HETATM 1 C ACE A 22 -9.511 0.563 7.993 1.00 0.00 C HETATM 2 O ACE A 22 -9.503 -0.552 7.472 1.00 0.00 O HETATM 3 CH3 ACE A 22 -10.830 1.293 8.218 1.00 0.00 C HETATM 4 H1 ACE A 22 -11.659 0.682 7.863 1.00 0.00 H HETATM 5 H2 ACE A 22 -10.961 1.492 9.283 1.00 0.00 H HETATM 6 H3 ACE A 22 -10.823 2.238 7.673 1.00 0.00 H ATOM 7 N CYS A 23 -8.403 1.204 8.388 1.00 0.00 N ATOM 8 CA CYS A 23 -7.058 0.658 8.269 1.00 0.00 C ATOM 9 C CYS A 23 -6.247 0.996 9.517 1.00 0.00 C ATOM 10 O CYS A 23 -6.565 1.951 10.224 1.00 0.00 O ATOM 11 CB CYS A 23 -6.354 1.206 7.018 1.00 0.00 C ATOM 12 SG CYS A 23 -7.310 1.256 5.472 1.00 0.00 S ATOM 13 H CYS A 23 -8.490 2.112 8.823 1.00 0.00 H ATOM 14 HA CYS A 23 -7.123 -0.426 8.222 1.00 0.00 H ATOM 15 HB2 CYS A 23 -6.060 2.236 7.223 1.00 0.00 H ATOM 16 HB3 CYS A 23 -5.444 0.630 6.846 1.00 0.00 H ATOM 17 N HIS A 24 -5.195 0.209 9.773 1.00 0.00 N ATOM 18 CA HIS A 24 -4.266 0.416 10.874 1.00 0.00 C ATOM 19 C HIS A 24 -2.835 0.286 10.358 1.00 0.00 C ATOM 20 O HIS A 24 -2.557 -0.544 9.494 1.00 0.00 O ATOM 21 CB HIS A 24 -4.550 -0.577 12.007 1.00 0.00 C ATOM 22 CG HIS A 24 -4.303 -2.019 11.641 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.237 -2.789 10.968 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.226 -2.849 11.842 1.00 0.00 C ATOM 25 CE1 HIS A 24 -4.708 -4.014 10.819 1.00 0.00 C ATOM 26 NE2 HIS A 24 -3.481 -4.117 11.332 1.00 0.00 N ATOM 27 H HIS A 24 -5.001 -0.564 9.146 1.00 0.00 H ATOM 28 HA HIS A 24 -4.392 1.421 11.277 1.00 0.00 H ATOM 29 HB2 HIS A 24 -3.908 -0.328 12.852 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.586 -0.465 12.326 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.145 -2.486 10.648 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.310 -2.559 12.338 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.222 -4.831 10.334 1.00 0.00 H ATOM 34 N TRP A 25 -1.933 1.115 10.888 1.00 0.00 N ATOM 35 CA TRP A 25 -0.537 1.124 10.496 1.00 0.00 C ATOM 36 C TRP A 25 0.196 -0.046 11.149 1.00 0.00 C ATOM 37 O TRP A 25 0.357 -0.071 12.369 1.00 0.00 O ATOM 38 CB TRP A 25 0.102 2.455 10.897 1.00 0.00 C ATOM 39 CG TRP A 25 1.563 2.565 10.589 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.564 2.530 11.497 1.00 0.00 C ATOM 41 CD2 TRP A 25 2.210 2.718 9.293 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.781 2.672 10.862 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.618 2.804 9.498 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.749 2.804 7.963 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.519 2.988 8.440 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.642 3.005 6.895 1.00 0.00 C ATOM 47 CH2 TRP A 25 4.025 3.099 7.131 1.00 0.00 C ATOM 48 H TRP A 25 -2.225 1.772 11.597 1.00 0.00 H ATOM 49 HA TRP A 25 -0.467 1.041 9.410 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.410 3.258 10.367 1.00 0.00 H ATOM 51 HB3 TRP A 25 -0.045 2.614 11.966 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.430 2.421 12.563 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.682 2.688 11.317 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.693 2.718 7.768 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.580 3.055 8.633 1.00 0.00 H ATOM 56 HZ3 TRP A 25 2.263 3.089 5.887 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.705 3.253 6.307 1.00 0.00 H ATOM 58 N ASP A 26 0.659 -0.995 10.332 1.00 0.00 N ATOM 59 CA ASP A 26 1.532 -2.069 10.772 1.00 0.00 C ATOM 60 C ASP A 26 2.971 -1.580 10.621 1.00 0.00 C ATOM 61 O ASP A 26 3.519 -1.598 9.522 1.00 0.00 O ATOM 62 CB ASP A 26 1.273 -3.328 9.941 1.00 0.00 C ATOM 63 CG ASP A 26 2.285 -4.424 10.263 1.00 0.00 C ATOM 64 OD1 ASP A 26 2.132 -5.043 11.337 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.199 -4.617 9.431 1.00 0.00 O ATOM 66 H ASP A 26 0.483 -0.913 9.339 1.00 0.00 H ATOM 67 HA ASP A 26 1.337 -2.320 11.816 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.268 -3.694 10.150 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.341 -3.082 8.884 1.00 0.00 H ATOM 70 N LEU A 27 3.569 -1.143 11.734 1.00 0.00 N ATOM 71 CA LEU A 27 4.933 -0.629 11.791 1.00 0.00 C ATOM 72 C LEU A 27 6.005 -1.700 11.561 1.00 0.00 C ATOM 73 O LEU A 27 7.163 -1.351 11.343 1.00 0.00 O ATOM 74 CB LEU A 27 5.158 0.172 13.088 1.00 0.00 C ATOM 75 CG LEU A 27 5.265 -0.579 14.433 1.00 0.00 C ATOM 76 CD1 LEU A 27 4.082 -1.505 14.730 1.00 0.00 C ATOM 77 CD2 LEU A 27 6.588 -1.333 14.622 1.00 0.00 C ATOM 78 H LEU A 27 3.032 -1.138 12.588 1.00 0.00 H ATOM 79 HA LEU A 27 5.033 0.086 10.974 1.00 0.00 H ATOM 80 HB2 LEU A 27 6.071 0.757 12.963 1.00 0.00 H ATOM 81 HB3 LEU A 27 4.336 0.881 13.180 1.00 0.00 H ATOM 82 HG LEU A 27 5.254 0.199 15.200 1.00 0.00 H ATOM 83 HD11 LEU A 27 4.081 -2.358 14.052 1.00 0.00 H ATOM 84 HD12 LEU A 27 4.164 -1.878 15.752 1.00 0.00 H ATOM 85 HD13 LEU A 27 3.146 -0.955 14.635 1.00 0.00 H ATOM 86 HD21 LEU A 27 6.599 -2.262 14.057 1.00 0.00 H ATOM 87 HD22 LEU A 27 7.426 -0.708 14.313 1.00 0.00 H ATOM 88 HD23 LEU A 27 6.710 -1.580 15.678 1.00 0.00 H ATOM 89 N LEU A 28 5.643 -2.989 11.611 1.00 0.00 N ATOM 90 CA LEU A 28 6.577 -4.085 11.393 1.00 0.00 C ATOM 91 C LEU A 28 7.061 -4.071 9.942 1.00 0.00 C ATOM 92 O LEU A 28 8.264 -4.009 9.690 1.00 0.00 O ATOM 93 CB LEU A 28 5.898 -5.413 11.766 1.00 0.00 C ATOM 94 CG LEU A 28 6.772 -6.655 11.520 1.00 0.00 C ATOM 95 CD1 LEU A 28 8.058 -6.629 12.353 1.00 0.00 C ATOM 96 CD2 LEU A 28 5.964 -7.909 11.870 1.00 0.00 C ATOM 97 H LEU A 28 4.681 -3.225 11.804 1.00 0.00 H ATOM 98 HA LEU A 28 7.432 -3.934 12.054 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.623 -5.377 12.821 1.00 0.00 H ATOM 100 HB3 LEU A 28 4.986 -5.518 11.181 1.00 0.00 H ATOM 101 HG LEU A 28 7.038 -6.716 10.464 1.00 0.00 H ATOM 102 HD11 LEU A 28 8.707 -5.817 12.028 1.00 0.00 H ATOM 103 HD12 LEU A 28 7.819 -6.501 13.409 1.00 0.00 H ATOM 104 HD13 LEU A 28 8.598 -7.569 12.223 1.00 0.00 H ATOM 105 HD21 LEU A 28 5.687 -7.895 12.925 1.00 0.00 H ATOM 106 HD22 LEU A 28 5.060 -7.949 11.263 1.00 0.00 H ATOM 107 HD23 LEU A 28 6.559 -8.801 11.671 1.00 0.00 H ATOM 108 N VAL A 29 6.116 -4.112 8.998 1.00 0.00 N ATOM 109 CA VAL A 29 6.385 -4.068 7.565 1.00 0.00 C ATOM 110 C VAL A 29 6.406 -2.613 7.078 1.00 0.00 C ATOM 111 O VAL A 29 7.025 -2.325 6.056 1.00 0.00 O ATOM 112 CB VAL A 29 5.332 -4.908 6.823 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.567 -4.919 5.307 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.331 -6.360 7.325 1.00 0.00 C ATOM 115 H VAL A 29 5.147 -4.171 9.283 1.00 0.00 H ATOM 116 HA VAL A 29 7.359 -4.512 7.360 1.00 0.00 H ATOM 117 HB VAL A 29 4.354 -4.474 7.017 1.00 0.00 H ATOM 118 HG11 VAL A 29 4.879 -5.617 4.830 1.00 0.00 H ATOM 119 HG12 VAL A 29 5.389 -3.930 4.885 1.00 0.00 H ATOM 120 HG13 VAL A 29 6.590 -5.228 5.088 1.00 0.00 H ATOM 121 HG21 VAL A 29 5.085 -6.406 8.385 1.00 0.00 H ATOM 122 HG22 VAL A 29 4.585 -6.936 6.779 1.00 0.00 H ATOM 123 HG23 VAL A 29 6.312 -6.807 7.167 1.00 0.00 H ATOM 124 N ARG A 30 5.743 -1.706 7.811 1.00 0.00 N ATOM 125 CA ARG A 30 5.641 -0.279 7.534 1.00 0.00 C ATOM 126 C ARG A 30 4.700 -0.044 6.355 1.00 0.00 C ATOM 127 O ARG A 30 5.093 0.516 5.333 1.00 0.00 O ATOM 128 CB ARG A 30 7.016 0.396 7.385 1.00 0.00 C ATOM 129 CG ARG A 30 7.827 0.218 8.672 1.00 0.00 C ATOM 130 CD ARG A 30 9.227 0.824 8.550 1.00 0.00 C ATOM 131 NE ARG A 30 9.957 0.728 9.820 1.00 0.00 N ATOM 132 CZ ARG A 30 10.458 -0.402 10.350 1.00 0.00 C ATOM 133 NH1 ARG A 30 10.358 -1.575 9.708 1.00 0.00 N ATOM 134 NH2 ARG A 30 11.068 -0.356 11.542 1.00 0.00 N ATOM 135 H ARG A 30 5.236 -2.027 8.623 1.00 0.00 H ATOM 136 HA ARG A 30 5.165 0.178 8.402 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.570 -0.008 6.538 1.00 0.00 H ATOM 138 HB3 ARG A 30 6.872 1.463 7.212 1.00 0.00 H ATOM 139 HG2 ARG A 30 7.300 0.704 9.495 1.00 0.00 H ATOM 140 HG3 ARG A 30 7.924 -0.843 8.892 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.783 0.320 7.759 1.00 0.00 H ATOM 142 HD3 ARG A 30 9.135 1.880 8.288 1.00 0.00 H ATOM 143 HE ARG A 30 10.068 1.587 10.340 1.00 0.00 H ATOM 144 HH11 ARG A 30 9.897 -1.623 8.811 1.00 0.00 H ATOM 145 HH12 ARG A 30 10.721 -2.418 10.127 1.00 0.00 H ATOM 146 HH21 ARG A 30 11.148 0.521 12.037 1.00 0.00 H ATOM 147 HH22 ARG A 30 11.445 -1.199 11.950 1.00 0.00 H ATOM 148 N HIS A 31 3.445 -0.475 6.522 1.00 0.00 N ATOM 149 CA HIS A 31 2.363 -0.236 5.578 1.00 0.00 C ATOM 150 C HIS A 31 1.022 -0.177 6.307 1.00 0.00 C ATOM 151 O HIS A 31 0.905 -0.642 7.442 1.00 0.00 O ATOM 152 CB HIS A 31 2.363 -1.286 4.456 1.00 0.00 C ATOM 153 CG HIS A 31 2.212 -2.728 4.882 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.865 -3.117 6.168 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.332 -3.901 4.177 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.792 -4.458 6.178 1.00 0.00 C ATOM 157 NE2 HIS A 31 2.067 -4.999 4.991 1.00 0.00 N ATOM 158 H HIS A 31 3.204 -0.929 7.394 1.00 0.00 H ATOM 159 HA HIS A 31 2.519 0.738 5.112 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.552 -1.057 3.766 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.297 -1.191 3.903 1.00 0.00 H ATOM 162 HD1 HIS A 31 1.690 -2.499 6.948 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.587 -3.964 3.130 1.00 0.00 H ATOM 164 HE1 HIS A 31 1.542 -5.038 7.055 1.00 0.00 H ATOM 165 N TRP A 32 0.012 0.380 5.633 1.00 0.00 N ATOM 166 CA TRP A 32 -1.358 0.418 6.116 1.00 0.00 C ATOM 167 C TRP A 32 -2.056 -0.895 5.766 1.00 0.00 C ATOM 168 O TRP A 32 -2.176 -1.239 4.592 1.00 0.00 O ATOM 169 CB TRP A 32 -2.096 1.614 5.508 1.00 0.00 C ATOM 170 CG TRP A 32 -1.703 2.933 6.093 1.00 0.00 C ATOM 171 CD1 TRP A 32 -0.812 3.804 5.568 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.150 3.529 7.347 1.00 0.00 C ATOM 173 NE1 TRP A 32 -0.671 4.893 6.405 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.472 4.770 7.523 1.00 0.00 C ATOM 175 CE3 TRP A 32 -3.057 3.142 8.356 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -1.680 5.583 8.647 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.280 3.955 9.483 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.590 5.170 9.632 1.00 0.00 C ATOM 179 H TRP A 32 0.196 0.727 4.702 1.00 0.00 H ATOM 180 HA TRP A 32 -1.362 0.547 7.199 1.00 0.00 H ATOM 181 HB2 TRP A 32 -1.944 1.630 4.428 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.164 1.489 5.693 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.275 3.661 4.641 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.061 5.681 6.245 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.592 2.209 8.256 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.147 6.516 8.752 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -3.988 3.644 10.238 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.762 5.785 10.504 1.00 0.00 H ATOM 189 N VAL A 33 -2.517 -1.611 6.794 1.00 0.00 N ATOM 190 CA VAL A 33 -3.254 -2.857 6.670 1.00 0.00 C ATOM 191 C VAL A 33 -4.733 -2.519 6.830 1.00 0.00 C ATOM 192 O VAL A 33 -5.166 -2.129 7.914 1.00 0.00 O ATOM 193 CB VAL A 33 -2.768 -3.855 7.733 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.571 -5.161 7.674 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.286 -4.181 7.518 1.00 0.00 C ATOM 196 H VAL A 33 -2.379 -1.257 7.731 1.00 0.00 H ATOM 197 HA VAL A 33 -3.083 -3.304 5.689 1.00 0.00 H ATOM 198 HB VAL A 33 -2.881 -3.411 8.721 1.00 0.00 H ATOM 199 HG11 VAL A 33 -3.195 -5.857 8.425 1.00 0.00 H ATOM 200 HG12 VAL A 33 -4.625 -4.975 7.877 1.00 0.00 H ATOM 201 HG13 VAL A 33 -3.474 -5.616 6.688 1.00 0.00 H ATOM 202 HG21 VAL A 33 -0.956 -4.904 8.265 1.00 0.00 H ATOM 203 HG22 VAL A 33 -1.138 -4.602 6.523 1.00 0.00 H ATOM 204 HG23 VAL A 33 -0.686 -3.278 7.618 1.00 0.00 H ATOM 205 N CYS A 34 -5.492 -2.657 5.738 1.00 0.00 N ATOM 206 CA CYS A 34 -6.898 -2.289 5.658 1.00 0.00 C ATOM 207 C CYS A 34 -7.790 -3.518 5.810 1.00 0.00 C ATOM 208 O CYS A 34 -7.425 -4.617 5.399 1.00 0.00 O ATOM 209 CB CYS A 34 -7.159 -1.568 4.335 1.00 0.00 C ATOM 210 SG CYS A 34 -6.315 0.026 4.165 1.00 0.00 S ATOM 211 H CYS A 34 -5.060 -3.003 4.893 1.00 0.00 H ATOM 212 HA CYS A 34 -7.144 -1.596 6.453 1.00 0.00 H ATOM 213 HB2 CYS A 34 -6.848 -2.213 3.511 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.230 -1.386 4.237 1.00 0.00 H HETATM 215 N NH2 A 35 -8.969 -3.330 6.408 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -9.597 -4.109 6.533 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -9.228 -2.406 6.735 1.00 0.00 H TER 218 NH2 A 35