HETATM 1 C ACE A 1 0.188 -7.837 -7.706 1.00 0.00 C HETATM 2 O ACE A 1 -0.246 -6.844 -7.118 1.00 0.00 O HETATM 3 CH3 ACE A 1 -0.044 -8.013 -9.203 1.00 0.00 C HETATM 4 H1 ACE A 1 0.911 -8.061 -9.758 1.00 0.00 H HETATM 5 H2 ACE A 1 -0.613 -8.936 -9.420 1.00 0.00 H HETATM 6 H3 ACE A 1 -0.622 -7.166 -9.618 1.00 0.00 H ATOM 7 N ILE A 2 0.883 -8.818 -7.112 1.00 0.00 N ATOM 8 CA ILE A 2 1.206 -8.817 -5.654 1.00 0.00 C ATOM 9 C ILE A 2 2.614 -8.165 -5.470 1.00 0.00 C ATOM 10 O ILE A 2 3.592 -8.529 -6.135 1.00 0.00 O ATOM 11 CB ILE A 2 1.130 -10.248 -5.009 1.00 0.00 C ATOM 12 CG1 ILE A 2 -0.135 -11.096 -5.354 1.00 0.00 C ATOM 13 CG2 ILE A 2 1.334 -10.236 -3.471 1.00 0.00 C ATOM 14 CD1 ILE A 2 -1.500 -10.499 -4.963 1.00 0.00 C ATOM 15 H ILE A 2 1.188 -9.570 -7.739 1.00 0.00 H ATOM 16 HA ILE A 2 0.438 -8.213 -5.125 1.00 0.00 H ATOM 17 HB ILE A 2 1.995 -10.803 -5.412 1.00 0.00 H ATOM 18 HG12 ILE A 2 -0.148 -11.300 -6.441 1.00 0.00 H ATOM 19 HG13 ILE A 2 -0.044 -12.099 -4.896 1.00 0.00 H ATOM 20 HG21 ILE A 2 2.314 -9.809 -3.186 1.00 0.00 H ATOM 21 HG22 ILE A 2 0.560 -9.641 -2.953 1.00 0.00 H ATOM 22 HG23 ILE A 2 1.307 -11.255 -3.041 1.00 0.00 H ATOM 23 HD11 ILE A 2 -2.326 -11.171 -5.258 1.00 0.00 H ATOM 24 HD12 ILE A 2 -1.585 -10.340 -3.872 1.00 0.00 H ATOM 25 HD13 ILE A 2 -1.681 -9.527 -5.457 1.00 0.00 H ATOM 26 N TRP A 3 2.685 -7.206 -4.538 1.00 0.00 N ATOM 27 CA TRP A 3 3.936 -6.464 -4.205 1.00 0.00 C ATOM 28 C TRP A 3 3.959 -6.036 -2.698 1.00 0.00 C ATOM 29 O TRP A 3 3.008 -6.267 -1.939 1.00 0.00 O ATOM 30 CB TRP A 3 4.214 -5.330 -5.245 1.00 0.00 C ATOM 31 CG TRP A 3 3.264 -4.121 -5.276 1.00 0.00 C ATOM 32 CD1 TRP A 3 2.022 -4.064 -5.944 1.00 0.00 C ATOM 33 CD2 TRP A 3 3.468 -2.850 -4.764 1.00 0.00 C ATOM 34 NE1 TRP A 3 1.435 -2.789 -5.849 1.00 0.00 N ATOM 35 CE2 TRP A 3 2.351 -2.050 -5.119 1.00 0.00 C ATOM 36 CE3 TRP A 3 4.554 -2.284 -4.048 1.00 0.00 C ATOM 37 CZ2 TRP A 3 2.316 -0.682 -4.763 1.00 0.00 C ATOM 38 CZ3 TRP A 3 4.489 -0.936 -3.694 1.00 0.00 C ATOM 39 CH2 TRP A 3 3.389 -0.147 -4.048 1.00 0.00 C ATOM 40 H TRP A 3 1.838 -7.153 -3.964 1.00 0.00 H ATOM 41 HA TRP A 3 4.778 -7.178 -4.302 1.00 0.00 H ATOM 42 HB2 TRP A 3 5.248 -4.966 -5.099 1.00 0.00 H ATOM 43 HB3 TRP A 3 4.248 -5.773 -6.260 1.00 0.00 H ATOM 44 HD1 TRP A 3 1.588 -4.884 -6.496 1.00 0.00 H ATOM 45 HE1 TRP A 3 0.551 -2.466 -6.259 1.00 0.00 H ATOM 46 HE3 TRP A 3 5.416 -2.876 -3.777 1.00 0.00 H ATOM 47 HZ2 TRP A 3 1.480 -0.058 -5.043 1.00 0.00 H ATOM 48 HZ3 TRP A 3 5.305 -0.493 -3.141 1.00 0.00 H ATOM 49 HH2 TRP A 3 3.374 0.895 -3.769 1.00 0.00 H ATOM 50 N GLY A 4 5.073 -5.414 -2.261 1.00 0.00 N ATOM 51 CA GLY A 4 5.259 -4.956 -0.861 1.00 0.00 C ATOM 52 C GLY A 4 4.266 -3.888 -0.356 1.00 0.00 C ATOM 53 O GLY A 4 4.233 -2.767 -0.871 1.00 0.00 O ATOM 54 H GLY A 4 5.793 -5.273 -2.977 1.00 0.00 H ATOM 55 HA2 GLY A 4 5.282 -5.837 -0.190 1.00 0.00 H ATOM 56 HA3 GLY A 4 6.270 -4.518 -0.776 1.00 0.00 H HETATM 57 N SET A 5 3.486 -4.250 0.677 1.00 0.00 N HETATM 58 CA SET A 5 2.476 -3.346 1.287 1.00 0.00 C HETATM 59 CB SET A 5 3.187 -2.377 2.280 1.00 0.00 C HETATM 60 OG SET A 5 3.648 -2.799 3.346 1.00 0.00 O HETATM 61 NT SET A 5 0.124 -3.462 2.191 1.00 0.00 N HETATM 62 C SET A 5 1.374 -4.221 1.954 1.00 0.00 C HETATM 63 H SET A 5 3.614 -5.218 0.993 1.00 0.00 H HETATM 64 HA SET A 5 1.995 -2.771 0.468 1.00 0.00 H HETATM 65 HB2 SET A 5 1.150 -5.117 1.338 1.00 0.00 H HETATM 66 HB3 SET A 5 1.731 -4.636 2.915 1.00 0.00 H HETATM 67 HNT2 SET A 5 -0.001 -2.853 3.007 1.00 0.00 H ATOM 68 N SER A 6 3.300 -1.091 1.899 1.00 0.00 N ATOM 69 CA SER A 6 3.982 -0.056 2.718 1.00 0.00 C ATOM 70 C SER A 6 3.460 1.341 2.289 1.00 0.00 C ATOM 71 O SER A 6 3.432 1.681 1.100 1.00 0.00 O ATOM 72 CB SER A 6 5.522 -0.108 2.541 1.00 0.00 C ATOM 73 OG SER A 6 6.072 -1.279 3.135 1.00 0.00 O ATOM 74 H SER A 6 2.714 -0.813 1.104 1.00 0.00 H ATOM 75 HA SER A 6 3.752 -0.231 3.790 1.00 0.00 H ATOM 76 HB2 SER A 6 5.803 -0.069 1.471 1.00 0.00 H ATOM 77 HB3 SER A 6 6.001 0.772 3.011 1.00 0.00 H ATOM 78 HG SER A 6 5.490 -2.003 2.886 1.00 0.00 H ATOM 79 N GLY A 7 3.073 2.150 3.282 1.00 0.00 N ATOM 80 CA GLY A 7 2.562 3.512 3.034 1.00 0.00 C ATOM 81 C GLY A 7 2.122 4.160 4.350 1.00 0.00 C ATOM 82 O GLY A 7 2.952 4.724 5.069 1.00 0.00 O ATOM 83 H GLY A 7 3.162 1.760 4.227 1.00 0.00 H ATOM 84 HA2 GLY A 7 3.353 4.132 2.570 1.00 0.00 H ATOM 85 HA3 GLY A 7 1.732 3.486 2.299 1.00 0.00 H ATOM 86 N LYS A 8 0.812 4.084 4.641 1.00 0.00 N ATOM 87 CA LYS A 8 0.225 4.657 5.888 1.00 0.00 C ATOM 88 C LYS A 8 -1.167 3.991 6.099 1.00 0.00 C ATOM 89 O LYS A 8 -1.234 2.935 6.736 1.00 0.00 O ATOM 90 CB LYS A 8 0.267 6.224 5.918 1.00 0.00 C ATOM 91 CG LYS A 8 -0.188 6.906 7.230 1.00 0.00 C ATOM 92 CD LYS A 8 0.750 6.672 8.437 1.00 0.00 C ATOM 93 CE LYS A 8 0.345 7.413 9.727 1.00 0.00 C ATOM 94 NZ LYS A 8 -0.864 6.841 10.361 1.00 0.00 N ATOM 95 H LYS A 8 0.318 3.405 4.044 1.00 0.00 H ATOM 96 HA LYS A 8 0.855 4.305 6.729 1.00 0.00 H ATOM 97 HB2 LYS A 8 1.289 6.579 5.689 1.00 0.00 H ATOM 98 HB3 LYS A 8 -0.346 6.618 5.085 1.00 0.00 H ATOM 99 HG2 LYS A 8 -0.265 7.994 7.044 1.00 0.00 H ATOM 100 HG3 LYS A 8 -1.218 6.585 7.478 1.00 0.00 H ATOM 101 HD2 LYS A 8 0.850 5.589 8.645 1.00 0.00 H ATOM 102 HD3 LYS A 8 1.769 7.001 8.157 1.00 0.00 H ATOM 103 HE2 LYS A 8 1.183 7.368 10.450 1.00 0.00 H ATOM 104 HE3 LYS A 8 0.194 8.491 9.523 1.00 0.00 H ATOM 105 HZ1 LYS A 8 -1.114 7.329 11.230 1.00 0.00 H ATOM 106 HZ2 LYS A 8 -1.681 6.895 9.742 1.00 0.00 H ATOM 107 HZ3 LYS A 8 -0.738 5.851 10.599 1.00 0.00 H ATOM 108 N LEU A 9 -2.263 4.588 5.583 1.00 0.00 N ATOM 109 CA LEU A 9 -3.639 4.024 5.706 1.00 0.00 C ATOM 110 C LEU A 9 -3.954 2.947 4.611 1.00 0.00 C ATOM 111 O LEU A 9 -4.598 1.950 4.949 1.00 0.00 O ATOM 112 CB LEU A 9 -4.667 5.195 5.812 1.00 0.00 C ATOM 113 CG LEU A 9 -6.165 4.819 5.994 1.00 0.00 C ATOM 114 CD1 LEU A 9 -6.450 4.085 7.321 1.00 0.00 C ATOM 115 CD2 LEU A 9 -7.055 6.073 5.893 1.00 0.00 C ATOM 116 H LEU A 9 -2.078 5.461 5.077 1.00 0.00 H ATOM 117 HA LEU A 9 -3.698 3.494 6.677 1.00 0.00 H ATOM 118 HB2 LEU A 9 -4.383 5.856 6.659 1.00 0.00 H ATOM 119 HB3 LEU A 9 -4.575 5.844 4.920 1.00 0.00 H ATOM 120 HG LEU A 9 -6.462 4.147 5.166 1.00 0.00 H ATOM 121 HD11 LEU A 9 -7.522 3.837 7.429 1.00 0.00 H ATOM 122 HD12 LEU A 9 -5.901 3.128 7.385 1.00 0.00 H ATOM 123 HD13 LEU A 9 -6.161 4.690 8.201 1.00 0.00 H ATOM 124 HD21 LEU A 9 -8.129 5.819 5.970 1.00 0.00 H ATOM 125 HD22 LEU A 9 -6.834 6.807 6.691 1.00 0.00 H ATOM 126 HD23 LEU A 9 -6.922 6.591 4.925 1.00 0.00 H ATOM 127 N ILE A 10 -3.538 3.129 3.334 1.00 0.00 N ATOM 128 CA ILE A 10 -3.773 2.144 2.239 1.00 0.00 C ATOM 129 C ILE A 10 -2.446 1.364 1.964 1.00 0.00 C ATOM 130 O ILE A 10 -1.332 1.889 2.092 1.00 0.00 O ATOM 131 CB ILE A 10 -4.432 2.789 0.963 1.00 0.00 C ATOM 132 CG1 ILE A 10 -3.809 4.091 0.370 1.00 0.00 C ATOM 133 CG2 ILE A 10 -5.943 3.036 1.201 1.00 0.00 C ATOM 134 CD1 ILE A 10 -2.393 3.969 -0.207 1.00 0.00 C ATOM 135 H ILE A 10 -2.846 3.872 3.191 1.00 0.00 H ATOM 136 HA ILE A 10 -4.498 1.385 2.599 1.00 0.00 H ATOM 137 HB ILE A 10 -4.392 2.029 0.158 1.00 0.00 H ATOM 138 HG12 ILE A 10 -4.453 4.457 -0.452 1.00 0.00 H ATOM 139 HG13 ILE A 10 -3.826 4.903 1.122 1.00 0.00 H ATOM 140 HG21 ILE A 10 -6.121 3.798 1.983 1.00 0.00 H ATOM 141 HG22 ILE A 10 -6.457 3.381 0.284 1.00 0.00 H ATOM 142 HG23 ILE A 10 -6.465 2.115 1.521 1.00 0.00 H ATOM 143 HD11 ILE A 10 -1.635 3.854 0.586 1.00 0.00 H ATOM 144 HD12 ILE A 10 -2.299 3.106 -0.891 1.00 0.00 H ATOM 145 HD13 ILE A 10 -2.117 4.873 -0.780 1.00 0.00 H ATOM 146 N ASP A 11 -2.584 0.083 1.581 1.00 0.00 N ATOM 147 CA ASP A 11 -1.429 -0.807 1.287 1.00 0.00 C ATOM 148 C ASP A 11 -0.727 -0.517 -0.081 1.00 0.00 C ATOM 149 O ASP A 11 0.480 -0.253 -0.089 1.00 0.00 O ATOM 150 CB ASP A 11 -1.905 -2.279 1.480 1.00 0.00 C ATOM 151 CG ASP A 11 -0.823 -3.348 1.248 1.00 0.00 C ATOM 152 OD1 ASP A 11 -0.830 -4.002 0.202 1.00 0.00 O ATOM 153 H ASP A 11 -3.552 -0.252 1.533 1.00 0.00 H ATOM 154 HA ASP A 11 -0.665 -0.631 2.072 1.00 0.00 H ATOM 155 HB2 ASP A 11 -2.329 -2.415 2.494 1.00 0.00 H ATOM 156 HB3 ASP A 11 -2.748 -2.493 0.795 1.00 0.00 H ATOM 157 N THR A 12 -1.463 -0.581 -1.209 1.00 0.00 N ATOM 158 CA THR A 12 -0.900 -0.341 -2.566 1.00 0.00 C ATOM 159 C THR A 12 -0.742 1.182 -2.872 1.00 0.00 C ATOM 160 O THR A 12 -1.718 1.882 -3.157 1.00 0.00 O ATOM 161 CB THR A 12 -1.708 -1.144 -3.635 1.00 0.00 C ATOM 162 OG1 THR A 12 -1.095 -0.990 -4.910 1.00 0.00 O ATOM 163 CG2 THR A 12 -3.206 -0.817 -3.804 1.00 0.00 C ATOM 164 H THR A 12 -2.453 -0.804 -1.065 1.00 0.00 H ATOM 165 HA THR A 12 0.107 -0.809 -2.594 1.00 0.00 H ATOM 166 HB THR A 12 -1.639 -2.217 -3.370 1.00 0.00 H ATOM 167 HG1 THR A 12 -1.668 -1.442 -5.533 1.00 0.00 H ATOM 168 HG21 THR A 12 -3.763 -0.930 -2.856 1.00 0.00 H ATOM 169 HG22 THR A 12 -3.370 0.215 -4.163 1.00 0.00 H ATOM 170 HG23 THR A 12 -3.683 -1.493 -4.538 1.00 0.00 H ATOM 171 N THR A 13 0.508 1.678 -2.803 1.00 0.00 N ATOM 172 CA THR A 13 0.843 3.104 -3.083 1.00 0.00 C ATOM 173 C THR A 13 1.330 3.219 -4.561 1.00 0.00 C ATOM 174 O THR A 13 2.533 3.238 -4.842 1.00 0.00 O ATOM 175 CB THR A 13 1.874 3.672 -2.058 1.00 0.00 C ATOM 176 OG1 THR A 13 3.066 2.890 -2.026 1.00 0.00 O ATOM 177 CG2 THR A 13 1.349 3.805 -0.620 1.00 0.00 C ATOM 178 H THR A 13 1.228 0.998 -2.538 1.00 0.00 H ATOM 179 HA THR A 13 -0.062 3.737 -2.975 1.00 0.00 H ATOM 180 HB THR A 13 2.154 4.693 -2.384 1.00 0.00 H ATOM 181 HG1 THR A 13 3.405 2.891 -2.926 1.00 0.00 H ATOM 182 HG21 THR A 13 2.122 4.231 0.045 1.00 0.00 H ATOM 183 HG22 THR A 13 0.472 4.474 -0.568 1.00 0.00 H ATOM 184 HG23 THR A 13 1.053 2.827 -0.195 1.00 0.00 H ATOM 185 N ALA A 14 0.367 3.279 -5.501 1.00 0.00 N ATOM 186 CA ALA A 14 0.653 3.382 -6.953 1.00 0.00 C ATOM 187 C ALA A 14 -0.478 4.185 -7.627 1.00 0.00 C ATOM 188 O ALA A 14 -1.637 3.783 -7.744 1.00 0.00 O ATOM 189 CB ALA A 14 0.801 1.976 -7.571 1.00 0.00 C ATOM 190 OXT ALA A 14 -0.049 5.405 -8.080 1.00 0.00 O ATOM 191 H ALA A 14 -0.584 3.155 -5.137 1.00 0.00 H ATOM 192 HA ALA A 14 1.606 3.924 -7.115 1.00 0.00 H ATOM 193 HB1 ALA A 14 1.642 1.419 -7.117 1.00 0.00 H ATOM 194 HB2 ALA A 14 -0.109 1.359 -7.438 1.00 0.00 H ATOM 195 HB3 ALA A 14 1.006 2.028 -8.657 1.00 0.00 H ATOM 196 HXT ALA A 14 -0.764 5.892 -8.494 1.00 0.00 H TER 197 ALA A 14