HETATM 1 C ACE A 22 -9.497 0.633 7.939 1.00 0.00 C HETATM 2 O ACE A 22 -9.502 -0.486 7.427 1.00 0.00 O HETATM 3 CH3 ACE A 22 -10.806 1.387 8.144 1.00 0.00 C HETATM 4 H1 ACE A 22 -10.947 1.594 9.205 1.00 0.00 H HETATM 5 H2 ACE A 22 -10.776 2.326 7.592 1.00 0.00 H HETATM 6 H3 ACE A 22 -11.641 0.786 7.783 1.00 0.00 H ATOM 7 N CYS A 23 -8.383 1.258 8.343 1.00 0.00 N ATOM 8 CA CYS A 23 -7.046 0.689 8.243 1.00 0.00 C ATOM 9 C CYS A 23 -6.242 1.025 9.496 1.00 0.00 C ATOM 10 O CYS A 23 -6.551 1.992 10.191 1.00 0.00 O ATOM 11 CB CYS A 23 -6.319 1.216 6.994 1.00 0.00 C ATOM 12 SG CYS A 23 -7.260 1.272 5.439 1.00 0.00 S ATOM 13 H CYS A 23 -8.460 2.171 8.771 1.00 0.00 H ATOM 14 HA CYS A 23 -7.127 -0.394 8.204 1.00 0.00 H ATOM 15 HB2 CYS A 23 -6.009 2.241 7.195 1.00 0.00 H ATOM 16 HB3 CYS A 23 -5.419 0.621 6.837 1.00 0.00 H ATOM 17 N HIS A 24 -5.207 0.222 9.770 1.00 0.00 N ATOM 18 CA HIS A 24 -4.282 0.426 10.875 1.00 0.00 C ATOM 19 C HIS A 24 -2.851 0.278 10.366 1.00 0.00 C ATOM 20 O HIS A 24 -2.575 -0.567 9.515 1.00 0.00 O ATOM 21 CB HIS A 24 -4.582 -0.557 12.013 1.00 0.00 C ATOM 22 CG HIS A 24 -4.353 -2.003 11.658 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.289 -2.763 10.974 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.292 -2.849 11.881 1.00 0.00 C ATOM 25 CE1 HIS A 24 -4.776 -3.997 10.838 1.00 0.00 C ATOM 26 NE2 HIS A 24 -3.559 -4.116 11.373 1.00 0.00 N ATOM 27 H HIS A 24 -5.021 -0.560 9.153 1.00 0.00 H ATOM 28 HA HIS A 24 -4.399 1.434 11.273 1.00 0.00 H ATOM 29 HB2 HIS A 24 -3.941 -0.309 12.860 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.619 -0.430 12.327 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.187 -2.447 10.637 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.381 -2.571 12.390 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.295 -4.808 10.349 1.00 0.00 H ATOM 34 N TRP A 25 -1.943 1.108 10.886 1.00 0.00 N ATOM 35 CA TRP A 25 -0.547 1.104 10.491 1.00 0.00 C ATOM 36 C TRP A 25 0.180 -0.068 11.145 1.00 0.00 C ATOM 37 O TRP A 25 0.324 -0.100 12.366 1.00 0.00 O ATOM 38 CB TRP A 25 0.104 2.431 10.887 1.00 0.00 C ATOM 39 CG TRP A 25 1.561 2.535 10.558 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.578 2.483 11.447 1.00 0.00 C ATOM 41 CD2 TRP A 25 2.186 2.704 9.252 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.782 2.640 10.794 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.597 2.792 9.435 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.704 2.803 7.931 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.481 2.994 8.365 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.579 3.014 6.850 1.00 0.00 C ATOM 47 CH2 TRP A 25 3.965 3.113 7.065 1.00 0.00 C ATOM 48 H TRP A 25 -2.231 1.776 11.586 1.00 0.00 H ATOM 49 HA TRP A 25 -0.483 1.019 9.405 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.412 3.238 10.367 1.00 0.00 H ATOM 51 HB3 TRP A 25 -0.026 2.586 11.959 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.465 2.358 12.514 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.691 2.652 11.231 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.645 2.717 7.752 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.543 3.065 8.542 1.00 0.00 H ATOM 56 HZ3 TRP A 25 2.184 3.103 5.849 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.632 3.276 6.231 1.00 0.00 H ATOM 58 N ASP A 26 0.657 -1.009 10.326 1.00 0.00 N ATOM 59 CA ASP A 26 1.541 -2.072 10.767 1.00 0.00 C ATOM 60 C ASP A 26 2.975 -1.568 10.624 1.00 0.00 C ATOM 61 O ASP A 26 3.511 -1.521 9.518 1.00 0.00 O ATOM 62 CB ASP A 26 1.296 -3.337 9.941 1.00 0.00 C ATOM 63 CG ASP A 26 2.310 -4.425 10.280 1.00 0.00 C ATOM 64 OD1 ASP A 26 2.119 -5.077 11.329 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.265 -4.577 9.490 1.00 0.00 O ATOM 66 H ASP A 26 0.490 -0.923 9.333 1.00 0.00 H ATOM 67 HA ASP A 26 1.343 -2.326 11.810 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.290 -3.707 10.143 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.374 -3.096 8.884 1.00 0.00 H ATOM 70 N LEU A 27 3.580 -1.192 11.755 1.00 0.00 N ATOM 71 CA LEU A 27 4.937 -0.670 11.841 1.00 0.00 C ATOM 72 C LEU A 27 5.983 -1.720 11.451 1.00 0.00 C ATOM 73 O LEU A 27 7.050 -1.356 10.965 1.00 0.00 O ATOM 74 CB LEU A 27 5.161 -0.152 13.271 1.00 0.00 C ATOM 75 CG LEU A 27 6.546 0.470 13.533 1.00 0.00 C ATOM 76 CD1 LEU A 27 6.788 1.725 12.685 1.00 0.00 C ATOM 77 CD2 LEU A 27 6.654 0.842 15.015 1.00 0.00 C ATOM 78 H LEU A 27 3.055 -1.254 12.616 1.00 0.00 H ATOM 79 HA LEU A 27 5.013 0.164 11.145 1.00 0.00 H ATOM 80 HB2 LEU A 27 4.399 0.595 13.495 1.00 0.00 H ATOM 81 HB3 LEU A 27 5.029 -0.989 13.959 1.00 0.00 H ATOM 82 HG LEU A 27 7.327 -0.258 13.320 1.00 0.00 H ATOM 83 HD11 LEU A 27 6.789 1.478 11.625 1.00 0.00 H ATOM 84 HD12 LEU A 27 6.013 2.465 12.886 1.00 0.00 H ATOM 85 HD13 LEU A 27 7.758 2.153 12.937 1.00 0.00 H ATOM 86 HD21 LEU A 27 6.518 -0.046 15.632 1.00 0.00 H ATOM 87 HD22 LEU A 27 7.638 1.263 15.220 1.00 0.00 H ATOM 88 HD23 LEU A 27 5.891 1.577 15.275 1.00 0.00 H ATOM 89 N LEU A 28 5.692 -3.011 11.665 1.00 0.00 N ATOM 90 CA LEU A 28 6.624 -4.103 11.404 1.00 0.00 C ATOM 91 C LEU A 28 7.076 -4.091 9.941 1.00 0.00 C ATOM 92 O LEU A 28 8.275 -4.070 9.669 1.00 0.00 O ATOM 93 CB LEU A 28 5.972 -5.432 11.830 1.00 0.00 C ATOM 94 CG LEU A 28 6.880 -6.677 11.862 1.00 0.00 C ATOM 95 CD1 LEU A 28 7.127 -7.298 10.483 1.00 0.00 C ATOM 96 CD2 LEU A 28 8.212 -6.424 12.578 1.00 0.00 C ATOM 97 H LEU A 28 4.793 -3.250 12.059 1.00 0.00 H ATOM 98 HA LEU A 28 7.494 -3.925 12.037 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.601 -5.293 12.845 1.00 0.00 H ATOM 100 HB3 LEU A 28 5.112 -5.638 11.193 1.00 0.00 H ATOM 101 HG LEU A 28 6.343 -7.428 12.443 1.00 0.00 H ATOM 102 HD11 LEU A 28 6.174 -7.487 9.989 1.00 0.00 H ATOM 103 HD12 LEU A 28 7.739 -6.651 9.858 1.00 0.00 H ATOM 104 HD13 LEU A 28 7.647 -8.249 10.605 1.00 0.00 H ATOM 105 HD21 LEU A 28 8.852 -5.775 11.980 1.00 0.00 H ATOM 106 HD22 LEU A 28 8.030 -5.961 13.548 1.00 0.00 H ATOM 107 HD23 LEU A 28 8.727 -7.372 12.732 1.00 0.00 H ATOM 108 N VAL A 29 6.118 -4.079 9.007 1.00 0.00 N ATOM 109 CA VAL A 29 6.381 -4.019 7.572 1.00 0.00 C ATOM 110 C VAL A 29 6.458 -2.561 7.103 1.00 0.00 C ATOM 111 O VAL A 29 7.118 -2.282 6.105 1.00 0.00 O ATOM 112 CB VAL A 29 5.289 -4.795 6.813 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.530 -4.782 5.297 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.218 -6.256 7.278 1.00 0.00 C ATOM 115 H VAL A 29 5.150 -4.108 9.302 1.00 0.00 H ATOM 116 HA VAL A 29 7.333 -4.501 7.354 1.00 0.00 H ATOM 117 HB VAL A 29 4.333 -4.320 7.015 1.00 0.00 H ATOM 118 HG11 VAL A 29 4.820 -5.444 4.803 1.00 0.00 H ATOM 119 HG12 VAL A 29 5.389 -3.778 4.896 1.00 0.00 H ATOM 120 HG13 VAL A 29 6.541 -5.124 5.075 1.00 0.00 H ATOM 121 HG21 VAL A 29 4.459 -6.788 6.705 1.00 0.00 H ATOM 122 HG22 VAL A 29 6.182 -6.743 7.129 1.00 0.00 H ATOM 123 HG23 VAL A 29 4.947 -6.312 8.331 1.00 0.00 H ATOM 124 N ARG A 30 5.787 -1.643 7.815 1.00 0.00 N ATOM 125 CA ARG A 30 5.657 -0.227 7.495 1.00 0.00 C ATOM 126 C ARG A 30 4.689 -0.040 6.328 1.00 0.00 C ATOM 127 O ARG A 30 5.058 0.496 5.285 1.00 0.00 O ATOM 128 CB ARG A 30 7.012 0.472 7.275 1.00 0.00 C ATOM 129 CG ARG A 30 7.899 0.348 8.516 1.00 0.00 C ATOM 130 CD ARG A 30 9.176 1.177 8.375 1.00 0.00 C ATOM 131 NE ARG A 30 9.985 1.084 9.597 1.00 0.00 N ATOM 132 CZ ARG A 30 11.144 1.732 9.800 1.00 0.00 C ATOM 133 NH1 ARG A 30 11.656 2.534 8.856 1.00 0.00 N ATOM 134 NH2 ARG A 30 11.794 1.573 10.959 1.00 0.00 N ATOM 135 H ARG A 30 5.264 -1.955 8.623 1.00 0.00 H ATOM 136 HA ARG A 30 5.197 0.248 8.361 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.536 0.076 6.406 1.00 0.00 H ATOM 138 HB3 ARG A 30 6.825 1.531 7.095 1.00 0.00 H ATOM 139 HG2 ARG A 30 7.346 0.710 9.383 1.00 0.00 H ATOM 140 HG3 ARG A 30 8.174 -0.696 8.670 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.753 0.806 7.527 1.00 0.00 H ATOM 142 HD3 ARG A 30 8.909 2.220 8.200 1.00 0.00 H ATOM 143 HE ARG A 30 9.632 0.483 10.328 1.00 0.00 H ATOM 144 HH11 ARG A 30 11.171 2.655 7.978 1.00 0.00 H ATOM 145 HH12 ARG A 30 12.528 3.017 9.017 1.00 0.00 H ATOM 146 HH21 ARG A 30 11.415 0.968 11.674 1.00 0.00 H ATOM 147 HH22 ARG A 30 12.667 2.054 11.122 1.00 0.00 H ATOM 148 N HIS A 31 3.441 -0.481 6.522 1.00 0.00 N ATOM 149 CA HIS A 31 2.350 -0.258 5.583 1.00 0.00 C ATOM 150 C HIS A 31 1.010 -0.197 6.314 1.00 0.00 C ATOM 151 O HIS A 31 0.896 -0.651 7.453 1.00 0.00 O ATOM 152 CB HIS A 31 2.348 -1.314 4.466 1.00 0.00 C ATOM 153 CG HIS A 31 2.178 -2.753 4.898 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.851 -3.132 6.191 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.261 -3.930 4.193 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.758 -4.473 6.208 1.00 0.00 C ATOM 157 NE2 HIS A 31 1.996 -5.021 5.015 1.00 0.00 N ATOM 158 H HIS A 31 3.212 -0.917 7.407 1.00 0.00 H ATOM 159 HA HIS A 31 2.497 0.713 5.107 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.542 -1.083 3.771 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.285 -1.231 3.918 1.00 0.00 H ATOM 162 HD1 HIS A 31 1.702 -2.510 6.972 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.494 -3.998 3.140 1.00 0.00 H ATOM 164 HE1 HIS A 31 1.518 -5.047 7.090 1.00 0.00 H ATOM 165 N TRP A 32 -0.001 0.352 5.635 1.00 0.00 N ATOM 166 CA TRP A 32 -1.373 0.389 6.118 1.00 0.00 C ATOM 167 C TRP A 32 -2.064 -0.928 5.780 1.00 0.00 C ATOM 168 O TRP A 32 -2.174 -1.289 4.610 1.00 0.00 O ATOM 169 CB TRP A 32 -2.115 1.575 5.497 1.00 0.00 C ATOM 170 CG TRP A 32 -1.726 2.904 6.061 1.00 0.00 C ATOM 171 CD1 TRP A 32 -0.850 3.777 5.514 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.160 3.510 7.314 1.00 0.00 C ATOM 173 NE1 TRP A 32 -0.706 4.875 6.337 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.490 4.759 7.468 1.00 0.00 C ATOM 175 CE3 TRP A 32 -3.050 3.127 8.340 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -1.689 5.582 8.585 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.264 3.949 9.462 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.582 5.173 9.588 1.00 0.00 C ATOM 179 H TRP A 32 0.181 0.690 4.702 1.00 0.00 H ATOM 180 HA TRP A 32 -1.378 0.529 7.200 1.00 0.00 H ATOM 181 HB2 TRP A 32 -1.965 1.577 4.416 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.182 1.449 5.686 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.326 3.628 4.581 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.105 5.667 6.159 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.578 2.189 8.259 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.162 6.522 8.673 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -3.958 3.642 10.229 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.747 5.796 10.455 1.00 0.00 H ATOM 189 N VAL A 33 -2.534 -1.632 6.814 1.00 0.00 N ATOM 190 CA VAL A 33 -3.275 -2.876 6.698 1.00 0.00 C ATOM 191 C VAL A 33 -4.754 -2.528 6.846 1.00 0.00 C ATOM 192 O VAL A 33 -5.193 -2.132 7.926 1.00 0.00 O ATOM 193 CB VAL A 33 -2.800 -3.867 7.773 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.606 -5.171 7.716 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.317 -4.197 7.573 1.00 0.00 C ATOM 196 H VAL A 33 -2.403 -1.267 7.748 1.00 0.00 H ATOM 197 HA VAL A 33 -3.102 -3.334 5.722 1.00 0.00 H ATOM 198 HB VAL A 33 -2.921 -3.415 8.756 1.00 0.00 H ATOM 199 HG11 VAL A 33 -4.662 -4.982 7.905 1.00 0.00 H ATOM 200 HG12 VAL A 33 -3.499 -5.633 6.734 1.00 0.00 H ATOM 201 HG13 VAL A 33 -3.239 -5.862 8.476 1.00 0.00 H ATOM 202 HG21 VAL A 33 -0.714 -3.296 7.676 1.00 0.00 H ATOM 203 HG22 VAL A 33 -0.995 -4.919 8.325 1.00 0.00 H ATOM 204 HG23 VAL A 33 -1.161 -4.622 6.582 1.00 0.00 H ATOM 205 N CYS A 34 -5.505 -2.663 5.749 1.00 0.00 N ATOM 206 CA CYS A 34 -6.904 -2.277 5.653 1.00 0.00 C ATOM 207 C CYS A 34 -7.816 -3.491 5.806 1.00 0.00 C ATOM 208 O CYS A 34 -7.462 -4.600 5.408 1.00 0.00 O ATOM 209 CB CYS A 34 -7.144 -1.563 4.323 1.00 0.00 C ATOM 210 SG CYS A 34 -6.272 0.018 4.149 1.00 0.00 S ATOM 211 H CYS A 34 -5.070 -3.017 4.908 1.00 0.00 H ATOM 212 HA CYS A 34 -7.149 -1.576 6.442 1.00 0.00 H ATOM 213 HB2 CYS A 34 -6.836 -2.217 3.507 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.210 -1.363 4.216 1.00 0.00 H HETATM 215 N NH2 A 35 -8.998 -3.282 6.389 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -9.638 -4.052 6.513 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -9.247 -2.353 6.707 1.00 0.00 H TER 218 NH2 A 35