HETATM 1 C ACE A 1 5.198 -4.723 -10.955 1.00 0.00 C HETATM 2 O ACE A 1 6.182 -5.436 -11.164 1.00 0.00 O HETATM 3 CH3 ACE A 1 3.844 -5.076 -11.563 1.00 0.00 C HETATM 4 H1 ACE A 1 3.079 -5.242 -10.782 1.00 0.00 H HETATM 5 H2 ACE A 1 3.480 -4.277 -12.235 1.00 0.00 H HETATM 6 H3 ACE A 1 3.907 -6.004 -12.162 1.00 0.00 H ATOM 7 N ILE A 2 5.217 -3.610 -10.209 1.00 0.00 N ATOM 8 CA ILE A 2 6.444 -3.094 -9.527 1.00 0.00 C ATOM 9 C ILE A 2 6.179 -2.759 -8.023 1.00 0.00 C ATOM 10 O ILE A 2 6.902 -3.275 -7.165 1.00 0.00 O ATOM 11 CB ILE A 2 7.219 -1.968 -10.309 1.00 0.00 C ATOM 12 CG1 ILE A 2 6.466 -0.642 -10.648 1.00 0.00 C ATOM 13 CG2 ILE A 2 7.986 -2.519 -11.537 1.00 0.00 C ATOM 14 CD1 ILE A 2 5.425 -0.657 -11.786 1.00 0.00 C ATOM 15 H ILE A 2 4.311 -3.135 -10.135 1.00 0.00 H ATOM 16 HA ILE A 2 7.165 -3.936 -9.460 1.00 0.00 H ATOM 17 HB ILE A 2 8.027 -1.652 -9.621 1.00 0.00 H ATOM 18 HG12 ILE A 2 5.987 -0.243 -9.736 1.00 0.00 H ATOM 19 HG13 ILE A 2 7.221 0.124 -10.907 1.00 0.00 H ATOM 20 HG21 ILE A 2 8.618 -1.744 -12.009 1.00 0.00 H ATOM 21 HG22 ILE A 2 8.658 -3.352 -11.258 1.00 0.00 H ATOM 22 HG23 ILE A 2 7.302 -2.904 -12.316 1.00 0.00 H ATOM 23 HD11 ILE A 2 5.866 -0.983 -12.746 1.00 0.00 H ATOM 24 HD12 ILE A 2 4.571 -1.322 -11.570 1.00 0.00 H ATOM 25 HD13 ILE A 2 5.011 0.354 -11.956 1.00 0.00 H ATOM 26 N TRP A 3 5.177 -1.917 -7.689 1.00 0.00 N ATOM 27 CA TRP A 3 4.856 -1.544 -6.282 1.00 0.00 C ATOM 28 C TRP A 3 3.971 -2.618 -5.574 1.00 0.00 C ATOM 29 O TRP A 3 4.430 -3.213 -4.594 1.00 0.00 O ATOM 30 CB TRP A 3 4.272 -0.101 -6.275 1.00 0.00 C ATOM 31 CG TRP A 3 4.117 0.576 -4.902 1.00 0.00 C ATOM 32 CD1 TRP A 3 5.130 0.718 -3.925 1.00 0.00 C ATOM 33 CD2 TRP A 3 3.039 1.305 -4.419 1.00 0.00 C ATOM 34 NE1 TRP A 3 4.711 1.513 -2.843 1.00 0.00 N ATOM 35 CE2 TRP A 3 3.420 1.881 -3.178 1.00 0.00 C ATOM 36 CE3 TRP A 3 1.762 1.583 -4.974 1.00 0.00 C ATOM 37 CZ2 TRP A 3 2.538 2.756 -2.501 1.00 0.00 C ATOM 38 CZ3 TRP A 3 0.900 2.429 -4.273 1.00 0.00 C ATOM 39 CH2 TRP A 3 1.285 3.011 -3.059 1.00 0.00 C ATOM 40 H TRP A 3 4.640 -1.549 -8.479 1.00 0.00 H ATOM 41 HA TRP A 3 5.809 -1.492 -5.719 1.00 0.00 H ATOM 42 HB2 TRP A 3 4.921 0.562 -6.880 1.00 0.00 H ATOM 43 HB3 TRP A 3 3.302 -0.093 -6.808 1.00 0.00 H ATOM 44 HD1 TRP A 3 6.125 0.307 -4.014 1.00 0.00 H ATOM 45 HE1 TRP A 3 5.250 1.793 -2.016 1.00 0.00 H ATOM 46 HE3 TRP A 3 1.458 1.168 -5.923 1.00 0.00 H ATOM 47 HZ2 TRP A 3 2.827 3.220 -1.569 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -0.074 2.651 -4.682 1.00 0.00 H ATOM 49 HH2 TRP A 3 0.605 3.676 -2.549 1.00 0.00 H ATOM 50 N GLY A 4 2.729 -2.858 -6.047 1.00 0.00 N ATOM 51 CA GLY A 4 1.820 -3.860 -5.443 1.00 0.00 C ATOM 52 C GLY A 4 1.059 -3.334 -4.212 1.00 0.00 C ATOM 53 O GLY A 4 -0.003 -2.721 -4.351 1.00 0.00 O ATOM 54 H GLY A 4 2.481 -2.338 -6.895 1.00 0.00 H ATOM 55 HA2 GLY A 4 1.079 -4.158 -6.207 1.00 0.00 H ATOM 56 HA3 GLY A 4 2.366 -4.797 -5.212 1.00 0.00 H ATOM 57 N ASP A 5 1.616 -3.591 -3.017 1.00 0.00 N ATOM 58 CA ASP A 5 1.016 -3.152 -1.728 1.00 0.00 C ATOM 59 C ASP A 5 1.397 -1.662 -1.377 1.00 0.00 C ATOM 60 O ASP A 5 2.347 -1.102 -1.939 1.00 0.00 O ATOM 61 CB ASP A 5 1.491 -4.179 -0.651 1.00 0.00 C ATOM 62 CG ASP A 5 0.859 -4.038 0.748 1.00 0.00 C ATOM 63 OD1 ASP A 5 1.497 -3.510 1.663 1.00 0.00 O ATOM 64 H ASP A 5 2.534 -4.047 -3.063 1.00 0.00 H ATOM 65 HA ASP A 5 -0.083 -3.265 -1.844 1.00 0.00 H ATOM 66 HB2 ASP A 5 1.314 -5.215 -1.003 1.00 0.00 H ATOM 67 HB3 ASP A 5 2.591 -4.113 -0.537 1.00 0.00 H ATOM 68 N SER A 6 0.672 -1.015 -0.433 1.00 0.00 N ATOM 69 CA SER A 6 0.952 0.384 -0.011 1.00 0.00 C ATOM 70 C SER A 6 2.264 0.576 0.818 1.00 0.00 C ATOM 71 O SER A 6 3.054 1.466 0.489 1.00 0.00 O ATOM 72 CB SER A 6 -0.292 0.925 0.734 1.00 0.00 C ATOM 73 OG SER A 6 -0.145 2.308 1.041 1.00 0.00 O ATOM 74 H SER A 6 -0.060 -1.541 0.057 1.00 0.00 H ATOM 75 HA SER A 6 1.049 0.992 -0.929 1.00 0.00 H ATOM 76 HB2 SER A 6 -1.207 0.793 0.126 1.00 0.00 H ATOM 77 HB3 SER A 6 -0.472 0.365 1.672 1.00 0.00 H ATOM 78 HG SER A 6 0.023 2.755 0.208 1.00 0.00 H ATOM 79 N GLY A 7 2.489 -0.225 1.880 1.00 0.00 N ATOM 80 CA GLY A 7 3.695 -0.108 2.739 1.00 0.00 C ATOM 81 C GLY A 7 3.635 1.028 3.786 1.00 0.00 C ATOM 82 O GLY A 7 4.517 1.890 3.811 1.00 0.00 O ATOM 83 H GLY A 7 1.782 -0.950 2.036 1.00 0.00 H ATOM 84 HA2 GLY A 7 3.848 -1.069 3.264 1.00 0.00 H ATOM 85 HA3 GLY A 7 4.600 0.013 2.112 1.00 0.00 H ATOM 86 N LYS A 8 2.597 1.014 4.643 1.00 0.00 N ATOM 87 CA LYS A 8 2.388 2.037 5.703 1.00 0.00 C ATOM 88 C LYS A 8 1.456 1.462 6.813 1.00 0.00 C ATOM 89 O LYS A 8 1.894 1.338 7.961 1.00 0.00 O ATOM 90 CB LYS A 8 1.896 3.395 5.105 1.00 0.00 C ATOM 91 CG LYS A 8 1.907 4.616 6.058 1.00 0.00 C ATOM 92 CD LYS A 8 3.281 5.063 6.609 1.00 0.00 C ATOM 93 CE LYS A 8 4.289 5.523 5.536 1.00 0.00 C ATOM 94 NZ LYS A 8 5.550 5.983 6.154 1.00 0.00 N ATOM 95 H LYS A 8 1.943 0.236 4.501 1.00 0.00 H ATOM 96 HA LYS A 8 3.371 2.216 6.180 1.00 0.00 H ATOM 97 HB2 LYS A 8 2.496 3.652 4.212 1.00 0.00 H ATOM 98 HB3 LYS A 8 0.871 3.269 4.705 1.00 0.00 H ATOM 99 HG2 LYS A 8 1.435 5.472 5.539 1.00 0.00 H ATOM 100 HG3 LYS A 8 1.237 4.409 6.913 1.00 0.00 H ATOM 101 HD2 LYS A 8 3.105 5.888 7.326 1.00 0.00 H ATOM 102 HD3 LYS A 8 3.716 4.247 7.218 1.00 0.00 H ATOM 103 HE2 LYS A 8 4.509 4.698 4.832 1.00 0.00 H ATOM 104 HE3 LYS A 8 3.855 6.339 4.926 1.00 0.00 H ATOM 105 HZ1 LYS A 8 5.398 6.772 6.793 1.00 0.00 H ATOM 106 HZ2 LYS A 8 5.999 5.240 6.702 1.00 0.00 H ATOM 107 HZ3 LYS A 8 6.234 6.292 5.454 1.00 0.00 H ATOM 108 N LEU A 9 0.188 1.131 6.482 1.00 0.00 N ATOM 109 CA LEU A 9 -0.796 0.567 7.447 1.00 0.00 C ATOM 110 C LEU A 9 -1.675 -0.512 6.744 1.00 0.00 C ATOM 111 O LEU A 9 -1.467 -1.704 6.987 1.00 0.00 O ATOM 112 CB LEU A 9 -1.560 1.632 8.307 1.00 0.00 C ATOM 113 CG LEU A 9 -1.879 3.057 7.757 1.00 0.00 C ATOM 114 CD1 LEU A 9 -2.816 3.089 6.535 1.00 0.00 C ATOM 115 CD2 LEU A 9 -2.470 3.938 8.876 1.00 0.00 C ATOM 116 H LEU A 9 -0.050 1.289 5.497 1.00 0.00 H ATOM 117 HA LEU A 9 -0.226 -0.025 8.191 1.00 0.00 H ATOM 118 HB2 LEU A 9 -2.488 1.177 8.706 1.00 0.00 H ATOM 119 HB3 LEU A 9 -0.940 1.782 9.213 1.00 0.00 H ATOM 120 HG LEU A 9 -0.926 3.527 7.454 1.00 0.00 H ATOM 121 HD11 LEU A 9 -3.774 2.570 6.730 1.00 0.00 H ATOM 122 HD12 LEU A 9 -3.060 4.124 6.230 1.00 0.00 H ATOM 123 HD13 LEU A 9 -2.349 2.616 5.653 1.00 0.00 H ATOM 124 HD21 LEU A 9 -2.642 4.976 8.534 1.00 0.00 H ATOM 125 HD22 LEU A 9 -3.439 3.550 9.244 1.00 0.00 H ATOM 126 HD23 LEU A 9 -1.792 4.004 9.747 1.00 0.00 H ATOM 127 N ILE A 10 -2.629 -0.117 5.878 1.00 0.00 N ATOM 128 CA ILE A 10 -3.533 -1.054 5.147 1.00 0.00 C ATOM 129 C ILE A 10 -2.955 -1.215 3.699 1.00 0.00 C ATOM 130 O ILE A 10 -2.881 -0.248 2.933 1.00 0.00 O ATOM 131 CB ILE A 10 -5.020 -0.562 5.320 1.00 0.00 C ATOM 132 CG1 ILE A 10 -6.080 -1.697 5.364 1.00 0.00 C ATOM 133 CG2 ILE A 10 -5.460 0.611 4.411 1.00 0.00 C ATOM 134 CD1 ILE A 10 -6.365 -2.466 4.068 1.00 0.00 C ATOM 135 H ILE A 10 -2.710 0.900 5.771 1.00 0.00 H ATOM 136 HA ILE A 10 -3.489 -2.041 5.652 1.00 0.00 H ATOM 137 HB ILE A 10 -5.093 -0.147 6.347 1.00 0.00 H ATOM 138 HG12 ILE A 10 -5.796 -2.427 6.146 1.00 0.00 H ATOM 139 HG13 ILE A 10 -7.038 -1.275 5.724 1.00 0.00 H ATOM 140 HG21 ILE A 10 -6.461 0.994 4.686 1.00 0.00 H ATOM 141 HG22 ILE A 10 -4.760 1.464 4.474 1.00 0.00 H ATOM 142 HG23 ILE A 10 -5.507 0.307 3.350 1.00 0.00 H ATOM 143 HD11 ILE A 10 -5.468 -2.986 3.691 1.00 0.00 H ATOM 144 HD12 ILE A 10 -7.148 -3.230 4.233 1.00 0.00 H ATOM 145 HD13 ILE A 10 -6.733 -1.798 3.270 1.00 0.00 H HETATM 146 N SET A 11 -2.535 -2.445 3.337 1.00 0.00 N HETATM 147 CA SET A 11 -1.913 -2.745 2.012 1.00 0.00 C HETATM 148 CB SET A 11 -2.804 -2.538 0.743 1.00 0.00 C HETATM 149 OG SET A 11 -2.427 -1.738 -0.118 1.00 0.00 O HETATM 150 NT SET A 11 -0.403 -4.470 0.878 1.00 0.00 N HETATM 151 C SET A 11 -1.229 -4.146 2.083 1.00 0.00 C HETATM 152 H SET A 11 -2.629 -3.159 4.067 1.00 0.00 H HETATM 153 HA SET A 11 -1.077 -2.024 1.910 1.00 0.00 H HETATM 154 HB2 SET A 11 -0.611 -4.213 3.007 1.00 0.00 H HETATM 155 HB3 SET A 11 -1.997 -4.930 2.236 1.00 0.00 H HETATM 156 HNT2 SET A 11 -0.775 -4.878 0.005 1.00 0.00 H ATOM 157 N THR A 12 -3.949 -3.237 0.623 1.00 0.00 N ATOM 158 CA THR A 12 -4.859 -3.131 -0.564 1.00 0.00 C ATOM 159 C THR A 12 -5.480 -1.747 -0.977 1.00 0.00 C ATOM 160 O THR A 12 -6.047 -1.658 -2.070 1.00 0.00 O ATOM 161 CB THR A 12 -5.913 -4.281 -0.488 1.00 0.00 C ATOM 162 OG1 THR A 12 -6.536 -4.452 -1.757 1.00 0.00 O ATOM 163 CG2 THR A 12 -7.026 -4.109 0.564 1.00 0.00 C ATOM 164 H THR A 12 -4.021 -4.021 1.279 1.00 0.00 H ATOM 165 HA THR A 12 -4.216 -3.377 -1.427 1.00 0.00 H ATOM 166 HB THR A 12 -5.391 -5.232 -0.266 1.00 0.00 H ATOM 167 HG1 THR A 12 -6.911 -3.597 -1.986 1.00 0.00 H ATOM 168 HG21 THR A 12 -7.624 -3.195 0.391 1.00 0.00 H ATOM 169 HG22 THR A 12 -7.725 -4.965 0.552 1.00 0.00 H ATOM 170 HG23 THR A 12 -6.612 -4.044 1.586 1.00 0.00 H ATOM 171 N THR A 13 -5.392 -0.699 -0.140 1.00 0.00 N ATOM 172 CA THR A 13 -5.926 0.655 -0.459 1.00 0.00 C ATOM 173 C THR A 13 -4.956 1.706 0.158 1.00 0.00 C ATOM 174 O THR A 13 -4.883 1.872 1.380 1.00 0.00 O ATOM 175 CB THR A 13 -7.433 0.831 -0.097 1.00 0.00 C ATOM 176 OG1 THR A 13 -7.880 2.100 -0.560 1.00 0.00 O ATOM 177 CG2 THR A 13 -7.837 0.703 1.382 1.00 0.00 C ATOM 178 H THR A 13 -4.762 -0.872 0.649 1.00 0.00 H ATOM 179 HA THR A 13 -5.894 0.780 -1.562 1.00 0.00 H ATOM 180 HB THR A 13 -8.001 0.061 -0.655 1.00 0.00 H ATOM 181 HG1 THR A 13 -8.801 2.170 -0.299 1.00 0.00 H ATOM 182 HG21 THR A 13 -7.539 -0.275 1.798 1.00 0.00 H ATOM 183 HG22 THR A 13 -7.374 1.487 2.009 1.00 0.00 H ATOM 184 HG23 THR A 13 -8.931 0.788 1.511 1.00 0.00 H ATOM 185 N ALA A 14 -4.208 2.414 -0.708 1.00 0.00 N ATOM 186 CA ALA A 14 -3.235 3.449 -0.283 1.00 0.00 C ATOM 187 C ALA A 14 -3.927 4.803 0.000 1.00 0.00 C ATOM 188 O ALA A 14 -4.490 5.484 -0.858 1.00 0.00 O ATOM 189 CB ALA A 14 -2.160 3.586 -1.377 1.00 0.00 C ATOM 190 OXT ALA A 14 -3.847 5.158 1.321 1.00 0.00 O ATOM 191 H ALA A 14 -4.323 2.141 -1.689 1.00 0.00 H ATOM 192 HA ALA A 14 -2.718 3.111 0.638 1.00 0.00 H ATOM 193 HB1 ALA A 14 -1.640 2.628 -1.567 1.00 0.00 H ATOM 194 HB2 ALA A 14 -2.581 3.926 -2.343 1.00 0.00 H ATOM 195 HB3 ALA A 14 -1.381 4.316 -1.087 1.00 0.00 H ATOM 196 HXT ALA A 14 -4.289 5.994 1.482 1.00 0.00 H TER 197 ALA A 14