HETATM 1 C ACE A 0 8.097 -2.705 -2.687 1.00 0.00 C HETATM 2 O ACE A 0 9.202 -2.442 -3.157 1.00 0.00 O HETATM 3 CH3 ACE A 0 6.875 -1.902 -3.116 1.00 0.00 C HETATM 4 H1 ACE A 0 7.139 -1.222 -3.925 1.00 0.00 H HETATM 5 H2 ACE A 0 6.093 -2.579 -3.462 1.00 0.00 H HETATM 6 H3 ACE A 0 6.503 -1.324 -2.269 1.00 0.00 H ATOM 7 N ASN A 1 7.877 -3.681 -1.797 1.00 0.00 N ATOM 8 CA ASN A 1 8.879 -4.570 -1.217 1.00 0.00 C ATOM 9 C ASN A 1 9.811 -3.825 -0.261 1.00 0.00 C ATOM 10 O ASN A 1 9.714 -3.990 0.953 1.00 0.00 O ATOM 11 CB ASN A 1 9.627 -5.370 -2.297 1.00 0.00 C ATOM 12 CG ASN A 1 10.542 -6.423 -1.676 1.00 0.00 C ATOM 13 OD1 ASN A 1 10.128 -7.560 -1.462 1.00 0.00 O ATOM 14 ND2 ASN A 1 11.792 -6.053 -1.385 1.00 0.00 N ATOM 15 H ASN A 1 6.928 -3.811 -1.477 1.00 0.00 H ATOM 16 HA ASN A 1 8.334 -5.295 -0.618 1.00 0.00 H ATOM 17 HB2 ASN A 1 8.892 -5.880 -2.923 1.00 0.00 H ATOM 18 HB3 ASN A 1 10.223 -4.720 -2.937 1.00 0.00 H ATOM 19 HD21 ASN A 1 12.099 -5.110 -1.573 1.00 0.00 H ATOM 20 HD22 ASN A 1 12.425 -6.723 -0.973 1.00 0.00 H ATOM 21 N LEU A 2 10.711 -3.010 -0.816 1.00 0.00 N ATOM 22 CA LEU A 2 11.649 -2.189 -0.061 1.00 0.00 C ATOM 23 C LEU A 2 10.901 -0.995 0.557 1.00 0.00 C ATOM 24 O LEU A 2 9.777 -0.733 0.132 1.00 0.00 O ATOM 25 CB LEU A 2 12.822 -1.805 -0.980 1.00 0.00 C ATOM 26 CG LEU A 2 12.472 -0.812 -2.103 1.00 0.00 C ATOM 27 CD1 LEU A 2 12.763 0.637 -1.689 1.00 0.00 C ATOM 28 CD2 LEU A 2 13.309 -1.140 -3.345 1.00 0.00 C ATOM 29 H LEU A 2 10.678 -2.907 -1.821 1.00 0.00 H ATOM 30 HA LEU A 2 12.046 -2.816 0.737 1.00 0.00 H ATOM 31 HB2 LEU A 2 13.652 -1.412 -0.396 1.00 0.00 H ATOM 32 HB3 LEU A 2 13.173 -2.735 -1.432 1.00 0.00 H ATOM 33 HG LEU A 2 11.419 -0.901 -2.373 1.00 0.00 H ATOM 34 HD11 LEU A 2 13.819 0.750 -1.442 1.00 0.00 H ATOM 35 HD12 LEU A 2 12.521 1.310 -2.511 1.00 0.00 H ATOM 36 HD13 LEU A 2 12.167 0.922 -0.826 1.00 0.00 H ATOM 37 HD21 LEU A 2 14.371 -1.111 -3.098 1.00 0.00 H ATOM 38 HD22 LEU A 2 13.053 -2.134 -3.713 1.00 0.00 H ATOM 39 HD23 LEU A 2 13.110 -0.415 -4.134 1.00 0.00 H ATOM 40 N PRO A 3 11.483 -0.285 1.549 1.00 0.00 N ATOM 41 CA PRO A 3 10.846 0.792 2.309 1.00 0.00 C ATOM 42 C PRO A 3 10.069 1.809 1.463 1.00 0.00 C ATOM 43 O PRO A 3 10.634 2.785 0.972 1.00 0.00 O ATOM 44 CB PRO A 3 11.970 1.439 3.123 1.00 0.00 C ATOM 45 CG PRO A 3 12.877 0.246 3.407 1.00 0.00 C ATOM 46 CD PRO A 3 12.815 -0.523 2.089 1.00 0.00 C ATOM 47 HA PRO A 3 10.165 0.333 3.026 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.524 2.161 2.522 1.00 0.00 H ATOM 49 HB3 PRO A 3 11.603 1.909 4.037 1.00 0.00 H ATOM 50 HG2 PRO A 3 13.892 0.548 3.666 1.00 0.00 H ATOM 51 HG3 PRO A 3 12.444 -0.358 4.206 1.00 0.00 H ATOM 52 HD2 PRO A 3 13.558 -0.104 1.411 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.020 -1.577 2.274 1.00 0.00 H ATOM 54 N ARG A 4 8.763 1.563 1.306 1.00 0.00 N ATOM 55 CA ARG A 4 7.832 2.337 0.496 1.00 0.00 C ATOM 56 C ARG A 4 6.447 2.236 1.132 1.00 0.00 C ATOM 57 O ARG A 4 6.198 1.326 1.923 1.00 0.00 O ATOM 58 CB ARG A 4 7.762 1.754 -0.924 1.00 0.00 C ATOM 59 CG ARG A 4 9.014 2.027 -1.765 1.00 0.00 C ATOM 60 CD ARG A 4 8.947 1.227 -3.066 1.00 0.00 C ATOM 61 NE ARG A 4 10.051 1.584 -3.965 1.00 0.00 N ATOM 62 CZ ARG A 4 10.559 0.805 -4.935 1.00 0.00 C ATOM 63 NH1 ARG A 4 10.143 -0.458 -5.111 1.00 0.00 N ATOM 64 NH2 ARG A 4 11.503 1.302 -5.745 1.00 0.00 N ATOM 65 H ARG A 4 8.383 0.737 1.750 1.00 0.00 H ATOM 66 HA ARG A 4 8.133 3.385 0.459 1.00 0.00 H ATOM 67 HB2 ARG A 4 7.599 0.678 -0.852 1.00 0.00 H ATOM 68 HB3 ARG A 4 6.910 2.194 -1.444 1.00 0.00 H ATOM 69 HG2 ARG A 4 9.079 3.095 -1.980 1.00 0.00 H ATOM 70 HG3 ARG A 4 9.910 1.714 -1.234 1.00 0.00 H ATOM 71 HD2 ARG A 4 8.994 0.171 -2.804 1.00 0.00 H ATOM 72 HD3 ARG A 4 8.004 1.430 -3.576 1.00 0.00 H ATOM 73 HE ARG A 4 10.430 2.514 -3.856 1.00 0.00 H ATOM 74 HH11 ARG A 4 9.470 -0.872 -4.480 1.00 0.00 H ATOM 75 HH12 ARG A 4 10.529 -1.017 -5.857 1.00 0.00 H ATOM 76 HH21 ARG A 4 11.826 2.251 -5.624 1.00 0.00 H ATOM 77 HH22 ARG A 4 11.895 0.729 -6.478 1.00 0.00 H ATOM 78 N CYS A 5 5.543 3.155 0.766 1.00 0.00 N ATOM 79 CA CYS A 5 4.134 3.094 1.131 1.00 0.00 C ATOM 80 C CYS A 5 3.282 3.532 -0.056 1.00 0.00 C ATOM 81 O CYS A 5 3.646 4.467 -0.767 1.00 0.00 O ATOM 82 CB CYS A 5 3.832 3.950 2.368 1.00 0.00 C ATOM 83 SG CYS A 5 4.734 3.561 3.897 1.00 0.00 S ATOM 84 H CYS A 5 5.818 3.885 0.125 1.00 0.00 H ATOM 85 HA CYS A 5 3.867 2.064 1.333 1.00 0.00 H ATOM 86 HB2 CYS A 5 4.051 4.988 2.119 1.00 0.00 H ATOM 87 HB3 CYS A 5 2.767 3.876 2.588 1.00 0.00 H ATOM 88 N THR A 6 2.156 2.838 -0.262 1.00 0.00 N ATOM 89 CA THR A 6 1.240 3.052 -1.371 1.00 0.00 C ATOM 90 C THR A 6 -0.178 3.206 -0.822 1.00 0.00 C ATOM 91 O THR A 6 -0.677 2.304 -0.151 1.00 0.00 O ATOM 92 CB THR A 6 1.321 1.864 -2.342 1.00 0.00 C ATOM 93 OG1 THR A 6 1.114 0.647 -1.651 1.00 0.00 O ATOM 94 CG2 THR A 6 2.678 1.808 -3.050 1.00 0.00 C ATOM 95 H THR A 6 1.937 2.074 0.364 1.00 0.00 H ATOM 96 HA THR A 6 1.501 3.959 -1.919 1.00 0.00 H ATOM 97 HB THR A 6 0.542 1.975 -3.098 1.00 0.00 H ATOM 98 HG1 THR A 6 0.335 0.741 -1.095 1.00 0.00 H ATOM 99 HG21 THR A 6 2.676 0.992 -3.773 1.00 0.00 H ATOM 100 HG22 THR A 6 2.861 2.746 -3.575 1.00 0.00 H ATOM 101 HG23 THR A 6 3.478 1.637 -2.329 1.00 0.00 H ATOM 102 N GLU A 7 -0.824 4.342 -1.111 1.00 0.00 N ATOM 103 CA GLU A 7 -2.195 4.601 -0.702 1.00 0.00 C ATOM 104 C GLU A 7 -3.135 3.679 -1.480 1.00 0.00 C ATOM 105 O GLU A 7 -3.153 3.710 -2.709 1.00 0.00 O ATOM 106 CB GLU A 7 -2.527 6.083 -0.924 1.00 0.00 C ATOM 107 CG GLU A 7 -3.954 6.445 -0.490 1.00 0.00 C ATOM 108 CD GLU A 7 -4.237 6.083 0.966 1.00 0.00 C ATOM 109 OE1 GLU A 7 -3.438 6.505 1.829 1.00 0.00 O ATOM 110 OE2 GLU A 7 -5.251 5.388 1.192 1.00 0.00 O ATOM 111 H GLU A 7 -0.356 5.049 -1.659 1.00 0.00 H ATOM 112 HA GLU A 7 -2.273 4.388 0.363 1.00 0.00 H ATOM 113 HB2 GLU A 7 -1.827 6.691 -0.352 1.00 0.00 H ATOM 114 HB3 GLU A 7 -2.411 6.328 -1.981 1.00 0.00 H ATOM 115 HG2 GLU A 7 -4.093 7.520 -0.611 1.00 0.00 H ATOM 116 HG3 GLU A 7 -4.671 5.937 -1.137 1.00 0.00 H ATOM 117 N GLY A 8 -3.903 2.859 -0.754 1.00 0.00 N ATOM 118 CA GLY A 8 -4.848 1.902 -1.306 1.00 0.00 C ATOM 119 C GLY A 8 -6.129 1.866 -0.470 1.00 0.00 C ATOM 120 O GLY A 8 -6.327 2.724 0.390 1.00 0.00 O ATOM 121 H GLY A 8 -3.838 2.901 0.255 1.00 0.00 H ATOM 122 HA2 GLY A 8 -5.109 2.169 -2.331 1.00 0.00 H ATOM 123 HA3 GLY A 8 -4.375 0.920 -1.300 1.00 0.00 H ATOM 124 N PRO A 9 -7.003 0.874 -0.713 1.00 0.00 N ATOM 125 CA PRO A 9 -8.273 0.703 -0.017 1.00 0.00 C ATOM 126 C PRO A 9 -8.138 0.723 1.508 1.00 0.00 C ATOM 127 O PRO A 9 -8.992 1.284 2.192 1.00 0.00 O ATOM 128 CB PRO A 9 -8.835 -0.634 -0.508 1.00 0.00 C ATOM 129 CG PRO A 9 -8.227 -0.775 -1.902 1.00 0.00 C ATOM 130 CD PRO A 9 -6.845 -0.147 -1.735 1.00 0.00 C ATOM 131 HA PRO A 9 -8.943 1.504 -0.333 1.00 0.00 H ATOM 132 HB2 PRO A 9 -8.472 -1.450 0.117 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.925 -0.640 -0.531 1.00 0.00 H ATOM 134 HG2 PRO A 9 -8.175 -1.815 -2.229 1.00 0.00 H ATOM 135 HG3 PRO A 9 -8.811 -0.185 -2.610 1.00 0.00 H ATOM 136 HD2 PRO A 9 -6.137 -0.899 -1.384 1.00 0.00 H ATOM 137 HD3 PRO A 9 -6.510 0.267 -2.687 1.00 0.00 H ATOM 138 N TRP A 10 -7.067 0.115 2.032 1.00 0.00 N ATOM 139 CA TRP A 10 -6.829 -0.044 3.461 1.00 0.00 C ATOM 140 C TRP A 10 -5.847 1.015 3.971 1.00 0.00 C ATOM 141 O TRP A 10 -5.006 0.721 4.819 1.00 0.00 O ATOM 142 CB TRP A 10 -6.307 -1.466 3.704 1.00 0.00 C ATOM 143 CG TRP A 10 -7.142 -2.551 3.100 1.00 0.00 C ATOM 144 CD1 TRP A 10 -8.255 -3.098 3.635 1.00 0.00 C ATOM 145 CD2 TRP A 10 -6.967 -3.192 1.807 1.00 0.00 C ATOM 146 NE1 TRP A 10 -8.779 -4.037 2.768 1.00 0.00 N ATOM 147 CE2 TRP A 10 -8.025 -4.125 1.613 1.00 0.00 C ATOM 148 CE3 TRP A 10 -6.022 -3.062 0.770 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -8.141 -4.891 0.443 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -6.129 -3.820 -0.411 1.00 0.00 C ATOM 151 CH2 TRP A 10 -7.187 -4.732 -0.576 1.00 0.00 C ATOM 152 H TRP A 10 -6.397 -0.306 1.405 1.00 0.00 H ATOM 153 HA TRP A 10 -7.764 0.064 4.012 1.00 0.00 H ATOM 154 HB2 TRP A 10 -5.306 -1.543 3.278 1.00 0.00 H ATOM 155 HB3 TRP A 10 -6.223 -1.652 4.772 1.00 0.00 H ATOM 156 HD1 TRP A 10 -8.681 -2.832 4.591 1.00 0.00 H ATOM 157 HE1 TRP A 10 -9.610 -4.587 2.930 1.00 0.00 H ATOM 158 HE3 TRP A 10 -5.210 -2.363 0.903 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -8.956 -5.590 0.326 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -5.395 -3.701 -1.194 1.00 0.00 H ATOM 161 HH2 TRP A 10 -7.265 -5.311 -1.485 1.00 0.00 H ATOM 162 N GLY A 11 -5.946 2.248 3.456 1.00 0.00 N ATOM 163 CA GLY A 11 -5.077 3.340 3.864 1.00 0.00 C ATOM 164 C GLY A 11 -3.724 3.224 3.170 1.00 0.00 C ATOM 165 O GLY A 11 -3.603 2.597 2.119 1.00 0.00 O ATOM 166 H GLY A 11 -6.633 2.435 2.738 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.527 4.294 3.595 1.00 0.00 H ATOM 168 HA3 GLY A 11 -4.943 3.320 4.946 1.00 0.00 H ATOM 169 N TRP A 12 -2.697 3.818 3.783 1.00 0.00 N ATOM 170 CA TRP A 12 -1.315 3.632 3.370 1.00 0.00 C ATOM 171 C TRP A 12 -0.876 2.203 3.683 1.00 0.00 C ATOM 172 O TRP A 12 -0.768 1.828 4.850 1.00 0.00 O ATOM 173 CB TRP A 12 -0.416 4.657 4.067 1.00 0.00 C ATOM 174 CG TRP A 12 -0.548 6.051 3.538 1.00 0.00 C ATOM 175 CD1 TRP A 12 -1.214 7.068 4.129 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.026 6.591 2.289 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.139 8.199 3.341 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.418 7.958 2.188 1.00 0.00 C ATOM 179 CE3 TRP A 12 0.739 6.063 1.227 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.070 8.758 1.090 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.098 6.857 0.122 1.00 0.00 C ATOM 182 CH2 TRP A 12 0.694 8.202 0.052 1.00 0.00 C ATOM 183 H TRP A 12 -2.881 4.352 4.619 1.00 0.00 H ATOM 184 HA TRP A 12 -1.232 3.800 2.297 1.00 0.00 H ATOM 185 HB2 TRP A 12 -0.615 4.650 5.140 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.622 4.358 3.919 1.00 0.00 H ATOM 187 HD1 TRP A 12 -1.734 7.005 5.074 1.00 0.00 H ATOM 188 HE1 TRP A 12 -1.555 9.093 3.557 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.050 5.031 1.264 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.385 9.791 1.044 1.00 0.00 H ATOM 191 HZ3 TRP A 12 1.684 6.432 -0.679 1.00 0.00 H ATOM 192 HH2 TRP A 12 0.971 8.805 -0.801 1.00 0.00 H ATOM 193 N VAL A 13 -0.612 1.419 2.632 1.00 0.00 N ATOM 194 CA VAL A 13 -0.140 0.048 2.728 1.00 0.00 C ATOM 195 C VAL A 13 1.371 0.104 2.524 1.00 0.00 C ATOM 196 O VAL A 13 1.836 0.375 1.417 1.00 0.00 O ATOM 197 CB VAL A 13 -0.833 -0.828 1.667 1.00 0.00 C ATOM 198 CG1 VAL A 13 -0.310 -2.270 1.728 1.00 0.00 C ATOM 199 CG2 VAL A 13 -2.353 -0.844 1.875 1.00 0.00 C ATOM 200 H VAL A 13 -0.732 1.798 1.702 1.00 0.00 H ATOM 201 HA VAL A 13 -0.368 -0.369 3.710 1.00 0.00 H ATOM 202 HB VAL A 13 -0.629 -0.429 0.672 1.00 0.00 H ATOM 203 HG11 VAL A 13 -0.835 -2.883 0.995 1.00 0.00 H ATOM 204 HG12 VAL A 13 0.755 -2.302 1.501 1.00 0.00 H ATOM 205 HG13 VAL A 13 -0.477 -2.685 2.723 1.00 0.00 H ATOM 206 HG21 VAL A 13 -2.591 -1.195 2.880 1.00 0.00 H ATOM 207 HG22 VAL A 13 -2.765 0.154 1.738 1.00 0.00 H ATOM 208 HG23 VAL A 13 -2.816 -1.508 1.146 1.00 0.00 H ATOM 209 N CYS A 14 2.123 -0.129 3.605 1.00 0.00 N ATOM 210 CA CYS A 14 3.571 0.009 3.633 1.00 0.00 C ATOM 211 C CYS A 14 4.255 -1.347 3.493 1.00 0.00 C ATOM 212 O CYS A 14 3.768 -2.352 4.009 1.00 0.00 O ATOM 213 CB CYS A 14 4.006 0.738 4.905 1.00 0.00 C ATOM 214 SG CYS A 14 3.436 2.456 5.049 1.00 0.00 S ATOM 215 H CYS A 14 1.665 -0.366 4.473 1.00 0.00 H ATOM 216 HA CYS A 14 3.890 0.620 2.801 1.00 0.00 H ATOM 217 HB2 CYS A 14 3.636 0.184 5.768 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.096 0.748 4.951 1.00 0.00 H ATOM 219 N MET A 15 5.386 -1.348 2.779 1.00 0.00 N ATOM 220 CA MET A 15 6.202 -2.513 2.479 1.00 0.00 C ATOM 221 C MET A 15 7.636 -2.234 2.929 1.00 0.00 C ATOM 222 O MET A 15 8.134 -1.138 2.590 1.00 0.00 O ATOM 223 CB MET A 15 6.166 -2.797 0.971 1.00 0.00 C ATOM 224 CG MET A 15 4.751 -3.034 0.426 1.00 0.00 C ATOM 225 SD MET A 15 3.811 -4.393 1.177 1.00 0.00 S ATOM 226 CE MET A 15 4.837 -5.806 0.698 1.00 0.00 C ATOM 227 OXT MET A 15 8.208 -3.118 3.603 1.00 0.00 O ATOM 228 H MET A 15 5.715 -0.465 2.412 1.00 0.00 H ATOM 229 HA MET A 15 5.837 -3.389 3.018 1.00 0.00 H ATOM 230 HB2 MET A 15 6.601 -1.952 0.435 1.00 0.00 H ATOM 231 HB3 MET A 15 6.776 -3.677 0.773 1.00 0.00 H ATOM 232 HG2 MET A 15 4.167 -2.122 0.545 1.00 0.00 H ATOM 233 HG3 MET A 15 4.829 -3.235 -0.643 1.00 0.00 H ATOM 234 HE1 MET A 15 5.791 -5.767 1.223 1.00 0.00 H ATOM 235 HE2 MET A 15 4.321 -6.727 0.965 1.00 0.00 H ATOM 236 HE3 MET A 15 5.010 -5.788 -0.378 1.00 0.00 H TER 237 MET A 15