HETATM 1 C ACE A 0 8.862 -2.565 4.873 1.00 0.00 C HETATM 2 O ACE A 0 9.692 -1.943 5.534 1.00 0.00 O HETATM 3 CH3 ACE A 0 7.408 -2.111 4.850 1.00 0.00 C HETATM 4 H1 ACE A 0 7.224 -1.566 3.925 1.00 0.00 H HETATM 5 H2 ACE A 0 6.742 -2.973 4.906 1.00 0.00 H HETATM 6 H3 ACE A 0 7.212 -1.452 5.697 1.00 0.00 H ATOM 7 N ASN A 1 9.165 -3.646 4.145 1.00 0.00 N ATOM 8 CA ASN A 1 10.522 -4.155 3.988 1.00 0.00 C ATOM 9 C ASN A 1 11.371 -3.113 3.265 1.00 0.00 C ATOM 10 O ASN A 1 12.398 -2.670 3.776 1.00 0.00 O ATOM 11 CB ASN A 1 10.488 -5.491 3.234 1.00 0.00 C ATOM 12 CG ASN A 1 11.890 -6.066 3.039 1.00 0.00 C ATOM 13 OD1 ASN A 1 12.378 -6.813 3.883 1.00 0.00 O ATOM 14 ND2 ASN A 1 12.541 -5.724 1.925 1.00 0.00 N ATOM 15 H ASN A 1 8.429 -4.103 3.625 1.00 0.00 H ATOM 16 HA ASN A 1 10.949 -4.328 4.974 1.00 0.00 H ATOM 17 HB2 ASN A 1 9.898 -6.204 3.813 1.00 0.00 H ATOM 18 HB3 ASN A 1 10.008 -5.363 2.263 1.00 0.00 H ATOM 19 HD21 ASN A 1 12.110 -5.106 1.253 1.00 0.00 H ATOM 20 HD22 ASN A 1 13.470 -6.084 1.763 1.00 0.00 H ATOM 21 N LEU A 2 10.909 -2.720 2.076 1.00 0.00 N ATOM 22 CA LEU A 2 11.430 -1.596 1.321 1.00 0.00 C ATOM 23 C LEU A 2 10.719 -0.345 1.855 1.00 0.00 C ATOM 24 O LEU A 2 9.490 -0.360 1.910 1.00 0.00 O ATOM 25 CB LEU A 2 11.114 -1.818 -0.167 1.00 0.00 C ATOM 26 CG LEU A 2 11.624 -0.699 -1.091 1.00 0.00 C ATOM 27 CD1 LEU A 2 13.153 -0.706 -1.206 1.00 0.00 C ATOM 28 CD2 LEU A 2 11.023 -0.891 -2.488 1.00 0.00 C ATOM 29 H LEU A 2 10.047 -3.140 1.754 1.00 0.00 H ATOM 30 HA LEU A 2 12.510 -1.558 1.438 1.00 0.00 H ATOM 31 HB2 LEU A 2 11.553 -2.765 -0.485 1.00 0.00 H ATOM 32 HB3 LEU A 2 10.033 -1.892 -0.282 1.00 0.00 H ATOM 33 HG LEU A 2 11.298 0.272 -0.717 1.00 0.00 H ATOM 34 HD11 LEU A 2 13.471 0.078 -1.894 1.00 0.00 H ATOM 35 HD12 LEU A 2 13.615 -0.521 -0.238 1.00 0.00 H ATOM 36 HD13 LEU A 2 13.495 -1.670 -1.585 1.00 0.00 H ATOM 37 HD21 LEU A 2 11.379 -0.104 -3.154 1.00 0.00 H ATOM 38 HD22 LEU A 2 11.318 -1.860 -2.892 1.00 0.00 H ATOM 39 HD23 LEU A 2 9.935 -0.844 -2.432 1.00 0.00 H ATOM 40 N PRO A 3 11.438 0.721 2.255 1.00 0.00 N ATOM 41 CA PRO A 3 10.851 2.001 2.642 1.00 0.00 C ATOM 42 C PRO A 3 10.007 2.623 1.518 1.00 0.00 C ATOM 43 O PRO A 3 10.486 3.457 0.752 1.00 0.00 O ATOM 44 CB PRO A 3 12.032 2.892 3.056 1.00 0.00 C ATOM 45 CG PRO A 3 13.081 1.880 3.508 1.00 0.00 C ATOM 46 CD PRO A 3 12.868 0.735 2.521 1.00 0.00 C ATOM 47 HA PRO A 3 10.225 1.838 3.521 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.445 3.434 2.205 1.00 0.00 H ATOM 49 HB3 PRO A 3 11.764 3.590 3.850 1.00 0.00 H ATOM 50 HG2 PRO A 3 14.094 2.282 3.467 1.00 0.00 H ATOM 51 HG3 PRO A 3 12.846 1.541 4.518 1.00 0.00 H ATOM 52 HD2 PRO A 3 13.409 0.939 1.598 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.222 -0.189 2.978 1.00 0.00 H ATOM 54 N ARG A 4 8.741 2.204 1.425 1.00 0.00 N ATOM 55 CA ARG A 4 7.803 2.610 0.394 1.00 0.00 C ATOM 56 C ARG A 4 6.401 2.217 0.851 1.00 0.00 C ATOM 57 O ARG A 4 6.209 1.117 1.372 1.00 0.00 O ATOM 58 CB ARG A 4 8.162 1.920 -0.929 1.00 0.00 C ATOM 59 CG ARG A 4 7.248 2.374 -2.075 1.00 0.00 C ATOM 60 CD ARG A 4 7.568 1.622 -3.371 1.00 0.00 C ATOM 61 NE ARG A 4 8.973 1.777 -3.767 1.00 0.00 N ATOM 62 CZ ARG A 4 9.514 2.874 -4.324 1.00 0.00 C ATOM 63 NH1 ARG A 4 8.767 3.954 -4.593 1.00 0.00 N ATOM 64 NH2 ARG A 4 10.822 2.888 -4.613 1.00 0.00 N ATOM 65 H ARG A 4 8.429 1.485 2.065 1.00 0.00 H ATOM 66 HA ARG A 4 7.860 3.693 0.267 1.00 0.00 H ATOM 67 HB2 ARG A 4 9.195 2.163 -1.182 1.00 0.00 H ATOM 68 HB3 ARG A 4 8.081 0.839 -0.807 1.00 0.00 H ATOM 69 HG2 ARG A 4 6.206 2.173 -1.826 1.00 0.00 H ATOM 70 HG3 ARG A 4 7.369 3.447 -2.227 1.00 0.00 H ATOM 71 HD2 ARG A 4 7.373 0.560 -3.217 1.00 0.00 H ATOM 72 HD3 ARG A 4 6.913 1.972 -4.170 1.00 0.00 H ATOM 73 HE ARG A 4 9.575 0.986 -3.593 1.00 0.00 H ATOM 74 HH11 ARG A 4 7.781 3.952 -4.376 1.00 0.00 H ATOM 75 HH12 ARG A 4 9.187 4.772 -5.010 1.00 0.00 H ATOM 76 HH21 ARG A 4 11.394 2.080 -4.412 1.00 0.00 H ATOM 77 HH22 ARG A 4 11.241 3.707 -5.029 1.00 0.00 H ATOM 78 N CYS A 5 5.430 3.118 0.653 1.00 0.00 N ATOM 79 CA CYS A 5 4.034 2.887 0.991 1.00 0.00 C ATOM 80 C CYS A 5 3.134 3.460 -0.099 1.00 0.00 C ATOM 81 O CYS A 5 3.528 4.382 -0.812 1.00 0.00 O ATOM 82 CB CYS A 5 3.693 3.495 2.361 1.00 0.00 C ATOM 83 SG CYS A 5 4.842 3.153 3.728 1.00 0.00 S ATOM 84 H CYS A 5 5.655 3.997 0.211 1.00 0.00 H ATOM 85 HA CYS A 5 3.851 1.818 1.002 1.00 0.00 H ATOM 86 HB2 CYS A 5 3.669 4.580 2.246 1.00 0.00 H ATOM 87 HB3 CYS A 5 2.694 3.169 2.655 1.00 0.00 H ATOM 88 N THR A 6 1.930 2.893 -0.222 1.00 0.00 N ATOM 89 CA THR A 6 0.949 3.235 -1.239 1.00 0.00 C ATOM 90 C THR A 6 -0.419 3.385 -0.576 1.00 0.00 C ATOM 91 O THR A 6 -0.810 2.531 0.219 1.00 0.00 O ATOM 92 CB THR A 6 0.906 2.130 -2.306 1.00 0.00 C ATOM 93 OG1 THR A 6 0.681 0.873 -1.700 1.00 0.00 O ATOM 94 CG2 THR A 6 2.208 2.070 -3.112 1.00 0.00 C ATOM 95 H THR A 6 1.685 2.139 0.408 1.00 0.00 H ATOM 96 HA THR A 6 1.209 4.178 -1.722 1.00 0.00 H ATOM 97 HB THR A 6 0.086 2.340 -2.995 1.00 0.00 H ATOM 98 HG1 THR A 6 -0.049 0.956 -1.080 1.00 0.00 H ATOM 99 HG21 THR A 6 2.108 1.328 -3.905 1.00 0.00 H ATOM 100 HG22 THR A 6 2.412 3.043 -3.561 1.00 0.00 H ATOM 101 HG23 THR A 6 3.043 1.787 -2.471 1.00 0.00 H ATOM 102 N GLU A 7 -1.142 4.460 -0.913 1.00 0.00 N ATOM 103 CA GLU A 7 -2.475 4.731 -0.396 1.00 0.00 C ATOM 104 C GLU A 7 -3.489 3.825 -1.099 1.00 0.00 C ATOM 105 O GLU A 7 -4.177 4.247 -2.027 1.00 0.00 O ATOM 106 CB GLU A 7 -2.793 6.223 -0.560 1.00 0.00 C ATOM 107 CG GLU A 7 -4.029 6.621 0.254 1.00 0.00 C ATOM 108 CD GLU A 7 -4.285 8.121 0.154 1.00 0.00 C ATOM 109 OE1 GLU A 7 -4.919 8.525 -0.845 1.00 0.00 O ATOM 110 OE2 GLU A 7 -3.840 8.838 1.076 1.00 0.00 O ATOM 111 H GLU A 7 -0.755 5.122 -1.570 1.00 0.00 H ATOM 112 HA GLU A 7 -2.486 4.517 0.671 1.00 0.00 H ATOM 113 HB2 GLU A 7 -1.947 6.800 -0.192 1.00 0.00 H ATOM 114 HB3 GLU A 7 -2.940 6.469 -1.613 1.00 0.00 H ATOM 115 HG2 GLU A 7 -4.905 6.085 -0.113 1.00 0.00 H ATOM 116 HG3 GLU A 7 -3.873 6.357 1.301 1.00 0.00 H ATOM 117 N GLY A 8 -3.566 2.569 -0.650 1.00 0.00 N ATOM 118 CA GLY A 8 -4.457 1.558 -1.194 1.00 0.00 C ATOM 119 C GLY A 8 -5.842 1.626 -0.544 1.00 0.00 C ATOM 120 O GLY A 8 -6.146 2.584 0.167 1.00 0.00 O ATOM 121 H GLY A 8 -2.981 2.305 0.134 1.00 0.00 H ATOM 122 HA2 GLY A 8 -4.549 1.684 -2.273 1.00 0.00 H ATOM 123 HA3 GLY A 8 -4.010 0.585 -0.990 1.00 0.00 H ATOM 124 N PRO A 9 -6.685 0.605 -0.778 1.00 0.00 N ATOM 125 CA PRO A 9 -8.021 0.487 -0.207 1.00 0.00 C ATOM 126 C PRO A 9 -8.044 0.671 1.312 1.00 0.00 C ATOM 127 O PRO A 9 -8.967 1.284 1.843 1.00 0.00 O ATOM 128 CB PRO A 9 -8.517 -0.907 -0.605 1.00 0.00 C ATOM 129 CG PRO A 9 -7.759 -1.189 -1.900 1.00 0.00 C ATOM 130 CD PRO A 9 -6.407 -0.523 -1.652 1.00 0.00 C ATOM 131 HA PRO A 9 -8.660 1.237 -0.677 1.00 0.00 H ATOM 132 HB2 PRO A 9 -8.220 -1.643 0.142 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.598 -0.935 -0.745 1.00 0.00 H ATOM 134 HG2 PRO A 9 -7.665 -2.257 -2.103 1.00 0.00 H ATOM 135 HG3 PRO A 9 -8.264 -0.690 -2.729 1.00 0.00 H ATOM 136 HD2 PRO A 9 -5.741 -1.219 -1.141 1.00 0.00 H ATOM 137 HD3 PRO A 9 -5.968 -0.212 -2.601 1.00 0.00 H ATOM 138 N TRP A 10 -7.022 0.146 2.000 1.00 0.00 N ATOM 139 CA TRP A 10 -6.899 0.184 3.452 1.00 0.00 C ATOM 140 C TRP A 10 -5.954 1.308 3.891 1.00 0.00 C ATOM 141 O TRP A 10 -5.291 1.189 4.920 1.00 0.00 O ATOM 142 CB TRP A 10 -6.400 -1.186 3.928 1.00 0.00 C ATOM 143 CG TRP A 10 -7.157 -2.355 3.382 1.00 0.00 C ATOM 144 CD1 TRP A 10 -8.311 -2.864 3.868 1.00 0.00 C ATOM 145 CD2 TRP A 10 -6.846 -3.140 2.197 1.00 0.00 C ATOM 146 NE1 TRP A 10 -8.733 -3.911 3.072 1.00 0.00 N ATOM 147 CE2 TRP A 10 -7.867 -4.116 2.016 1.00 0.00 C ATOM 148 CE3 TRP A 10 -5.804 -3.107 1.250 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -7.853 -5.018 0.941 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -5.782 -4.002 0.164 1.00 0.00 C ATOM 151 CH2 TRP A 10 -6.805 -4.956 0.008 1.00 0.00 C ATOM 152 H TRP A 10 -6.295 -0.335 1.491 1.00 0.00 H ATOM 153 HA TRP A 10 -7.875 0.359 3.907 1.00 0.00 H ATOM 154 HB2 TRP A 10 -5.360 -1.297 3.622 1.00 0.00 H ATOM 155 HB3 TRP A 10 -6.427 -1.234 5.013 1.00 0.00 H ATOM 156 HD1 TRP A 10 -8.833 -2.497 4.740 1.00 0.00 H ATOM 157 HE1 TRP A 10 -9.568 -4.460 3.218 1.00 0.00 H ATOM 158 HE3 TRP A 10 -5.019 -2.376 1.377 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -8.641 -5.748 0.830 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -4.976 -3.957 -0.553 1.00 0.00 H ATOM 161 HH2 TRP A 10 -6.783 -5.640 -0.827 1.00 0.00 H ATOM 162 N GLY A 11 -5.885 2.399 3.116 1.00 0.00 N ATOM 163 CA GLY A 11 -5.034 3.536 3.423 1.00 0.00 C ATOM 164 C GLY A 11 -3.589 3.255 3.021 1.00 0.00 C ATOM 165 O GLY A 11 -3.322 2.402 2.176 1.00 0.00 O ATOM 166 H GLY A 11 -6.423 2.440 2.261 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.379 4.407 2.867 1.00 0.00 H ATOM 168 HA3 GLY A 11 -5.089 3.762 4.489 1.00 0.00 H ATOM 169 N TRP A 12 -2.659 3.985 3.644 1.00 0.00 N ATOM 170 CA TRP A 12 -1.228 3.836 3.428 1.00 0.00 C ATOM 171 C TRP A 12 -0.745 2.475 3.929 1.00 0.00 C ATOM 172 O TRP A 12 -0.435 2.320 5.109 1.00 0.00 O ATOM 173 CB TRP A 12 -0.480 4.992 4.097 1.00 0.00 C ATOM 174 CG TRP A 12 -0.686 6.317 3.432 1.00 0.00 C ATOM 175 CD1 TRP A 12 -1.495 7.308 3.868 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.108 6.796 2.182 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.452 8.370 2.988 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.609 8.106 1.927 1.00 0.00 C ATOM 179 CE3 TRP A 12 0.785 6.253 1.234 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.240 8.841 0.790 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.159 6.980 0.088 1.00 0.00 C ATOM 182 CH2 TRP A 12 0.650 8.271 -0.134 1.00 0.00 C ATOM 183 H TRP A 12 -2.964 4.675 4.313 1.00 0.00 H ATOM 184 HA TRP A 12 -1.019 3.904 2.362 1.00 0.00 H ATOM 185 HB2 TRP A 12 -0.774 5.060 5.146 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.589 4.777 4.061 1.00 0.00 H ATOM 187 HD1 TRP A 12 -2.091 7.274 4.768 1.00 0.00 H ATOM 188 HE1 TRP A 12 -1.971 9.232 3.080 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.186 5.263 1.391 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.642 9.830 0.626 1.00 0.00 H ATOM 191 HZ3 TRP A 12 1.844 6.545 -0.625 1.00 0.00 H ATOM 192 HH2 TRP A 12 0.942 8.823 -1.015 1.00 0.00 H ATOM 193 N VAL A 13 -0.669 1.504 3.011 1.00 0.00 N ATOM 194 CA VAL A 13 -0.133 0.175 3.261 1.00 0.00 C ATOM 195 C VAL A 13 1.302 0.147 2.737 1.00 0.00 C ATOM 196 O VAL A 13 1.571 0.628 1.637 1.00 0.00 O ATOM 197 CB VAL A 13 -1.024 -0.915 2.636 1.00 0.00 C ATOM 198 CG1 VAL A 13 -2.364 -0.995 3.379 1.00 0.00 C ATOM 199 CG2 VAL A 13 -1.295 -0.725 1.136 1.00 0.00 C ATOM 200 H VAL A 13 -0.948 1.723 2.063 1.00 0.00 H ATOM 201 HA VAL A 13 -0.105 -0.013 4.336 1.00 0.00 H ATOM 202 HB VAL A 13 -0.518 -1.874 2.766 1.00 0.00 H ATOM 203 HG11 VAL A 13 -2.191 -1.173 4.441 1.00 0.00 H ATOM 204 HG12 VAL A 13 -2.923 -0.068 3.260 1.00 0.00 H ATOM 205 HG13 VAL A 13 -2.955 -1.820 2.979 1.00 0.00 H ATOM 206 HG21 VAL A 13 -0.361 -0.688 0.578 1.00 0.00 H ATOM 207 HG22 VAL A 13 -1.880 -1.568 0.767 1.00 0.00 H ATOM 208 HG23 VAL A 13 -1.861 0.189 0.959 1.00 0.00 H ATOM 209 N CYS A 14 2.222 -0.386 3.550 1.00 0.00 N ATOM 210 CA CYS A 14 3.658 -0.315 3.319 1.00 0.00 C ATOM 211 C CYS A 14 4.217 -1.678 2.925 1.00 0.00 C ATOM 212 O CYS A 14 3.763 -2.706 3.426 1.00 0.00 O ATOM 213 CB CYS A 14 4.348 0.243 4.564 1.00 0.00 C ATOM 214 SG CYS A 14 3.836 1.921 5.027 1.00 0.00 S ATOM 215 H CYS A 14 1.919 -0.798 4.420 1.00 0.00 H ATOM 216 HA CYS A 14 3.868 0.374 2.511 1.00 0.00 H ATOM 217 HB2 CYS A 14 4.143 -0.420 5.405 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.425 0.258 4.396 1.00 0.00 H ATOM 219 N MET A 15 5.204 -1.673 2.021 1.00 0.00 N ATOM 220 CA MET A 15 5.834 -2.875 1.496 1.00 0.00 C ATOM 221 C MET A 15 7.218 -2.527 0.950 1.00 0.00 C ATOM 222 O MET A 15 8.172 -3.245 1.323 1.00 0.00 O ATOM 223 CB MET A 15 4.941 -3.491 0.410 1.00 0.00 C ATOM 224 CG MET A 15 5.512 -4.816 -0.111 1.00 0.00 C ATOM 225 SD MET A 15 4.438 -5.717 -1.262 1.00 0.00 S ATOM 226 CE MET A 15 4.457 -4.591 -2.681 1.00 0.00 C ATOM 227 OXT MET A 15 7.298 -1.558 0.164 1.00 0.00 O ATOM 228 H MET A 15 5.540 -0.783 1.671 1.00 0.00 H ATOM 229 HA MET A 15 5.951 -3.597 2.307 1.00 0.00 H ATOM 230 HB2 MET A 15 3.952 -3.688 0.827 1.00 0.00 H ATOM 231 HB3 MET A 15 4.836 -2.786 -0.415 1.00 0.00 H ATOM 232 HG2 MET A 15 6.464 -4.635 -0.610 1.00 0.00 H ATOM 233 HG3 MET A 15 5.692 -5.471 0.741 1.00 0.00 H ATOM 234 HE1 MET A 15 3.938 -5.061 -3.516 1.00 0.00 H ATOM 235 HE2 MET A 15 3.950 -3.661 -2.425 1.00 0.00 H ATOM 236 HE3 MET A 15 5.487 -4.380 -2.969 1.00 0.00 H TER 237 MET A 15