HETATM 1 C ACE A 22 -9.244 1.241 9.043 1.00 0.00 C HETATM 2 O ACE A 22 -9.205 0.249 9.769 1.00 0.00 O HETATM 3 CH3 ACE A 22 -10.475 2.139 9.031 1.00 0.00 C HETATM 4 H1 ACE A 22 -10.896 2.170 8.026 1.00 0.00 H HETATM 5 H2 ACE A 22 -11.224 1.751 9.721 1.00 0.00 H HETATM 6 H3 ACE A 22 -10.195 3.148 9.336 1.00 0.00 H ATOM 7 N CYS A 23 -8.239 1.597 8.234 1.00 0.00 N ATOM 8 CA CYS A 23 -6.990 0.852 8.141 1.00 0.00 C ATOM 9 C CYS A 23 -6.098 1.193 9.335 1.00 0.00 C ATOM 10 O CYS A 23 -6.187 2.293 9.878 1.00 0.00 O ATOM 11 CB CYS A 23 -6.279 1.166 6.819 1.00 0.00 C ATOM 12 SG CYS A 23 -7.318 1.100 5.332 1.00 0.00 S ATOM 13 H CYS A 23 -8.332 2.433 7.677 1.00 0.00 H ATOM 14 HA CYS A 23 -7.221 -0.212 8.165 1.00 0.00 H ATOM 15 HB2 CYS A 23 -5.871 2.177 6.877 1.00 0.00 H ATOM 16 HB3 CYS A 23 -5.445 0.474 6.698 1.00 0.00 H ATOM 17 N HIS A 24 -5.243 0.246 9.738 1.00 0.00 N ATOM 18 CA HIS A 24 -4.325 0.393 10.860 1.00 0.00 C ATOM 19 C HIS A 24 -2.890 0.205 10.377 1.00 0.00 C ATOM 20 O HIS A 24 -2.613 -0.684 9.573 1.00 0.00 O ATOM 21 CB HIS A 24 -4.688 -0.597 11.974 1.00 0.00 C ATOM 22 CG HIS A 24 -4.642 -2.045 11.559 1.00 0.00 C ATOM 23 ND1 HIS A 24 -5.699 -2.669 10.916 1.00 0.00 N ATOM 24 CD2 HIS A 24 -3.675 -3.013 11.689 1.00 0.00 C ATOM 25 CE1 HIS A 24 -5.335 -3.942 10.693 1.00 0.00 C ATOM 26 NE2 HIS A 24 -4.111 -4.219 11.148 1.00 0.00 N ATOM 27 H HIS A 24 -5.207 -0.627 9.226 1.00 0.00 H ATOM 28 HA HIS A 24 -4.411 1.393 11.287 1.00 0.00 H ATOM 29 HB2 HIS A 24 -3.997 -0.456 12.806 1.00 0.00 H ATOM 30 HB3 HIS A 24 -5.694 -0.371 12.329 1.00 0.00 H ATOM 31 HD1 HIS A 24 -6.578 -2.243 10.656 1.00 0.00 H ATOM 32 HD2 HIS A 24 -2.711 -2.860 12.151 1.00 0.00 H ATOM 33 HE1 HIS A 24 -5.968 -4.667 10.203 1.00 0.00 H ATOM 34 N TRP A 25 -1.979 1.054 10.862 1.00 0.00 N ATOM 35 CA TRP A 25 -0.583 1.035 10.465 1.00 0.00 C ATOM 36 C TRP A 25 0.143 -0.131 11.132 1.00 0.00 C ATOM 37 O TRP A 25 0.273 -0.160 12.355 1.00 0.00 O ATOM 38 CB TRP A 25 0.077 2.364 10.839 1.00 0.00 C ATOM 39 CG TRP A 25 1.531 2.465 10.494 1.00 0.00 C ATOM 40 CD1 TRP A 25 2.557 2.352 11.366 1.00 0.00 C ATOM 41 CD2 TRP A 25 2.143 2.701 9.193 1.00 0.00 C ATOM 42 NE1 TRP A 25 3.756 2.530 10.707 1.00 0.00 N ATOM 43 CE2 TRP A 25 3.556 2.759 9.361 1.00 0.00 C ATOM 44 CE3 TRP A 25 1.646 2.884 7.885 1.00 0.00 C ATOM 45 CZ2 TRP A 25 4.430 3.008 8.293 1.00 0.00 C ATOM 46 CZ3 TRP A 25 2.511 3.140 6.806 1.00 0.00 C ATOM 47 CH2 TRP A 25 3.901 3.205 7.008 1.00 0.00 C ATOM 48 H TRP A 25 -2.268 1.757 11.526 1.00 0.00 H ATOM 49 HA TRP A 25 -0.524 0.936 9.381 1.00 0.00 H ATOM 50 HB2 TRP A 25 -0.442 3.167 10.316 1.00 0.00 H ATOM 51 HB3 TRP A 25 -0.041 2.533 11.911 1.00 0.00 H ATOM 52 HD1 TRP A 25 2.456 2.169 12.426 1.00 0.00 H ATOM 53 HE1 TRP A 25 4.670 2.506 11.134 1.00 0.00 H ATOM 54 HE3 TRP A 25 0.583 2.823 7.717 1.00 0.00 H ATOM 55 HZ2 TRP A 25 5.496 3.054 8.460 1.00 0.00 H ATOM 56 HZ3 TRP A 25 2.105 3.288 5.816 1.00 0.00 H ATOM 57 HH2 TRP A 25 4.561 3.402 6.175 1.00 0.00 H ATOM 58 N ASP A 26 0.638 -1.070 10.321 1.00 0.00 N ATOM 59 CA ASP A 26 1.530 -2.126 10.767 1.00 0.00 C ATOM 60 C ASP A 26 2.959 -1.607 10.631 1.00 0.00 C ATOM 61 O ASP A 26 3.484 -1.505 9.524 1.00 0.00 O ATOM 62 CB ASP A 26 1.298 -3.393 9.942 1.00 0.00 C ATOM 63 CG ASP A 26 2.307 -4.480 10.300 1.00 0.00 C ATOM 64 OD1 ASP A 26 2.044 -5.200 11.287 1.00 0.00 O ATOM 65 OD2 ASP A 26 3.330 -4.568 9.586 1.00 0.00 O ATOM 66 H ASP A 26 0.482 -0.985 9.325 1.00 0.00 H ATOM 67 HA ASP A 26 1.326 -2.378 11.809 1.00 0.00 H ATOM 68 HB2 ASP A 26 0.291 -3.763 10.136 1.00 0.00 H ATOM 69 HB3 ASP A 26 1.382 -3.159 8.882 1.00 0.00 H ATOM 70 N LEU A 27 3.575 -1.276 11.771 1.00 0.00 N ATOM 71 CA LEU A 27 4.919 -0.723 11.857 1.00 0.00 C ATOM 72 C LEU A 27 5.989 -1.741 11.446 1.00 0.00 C ATOM 73 O LEU A 27 7.040 -1.344 10.951 1.00 0.00 O ATOM 74 CB LEU A 27 5.140 -0.220 13.293 1.00 0.00 C ATOM 75 CG LEU A 27 6.506 0.442 13.550 1.00 0.00 C ATOM 76 CD1 LEU A 27 6.704 1.709 12.708 1.00 0.00 C ATOM 77 CD2 LEU A 27 6.611 0.808 15.034 1.00 0.00 C ATOM 78 H LEU A 27 3.066 -1.387 12.636 1.00 0.00 H ATOM 79 HA LEU A 27 4.974 0.122 11.173 1.00 0.00 H ATOM 80 HB2 LEU A 27 4.356 0.500 13.532 1.00 0.00 H ATOM 81 HB3 LEU A 27 5.039 -1.070 13.970 1.00 0.00 H ATOM 82 HG LEU A 27 7.308 -0.261 13.328 1.00 0.00 H ATOM 83 HD11 LEU A 27 6.724 1.466 11.648 1.00 0.00 H ATOM 84 HD12 LEU A 27 5.898 2.416 12.904 1.00 0.00 H ATOM 85 HD13 LEU A 27 7.654 2.175 12.970 1.00 0.00 H ATOM 86 HD21 LEU A 27 5.830 1.519 15.302 1.00 0.00 H ATOM 87 HD22 LEU A 27 6.503 -0.088 15.645 1.00 0.00 H ATOM 88 HD23 LEU A 27 7.585 1.254 15.237 1.00 0.00 H ATOM 89 N LEU A 28 5.734 -3.040 11.652 1.00 0.00 N ATOM 90 CA LEU A 28 6.696 -4.103 11.382 1.00 0.00 C ATOM 91 C LEU A 28 7.128 -4.079 9.913 1.00 0.00 C ATOM 92 O LEU A 28 8.322 -4.057 9.622 1.00 0.00 O ATOM 93 CB LEU A 28 6.106 -5.475 11.752 1.00 0.00 C ATOM 94 CG LEU A 28 5.930 -5.769 13.255 1.00 0.00 C ATOM 95 CD1 LEU A 28 7.260 -5.736 14.016 1.00 0.00 C ATOM 96 CD2 LEU A 28 4.905 -4.865 13.950 1.00 0.00 C ATOM 97 H LEU A 28 4.840 -3.305 12.035 1.00 0.00 H ATOM 98 HA LEU A 28 7.588 -3.926 11.984 1.00 0.00 H ATOM 99 HB2 LEU A 28 5.141 -5.594 11.259 1.00 0.00 H ATOM 100 HB3 LEU A 28 6.773 -6.240 11.354 1.00 0.00 H ATOM 101 HG LEU A 28 5.547 -6.789 13.320 1.00 0.00 H ATOM 102 HD11 LEU A 28 7.995 -6.361 13.507 1.00 0.00 H ATOM 103 HD12 LEU A 28 7.640 -4.718 14.090 1.00 0.00 H ATOM 104 HD13 LEU A 28 7.108 -6.123 15.025 1.00 0.00 H ATOM 105 HD21 LEU A 28 4.681 -5.270 14.937 1.00 0.00 H ATOM 106 HD22 LEU A 28 5.299 -3.857 14.076 1.00 0.00 H ATOM 107 HD23 LEU A 28 3.982 -4.830 13.370 1.00 0.00 H ATOM 108 N VAL A 29 6.153 -4.073 8.997 1.00 0.00 N ATOM 109 CA VAL A 29 6.378 -4.004 7.557 1.00 0.00 C ATOM 110 C VAL A 29 6.420 -2.541 7.088 1.00 0.00 C ATOM 111 O VAL A 29 7.056 -2.247 6.079 1.00 0.00 O ATOM 112 CB VAL A 29 5.293 -4.828 6.842 1.00 0.00 C ATOM 113 CG1 VAL A 29 5.368 -4.708 5.314 1.00 0.00 C ATOM 114 CG2 VAL A 29 5.397 -6.310 7.227 1.00 0.00 C ATOM 115 H VAL A 29 5.193 -4.108 9.313 1.00 0.00 H ATOM 116 HA VAL A 29 7.339 -4.459 7.313 1.00 0.00 H ATOM 117 HB VAL A 29 4.322 -4.467 7.164 1.00 0.00 H ATOM 118 HG11 VAL A 29 6.364 -4.980 4.966 1.00 0.00 H ATOM 119 HG12 VAL A 29 4.636 -5.376 4.857 1.00 0.00 H ATOM 120 HG13 VAL A 29 5.137 -3.691 4.998 1.00 0.00 H ATOM 121 HG21 VAL A 29 5.272 -6.438 8.303 1.00 0.00 H ATOM 122 HG22 VAL A 29 4.614 -6.876 6.722 1.00 0.00 H ATOM 123 HG23 VAL A 29 6.368 -6.705 6.931 1.00 0.00 H ATOM 124 N ARG A 30 5.754 -1.632 7.815 1.00 0.00 N ATOM 125 CA ARG A 30 5.645 -0.209 7.513 1.00 0.00 C ATOM 126 C ARG A 30 4.668 0.020 6.360 1.00 0.00 C ATOM 127 O ARG A 30 5.036 0.571 5.324 1.00 0.00 O ATOM 128 CB ARG A 30 7.010 0.455 7.261 1.00 0.00 C ATOM 129 CG ARG A 30 7.933 0.350 8.481 1.00 0.00 C ATOM 130 CD ARG A 30 9.205 1.183 8.298 1.00 0.00 C ATOM 131 NE ARG A 30 8.909 2.622 8.278 1.00 0.00 N ATOM 132 CZ ARG A 30 9.822 3.589 8.090 1.00 0.00 C ATOM 133 NH1 ARG A 30 11.114 3.286 7.907 1.00 0.00 N ATOM 134 NH2 ARG A 30 9.435 4.871 8.086 1.00 0.00 N ATOM 135 H ARG A 30 5.238 -1.949 8.625 1.00 0.00 H ATOM 136 HA ARG A 30 5.215 0.269 8.393 1.00 0.00 H ATOM 137 HB2 ARG A 30 7.505 0.020 6.393 1.00 0.00 H ATOM 138 HB3 ARG A 30 6.834 1.509 7.049 1.00 0.00 H ATOM 139 HG2 ARG A 30 7.408 0.706 9.367 1.00 0.00 H ATOM 140 HG3 ARG A 30 8.216 -0.693 8.626 1.00 0.00 H ATOM 141 HD2 ARG A 30 9.876 0.974 9.132 1.00 0.00 H ATOM 142 HD3 ARG A 30 9.693 0.891 7.367 1.00 0.00 H ATOM 143 HE ARG A 30 7.946 2.890 8.419 1.00 0.00 H ATOM 144 HH11 ARG A 30 11.412 2.322 7.910 1.00 0.00 H ATOM 145 HH12 ARG A 30 11.794 4.020 7.766 1.00 0.00 H ATOM 146 HH21 ARG A 30 8.462 5.107 8.223 1.00 0.00 H ATOM 147 HH22 ARG A 30 10.113 5.606 7.946 1.00 0.00 H ATOM 148 N HIS A 31 3.412 -0.401 6.551 1.00 0.00 N ATOM 149 CA HIS A 31 2.324 -0.156 5.615 1.00 0.00 C ATOM 150 C HIS A 31 0.987 -0.088 6.348 1.00 0.00 C ATOM 151 O HIS A 31 0.890 -0.467 7.514 1.00 0.00 O ATOM 152 CB HIS A 31 2.300 -1.213 4.502 1.00 0.00 C ATOM 153 CG HIS A 31 1.939 -2.605 4.955 1.00 0.00 C ATOM 154 ND1 HIS A 31 1.269 -3.499 4.133 1.00 0.00 N ATOM 155 CD2 HIS A 31 2.144 -3.286 6.130 1.00 0.00 C ATOM 156 CE1 HIS A 31 1.124 -4.643 4.821 1.00 0.00 C ATOM 157 NE2 HIS A 31 1.638 -4.579 6.050 1.00 0.00 N ATOM 158 H HIS A 31 3.177 -0.842 7.432 1.00 0.00 H ATOM 159 HA HIS A 31 2.485 0.815 5.141 1.00 0.00 H ATOM 160 HB2 HIS A 31 1.573 -0.903 3.751 1.00 0.00 H ATOM 161 HB3 HIS A 31 3.276 -1.241 4.022 1.00 0.00 H ATOM 162 HD1 HIS A 31 0.955 -3.324 3.189 1.00 0.00 H ATOM 163 HD2 HIS A 31 2.649 -2.885 6.994 1.00 0.00 H ATOM 164 HE1 HIS A 31 0.638 -5.522 4.423 1.00 0.00 H ATOM 165 N TRP A 32 -0.042 0.380 5.638 1.00 0.00 N ATOM 166 CA TRP A 32 -1.415 0.401 6.115 1.00 0.00 C ATOM 167 C TRP A 32 -2.079 -0.935 5.795 1.00 0.00 C ATOM 168 O TRP A 32 -2.179 -1.316 4.629 1.00 0.00 O ATOM 169 CB TRP A 32 -2.175 1.563 5.470 1.00 0.00 C ATOM 170 CG TRP A 32 -1.783 2.911 5.987 1.00 0.00 C ATOM 171 CD1 TRP A 32 -0.954 3.787 5.378 1.00 0.00 C ATOM 172 CD2 TRP A 32 -2.162 3.534 7.250 1.00 0.00 C ATOM 173 NE1 TRP A 32 -0.790 4.906 6.170 1.00 0.00 N ATOM 174 CE2 TRP A 32 -1.511 4.798 7.343 1.00 0.00 C ATOM 175 CE3 TRP A 32 -2.982 3.152 8.333 1.00 0.00 C ATOM 176 CZ2 TRP A 32 -1.665 5.640 8.455 1.00 0.00 C ATOM 177 CZ3 TRP A 32 -3.147 3.989 9.451 1.00 0.00 C ATOM 178 CH2 TRP A 32 -2.489 5.230 9.515 1.00 0.00 C ATOM 179 H TRP A 32 0.130 0.661 4.683 1.00 0.00 H ATOM 180 HA TRP A 32 -1.430 0.558 7.193 1.00 0.00 H ATOM 181 HB2 TRP A 32 -2.041 1.533 4.387 1.00 0.00 H ATOM 182 HB3 TRP A 32 -3.237 1.436 5.679 1.00 0.00 H ATOM 183 HD1 TRP A 32 -0.475 3.630 4.423 1.00 0.00 H ATOM 184 HE1 TRP A 32 -0.215 5.706 5.945 1.00 0.00 H ATOM 185 HE3 TRP A 32 -3.492 2.201 8.299 1.00 0.00 H ATOM 186 HZ2 TRP A 32 -1.155 6.591 8.495 1.00 0.00 H ATOM 187 HZ3 TRP A 32 -3.781 3.678 10.268 1.00 0.00 H ATOM 188 HH2 TRP A 32 -2.617 5.866 10.378 1.00 0.00 H ATOM 189 N VAL A 33 -2.539 -1.633 6.839 1.00 0.00 N ATOM 190 CA VAL A 33 -3.271 -2.884 6.737 1.00 0.00 C ATOM 191 C VAL A 33 -4.753 -2.552 6.892 1.00 0.00 C ATOM 192 O VAL A 33 -5.186 -2.116 7.957 1.00 0.00 O ATOM 193 CB VAL A 33 -2.782 -3.868 7.812 1.00 0.00 C ATOM 194 CG1 VAL A 33 -3.593 -5.171 7.779 1.00 0.00 C ATOM 195 CG2 VAL A 33 -1.305 -4.208 7.585 1.00 0.00 C ATOM 196 H VAL A 33 -2.411 -1.255 7.768 1.00 0.00 H ATOM 197 HA VAL A 33 -3.100 -3.346 5.763 1.00 0.00 H ATOM 198 HB VAL A 33 -2.885 -3.411 8.797 1.00 0.00 H ATOM 199 HG11 VAL A 33 -3.210 -5.860 8.533 1.00 0.00 H ATOM 200 HG12 VAL A 33 -4.643 -4.978 7.992 1.00 0.00 H ATOM 201 HG13 VAL A 33 -3.509 -5.637 6.797 1.00 0.00 H ATOM 202 HG21 VAL A 33 -0.694 -3.309 7.647 1.00 0.00 H ATOM 203 HG22 VAL A 33 -0.968 -4.915 8.344 1.00 0.00 H ATOM 204 HG23 VAL A 33 -1.180 -4.660 6.601 1.00 0.00 H ATOM 205 N CYS A 34 -5.515 -2.749 5.813 1.00 0.00 N ATOM 206 CA CYS A 34 -6.936 -2.451 5.741 1.00 0.00 C ATOM 207 C CYS A 34 -7.749 -3.730 5.932 1.00 0.00 C ATOM 208 O CYS A 34 -7.280 -4.826 5.635 1.00 0.00 O ATOM 209 CB CYS A 34 -7.242 -1.801 4.388 1.00 0.00 C ATOM 210 SG CYS A 34 -6.393 -0.229 4.073 1.00 0.00 S ATOM 211 H CYS A 34 -5.083 -3.120 4.979 1.00 0.00 H ATOM 212 HA CYS A 34 -7.214 -1.745 6.521 1.00 0.00 H ATOM 213 HB2 CYS A 34 -6.964 -2.497 3.595 1.00 0.00 H ATOM 214 HB3 CYS A 34 -8.315 -1.619 4.318 1.00 0.00 H HETATM 215 N NH2 A 35 -8.979 -3.593 6.434 1.00 0.00 N HETATM 216 HN1 NH2 A 35 -9.551 -4.411 6.578 1.00 0.00 H HETATM 217 HN2 NH2 A 35 -9.331 -2.677 6.667 1.00 0.00 H TER 218 NH2 A 35