HETATM 1 C ACE A 22 -8.519 -0.658 9.098 1.00 0.00 C HETATM 2 O ACE A 22 -7.672 -1.453 9.503 1.00 0.00 O HETATM 3 CH3 ACE A 22 -9.992 -0.891 9.403 1.00 0.00 C HETATM 4 H1 ACE A 22 -10.111 -1.802 9.990 1.00 0.00 H HETATM 5 H2 ACE A 22 -10.386 -0.047 9.970 1.00 0.00 H HETATM 6 H3 ACE A 22 -10.548 -0.992 8.470 1.00 0.00 H ATOM 7 N CYS A 23 -8.226 0.432 8.379 1.00 0.00 N ATOM 8 CA CYS A 23 -6.882 0.826 7.978 1.00 0.00 C ATOM 9 C CYS A 23 -6.071 1.263 9.194 1.00 0.00 C ATOM 10 O CYS A 23 -6.156 2.415 9.617 1.00 0.00 O ATOM 11 CB CYS A 23 -6.953 1.926 6.915 1.00 0.00 C ATOM 12 SG CYS A 23 -7.770 1.476 5.357 1.00 0.00 S ATOM 13 H CYS A 23 -8.985 1.030 8.087 1.00 0.00 H ATOM 14 HA CYS A 23 -6.361 -0.007 7.517 1.00 0.00 H ATOM 15 HB2 CYS A 23 -7.485 2.784 7.328 1.00 0.00 H ATOM 16 HB3 CYS A 23 -5.937 2.240 6.673 1.00 0.00 H ATOM 17 N HIS A 24 -5.281 0.332 9.739 1.00 0.00 N ATOM 18 CA HIS A 24 -4.345 0.565 10.829 1.00 0.00 C ATOM 19 C HIS A 24 -2.928 0.351 10.305 1.00 0.00 C ATOM 20 O HIS A 24 -2.698 -0.537 9.484 1.00 0.00 O ATOM 21 CB HIS A 24 -4.657 -0.367 12.006 1.00 0.00 C ATOM 22 CG HIS A 24 -4.478 -1.832 11.697 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.442 -2.582 11.042 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.438 -2.702 11.928 1.00 0.00 C ATOM 25 CE1 HIS A 24 -4.959 -3.829 10.915 1.00 0.00 C ATOM 26 NE2 HIS A 24 -3.740 -3.970 11.440 1.00 0.00 N ATOM 27 H HIS A 24 -5.287 -0.596 9.331 1.00 0.00 H ATOM 28 HA HIS A 24 -4.436 1.589 11.190 1.00 0.00 H ATOM 29 HB2 HIS A 24 -3.999 -0.111 12.836 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.687 -0.200 12.326 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.331 -2.246 10.698 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.512 -2.436 12.416 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.499 -4.632 10.437 1.00 0.00 H ATOM 34 N TRP A 25 -1.978 1.170 10.766 1.00 0.00 N ATOM 35 CA TRP A 25 -0.600 1.094 10.317 1.00 0.00 C ATOM 36 C TRP A 25 0.133 -0.030 11.046 1.00 0.00 C ATOM 37 O TRP A 25 0.227 -0.017 12.272 1.00 0.00 O ATOM 38 CB TRP A 25 0.101 2.435 10.540 1.00 0.00 C ATOM 39 CG TRP A 25 1.508 2.485 10.028 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.616 2.190 10.742 1.00 0.00 C ATOM 41 CD2 TRP A 25 1.979 2.831 8.693 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.740 2.358 9.959 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.402 2.770 8.686 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.347 3.203 7.489 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.159 3.092 7.550 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.095 3.513 6.338 1.00 0.00 C ATOM 47 CH2 TRP A 25 3.498 3.464 6.369 1.00 0.00 C ATOM 48 H TRP A 25 -2.218 1.877 11.446 1.00 0.00 H ATOM 49 HA TRP A 25 -0.588 0.906 9.244 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.468 3.213 10.029 1.00 0.00 H ATOM 51 HB3 TRP A 25 0.105 2.667 11.606 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.620 1.883 11.777 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.693 2.214 10.260 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.272 3.247 7.457 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.236 3.054 7.583 1.00 0.00 H ATOM 56 HZ3 TRP A 25 1.588 3.792 5.426 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.069 3.706 5.484 1.00 0.00 H ATOM 58 N ASP A 26 0.670 -0.984 10.281 1.00 0.00 N ATOM 59 CA ASP A 26 1.544 -2.029 10.786 1.00 0.00 C ATOM 60 C ASP A 26 2.985 -1.525 10.710 1.00 0.00 C ATOM 61 O ASP A 26 3.527 -1.355 9.620 1.00 0.00 O ATOM 62 CB ASP A 26 1.360 -3.304 9.961 1.00 0.00 C ATOM 63 CG ASP A 26 2.421 -4.346 10.302 1.00 0.00 C ATOM 64 OD1 ASP A 26 2.398 -4.831 11.454 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.245 -4.630 9.407 1.00 0.00 O ATOM 66 H ASP A 26 0.545 -0.929 9.278 1.00 0.00 H ATOM 67 HA ASP A 26 1.289 -2.267 11.820 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.372 -3.719 10.159 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.433 -3.060 8.903 1.00 0.00 H ATOM 70 N LEU A 27 3.592 -1.300 11.881 1.00 0.00 N ATOM 71 CA LEU A 27 4.965 -0.836 12.030 1.00 0.00 C ATOM 72 C LEU A 27 5.979 -1.860 11.513 1.00 0.00 C ATOM 73 O LEU A 27 7.040 -1.469 11.035 1.00 0.00 O ATOM 74 CB LEU A 27 5.243 -0.546 13.513 1.00 0.00 C ATOM 75 CG LEU A 27 4.431 0.631 14.079 1.00 0.00 C ATOM 76 CD1 LEU A 27 4.457 0.579 15.611 1.00 0.00 C ATOM 77 CD2 LEU A 27 5.005 1.978 13.622 1.00 0.00 C ATOM 78 H LEU A 27 3.067 -1.460 12.728 1.00 0.00 H ATOM 79 HA LEU A 27 5.093 0.079 11.452 1.00 0.00 H ATOM 80 HB2 LEU A 27 5.008 -1.448 14.080 1.00 0.00 H ATOM 81 HB3 LEU A 27 6.305 -0.333 13.647 1.00 0.00 H ATOM 82 HG LEU A 27 3.392 0.555 13.760 1.00 0.00 H ATOM 83 HD11 LEU A 27 4.007 -0.352 15.959 1.00 0.00 H ATOM 84 HD12 LEU A 27 5.484 0.635 15.970 1.00 0.00 H ATOM 85 HD13 LEU A 27 3.889 1.415 16.019 1.00 0.00 H ATOM 86 HD21 LEU A 27 5.003 2.052 12.537 1.00 0.00 H ATOM 87 HD22 LEU A 27 4.398 2.789 14.025 1.00 0.00 H ATOM 88 HD23 LEU A 27 6.028 2.090 13.981 1.00 0.00 H ATOM 89 N LEU A 28 5.670 -3.159 11.623 1.00 0.00 N ATOM 90 CA LEU A 28 6.597 -4.238 11.298 1.00 0.00 C ATOM 91 C LEU A 28 7.044 -4.160 9.837 1.00 0.00 C ATOM 92 O LEU A 28 8.241 -4.136 9.558 1.00 0.00 O ATOM 93 CB LEU A 28 5.963 -5.604 11.606 1.00 0.00 C ATOM 94 CG LEU A 28 5.465 -5.764 13.054 1.00 0.00 C ATOM 95 CD1 LEU A 28 4.830 -7.149 13.212 1.00 0.00 C ATOM 96 CD2 LEU A 28 6.598 -5.605 14.075 1.00 0.00 C ATOM 97 H LEU A 28 4.768 -3.414 11.997 1.00 0.00 H ATOM 98 HA LEU A 28 7.487 -4.123 11.916 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.117 -5.761 10.937 1.00 0.00 H ATOM 100 HB3 LEU A 28 6.703 -6.379 11.401 1.00 0.00 H ATOM 101 HG LEU A 28 4.697 -5.022 13.268 1.00 0.00 H ATOM 102 HD11 LEU A 28 4.442 -7.266 14.225 1.00 0.00 H ATOM 103 HD12 LEU A 28 4.007 -7.261 12.506 1.00 0.00 H ATOM 104 HD13 LEU A 28 5.571 -7.926 13.022 1.00 0.00 H ATOM 105 HD21 LEU A 28 6.969 -4.581 14.074 1.00 0.00 H ATOM 106 HD22 LEU A 28 6.225 -5.830 15.074 1.00 0.00 H ATOM 107 HD23 LEU A 28 7.416 -6.287 13.838 1.00 0.00 H ATOM 108 N VAL A 29 6.080 -4.109 8.911 1.00 0.00 N ATOM 109 CA VAL A 29 6.330 -3.998 7.480 1.00 0.00 C ATOM 110 C VAL A 29 6.408 -2.525 7.065 1.00 0.00 C ATOM 111 O VAL A 29 7.047 -2.215 6.062 1.00 0.00 O ATOM 112 CB VAL A 29 5.239 -4.757 6.705 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.452 -4.677 5.188 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.203 -6.238 7.110 1.00 0.00 C ATOM 115 H VAL A 29 5.115 -4.148 9.212 1.00 0.00 H ATOM 116 HA VAL A 29 7.282 -4.469 7.237 1.00 0.00 H ATOM 117 HB VAL A 29 4.279 -4.308 6.943 1.00 0.00 H ATOM 118 HG11 VAL A 29 6.464 -4.995 4.934 1.00 0.00 H ATOM 119 HG12 VAL A 29 4.742 -5.330 4.678 1.00 0.00 H ATOM 120 HG13 VAL A 29 5.292 -3.660 4.832 1.00 0.00 H ATOM 121 HG21 VAL A 29 6.164 -6.706 6.891 1.00 0.00 H ATOM 122 HG22 VAL A 29 4.989 -6.348 8.173 1.00 0.00 H ATOM 123 HG23 VAL A 29 4.422 -6.753 6.552 1.00 0.00 H ATOM 124 N ARG A 30 5.771 -1.626 7.834 1.00 0.00 N ATOM 125 CA ARG A 30 5.708 -0.188 7.601 1.00 0.00 C ATOM 126 C ARG A 30 4.758 0.105 6.439 1.00 0.00 C ATOM 127 O ARG A 30 5.149 0.711 5.443 1.00 0.00 O ATOM 128 CB ARG A 30 7.102 0.444 7.419 1.00 0.00 C ATOM 129 CG ARG A 30 8.021 0.150 8.612 1.00 0.00 C ATOM 130 CD ARG A 30 9.430 0.695 8.372 1.00 0.00 C ATOM 131 NE ARG A 30 10.096 -0.035 7.286 1.00 0.00 N ATOM 132 CZ ARG A 30 11.328 0.229 6.827 1.00 0.00 C ATOM 133 NH1 ARG A 30 12.063 1.216 7.359 1.00 0.00 N ATOM 134 NH2 ARG A 30 11.830 -0.504 5.824 1.00 0.00 N ATOM 135 H ARG A 30 5.252 -1.960 8.635 1.00 0.00 H ATOM 136 HA ARG A 30 5.275 0.265 8.492 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.563 0.101 6.494 1.00 0.00 H ATOM 138 HB3 ARG A 30 6.988 1.524 7.342 1.00 0.00 H ATOM 139 HG2 ARG A 30 7.605 0.619 9.505 1.00 0.00 H ATOM 140 HG3 ARG A 30 8.100 -0.924 8.782 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.372 1.756 8.127 1.00 0.00 H ATOM 142 HD3 ARG A 30 10.011 0.571 9.287 1.00 0.00 H ATOM 143 HE ARG A 30 9.574 -0.790 6.862 1.00 0.00 H ATOM 144 HH11 ARG A 30 11.690 1.770 8.116 1.00 0.00 H ATOM 145 HH12 ARG A 30 12.989 1.408 7.006 1.00 0.00 H ATOM 146 HH21 ARG A 30 11.283 -1.248 5.417 1.00 0.00 H ATOM 147 HH22 ARG A 30 12.757 -0.313 5.471 1.00 0.00 H ATOM 148 N HIS A 31 3.500 -0.332 6.580 1.00 0.00 N ATOM 149 CA HIS A 31 2.434 -0.072 5.620 1.00 0.00 C ATOM 150 C HIS A 31 1.075 -0.032 6.314 1.00 0.00 C ATOM 151 O HIS A 31 0.949 -0.458 7.461 1.00 0.00 O ATOM 152 CB HIS A 31 2.456 -1.107 4.483 1.00 0.00 C ATOM 153 CG HIS A 31 2.212 -2.547 4.876 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.878 -2.950 6.160 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.235 -3.705 4.135 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.723 -4.285 6.136 1.00 0.00 C ATOM 157 NE2 HIS A 31 1.927 -4.807 4.927 1.00 0.00 N ATOM 158 H HIS A 31 3.249 -0.814 7.433 1.00 0.00 H ATOM 159 HA HIS A 31 2.597 0.910 5.173 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.696 -0.834 3.751 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.422 -1.050 3.987 1.00 0.00 H ATOM 162 HD1 HIS A 31 1.762 -2.348 6.962 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.461 -3.752 3.081 1.00 0.00 H ATOM 164 HE1 HIS A 31 1.469 -4.876 7.004 1.00 0.00 H ATOM 165 N TRP A 32 0.056 0.450 5.595 1.00 0.00 N ATOM 166 CA TRP A 32 -1.332 0.368 6.024 1.00 0.00 C ATOM 167 C TRP A 32 -1.849 -1.057 5.837 1.00 0.00 C ATOM 168 O TRP A 32 -1.512 -1.719 4.856 1.00 0.00 O ATOM 169 CB TRP A 32 -2.193 1.354 5.230 1.00 0.00 C ATOM 170 CG TRP A 32 -1.982 2.794 5.580 1.00 0.00 C ATOM 171 CD1 TRP A 32 -1.353 3.714 4.818 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.373 3.487 6.802 1.00 0.00 C ATOM 173 NE1 TRP A 32 -1.322 4.926 5.476 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.933 4.841 6.711 1.00 0.00 C ATOM 175 CE3 TRP A 32 -3.040 3.106 7.984 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -2.141 5.766 7.744 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.248 4.024 9.031 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.801 5.351 8.912 1.00 0.00 C ATOM 179 H TRP A 32 0.245 0.782 4.661 1.00 0.00 H ATOM 180 HA TRP A 32 -1.399 0.633 7.079 1.00 0.00 H ATOM 181 HB2 TRP A 32 -2.021 1.208 4.162 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.242 1.132 5.431 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.926 3.529 3.843 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.903 5.775 5.124 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.393 2.091 8.087 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.794 6.784 7.645 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -3.751 3.709 9.932 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.965 6.051 9.719 1.00 0.00 H ATOM 189 N VAL A 33 -2.675 -1.512 6.783 1.00 0.00 N ATOM 190 CA VAL A 33 -3.351 -2.798 6.755 1.00 0.00 C ATOM 191 C VAL A 33 -4.834 -2.526 6.988 1.00 0.00 C ATOM 192 O VAL A 33 -5.238 -2.225 8.109 1.00 0.00 O ATOM 193 CB VAL A 33 -2.756 -3.733 7.823 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.473 -5.090 7.822 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.265 -3.968 7.557 1.00 0.00 C ATOM 196 H VAL A 33 -2.868 -0.920 7.582 1.00 0.00 H ATOM 197 HA VAL A 33 -3.228 -3.273 5.781 1.00 0.00 H ATOM 198 HB VAL A 33 -2.862 -3.279 8.809 1.00 0.00 H ATOM 199 HG11 VAL A 33 -3.376 -5.560 6.844 1.00 0.00 H ATOM 200 HG12 VAL A 33 -3.028 -5.740 8.575 1.00 0.00 H ATOM 201 HG13 VAL A 33 -4.530 -4.968 8.056 1.00 0.00 H ATOM 202 HG21 VAL A 33 -1.127 -4.354 6.548 1.00 0.00 H ATOM 203 HG22 VAL A 33 -0.711 -3.037 7.667 1.00 0.00 H ATOM 204 HG23 VAL A 33 -0.873 -4.692 8.273 1.00 0.00 H ATOM 205 N CYS A 34 -5.636 -2.626 5.923 1.00 0.00 N ATOM 206 CA CYS A 34 -7.064 -2.339 5.935 1.00 0.00 C ATOM 207 C CYS A 34 -7.836 -3.652 6.036 1.00 0.00 C ATOM 208 O CYS A 34 -8.405 -4.132 5.058 1.00 0.00 O ATOM 209 CB CYS A 34 -7.434 -1.524 4.690 1.00 0.00 C ATOM 210 SG CYS A 34 -6.565 0.060 4.480 1.00 0.00 S ATOM 211 H CYS A 34 -5.229 -2.887 5.036 1.00 0.00 H ATOM 212 HA CYS A 34 -7.341 -1.749 6.802 1.00 0.00 H ATOM 213 HB2 CYS A 34 -7.213 -2.125 3.808 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.506 -1.324 4.702 1.00 0.00 H HETATM 215 N NH2 A 35 -7.853 -4.236 7.236 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -8.347 -5.106 7.365 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -7.371 -3.800 8.010 1.00 0.00 H TER 218 NH2 A 35