HETATM 1 C ACE A 0 11.925 -7.266 -1.863 1.00 0.00 C HETATM 2 O ACE A 0 12.318 -6.931 -2.979 1.00 0.00 O HETATM 3 CH3 ACE A 0 12.680 -8.321 -1.064 1.00 0.00 C HETATM 4 H1 ACE A 0 13.024 -7.890 -0.123 1.00 0.00 H HETATM 5 H2 ACE A 0 12.021 -9.165 -0.857 1.00 0.00 H HETATM 6 H3 ACE A 0 13.542 -8.671 -1.633 1.00 0.00 H ATOM 7 N ASN A 1 10.838 -6.744 -1.284 1.00 0.00 N ATOM 8 CA ASN A 1 10.015 -5.711 -1.900 1.00 0.00 C ATOM 9 C ASN A 1 10.726 -4.357 -1.888 1.00 0.00 C ATOM 10 O ASN A 1 11.684 -4.151 -1.143 1.00 0.00 O ATOM 11 CB ASN A 1 8.667 -5.623 -1.170 1.00 0.00 C ATOM 12 CG ASN A 1 8.831 -5.246 0.303 1.00 0.00 C ATOM 13 OD1 ASN A 1 8.927 -6.124 1.157 1.00 0.00 O ATOM 14 ND2 ASN A 1 8.866 -3.948 0.609 1.00 0.00 N ATOM 15 H ASN A 1 10.575 -7.057 -0.360 1.00 0.00 H ATOM 16 HA ASN A 1 9.817 -5.995 -2.935 1.00 0.00 H ATOM 17 HB2 ASN A 1 8.031 -4.889 -1.665 1.00 0.00 H ATOM 18 HB3 ASN A 1 8.172 -6.593 -1.230 1.00 0.00 H ATOM 19 HD21 ASN A 1 8.788 -3.244 -0.113 1.00 0.00 H ATOM 20 HD22 ASN A 1 8.954 -3.670 1.576 1.00 0.00 H ATOM 21 N LEU A 2 10.230 -3.425 -2.708 1.00 0.00 N ATOM 22 CA LEU A 2 10.670 -2.038 -2.702 1.00 0.00 C ATOM 23 C LEU A 2 10.283 -1.430 -1.346 1.00 0.00 C ATOM 24 O LEU A 2 9.112 -1.514 -0.981 1.00 0.00 O ATOM 25 CB LEU A 2 9.974 -1.299 -3.857 1.00 0.00 C ATOM 26 CG LEU A 2 10.438 0.158 -4.031 1.00 0.00 C ATOM 27 CD1 LEU A 2 11.800 0.227 -4.733 1.00 0.00 C ATOM 28 CD2 LEU A 2 9.410 0.927 -4.868 1.00 0.00 C ATOM 29 H LEU A 2 9.454 -3.667 -3.308 1.00 0.00 H ATOM 30 HA LEU A 2 11.745 -2.033 -2.870 1.00 0.00 H ATOM 31 HB2 LEU A 2 10.150 -1.837 -4.789 1.00 0.00 H ATOM 32 HB3 LEU A 2 8.900 -1.307 -3.664 1.00 0.00 H ATOM 33 HG LEU A 2 10.511 0.647 -3.059 1.00 0.00 H ATOM 34 HD11 LEU A 2 12.114 1.268 -4.821 1.00 0.00 H ATOM 35 HD12 LEU A 2 12.556 -0.317 -4.169 1.00 0.00 H ATOM 36 HD13 LEU A 2 11.728 -0.206 -5.732 1.00 0.00 H ATOM 37 HD21 LEU A 2 8.443 0.926 -4.365 1.00 0.00 H ATOM 38 HD22 LEU A 2 9.737 1.959 -4.997 1.00 0.00 H ATOM 39 HD23 LEU A 2 9.302 0.461 -5.848 1.00 0.00 H ATOM 40 N PRO A 3 11.220 -0.837 -0.584 1.00 0.00 N ATOM 41 CA PRO A 3 10.929 -0.253 0.717 1.00 0.00 C ATOM 42 C PRO A 3 10.162 1.059 0.527 1.00 0.00 C ATOM 43 O PRO A 3 10.756 2.131 0.431 1.00 0.00 O ATOM 44 CB PRO A 3 12.294 -0.059 1.384 1.00 0.00 C ATOM 45 CG PRO A 3 13.235 0.165 0.202 1.00 0.00 C ATOM 46 CD PRO A 3 12.637 -0.723 -0.890 1.00 0.00 C ATOM 47 HA PRO A 3 10.337 -0.938 1.327 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.312 0.767 2.097 1.00 0.00 H ATOM 49 HB3 PRO A 3 12.578 -0.985 1.887 1.00 0.00 H ATOM 50 HG2 PRO A 3 13.188 1.209 -0.111 1.00 0.00 H ATOM 51 HG3 PRO A 3 14.265 -0.107 0.437 1.00 0.00 H ATOM 52 HD2 PRO A 3 12.809 -0.263 -1.862 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.097 -1.711 -0.850 1.00 0.00 H ATOM 54 N ARG A 4 8.830 0.956 0.462 1.00 0.00 N ATOM 55 CA ARG A 4 7.933 2.059 0.160 1.00 0.00 C ATOM 56 C ARG A 4 6.539 1.749 0.704 1.00 0.00 C ATOM 57 O ARG A 4 6.256 0.620 1.106 1.00 0.00 O ATOM 58 CB ARG A 4 7.893 2.274 -1.366 1.00 0.00 C ATOM 59 CG ARG A 4 8.629 3.540 -1.824 1.00 0.00 C ATOM 60 CD ARG A 4 7.909 4.840 -1.433 1.00 0.00 C ATOM 61 NE ARG A 4 6.502 4.854 -1.861 1.00 0.00 N ATOM 62 CZ ARG A 4 6.058 4.987 -3.121 1.00 0.00 C ATOM 63 NH1 ARG A 4 6.906 5.168 -4.143 1.00 0.00 N ATOM 64 NH2 ARG A 4 4.740 4.935 -3.351 1.00 0.00 N ATOM 65 H ARG A 4 8.411 0.039 0.548 1.00 0.00 H ATOM 66 HA ARG A 4 8.292 2.956 0.665 1.00 0.00 H ATOM 67 HB2 ARG A 4 8.363 1.421 -1.857 1.00 0.00 H ATOM 68 HB3 ARG A 4 6.864 2.312 -1.721 1.00 0.00 H ATOM 69 HG2 ARG A 4 9.636 3.547 -1.406 1.00 0.00 H ATOM 70 HG3 ARG A 4 8.717 3.501 -2.910 1.00 0.00 H ATOM 71 HD2 ARG A 4 7.936 4.962 -0.351 1.00 0.00 H ATOM 72 HD3 ARG A 4 8.435 5.688 -1.874 1.00 0.00 H ATOM 73 HE ARG A 4 5.804 4.747 -1.136 1.00 0.00 H ATOM 74 HH11 ARG A 4 7.900 5.212 -3.972 1.00 0.00 H ATOM 75 HH12 ARG A 4 6.555 5.265 -5.085 1.00 0.00 H ATOM 76 HH21 ARG A 4 4.107 4.797 -2.574 1.00 0.00 H ATOM 77 HH22 ARG A 4 4.379 5.034 -4.289 1.00 0.00 H ATOM 78 N CYS A 5 5.671 2.768 0.706 1.00 0.00 N ATOM 79 CA CYS A 5 4.262 2.648 1.054 1.00 0.00 C ATOM 80 C CYS A 5 3.436 3.425 0.034 1.00 0.00 C ATOM 81 O CYS A 5 3.938 4.360 -0.588 1.00 0.00 O ATOM 82 CB CYS A 5 4.005 3.154 2.481 1.00 0.00 C ATOM 83 SG CYS A 5 5.116 2.526 3.777 1.00 0.00 S ATOM 84 H CYS A 5 5.985 3.670 0.380 1.00 0.00 H ATOM 85 HA CYS A 5 3.967 1.606 0.967 1.00 0.00 H ATOM 86 HB2 CYS A 5 4.111 4.239 2.479 1.00 0.00 H ATOM 87 HB3 CYS A 5 2.975 2.922 2.757 1.00 0.00 H ATOM 88 N THR A 6 2.174 3.023 -0.149 1.00 0.00 N ATOM 89 CA THR A 6 1.294 3.566 -1.172 1.00 0.00 C ATOM 90 C THR A 6 -0.139 3.633 -0.645 1.00 0.00 C ATOM 91 O THR A 6 -0.552 2.795 0.156 1.00 0.00 O ATOM 92 CB THR A 6 1.410 2.728 -2.456 1.00 0.00 C ATOM 93 OG1 THR A 6 0.616 3.294 -3.477 1.00 0.00 O ATOM 94 CG2 THR A 6 1.004 1.263 -2.258 1.00 0.00 C ATOM 95 H THR A 6 1.810 2.268 0.419 1.00 0.00 H ATOM 96 HA THR A 6 1.605 4.582 -1.413 1.00 0.00 H ATOM 97 HB THR A 6 2.448 2.753 -2.791 1.00 0.00 H ATOM 98 HG1 THR A 6 0.935 4.180 -3.663 1.00 0.00 H ATOM 99 HG21 THR A 6 1.147 0.722 -3.194 1.00 0.00 H ATOM 100 HG22 THR A 6 1.618 0.795 -1.488 1.00 0.00 H ATOM 101 HG23 THR A 6 -0.046 1.192 -1.973 1.00 0.00 H ATOM 102 N GLU A 7 -0.891 4.641 -1.102 1.00 0.00 N ATOM 103 CA GLU A 7 -2.288 4.823 -0.750 1.00 0.00 C ATOM 104 C GLU A 7 -3.106 3.749 -1.473 1.00 0.00 C ATOM 105 O GLU A 7 -3.119 3.712 -2.703 1.00 0.00 O ATOM 106 CB GLU A 7 -2.729 6.249 -1.119 1.00 0.00 C ATOM 107 CG GLU A 7 -3.882 6.751 -0.240 1.00 0.00 C ATOM 108 CD GLU A 7 -5.114 5.853 -0.305 1.00 0.00 C ATOM 109 OE1 GLU A 7 -5.687 5.746 -1.411 1.00 0.00 O ATOM 110 OE2 GLU A 7 -5.458 5.289 0.756 1.00 0.00 O ATOM 111 H GLU A 7 -0.485 5.286 -1.764 1.00 0.00 H ATOM 112 HA GLU A 7 -2.389 4.709 0.329 1.00 0.00 H ATOM 113 HB2 GLU A 7 -1.893 6.931 -0.963 1.00 0.00 H ATOM 114 HB3 GLU A 7 -3.012 6.297 -2.172 1.00 0.00 H ATOM 115 HG2 GLU A 7 -3.538 6.813 0.793 1.00 0.00 H ATOM 116 HG3 GLU A 7 -4.163 7.753 -0.566 1.00 0.00 H ATOM 117 N GLY A 8 -3.769 2.875 -0.709 1.00 0.00 N ATOM 118 CA GLY A 8 -4.541 1.753 -1.220 1.00 0.00 C ATOM 119 C GLY A 8 -5.840 1.569 -0.430 1.00 0.00 C ATOM 120 O GLY A 8 -6.222 2.446 0.343 1.00 0.00 O ATOM 121 H GLY A 8 -3.728 2.978 0.296 1.00 0.00 H ATOM 122 HA2 GLY A 8 -4.797 1.909 -2.269 1.00 0.00 H ATOM 123 HA3 GLY A 8 -3.925 0.858 -1.132 1.00 0.00 H ATOM 124 N PRO A 9 -6.526 0.428 -0.624 1.00 0.00 N ATOM 125 CA PRO A 9 -7.805 0.111 0.001 1.00 0.00 C ATOM 126 C PRO A 9 -7.811 0.296 1.520 1.00 0.00 C ATOM 127 O PRO A 9 -8.794 0.785 2.074 1.00 0.00 O ATOM 128 CB PRO A 9 -8.101 -1.341 -0.384 1.00 0.00 C ATOM 129 CG PRO A 9 -7.379 -1.499 -1.719 1.00 0.00 C ATOM 130 CD PRO A 9 -6.133 -0.635 -1.534 1.00 0.00 C ATOM 131 HA PRO A 9 -8.566 0.754 -0.446 1.00 0.00 H ATOM 132 HB2 PRO A 9 -7.655 -2.024 0.339 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.171 -1.536 -0.467 1.00 0.00 H ATOM 134 HG2 PRO A 9 -7.134 -2.539 -1.939 1.00 0.00 H ATOM 135 HG3 PRO A 9 -7.997 -1.080 -2.514 1.00 0.00 H ATOM 136 HD2 PRO A 9 -5.340 -1.226 -1.074 1.00 0.00 H ATOM 137 HD3 PRO A 9 -5.802 -0.254 -2.501 1.00 0.00 H ATOM 138 N TRP A 10 -6.717 -0.092 2.185 1.00 0.00 N ATOM 139 CA TRP A 10 -6.591 -0.075 3.637 1.00 0.00 C ATOM 140 C TRP A 10 -5.819 1.165 4.099 1.00 0.00 C ATOM 141 O TRP A 10 -5.070 1.099 5.073 1.00 0.00 O ATOM 142 CB TRP A 10 -5.885 -1.365 4.074 1.00 0.00 C ATOM 143 CG TRP A 10 -6.439 -2.621 3.477 1.00 0.00 C ATOM 144 CD1 TRP A 10 -7.505 -3.321 3.923 1.00 0.00 C ATOM 145 CD2 TRP A 10 -5.988 -3.306 2.277 1.00 0.00 C ATOM 146 NE1 TRP A 10 -7.742 -4.395 3.087 1.00 0.00 N ATOM 147 CE2 TRP A 10 -6.838 -4.425 2.044 1.00 0.00 C ATOM 148 CE3 TRP A 10 -4.950 -3.077 1.353 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -6.664 -5.276 0.942 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -4.768 -3.921 0.241 1.00 0.00 C ATOM 151 CH2 TRP A 10 -5.624 -5.018 0.034 1.00 0.00 C ATOM 152 H TRP A 10 -5.939 -0.464 1.659 1.00 0.00 H ATOM 153 HA TRP A 10 -7.578 -0.060 4.102 1.00 0.00 H ATOM 154 HB2 TRP A 10 -4.837 -1.301 3.779 1.00 0.00 H ATOM 155 HB3 TRP A 10 -5.914 -1.454 5.157 1.00 0.00 H ATOM 156 HD1 TRP A 10 -8.093 -3.071 4.794 1.00 0.00 H ATOM 157 HE1 TRP A 10 -8.483 -5.073 3.199 1.00 0.00 H ATOM 158 HE3 TRP A 10 -4.294 -2.235 1.518 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -7.325 -6.117 0.791 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -3.966 -3.726 -0.456 1.00 0.00 H ATOM 161 HH2 TRP A 10 -5.480 -5.662 -0.821 1.00 0.00 H ATOM 162 N GLY A 11 -5.985 2.294 3.397 1.00 0.00 N ATOM 163 CA GLY A 11 -5.239 3.509 3.680 1.00 0.00 C ATOM 164 C GLY A 11 -3.841 3.401 3.079 1.00 0.00 C ATOM 165 O GLY A 11 -3.612 2.623 2.154 1.00 0.00 O ATOM 166 H GLY A 11 -6.597 2.297 2.592 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.744 4.367 3.241 1.00 0.00 H ATOM 168 HA3 GLY A 11 -5.173 3.664 4.758 1.00 0.00 H ATOM 169 N TRP A 12 -2.900 4.173 3.630 1.00 0.00 N ATOM 170 CA TRP A 12 -1.487 4.052 3.307 1.00 0.00 C ATOM 171 C TRP A 12 -0.963 2.701 3.792 1.00 0.00 C ATOM 172 O TRP A 12 -0.626 2.545 4.964 1.00 0.00 O ATOM 173 CB TRP A 12 -0.706 5.230 3.892 1.00 0.00 C ATOM 174 CG TRP A 12 -0.874 6.499 3.118 1.00 0.00 C ATOM 175 CD1 TRP A 12 -1.799 7.455 3.353 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.134 6.941 1.942 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.682 8.460 2.415 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.670 8.191 1.516 1.00 0.00 C ATOM 179 CE3 TRP A 12 0.937 6.410 1.190 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.171 8.879 0.400 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.454 7.099 0.077 1.00 0.00 C ATOM 182 CH2 TRP A 12 0.897 8.325 -0.325 1.00 0.00 C ATOM 183 H TRP A 12 -3.173 4.814 4.360 1.00 0.00 H ATOM 184 HA TRP A 12 -1.361 4.098 2.227 1.00 0.00 H ATOM 185 HB2 TRP A 12 -0.997 5.391 4.931 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.356 4.984 3.874 1.00 0.00 H ATOM 187 HD1 TRP A 12 -2.529 7.432 4.149 1.00 0.00 H ATOM 188 HE1 TRP A 12 -2.255 9.290 2.373 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.371 5.464 1.478 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.603 9.823 0.102 1.00 0.00 H ATOM 191 HZ3 TRP A 12 2.290 6.687 -0.469 1.00 0.00 H ATOM 192 HH2 TRP A 12 1.293 8.844 -1.185 1.00 0.00 H ATOM 193 N VAL A 13 -0.905 1.737 2.867 1.00 0.00 N ATOM 194 CA VAL A 13 -0.458 0.375 3.110 1.00 0.00 C ATOM 195 C VAL A 13 0.992 0.259 2.643 1.00 0.00 C ATOM 196 O VAL A 13 1.349 0.771 1.581 1.00 0.00 O ATOM 197 CB VAL A 13 -1.410 -0.627 2.426 1.00 0.00 C ATOM 198 CG1 VAL A 13 -1.530 -0.440 0.906 1.00 0.00 C ATOM 199 CG2 VAL A 13 -0.991 -2.071 2.731 1.00 0.00 C ATOM 200 H VAL A 13 -1.168 1.973 1.920 1.00 0.00 H ATOM 201 HA VAL A 13 -0.499 0.173 4.181 1.00 0.00 H ATOM 202 HB VAL A 13 -2.404 -0.479 2.853 1.00 0.00 H ATOM 203 HG11 VAL A 13 -0.562 -0.569 0.422 1.00 0.00 H ATOM 204 HG12 VAL A 13 -2.219 -1.182 0.503 1.00 0.00 H ATOM 205 HG13 VAL A 13 -1.924 0.548 0.672 1.00 0.00 H ATOM 206 HG21 VAL A 13 -1.741 -2.760 2.343 1.00 0.00 H ATOM 207 HG22 VAL A 13 -0.032 -2.298 2.264 1.00 0.00 H ATOM 208 HG23 VAL A 13 -0.909 -2.214 3.808 1.00 0.00 H ATOM 209 N CYS A 14 1.828 -0.395 3.455 1.00 0.00 N ATOM 210 CA CYS A 14 3.261 -0.495 3.226 1.00 0.00 C ATOM 211 C CYS A 14 3.622 -1.837 2.601 1.00 0.00 C ATOM 212 O CYS A 14 2.985 -2.854 2.871 1.00 0.00 O ATOM 213 CB CYS A 14 4.022 -0.232 4.524 1.00 0.00 C ATOM 214 SG CYS A 14 3.929 1.487 5.096 1.00 0.00 S ATOM 215 H CYS A 14 1.463 -0.815 4.298 1.00 0.00 H ATOM 216 HA CYS A 14 3.570 0.278 2.535 1.00 0.00 H ATOM 217 HB2 CYS A 14 3.631 -0.884 5.305 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.075 -0.470 4.374 1.00 0.00 H ATOM 219 N MET A 15 4.648 -1.814 1.745 1.00 0.00 N ATOM 220 CA MET A 15 5.086 -2.950 0.951 1.00 0.00 C ATOM 221 C MET A 15 5.878 -3.930 1.819 1.00 0.00 C ATOM 222 O MET A 15 6.654 -3.448 2.674 1.00 0.00 O ATOM 223 CB MET A 15 5.936 -2.441 -0.220 1.00 0.00 C ATOM 224 CG MET A 15 5.138 -1.521 -1.152 1.00 0.00 C ATOM 225 SD MET A 15 6.136 -0.712 -2.429 1.00 0.00 S ATOM 226 CE MET A 15 4.909 0.452 -3.076 1.00 0.00 C ATOM 227 OXT MET A 15 5.697 -5.149 1.607 1.00 0.00 O ATOM 228 H MET A 15 5.142 -0.941 1.606 1.00 0.00 H ATOM 229 HA MET A 15 4.212 -3.462 0.545 1.00 0.00 H ATOM 230 HB2 MET A 15 6.790 -1.893 0.178 1.00 0.00 H ATOM 231 HB3 MET A 15 6.304 -3.290 -0.798 1.00 0.00 H ATOM 232 HG2 MET A 15 4.356 -2.104 -1.640 1.00 0.00 H ATOM 233 HG3 MET A 15 4.661 -0.730 -0.575 1.00 0.00 H ATOM 234 HE1 MET A 15 4.586 1.124 -2.281 1.00 0.00 H ATOM 235 HE2 MET A 15 5.357 1.035 -3.880 1.00 0.00 H ATOM 236 HE3 MET A 15 4.050 -0.097 -3.461 1.00 0.00 H TER 237 MET A 15