12.085 1.00 0.00 H ATOM 87 HD22 LEU A 27 7.514 1.039 10.945 1.00 0.00 H ATOM 88 HD23 LEU A 27 6.558 2.330 11.708 1.00 0.00 H ATOM 89 N LEU A 28 5.854 -2.936 11.604 1.00 0.00 N ATOM 90 CA LEU A 28 6.666 -4.138 11.430 1.00 0.00 C ATOM 91 C LEU A 28 7.093 -4.330 9.973 1.00 0.00 C ATOM 92 O LEU A 28 8.273 -4.536 9.700 1.00 0.00 O ATOM 93 CB LEU A 28 5.909 -5.376 11.936 1.00 0.00 C ATOM 94 CG LEU A 28 5.412 -5.283 13.389 1.00 0.00 C ATOM 95 CD1 LEU A 28 4.706 -6.591 13.760 1.00 0.00 C ATOM 96 CD2 LEU A 28 6.557 -5.025 14.376 1.00 0.00 C ATOM 97 H LEU A 28 5.025 -3.023 12.171 1.00 0.00 H ATOM 98 HA LEU A 28 7.574 -4.019 12.021 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.047 -5.550 11.291 1.00 0.00 H ATOM 100 HB3 LEU A 28 6.573 -6.238 11.848 1.00 0.00 H ATOM 101 HG LEU A 28 4.683 -4.478 13.482 1.00 0.00 H ATOM 102 HD11 LEU A 28 3.879 -6.772 13.074 1.00 0.00 H ATOM 103 HD12 LEU A 28 5.407 -7.424 13.703 1.00 0.00 H ATOM 104 HD13 LEU A 28 4.312 -6.524 14.774 1.00 0.00 H ATOM 105 HD21 LEU A 28 6.979 -4.033 14.217 1.00 0.00 H ATOM 106 HD22 LEU A 28 6.177 -5.073 15.398 1.00 0.00 H ATOM 107 HD23 LEU A 28 7.337 -5.775 14.251 1.00 0.00 H ATOM 108 N VAL A 29 6.132 -4.235 9.047 1.00 0.00 N ATOM 109 CA VAL A 29 6.392 -4.211 7.614 1.00 0.00 C ATOM 110 C VAL A 29 6.594 -2.755 7.188 1.00 0.00 C ATOM 111 O VAL A 29 7.533 -2.445 6.459 1.00 0.00 O ATOM 112 CB VAL A 29 5.229 -4.867 6.855 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.470 -4.832 5.340 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.034 -6.325 7.294 1.00 0.00 C ATOM 115 H VAL A 29 5.178 -4.097 9.355 1.00 0.00 H ATOM 116 HA VAL A 29 7.295 -4.774 7.386 1.00 0.00 H ATOM 117 HB VAL A 29 4.321 -4.313 7.074 1.00 0.00 H ATOM 118 HG11 VAL A 29 6.428 -5.298 5.104 1.00 0.00 H ATOM 119 HG12 VAL A 29 4.678 -5.376 4.826 1.00 0.00 H ATOM 120 HG13 VAL A 29 5.472 -3.805 4.977 1.00 0.00 H ATOM 121 HG21 VAL A 29 5.943 -6.896 7.101 1.00 0.00 H ATOM 122 HG22 VAL A 29 4.797 -6.380 8.355 1.00 0.00 H ATOM 123 HG23 VAL A 29 4.210 -6.768 6.735 1.00 0.00 H ATOM 124 N ARG A 30 5.713 -1.863 7.653 1.00 0.00 N ATOM 125 CA ARG A 30 5.803 -0.440 7.383 1.00 0.00 C ATOM 126 C ARG A 30 4.772 -0.074 6.314 1.00 0.00 C ATOM 127 O ARG A 30 5.103 0.529 5.295 1.00 0.00 O ATOM 128 CB ARG A 30 7.250 -0.085 7.007 1.00 0.00 C ATOM 129 CG ARG A 30 7.518 1.418 7.150 1.00 0.00 C ATOM 130 CD ARG A 30 8.973 1.745 6.806 1.00 0.00 C ATOM 131 NE ARG A 30 9.244 3.175 6.994 1.00 0.00 N ATOM 132 CZ ARG A 30 10.433 3.761 6.784 1.00 0.00 C ATOM 133 NH1 ARG A 30 11.488 3.045 6.373 1.00 0.00 N ATOM 134 NH2 ARG A 30 10.565 5.078 6.988 1.00 0.00 N ATOM 135 H ARG A 30 4.959 -2.172 8.252 1.00 0.00 H ATOM 136 HA ARG A 30 5.548 0.084 8.304 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.924 -0.607 7.688 1.00 0.00 H ATOM 138 HB3 ARG A 30 7.466 -0.414 5.990 1.00 0.00 H ATOM 139 HG2 ARG A 30 6.863 1.986 6.490 1.00 0.00 H ATOM 140 HG3 ARG A 30 7.332 1.715 8.182 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.632 1.167 7.455 1.00 0.00 H ATOM 142 HD3 ARG A 30 9.163 1.473 5.767 1.00 0.00 H ATOM 143 HE ARG A 30 8.470 3.747 7.303 1.00 0.00 H ATOM 144 HH11 ARG A 30 11.394 2.052 6.217 1.00 0.00 H ATOM 145 HH12 ARG A 30 12.379 3.495 6.217 1.00 0.00 H ATOM 146 HH21 ARG A 30 9.775 5.626 7.298 1.00 0.00 H ATOM 147 HH22 ARG A 30 11.456 5.528 6.833 1.00 0.00 H ATOM 148 N HIS A 31 3.512 -0.462 6.549 1.00 0.00 N ATOM 149 CA HIS A 31 2.395 -0.207 5.649 1.00 0.00 C ATOM 150 C HIS A 31 1.082 -0.096 6.423 1.00 0.00 C ATOM 151 O HIS A 31 1.010 -0.481 7.589 1.00 0.00 O ATOM 152 CB HIS A 31 2.323 -1.289 4.561 1.00 0.00 C ATOM 153 CG HIS A 31 2.112 -2.707 5.040 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.847 -3.042 6.360 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.106 -3.903 4.364 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.702 -4.376 6.418 1.00 0.00 C ATOM 157 NE2 HIS A 31 1.848 -4.962 5.229 1.00 0.00 N ATOM 158 H HIS A 31 3.305 -0.926 7.425 1.00 0.00 H ATOM 159 HA HIS A 31 2.557 0.752 5.153 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.509 -1.045 3.878 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.249 -1.261 3.988 1.00 0.00 H ATOM 162 HD1 HIS A 31 1.770 -2.396 7.134 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.275 -4.008 3.303 1.00 0.00 H ATOM 164 HE1 HIS A 31 1.493 -4.919 7.328 1.00 0.00 H ATOM 165 N TRP A 32 0.042 0.402 5.748 1.00 0.00 N ATOM 166 CA TRP A 32 -1.322 0.413 6.251 1.00 0.00 C ATOM 167 C TRP A 32 -1.998 -0.910 5.899 1.00 0.00 C ATOM 168 O TRP A 32 -2.042 -1.293 4.732 1.00 0.00 O ATOM 169 CB TRP A 32 -2.093 1.596 5.661 1.00 0.00 C ATOM 170 CG TRP A 32 -1.732 2.920 6.257 1.00 0.00 C ATOM 171 CD1 TRP A 32 -0.827 3.793 5.765 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.232 3.516 7.491 1.00 0.00 C ATOM 173 NE1 TRP A 32 -0.725 4.885 6.604 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.568 4.760 7.691 1.00 0.00 C ATOM 175 CE3 TRP A 32 -3.178 3.127 8.463 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -1.822 5.574 8.805 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.446 3.939 9.581 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.767 5.156 9.756 1.00 0.00 C ATOM 179 H TRP A 32 0.190 0.697 4.794 1.00 0.00 H ATOM 180 HA TRP A 32 -1.315 0.532 7.336 1.00 0.00 H ATOM 181 HB2 TRP A 32 -1.947 1.628 4.581 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.156 1.441 5.849 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.253 3.651 4.862 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.113 5.676 6.465 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.705 2.193 8.345 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.297 6.510 8.930 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -4.181 3.627 10.309 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.974 5.772 10.619 1.00 0.00 H ATOM 189 N VAL A 33 -2.530 -1.591 6.918 1.00 0.00 N ATOM 190 CA VAL A 33 -3.265 -2.838 6.790 1.00 0.00 C ATOM 191 C VAL A 33 -4.750 -2.489 6.847 1.00 0.00 C ATOM 192 O VAL A 33 -5.258 -2.109 7.901 1.00 0.00 O ATOM 193 CB VAL A 33 -2.852 -3.804 7.913 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.643 -5.116 7.828 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.357 -4.125 7.822 1.00 0.00 C ATOM 196 H VAL A 33 -2.452 -1.206 7.850 1.00 0.00 H ATOM 197 HA VAL A 33 -3.036 -3.318 5.837 1.00 0.00 H ATOM 198 HB VAL A 33 -3.043 -3.333 8.877 1.00 0.00 H ATOM 199 HG11 VAL A 33 -3.468 -5.594 6.864 1.00 0.00 H ATOM 200 HG12 VAL A 33 -3.320 -5.789 8.623 1.00 0.00 H ATOM 201 HG13 VAL A 33 -4.709 -4.932 7.945 1.00 0.00 H ATOM 202 HG21 VAL A 33 -0.768 -3.214 7.931 1.00 0.00 H ATOM 203 HG22 VAL A 33 -1.079 -4.816 8.617 1.00 0.00 H ATOM 204 HG23 VAL A 33 -1.136 -4.581 6.857 1.00 0.00 H ATOM 205 N CYS A 34 -5.428 -2.609 5.700 1.00 0.00 N ATOM 206 CA CYS A 34 -6.826 -2.238 5.527 1.00 0.00 C ATOM 207 C CYS A 34 -7.725 -3.470 5.595 1.00 0.00 C ATOM 208 O CYS A 34 -7.329 -4.563 5.195 1.00 0.00 O ATOM 209 CB CYS A 34 -6.995 -1.498 4.201 1.00 0.00 C ATOM 210 SG CYS A 34 -6.162 0.111 4.123 1.00 0.00 S ATOM 211 H CYS A 34 -4.939 -2.944 4.885 1.00 0.00 H ATOM 212 HA CYS A 34 -7.129 -1.559 6.315 1.00 0.00 H ATOM 213 HB2 CYS A 34 -6.613 -2.123 3.392 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.057 -1.325 4.026 1.00 0.00 H HETATM 215 N NH2 A 35 -8.945 -3.292 6.109 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -9.228 -2.375 6.432 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -9.578 -4.075 6.176 1.00 0.00 H TER 218 NH2 A 35