HETATM 1 C ACE A 0 9.405 -5.464 -1.549 1.00 0.00 C HETATM 2 O ACE A 0 10.265 -5.396 -0.673 1.00 0.00 O HETATM 3 CH3 ACE A 0 7.930 -5.530 -1.175 1.00 0.00 C HETATM 4 H1 ACE A 0 7.477 -4.550 -1.315 1.00 0.00 H HETATM 5 H2 ACE A 0 7.417 -6.260 -1.802 1.00 0.00 H HETATM 6 H3 ACE A 0 7.828 -5.827 -0.131 1.00 0.00 H ATOM 7 N ASN A 1 9.689 -5.489 -2.856 1.00 0.00 N ATOM 8 CA ASN A 1 11.046 -5.505 -3.390 1.00 0.00 C ATOM 9 C ASN A 1 11.795 -4.224 -3.033 1.00 0.00 C ATOM 10 O ASN A 1 12.893 -4.278 -2.482 1.00 0.00 O ATOM 11 CB ASN A 1 11.006 -5.710 -4.910 1.00 0.00 C ATOM 12 CG ASN A 1 10.351 -7.037 -5.285 1.00 0.00 C ATOM 13 OD1 ASN A 1 9.183 -7.068 -5.664 1.00 0.00 O ATOM 14 ND2 ASN A 1 11.099 -8.136 -5.178 1.00 0.00 N ATOM 15 H ASN A 1 8.927 -5.546 -3.517 1.00 0.00 H ATOM 16 HA ASN A 1 11.581 -6.342 -2.946 1.00 0.00 H ATOM 17 HB2 ASN A 1 10.446 -4.896 -5.374 1.00 0.00 H ATOM 18 HB3 ASN A 1 12.024 -5.693 -5.303 1.00 0.00 H ATOM 19 HD21 ASN A 1 12.055 -8.071 -4.861 1.00 0.00 H ATOM 20 HD22 ASN A 1 10.702 -9.034 -5.416 1.00 0.00 H ATOM 21 N LEU A 2 11.185 -3.081 -3.358 1.00 0.00 N ATOM 22 CA LEU A 2 11.701 -1.746 -3.097 1.00 0.00 C ATOM 23 C LEU A 2 10.879 -1.165 -1.940 1.00 0.00 C ATOM 24 O LEU A 2 9.700 -0.893 -2.147 1.00 0.00 O ATOM 25 CB LEU A 2 11.562 -0.920 -4.388 1.00 0.00 C ATOM 26 CG LEU A 2 12.394 0.374 -4.421 1.00 0.00 C ATOM 27 CD1 LEU A 2 12.272 1.001 -5.815 1.00 0.00 C ATOM 28 CD2 LEU A 2 11.956 1.406 -3.375 1.00 0.00 C ATOM 29 H LEU A 2 10.282 -3.152 -3.801 1.00 0.00 H ATOM 30 HA LEU A 2 12.764 -1.792 -2.864 1.00 0.00 H ATOM 31 HB2 LEU A 2 11.917 -1.543 -5.210 1.00 0.00 H ATOM 32 HB3 LEU A 2 10.512 -0.690 -4.578 1.00 0.00 H ATOM 33 HG LEU A 2 13.443 0.129 -4.251 1.00 0.00 H ATOM 34 HD11 LEU A 2 12.892 1.897 -5.875 1.00 0.00 H ATOM 35 HD12 LEU A 2 12.609 0.294 -6.573 1.00 0.00 H ATOM 36 HD13 LEU A 2 11.234 1.271 -6.014 1.00 0.00 H ATOM 37 HD21 LEU A 2 10.876 1.551 -3.416 1.00 0.00 H ATOM 38 HD22 LEU A 2 12.247 1.077 -2.379 1.00 0.00 H ATOM 39 HD23 LEU A 2 12.450 2.358 -3.567 1.00 0.00 H ATOM 40 N PRO A 3 11.456 -0.977 -0.737 1.00 0.00 N ATOM 41 CA PRO A 3 10.777 -0.387 0.412 1.00 0.00 C ATOM 42 C PRO A 3 10.008 0.887 0.050 1.00 0.00 C ATOM 43 O PRO A 3 10.607 1.889 -0.340 1.00 0.00 O ATOM 44 CB PRO A 3 11.876 -0.124 1.445 1.00 0.00 C ATOM 45 CG PRO A 3 12.876 -1.239 1.151 1.00 0.00 C ATOM 46 CD PRO A 3 12.812 -1.354 -0.372 1.00 0.00 C ATOM 47 HA PRO A 3 10.098 -1.137 0.820 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.359 0.837 1.258 1.00 0.00 H ATOM 49 HB3 PRO A 3 11.500 -0.164 2.468 1.00 0.00 H ATOM 50 HG2 PRO A 3 13.880 -1.003 1.508 1.00 0.00 H ATOM 51 HG3 PRO A 3 12.523 -2.168 1.601 1.00 0.00 H ATOM 52 HD2 PRO A 3 13.517 -0.655 -0.824 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.049 -2.376 -0.667 1.00 0.00 H ATOM 54 N ARG A 4 8.676 0.832 0.159 1.00 0.00 N ATOM 55 CA ARG A 4 7.769 1.883 -0.283 1.00 0.00 C ATOM 56 C ARG A 4 6.454 1.778 0.486 1.00 0.00 C ATOM 57 O ARG A 4 6.224 0.789 1.180 1.00 0.00 O ATOM 58 CB ARG A 4 7.530 1.740 -1.797 1.00 0.00 C ATOM 59 CG ARG A 4 6.752 0.458 -2.133 1.00 0.00 C ATOM 60 CD ARG A 4 6.765 0.169 -3.636 1.00 0.00 C ATOM 61 NE ARG A 4 6.005 -1.050 -3.947 1.00 0.00 N ATOM 62 CZ ARG A 4 6.445 -2.311 -3.794 1.00 0.00 C ATOM 63 NH1 ARG A 4 7.672 -2.567 -3.320 1.00 0.00 N ATOM 64 NH2 ARG A 4 5.643 -3.333 -4.118 1.00 0.00 N ATOM 65 H ARG A 4 8.248 -0.020 0.501 1.00 0.00 H ATOM 66 HA ARG A 4 8.214 2.858 -0.080 1.00 0.00 H ATOM 67 HB2 ARG A 4 6.967 2.600 -2.160 1.00 0.00 H ATOM 68 HB3 ARG A 4 8.495 1.724 -2.305 1.00 0.00 H ATOM 69 HG2 ARG A 4 7.196 -0.390 -1.615 1.00 0.00 H ATOM 70 HG3 ARG A 4 5.716 0.561 -1.808 1.00 0.00 H ATOM 71 HD2 ARG A 4 6.301 1.006 -4.160 1.00 0.00 H ATOM 72 HD3 ARG A 4 7.792 0.071 -3.990 1.00 0.00 H ATOM 73 HE ARG A 4 5.069 -0.914 -4.300 1.00 0.00 H ATOM 74 HH11 ARG A 4 8.278 -1.805 -3.044 1.00 0.00 H ATOM 75 HH12 ARG A 4 7.988 -3.519 -3.215 1.00 0.00 H ATOM 76 HH21 ARG A 4 4.713 -3.155 -4.470 1.00 0.00 H ATOM 77 HH22 ARG A 4 5.960 -4.285 -4.003 1.00 0.00 H ATOM 78 N CYS A 5 5.586 2.788 0.347 1.00 0.00 N ATOM 79 CA CYS A 5 4.214 2.742 0.833 1.00 0.00 C ATOM 80 C CYS A 5 3.297 3.405 -0.191 1.00 0.00 C ATOM 81 O CYS A 5 3.746 4.234 -0.981 1.00 0.00 O ATOM 82 CB CYS A 5 4.078 3.397 2.218 1.00 0.00 C ATOM 83 SG CYS A 5 5.246 2.873 3.511 1.00 0.00 S ATOM 84 H CYS A 5 5.843 3.582 -0.222 1.00 0.00 H ATOM 85 HA CYS A 5 3.902 1.704 0.879 1.00 0.00 H ATOM 86 HB2 CYS A 5 4.217 4.472 2.091 1.00 0.00 H ATOM 87 HB3 CYS A 5 3.064 3.234 2.585 1.00 0.00 H ATOM 88 N THR A 6 2.015 3.023 -0.182 1.00 0.00 N ATOM 89 CA THR A 6 1.028 3.481 -1.148 1.00 0.00 C ATOM 90 C THR A 6 -0.352 3.531 -0.496 1.00 0.00 C ATOM 91 O THR A 6 -0.681 2.688 0.339 1.00 0.00 O ATOM 92 CB THR A 6 1.053 2.581 -2.395 1.00 0.00 C ATOM 93 OG1 THR A 6 0.120 3.048 -3.346 1.00 0.00 O ATOM 94 CG2 THR A 6 0.756 1.108 -2.085 1.00 0.00 C ATOM 95 H THR A 6 1.708 2.345 0.504 1.00 0.00 H ATOM 96 HA THR A 6 1.285 4.493 -1.463 1.00 0.00 H ATOM 97 HB THR A 6 2.045 2.643 -2.843 1.00 0.00 H ATOM 98 HG1 THR A 6 0.380 3.929 -3.626 1.00 0.00 H ATOM 99 HG21 THR A 6 0.832 0.527 -3.004 1.00 0.00 H ATOM 100 HG22 THR A 6 1.475 0.716 -1.366 1.00 0.00 H ATOM 101 HG23 THR A 6 -0.252 0.996 -1.685 1.00 0.00 H ATOM 102 N GLU A 7 -1.152 4.531 -0.885 1.00 0.00 N ATOM 103 CA GLU A 7 -2.498 4.741 -0.378 1.00 0.00 C ATOM 104 C GLU A 7 -3.457 3.775 -1.077 1.00 0.00 C ATOM 105 O GLU A 7 -4.163 4.150 -2.011 1.00 0.00 O ATOM 106 CB GLU A 7 -2.888 6.214 -0.562 1.00 0.00 C ATOM 107 CG GLU A 7 -4.150 6.557 0.236 1.00 0.00 C ATOM 108 CD GLU A 7 -4.489 8.038 0.108 1.00 0.00 C ATOM 109 OE1 GLU A 7 -5.239 8.372 -0.835 1.00 0.00 O ATOM 110 OE2 GLU A 7 -3.989 8.812 0.953 1.00 0.00 O ATOM 111 H GLU A 7 -0.810 5.172 -1.586 1.00 0.00 H ATOM 112 HA GLU A 7 -2.508 4.539 0.691 1.00 0.00 H ATOM 113 HB2 GLU A 7 -2.075 6.837 -0.193 1.00 0.00 H ATOM 114 HB3 GLU A 7 -3.039 6.440 -1.618 1.00 0.00 H ATOM 115 HG2 GLU A 7 -4.992 5.966 -0.126 1.00 0.00 H ATOM 116 HG3 GLU A 7 -3.988 6.323 1.290 1.00 0.00 H ATOM 117 N GLY A 8 -3.468 2.522 -0.613 1.00 0.00 N ATOM 118 CA GLY A 8 -4.317 1.467 -1.137 1.00 0.00 C ATOM 119 C GLY A 8 -5.723 1.527 -0.532 1.00 0.00 C ATOM 120 O GLY A 8 -6.064 2.495 0.149 1.00 0.00 O ATOM 121 H GLY A 8 -2.872 2.299 0.175 1.00 0.00 H ATOM 122 HA2 GLY A 8 -4.378 1.547 -2.223 1.00 0.00 H ATOM 123 HA3 GLY A 8 -3.855 0.513 -0.881 1.00 0.00 H ATOM 124 N PRO A 9 -6.543 0.489 -0.770 1.00 0.00 N ATOM 125 CA PRO A 9 -7.900 0.370 -0.252 1.00 0.00 C ATOM 126 C PRO A 9 -7.987 0.592 1.260 1.00 0.00 C ATOM 127 O PRO A 9 -8.934 1.215 1.736 1.00 0.00 O ATOM 128 CB PRO A 9 -8.367 -1.037 -0.635 1.00 0.00 C ATOM 129 CG PRO A 9 -7.551 -1.346 -1.888 1.00 0.00 C ATOM 130 CD PRO A 9 -6.217 -0.658 -1.602 1.00 0.00 C ATOM 131 HA PRO A 9 -8.526 1.102 -0.766 1.00 0.00 H ATOM 132 HB2 PRO A 9 -8.098 -1.751 0.144 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.441 -1.078 -0.821 1.00 0.00 H ATOM 134 HG2 PRO A 9 -7.439 -2.418 -2.057 1.00 0.00 H ATOM 135 HG3 PRO A 9 -8.025 -0.875 -2.750 1.00 0.00 H ATOM 136 HD2 PRO A 9 -5.567 -1.333 -1.044 1.00 0.00 H ATOM 137 HD3 PRO A 9 -5.743 -0.369 -2.540 1.00 0.00 H ATOM 138 N TRP A 10 -6.995 0.088 2.004 1.00 0.00 N ATOM 139 CA TRP A 10 -6.937 0.158 3.459 1.00 0.00 C ATOM 140 C TRP A 10 -6.018 1.296 3.913 1.00 0.00 C ATOM 141 O TRP A 10 -5.354 1.182 4.942 1.00 0.00 O ATOM 142 CB TRP A 10 -6.459 -1.201 3.987 1.00 0.00 C ATOM 143 CG TRP A 10 -7.195 -2.382 3.438 1.00 0.00 C ATOM 144 CD1 TRP A 10 -8.367 -2.879 3.890 1.00 0.00 C ATOM 145 CD2 TRP A 10 -6.839 -3.192 2.284 1.00 0.00 C ATOM 146 NE1 TRP A 10 -8.759 -3.944 3.102 1.00 0.00 N ATOM 147 CE2 TRP A 10 -7.854 -4.172 2.084 1.00 0.00 C ATOM 148 CE3 TRP A 10 -5.762 -3.181 1.377 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -7.801 -5.096 1.030 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -5.700 -4.099 0.312 1.00 0.00 C ATOM 151 CH2 TRP A 10 -6.717 -5.054 0.137 1.00 0.00 C ATOM 152 H TRP A 10 -6.244 -0.401 1.538 1.00 0.00 H ATOM 153 HA TRP A 10 -7.933 0.340 3.866 1.00 0.00 H ATOM 154 HB2 TRP A 10 -5.407 -1.320 3.725 1.00 0.00 H ATOM 155 HB3 TRP A 10 -6.530 -1.223 5.071 1.00 0.00 H ATOM 156 HD1 TRP A 10 -8.923 -2.493 4.732 1.00 0.00 H ATOM 157 HE1 TRP A 10 -9.600 -4.488 3.228 1.00 0.00 H ATOM 158 HE3 TRP A 10 -4.982 -2.448 1.518 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -8.586 -5.827 0.904 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -4.866 -4.070 -0.374 1.00 0.00 H ATOM 161 HH2 TRP A 10 -6.665 -5.756 -0.683 1.00 0.00 H ATOM 162 N GLY A 11 -5.971 2.396 3.148 1.00 0.00 N ATOM 163 CA GLY A 11 -5.150 3.550 3.470 1.00 0.00 C ATOM 164 C GLY A 11 -3.697 3.308 3.075 1.00 0.00 C ATOM 165 O GLY A 11 -3.405 2.469 2.223 1.00 0.00 O ATOM 166 H GLY A 11 -6.507 2.430 2.291 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.513 4.418 2.921 1.00 0.00 H ATOM 168 HA3 GLY A 11 -5.217 3.765 4.538 1.00 0.00 H ATOM 169 N TRP A 12 -2.787 4.053 3.710 1.00 0.00 N ATOM 170 CA TRP A 12 -1.352 3.931 3.504 1.00 0.00 C ATOM 171 C TRP A 12 -0.845 2.580 4.007 1.00 0.00 C ATOM 172 O TRP A 12 -0.529 2.430 5.185 1.00 0.00 O ATOM 173 CB TRP A 12 -0.628 5.107 4.163 1.00 0.00 C ATOM 174 CG TRP A 12 -0.814 6.404 3.441 1.00 0.00 C ATOM 175 CD1 TRP A 12 -1.689 7.380 3.770 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.152 6.858 2.223 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.612 8.408 2.854 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.677 8.136 1.875 1.00 0.00 C ATOM 179 CE3 TRP A 12 0.836 6.314 1.373 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.245 8.840 0.741 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.280 7.014 0.236 1.00 0.00 C ATOM 182 CH2 TRP A 12 0.739 8.272 -0.084 1.00 0.00 C ATOM 183 H TRP A 12 -3.111 4.731 4.383 1.00 0.00 H ATOM 184 HA TRP A 12 -1.139 3.998 2.439 1.00 0.00 H ATOM 185 HB2 TRP A 12 -0.958 5.210 5.199 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.442 4.894 4.170 1.00 0.00 H ATOM 187 HD1 TRP A 12 -2.360 7.355 4.617 1.00 0.00 H ATOM 188 HE1 TRP A 12 -2.168 9.251 2.868 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.260 5.348 1.602 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.668 9.805 0.503 1.00 0.00 H ATOM 191 HZ3 TRP A 12 2.047 6.586 -0.393 1.00 0.00 H ATOM 192 HH2 TRP A 12 1.082 8.801 -0.961 1.00 0.00 H ATOM 193 N VAL A 13 -0.762 1.612 3.088 1.00 0.00 N ATOM 194 CA VAL A 13 -0.207 0.288 3.323 1.00 0.00 C ATOM 195 C VAL A 13 1.222 0.271 2.785 1.00 0.00 C ATOM 196 O VAL A 13 1.490 0.819 1.716 1.00 0.00 O ATOM 197 CB VAL A 13 -1.090 -0.804 2.689 1.00 0.00 C ATOM 198 CG1 VAL A 13 -2.430 -0.903 3.427 1.00 0.00 C ATOM 199 CG2 VAL A 13 -1.355 -0.598 1.190 1.00 0.00 C ATOM 200 H VAL A 13 -1.041 1.834 2.140 1.00 0.00 H ATOM 201 HA VAL A 13 -0.169 0.092 4.396 1.00 0.00 H ATOM 202 HB VAL A 13 -0.576 -1.759 2.811 1.00 0.00 H ATOM 203 HG11 VAL A 13 -3.002 0.017 3.309 1.00 0.00 H ATOM 204 HG12 VAL A 13 -3.008 -1.735 3.023 1.00 0.00 H ATOM 205 HG13 VAL A 13 -2.258 -1.082 4.489 1.00 0.00 H ATOM 206 HG21 VAL A 13 -0.418 -0.544 0.638 1.00 0.00 H ATOM 207 HG22 VAL A 13 -1.930 -1.442 0.807 1.00 0.00 H ATOM 208 HG23 VAL A 13 -1.926 0.313 1.021 1.00 0.00 H ATOM 209 N CYS A 14 2.139 -0.339 3.545 1.00 0.00 N ATOM 210 CA CYS A 14 3.560 -0.364 3.235 1.00 0.00 C ATOM 211 C CYS A 14 3.977 -1.732 2.703 1.00 0.00 C ATOM 212 O CYS A 14 3.436 -2.758 3.111 1.00 0.00 O ATOM 213 CB CYS A 14 4.374 0.074 4.452 1.00 0.00 C ATOM 214 SG CYS A 14 4.151 1.820 4.900 1.00 0.00 S ATOM 215 H CYS A 14 1.844 -0.788 4.399 1.00 0.00 H ATOM 216 HA CYS A 14 3.776 0.360 2.461 1.00 0.00 H ATOM 217 HB2 CYS A 14 4.097 -0.544 5.307 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.433 -0.081 4.246 1.00 0.00 H ATOM 219 N MET A 15 4.932 -1.714 1.766 1.00 0.00 N ATOM 220 CA MET A 15 5.401 -2.858 1.004 1.00 0.00 C ATOM 221 C MET A 15 6.929 -2.893 1.081 1.00 0.00 C ATOM 222 O MET A 15 7.554 -1.965 0.521 1.00 0.00 O ATOM 223 CB MET A 15 4.920 -2.727 -0.450 1.00 0.00 C ATOM 224 CG MET A 15 3.392 -2.722 -0.565 1.00 0.00 C ATOM 225 SD MET A 15 2.787 -2.517 -2.260 1.00 0.00 S ATOM 226 CE MET A 15 1.006 -2.637 -1.960 1.00 0.00 C ATOM 227 OXT MET A 15 7.447 -3.844 1.704 1.00 0.00 O ATOM 228 H MET A 15 5.336 -0.821 1.522 1.00 0.00 H ATOM 229 HA MET A 15 5.007 -3.787 1.419 1.00 0.00 H ATOM 230 HB2 MET A 15 5.300 -1.800 -0.878 1.00 0.00 H ATOM 231 HB3 MET A 15 5.306 -3.565 -1.030 1.00 0.00 H ATOM 232 HG2 MET A 15 3.007 -3.662 -0.169 1.00 0.00 H ATOM 233 HG3 MET A 15 2.981 -1.902 0.023 1.00 0.00 H ATOM 234 HE1 MET A 15 0.473 -2.504 -2.900 1.00 0.00 H ATOM 235 HE2 MET A 15 0.771 -3.617 -1.545 1.00 0.00 H ATOM 236 HE3 MET A 15 0.700 -1.862 -1.258 1.00 0.00 H TER 237 MET A 15