HETATM 1 C ACE A 0 8.209 -6.605 2.307 1.00 0.00 C HETATM 2 O ACE A 0 8.359 -7.744 1.868 1.00 0.00 O HETATM 3 CH3 ACE A 0 7.350 -6.363 3.543 1.00 0.00 C HETATM 4 H1 ACE A 0 7.937 -5.845 4.302 1.00 0.00 H HETATM 5 H2 ACE A 0 6.487 -5.754 3.275 1.00 0.00 H HETATM 6 H3 ACE A 0 7.004 -7.314 3.946 1.00 0.00 H ATOM 7 N ASN A 1 8.769 -5.525 1.750 1.00 0.00 N ATOM 8 CA ASN A 1 9.642 -5.564 0.585 1.00 0.00 C ATOM 9 C ASN A 1 10.516 -4.302 0.599 1.00 0.00 C ATOM 10 O ASN A 1 11.084 -3.976 1.640 1.00 0.00 O ATOM 11 CB ASN A 1 8.793 -5.745 -0.687 1.00 0.00 C ATOM 12 CG ASN A 1 9.639 -6.117 -1.902 1.00 0.00 C ATOM 13 OD1 ASN A 1 9.855 -5.290 -2.785 1.00 0.00 O ATOM 14 ND2 ASN A 1 10.122 -7.360 -1.950 1.00 0.00 N ATOM 15 H ASN A 1 8.615 -4.623 2.182 1.00 0.00 H ATOM 16 HA ASN A 1 10.309 -6.421 0.685 1.00 0.00 H ATOM 17 HB2 ASN A 1 8.074 -6.551 -0.535 1.00 0.00 H ATOM 18 HB3 ASN A 1 8.231 -4.833 -0.892 1.00 0.00 H ATOM 19 HD21 ASN A 1 9.920 -8.010 -1.204 1.00 0.00 H ATOM 20 HD22 ASN A 1 10.686 -7.647 -2.737 1.00 0.00 H ATOM 21 N LEU A 2 10.634 -3.583 -0.526 1.00 0.00 N ATOM 22 CA LEU A 2 11.408 -2.352 -0.613 1.00 0.00 C ATOM 23 C LEU A 2 10.728 -1.247 0.210 1.00 0.00 C ATOM 24 O LEU A 2 9.502 -1.249 0.318 1.00 0.00 O ATOM 25 CB LEU A 2 11.621 -1.985 -2.094 1.00 0.00 C ATOM 26 CG LEU A 2 10.339 -1.615 -2.864 1.00 0.00 C ATOM 27 CD1 LEU A 2 10.099 -0.101 -2.852 1.00 0.00 C ATOM 28 CD2 LEU A 2 10.457 -2.066 -4.325 1.00 0.00 C ATOM 29 H LEU A 2 10.160 -3.886 -1.365 1.00 0.00 H ATOM 30 HA LEU A 2 12.390 -2.570 -0.192 1.00 0.00 H ATOM 31 HB2 LEU A 2 12.334 -1.165 -2.177 1.00 0.00 H ATOM 32 HB3 LEU A 2 12.074 -2.857 -2.567 1.00 0.00 H ATOM 33 HG LEU A 2 9.476 -2.118 -2.427 1.00 0.00 H ATOM 34 HD11 LEU A 2 10.047 0.270 -1.832 1.00 0.00 H ATOM 35 HD12 LEU A 2 10.909 0.413 -3.371 1.00 0.00 H ATOM 36 HD13 LEU A 2 9.159 0.121 -3.356 1.00 0.00 H ATOM 37 HD21 LEU A 2 11.320 -1.593 -4.794 1.00 0.00 H ATOM 38 HD22 LEU A 2 10.574 -3.149 -4.373 1.00 0.00 H ATOM 39 HD23 LEU A 2 9.556 -1.788 -4.871 1.00 0.00 H ATOM 40 N PRO A 3 11.493 -0.314 0.804 1.00 0.00 N ATOM 41 CA PRO A 3 10.971 0.715 1.695 1.00 0.00 C ATOM 42 C PRO A 3 10.146 1.748 0.920 1.00 0.00 C ATOM 43 O PRO A 3 10.700 2.671 0.325 1.00 0.00 O ATOM 44 CB PRO A 3 12.201 1.333 2.369 1.00 0.00 C ATOM 45 CG PRO A 3 13.312 1.121 1.343 1.00 0.00 C ATOM 46 CD PRO A 3 12.944 -0.227 0.727 1.00 0.00 C ATOM 47 HA PRO A 3 10.354 0.263 2.472 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.066 2.384 2.628 1.00 0.00 H ATOM 49 HB3 PRO A 3 12.439 0.761 3.267 1.00 0.00 H ATOM 50 HG2 PRO A 3 13.260 1.899 0.580 1.00 0.00 H ATOM 51 HG3 PRO A 3 14.302 1.110 1.801 1.00 0.00 H ATOM 52 HD2 PRO A 3 13.309 -0.277 -0.298 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.383 -1.028 1.323 1.00 0.00 H ATOM 54 N ARG A 4 8.818 1.585 0.936 1.00 0.00 N ATOM 55 CA ARG A 4 7.869 2.450 0.247 1.00 0.00 C ATOM 56 C ARG A 4 6.469 2.164 0.789 1.00 0.00 C ATOM 57 O ARG A 4 6.215 1.062 1.272 1.00 0.00 O ATOM 58 CB ARG A 4 7.946 2.179 -1.263 1.00 0.00 C ATOM 59 CG ARG A 4 7.050 3.097 -2.106 1.00 0.00 C ATOM 60 CD ARG A 4 7.201 2.778 -3.597 1.00 0.00 C ATOM 61 NE ARG A 4 8.579 2.990 -4.059 1.00 0.00 N ATOM 62 CZ ARG A 4 9.075 2.558 -5.229 1.00 0.00 C ATOM 63 NH1 ARG A 4 8.299 1.907 -6.108 1.00 0.00 N ATOM 64 NH2 ARG A 4 10.363 2.780 -5.522 1.00 0.00 N ATOM 65 H ARG A 4 8.432 0.793 1.435 1.00 0.00 H ATOM 66 HA ARG A 4 8.127 3.492 0.445 1.00 0.00 H ATOM 67 HB2 ARG A 4 8.977 2.329 -1.579 1.00 0.00 H ATOM 68 HB3 ARG A 4 7.669 1.140 -1.451 1.00 0.00 H ATOM 69 HG2 ARG A 4 6.004 2.946 -1.841 1.00 0.00 H ATOM 70 HG3 ARG A 4 7.318 4.139 -1.926 1.00 0.00 H ATOM 71 HD2 ARG A 4 6.910 1.739 -3.760 1.00 0.00 H ATOM 72 HD3 ARG A 4 6.533 3.425 -4.166 1.00 0.00 H ATOM 73 HE ARG A 4 9.193 3.492 -3.433 1.00 0.00 H ATOM 74 HH11 ARG A 4 7.326 1.742 -5.898 1.00 0.00 H ATOM 75 HH12 ARG A 4 8.685 1.584 -6.984 1.00 0.00 H ATOM 76 HH21 ARG A 4 10.955 3.267 -4.864 1.00 0.00 H ATOM 77 HH22 ARG A 4 10.747 2.459 -6.399 1.00 0.00 H ATOM 78 N CYS A 5 5.566 3.150 0.701 1.00 0.00 N ATOM 79 CA CYS A 5 4.160 2.991 1.046 1.00 0.00 C ATOM 80 C CYS A 5 3.288 3.453 -0.116 1.00 0.00 C ATOM 81 O CYS A 5 3.660 4.371 -0.845 1.00 0.00 O ATOM 82 CB CYS A 5 3.815 3.758 2.329 1.00 0.00 C ATOM 83 SG CYS A 5 4.849 3.426 3.784 1.00 0.00 S ATOM 84 H CYS A 5 5.844 4.034 0.300 1.00 0.00 H ATOM 85 HA CYS A 5 3.943 1.938 1.190 1.00 0.00 H ATOM 86 HB2 CYS A 5 3.896 4.825 2.118 1.00 0.00 H ATOM 87 HB3 CYS A 5 2.778 3.546 2.592 1.00 0.00 H ATOM 88 N THR A 6 2.133 2.798 -0.282 1.00 0.00 N ATOM 89 CA THR A 6 1.195 3.031 -1.369 1.00 0.00 C ATOM 90 C THR A 6 -0.205 3.228 -0.791 1.00 0.00 C ATOM 91 O THR A 6 -0.706 2.352 -0.086 1.00 0.00 O ATOM 92 CB THR A 6 1.223 1.835 -2.333 1.00 0.00 C ATOM 93 OG1 THR A 6 0.994 0.630 -1.629 1.00 0.00 O ATOM 94 CG2 THR A 6 2.564 1.735 -3.067 1.00 0.00 C ATOM 95 H THR A 6 1.909 2.045 0.357 1.00 0.00 H ATOM 96 HA THR A 6 1.469 3.927 -1.929 1.00 0.00 H ATOM 97 HB THR A 6 0.433 1.964 -3.075 1.00 0.00 H ATOM 98 HG1 THR A 6 0.224 0.749 -1.064 1.00 0.00 H ATOM 99 HG21 THR A 6 2.523 0.917 -3.787 1.00 0.00 H ATOM 100 HG22 THR A 6 2.766 2.665 -3.600 1.00 0.00 H ATOM 101 HG23 THR A 6 3.373 1.542 -2.362 1.00 0.00 H ATOM 102 N GLU A 7 -0.837 4.368 -1.097 1.00 0.00 N ATOM 103 CA GLU A 7 -2.199 4.660 -0.677 1.00 0.00 C ATOM 104 C GLU A 7 -3.153 3.741 -1.445 1.00 0.00 C ATOM 105 O GLU A 7 -3.183 3.778 -2.674 1.00 0.00 O ATOM 106 CB GLU A 7 -2.508 6.148 -0.914 1.00 0.00 C ATOM 107 CG GLU A 7 -3.538 6.698 0.082 1.00 0.00 C ATOM 108 CD GLU A 7 -4.863 5.941 0.053 1.00 0.00 C ATOM 109 OE1 GLU A 7 -5.496 5.935 -1.024 1.00 0.00 O ATOM 110 OE2 GLU A 7 -5.216 5.380 1.113 1.00 0.00 O ATOM 111 H GLU A 7 -0.367 5.049 -1.674 1.00 0.00 H ATOM 112 HA GLU A 7 -2.275 4.468 0.392 1.00 0.00 H ATOM 113 HB2 GLU A 7 -1.598 6.729 -0.777 1.00 0.00 H ATOM 114 HB3 GLU A 7 -2.856 6.304 -1.937 1.00 0.00 H ATOM 115 HG2 GLU A 7 -3.119 6.646 1.087 1.00 0.00 H ATOM 116 HG3 GLU A 7 -3.730 7.746 -0.153 1.00 0.00 H ATOM 117 N GLY A 8 -3.913 2.914 -0.720 1.00 0.00 N ATOM 118 CA GLY A 8 -4.852 1.955 -1.280 1.00 0.00 C ATOM 119 C GLY A 8 -6.138 1.897 -0.453 1.00 0.00 C ATOM 120 O GLY A 8 -6.345 2.734 0.425 1.00 0.00 O ATOM 121 H GLY A 8 -3.843 2.946 0.289 1.00 0.00 H ATOM 122 HA2 GLY A 8 -5.113 2.228 -2.303 1.00 0.00 H ATOM 123 HA3 GLY A 8 -4.371 0.976 -1.282 1.00 0.00 H ATOM 124 N PRO A 9 -7.007 0.908 -0.725 1.00 0.00 N ATOM 125 CA PRO A 9 -8.281 0.713 -0.043 1.00 0.00 C ATOM 126 C PRO A 9 -8.161 0.704 1.483 1.00 0.00 C ATOM 127 O PRO A 9 -9.029 1.239 2.170 1.00 0.00 O ATOM 128 CB PRO A 9 -8.828 -0.619 -0.565 1.00 0.00 C ATOM 129 CG PRO A 9 -8.211 -0.726 -1.958 1.00 0.00 C ATOM 130 CD PRO A 9 -6.834 -0.090 -1.768 1.00 0.00 C ATOM 131 HA PRO A 9 -8.955 1.514 -0.350 1.00 0.00 H ATOM 132 HB2 PRO A 9 -8.462 -1.444 0.045 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.918 -0.634 -0.595 1.00 0.00 H ATOM 134 HG2 PRO A 9 -8.147 -1.758 -2.306 1.00 0.00 H ATOM 135 HG3 PRO A 9 -8.795 -0.126 -2.657 1.00 0.00 H ATOM 136 HD2 PRO A 9 -6.123 -0.844 -1.429 1.00 0.00 H ATOM 137 HD3 PRO A 9 -6.497 0.346 -2.709 1.00 0.00 H ATOM 138 N TRP A 10 -7.086 0.100 2.004 1.00 0.00 N ATOM 139 CA TRP A 10 -6.852 -0.073 3.432 1.00 0.00 C ATOM 140 C TRP A 10 -5.883 0.992 3.956 1.00 0.00 C ATOM 141 O TRP A 10 -5.065 0.708 4.829 1.00 0.00 O ATOM 142 CB TRP A 10 -6.312 -1.490 3.660 1.00 0.00 C ATOM 143 CG TRP A 10 -7.128 -2.578 3.035 1.00 0.00 C ATOM 144 CD1 TRP A 10 -8.235 -3.151 3.556 1.00 0.00 C ATOM 145 CD2 TRP A 10 -6.938 -3.194 1.732 1.00 0.00 C ATOM 146 NE1 TRP A 10 -8.740 -4.083 2.671 1.00 0.00 N ATOM 147 CE2 TRP A 10 -7.981 -4.140 1.518 1.00 0.00 C ATOM 148 CE3 TRP A 10 -5.991 -3.032 0.702 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -8.080 -4.888 0.335 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -6.081 -3.771 -0.492 1.00 0.00 C ATOM 151 CH2 TRP A 10 -7.124 -4.697 -0.677 1.00 0.00 C ATOM 152 H TRP A 10 -6.406 -0.301 1.375 1.00 0.00 H ATOM 153 HA TRP A 10 -7.790 0.018 3.981 1.00 0.00 H ATOM 154 HB2 TRP A 10 -5.307 -1.548 3.240 1.00 0.00 H ATOM 155 HB3 TRP A 10 -6.234 -1.689 4.726 1.00 0.00 H ATOM 156 HD1 TRP A 10 -8.668 -2.908 4.515 1.00 0.00 H ATOM 157 HE1 TRP A 10 -9.563 -4.649 2.820 1.00 0.00 H ATOM 158 HE3 TRP A 10 -5.190 -2.322 0.851 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -8.883 -5.598 0.202 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -5.346 -3.628 -1.270 1.00 0.00 H ATOM 161 HH2 TRP A 10 -7.189 -5.262 -1.596 1.00 0.00 H ATOM 162 N GLY A 11 -5.967 2.218 3.423 1.00 0.00 N ATOM 163 CA GLY A 11 -5.099 3.312 3.824 1.00 0.00 C ATOM 164 C GLY A 11 -3.738 3.180 3.148 1.00 0.00 C ATOM 165 O GLY A 11 -3.603 2.511 2.125 1.00 0.00 O ATOM 166 H GLY A 11 -6.635 2.396 2.685 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.544 4.262 3.531 1.00 0.00 H ATOM 168 HA3 GLY A 11 -4.978 3.311 4.908 1.00 0.00 H ATOM 169 N TRP A 12 -2.720 3.809 3.741 1.00 0.00 N ATOM 170 CA TRP A 12 -1.337 3.635 3.330 1.00 0.00 C ATOM 171 C TRP A 12 -0.861 2.233 3.704 1.00 0.00 C ATOM 172 O TRP A 12 -0.730 1.916 4.885 1.00 0.00 O ATOM 173 CB TRP A 12 -0.460 4.718 3.963 1.00 0.00 C ATOM 174 CG TRP A 12 -0.638 6.078 3.363 1.00 0.00 C ATOM 175 CD1 TRP A 12 -1.427 7.062 3.848 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.042 6.610 2.144 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.355 8.169 3.026 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.512 7.943 1.956 1.00 0.00 C ATOM 179 CE3 TRP A 12 0.849 6.101 1.174 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.114 8.731 0.866 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.255 6.883 0.077 1.00 0.00 C ATOM 182 CH2 TRP A 12 0.778 8.197 -0.077 1.00 0.00 C ATOM 183 H TRP A 12 -2.910 4.367 4.560 1.00 0.00 H ATOM 184 HA TRP A 12 -1.261 3.752 2.250 1.00 0.00 H ATOM 185 HB2 TRP A 12 -0.649 4.763 5.037 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.585 4.439 3.820 1.00 0.00 H ATOM 187 HD1 TRP A 12 -2.026 6.995 4.744 1.00 0.00 H ATOM 188 HE1 TRP A 12 -1.847 9.039 3.168 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.223 5.094 1.279 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.490 9.738 0.754 1.00 0.00 H ATOM 191 HZ3 TRP A 12 1.935 6.472 -0.654 1.00 0.00 H ATOM 192 HH2 TRP A 12 1.096 8.792 -0.920 1.00 0.00 H ATOM 193 N VAL A 13 -0.594 1.409 2.685 1.00 0.00 N ATOM 194 CA VAL A 13 -0.094 0.052 2.833 1.00 0.00 C ATOM 195 C VAL A 13 1.412 0.126 2.606 1.00 0.00 C ATOM 196 O VAL A 13 1.856 0.423 1.498 1.00 0.00 O ATOM 197 CB VAL A 13 -0.782 -0.879 1.817 1.00 0.00 C ATOM 198 CG1 VAL A 13 -0.219 -2.303 1.916 1.00 0.00 C ATOM 199 CG2 VAL A 13 -2.297 -0.928 2.057 1.00 0.00 C ATOM 200 H VAL A 13 -0.733 1.745 1.741 1.00 0.00 H ATOM 201 HA VAL A 13 -0.303 -0.326 3.835 1.00 0.00 H ATOM 202 HB VAL A 13 -0.607 -0.508 0.805 1.00 0.00 H ATOM 203 HG11 VAL A 13 -0.745 -2.955 1.218 1.00 0.00 H ATOM 204 HG12 VAL A 13 0.841 -2.317 1.665 1.00 0.00 H ATOM 205 HG13 VAL A 13 -0.351 -2.687 2.929 1.00 0.00 H ATOM 206 HG21 VAL A 13 -2.739 0.054 1.899 1.00 0.00 H ATOM 207 HG22 VAL A 13 -2.757 -1.627 1.359 1.00 0.00 H ATOM 208 HG23 VAL A 13 -2.505 -1.254 3.077 1.00 0.00 H ATOM 209 N CYS A 14 2.186 -0.125 3.669 1.00 0.00 N ATOM 210 CA CYS A 14 3.632 0.024 3.674 1.00 0.00 C ATOM 211 C CYS A 14 4.324 -1.322 3.487 1.00 0.00 C ATOM 212 O CYS A 14 3.846 -2.351 3.964 1.00 0.00 O ATOM 213 CB CYS A 14 4.087 0.704 4.965 1.00 0.00 C ATOM 214 SG CYS A 14 3.625 2.451 5.118 1.00 0.00 S ATOM 215 H CYS A 14 1.745 -0.387 4.538 1.00 0.00 H ATOM 216 HA CYS A 14 3.939 0.668 2.859 1.00 0.00 H ATOM 217 HB2 CYS A 14 3.678 0.159 5.816 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.175 0.655 5.024 1.00 0.00 H ATOM 219 N MET A 15 5.457 -1.281 2.779 1.00 0.00 N ATOM 220 CA MET A 15 6.314 -2.410 2.458 1.00 0.00 C ATOM 221 C MET A 15 7.745 -2.083 2.887 1.00 0.00 C ATOM 222 O MET A 15 8.087 -0.879 2.890 1.00 0.00 O ATOM 223 CB MET A 15 6.259 -2.686 0.949 1.00 0.00 C ATOM 224 CG MET A 15 4.844 -2.992 0.439 1.00 0.00 C ATOM 225 SD MET A 15 4.012 -4.420 1.190 1.00 0.00 S ATOM 226 CE MET A 15 4.916 -5.774 0.396 1.00 0.00 C ATOM 227 OXT MET A 15 8.477 -3.045 3.205 1.00 0.00 O ATOM 228 H MET A 15 5.763 -0.381 2.434 1.00 0.00 H ATOM 229 HA MET A 15 5.992 -3.299 3.002 1.00 0.00 H ATOM 230 HB2 MET A 15 6.635 -1.812 0.414 1.00 0.00 H ATOM 231 HB3 MET A 15 6.910 -3.530 0.720 1.00 0.00 H ATOM 232 HG2 MET A 15 4.212 -2.118 0.600 1.00 0.00 H ATOM 233 HG3 MET A 15 4.898 -3.162 -0.636 1.00 0.00 H ATOM 234 HE1 MET A 15 5.971 -5.717 0.660 1.00 0.00 H ATOM 235 HE2 MET A 15 4.512 -6.725 0.741 1.00 0.00 H ATOM 236 HE3 MET A 15 4.806 -5.705 -0.686 1.00 0.00 H TER 237 MET A 15