HETATM 1 C ACE A 1 -8.151 2.311 -3.357 1.00 0.00 C HETATM 2 O ACE A 1 -8.259 1.781 -4.465 1.00 0.00 O HETATM 3 CH3 ACE A 1 -9.340 3.022 -2.719 1.00 0.00 C HETATM 4 H1 ACE A 1 -9.118 4.087 -2.520 1.00 0.00 H HETATM 5 H2 ACE A 1 -10.224 2.990 -3.382 1.00 0.00 H HETATM 6 H3 ACE A 1 -9.630 2.547 -1.763 1.00 0.00 H ATOM 7 N ILE A 2 -7.024 2.308 -2.632 1.00 0.00 N ATOM 8 CA ILE A 2 -5.760 1.659 -3.091 1.00 0.00 C ATOM 9 C ILE A 2 -5.774 0.121 -2.815 1.00 0.00 C ATOM 10 O ILE A 2 -6.159 -0.334 -1.735 1.00 0.00 O ATOM 11 CB ILE A 2 -4.467 2.375 -2.543 1.00 0.00 C ATOM 12 CG1 ILE A 2 -4.416 2.818 -1.047 1.00 0.00 C ATOM 13 CG2 ILE A 2 -4.105 3.602 -3.417 1.00 0.00 C ATOM 14 CD1 ILE A 2 -4.560 1.710 0.004 1.00 0.00 C ATOM 15 H ILE A 2 -7.095 2.779 -1.724 1.00 0.00 H ATOM 16 HA ILE A 2 -5.724 1.776 -4.195 1.00 0.00 H ATOM 17 HB ILE A 2 -3.626 1.671 -2.687 1.00 0.00 H ATOM 18 HG12 ILE A 2 -3.445 3.314 -0.855 1.00 0.00 H ATOM 19 HG13 ILE A 2 -5.176 3.597 -0.850 1.00 0.00 H ATOM 20 HG21 ILE A 2 -4.003 3.331 -4.484 1.00 0.00 H ATOM 21 HG22 ILE A 2 -4.872 4.397 -3.353 1.00 0.00 H ATOM 22 HG23 ILE A 2 -3.139 4.051 -3.119 1.00 0.00 H ATOM 23 HD11 ILE A 2 -4.310 2.081 1.015 1.00 0.00 H ATOM 24 HD12 ILE A 2 -5.592 1.321 0.055 1.00 0.00 H ATOM 25 HD13 ILE A 2 -3.889 0.859 -0.210 1.00 0.00 H ATOM 26 N TRP A 3 -5.366 -0.675 -3.822 1.00 0.00 N ATOM 27 CA TRP A 3 -5.324 -2.162 -3.727 1.00 0.00 C ATOM 28 C TRP A 3 -4.065 -2.725 -4.444 1.00 0.00 C ATOM 29 O TRP A 3 -3.503 -2.136 -5.376 1.00 0.00 O ATOM 30 CB TRP A 3 -6.612 -2.812 -4.316 1.00 0.00 C ATOM 31 CG TRP A 3 -7.830 -2.753 -3.391 1.00 0.00 C ATOM 32 CD1 TRP A 3 -8.786 -1.727 -3.389 1.00 0.00 C ATOM 33 CD2 TRP A 3 -8.225 -3.634 -2.402 1.00 0.00 C ATOM 34 NE1 TRP A 3 -9.788 -1.940 -2.425 1.00 0.00 N ATOM 35 CE2 TRP A 3 -9.420 -3.135 -1.825 1.00 0.00 C ATOM 36 CE3 TRP A 3 -7.646 -4.839 -1.928 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -10.047 -3.841 -0.771 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -8.285 -5.520 -0.891 1.00 0.00 C ATOM 39 CH2 TRP A 3 -9.469 -5.031 -0.323 1.00 0.00 C ATOM 40 H TRP A 3 -5.070 -0.181 -4.671 1.00 0.00 H ATOM 41 HA TRP A 3 -5.246 -2.453 -2.657 1.00 0.00 H ATOM 42 HB2 TRP A 3 -6.856 -2.365 -5.299 1.00 0.00 H ATOM 43 HB3 TRP A 3 -6.435 -3.880 -4.547 1.00 0.00 H ATOM 44 HD1 TRP A 3 -8.707 -0.866 -4.030 1.00 0.00 H ATOM 45 HE1 TRP A 3 -10.592 -1.343 -2.204 1.00 0.00 H ATOM 46 HE3 TRP A 3 -6.731 -5.224 -2.355 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -10.955 -3.469 -0.319 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -7.858 -6.439 -0.518 1.00 0.00 H ATOM 49 HH2 TRP A 3 -9.938 -5.579 0.480 1.00 0.00 H ATOM 50 N GLY A 4 -3.651 -3.915 -3.980 1.00 0.00 N ATOM 51 CA GLY A 4 -2.472 -4.632 -4.522 1.00 0.00 C ATOM 52 C GLY A 4 -1.153 -4.117 -3.921 1.00 0.00 C ATOM 53 O GLY A 4 -0.792 -4.504 -2.805 1.00 0.00 O ATOM 54 H GLY A 4 -4.290 -4.305 -3.276 1.00 0.00 H ATOM 55 HA2 GLY A 4 -2.571 -5.705 -4.278 1.00 0.00 H ATOM 56 HA3 GLY A 4 -2.463 -4.596 -5.630 1.00 0.00 H HETATM 57 N SET A 5 -0.446 -3.258 -4.678 1.00 0.00 N HETATM 58 CA SET A 5 0.831 -2.650 -4.221 1.00 0.00 C HETATM 59 CB SET A 5 0.806 -1.144 -4.608 1.00 0.00 C HETATM 60 OG SET A 5 1.299 -0.756 -5.672 1.00 0.00 O HETATM 61 NT SET A 5 3.191 -3.379 -3.774 1.00 0.00 N HETATM 62 C SET A 5 2.069 -3.449 -4.742 1.00 0.00 C HETATM 63 H SET A 5 -0.892 -2.994 -5.564 1.00 0.00 H HETATM 64 HA SET A 5 0.848 -2.695 -3.116 1.00 0.00 H HETATM 65 HB2 SET A 5 1.806 -4.507 -4.943 1.00 0.00 H HETATM 66 HB3 SET A 5 2.407 -3.069 -5.725 1.00 0.00 H HETATM 67 HNT2 SET A 5 3.692 -2.501 -3.600 1.00 0.00 H ATOM 68 N SER A 6 0.206 -0.305 -3.737 1.00 0.00 N ATOM 69 CA SER A 6 0.076 1.158 -3.966 1.00 0.00 C ATOM 70 C SER A 6 -0.089 1.835 -2.580 1.00 0.00 C ATOM 71 O SER A 6 -1.133 1.702 -1.932 1.00 0.00 O ATOM 72 CB SER A 6 -1.133 1.501 -4.877 1.00 0.00 C ATOM 73 OG SER A 6 -0.925 1.062 -6.215 1.00 0.00 O ATOM 74 H SER A 6 -0.033 -0.718 -2.828 1.00 0.00 H ATOM 75 HA SER A 6 0.991 1.540 -4.464 1.00 0.00 H ATOM 76 HB2 SER A 6 -2.066 1.051 -4.484 1.00 0.00 H ATOM 77 HB3 SER A 6 -1.305 2.594 -4.892 1.00 0.00 H ATOM 78 HG SER A 6 -1.732 1.263 -6.696 1.00 0.00 H ATOM 79 N GLY A 7 0.943 2.564 -2.132 1.00 0.00 N ATOM 80 CA GLY A 7 0.902 3.256 -0.826 1.00 0.00 C ATOM 81 C GLY A 7 2.110 4.186 -0.657 1.00 0.00 C ATOM 82 O GLY A 7 2.093 5.310 -1.166 1.00 0.00 O ATOM 83 H GLY A 7 1.745 2.630 -2.769 1.00 0.00 H ATOM 84 HA2 GLY A 7 -0.021 3.863 -0.746 1.00 0.00 H ATOM 85 HA3 GLY A 7 0.838 2.514 -0.005 1.00 0.00 H ATOM 86 N LYS A 8 3.140 3.723 0.076 1.00 0.00 N ATOM 87 CA LYS A 8 4.377 4.521 0.317 1.00 0.00 C ATOM 88 C LYS A 8 5.551 3.539 0.611 1.00 0.00 C ATOM 89 O LYS A 8 6.222 3.114 -0.334 1.00 0.00 O ATOM 90 CB LYS A 8 4.138 5.667 1.353 1.00 0.00 C ATOM 91 CG LYS A 8 5.303 6.674 1.479 1.00 0.00 C ATOM 92 CD LYS A 8 5.014 7.801 2.494 1.00 0.00 C ATOM 93 CE LYS A 8 6.163 8.812 2.687 1.00 0.00 C ATOM 94 NZ LYS A 8 6.352 9.699 1.516 1.00 0.00 N ATOM 95 H LYS A 8 3.064 2.724 0.309 1.00 0.00 H ATOM 96 HA LYS A 8 4.644 5.017 -0.639 1.00 0.00 H ATOM 97 HB2 LYS A 8 3.229 6.233 1.069 1.00 0.00 H ATOM 98 HB3 LYS A 8 3.902 5.235 2.345 1.00 0.00 H ATOM 99 HG2 LYS A 8 6.227 6.141 1.775 1.00 0.00 H ATOM 100 HG3 LYS A 8 5.516 7.109 0.484 1.00 0.00 H ATOM 101 HD2 LYS A 8 4.083 8.334 2.218 1.00 0.00 H ATOM 102 HD3 LYS A 8 4.796 7.341 3.477 1.00 0.00 H ATOM 103 HE2 LYS A 8 5.952 9.436 3.577 1.00 0.00 H ATOM 104 HE3 LYS A 8 7.108 8.283 2.918 1.00 0.00 H ATOM 105 HZ1 LYS A 8 7.107 10.379 1.663 1.00 0.00 H ATOM 106 HZ2 LYS A 8 6.588 9.168 0.670 1.00 0.00 H ATOM 107 HZ3 LYS A 8 5.503 10.235 1.302 1.00 0.00 H ATOM 108 N LEU A 9 5.803 3.177 1.888 1.00 0.00 N ATOM 109 CA LEU A 9 6.902 2.244 2.273 1.00 0.00 C ATOM 110 C LEU A 9 6.514 0.730 2.162 1.00 0.00 C ATOM 111 O LEU A 9 7.355 -0.046 1.699 1.00 0.00 O ATOM 112 CB LEU A 9 7.484 2.686 3.653 1.00 0.00 C ATOM 113 CG LEU A 9 8.692 1.881 4.215 1.00 0.00 C ATOM 114 CD1 LEU A 9 9.956 1.993 3.338 1.00 0.00 C ATOM 115 CD2 LEU A 9 9.018 2.326 5.654 1.00 0.00 C ATOM 116 H LEU A 9 5.181 3.599 2.586 1.00 0.00 H ATOM 117 HA LEU A 9 7.730 2.393 1.551 1.00 0.00 H ATOM 118 HB2 LEU A 9 7.793 3.753 3.596 1.00 0.00 H ATOM 119 HB3 LEU A 9 6.676 2.679 4.409 1.00 0.00 H ATOM 120 HG LEU A 9 8.408 0.813 4.265 1.00 0.00 H ATOM 121 HD11 LEU A 9 10.292 3.041 3.224 1.00 0.00 H ATOM 122 HD12 LEU A 9 10.801 1.421 3.764 1.00 0.00 H ATOM 123 HD13 LEU A 9 9.788 1.590 2.323 1.00 0.00 H ATOM 124 HD21 LEU A 9 9.320 3.390 5.704 1.00 0.00 H ATOM 125 HD22 LEU A 9 8.149 2.200 6.326 1.00 0.00 H ATOM 126 HD23 LEU A 9 9.842 1.731 6.089 1.00 0.00 H ATOM 127 N ILE A 10 5.300 0.296 2.579 1.00 0.00 N ATOM 128 CA ILE A 10 4.866 -1.130 2.488 1.00 0.00 C ATOM 129 C ILE A 10 3.958 -1.320 1.232 1.00 0.00 C ATOM 130 O ILE A 10 3.145 -0.454 0.885 1.00 0.00 O ATOM 131 CB ILE A 10 4.186 -1.654 3.803 1.00 0.00 C ATOM 132 CG1 ILE A 10 2.911 -0.879 4.256 1.00 0.00 C ATOM 133 CG2 ILE A 10 5.208 -1.782 4.961 1.00 0.00 C ATOM 134 CD1 ILE A 10 1.960 -1.683 5.157 1.00 0.00 C ATOM 135 H ILE A 10 4.597 1.022 2.751 1.00 0.00 H ATOM 136 HA ILE A 10 5.764 -1.767 2.343 1.00 0.00 H ATOM 137 HB ILE A 10 3.867 -2.691 3.579 1.00 0.00 H ATOM 138 HG12 ILE A 10 3.191 0.067 4.756 1.00 0.00 H ATOM 139 HG13 ILE A 10 2.326 -0.566 3.372 1.00 0.00 H ATOM 140 HG21 ILE A 10 6.086 -2.386 4.667 1.00 0.00 H ATOM 141 HG22 ILE A 10 5.587 -0.796 5.290 1.00 0.00 H ATOM 142 HG23 ILE A 10 4.770 -2.276 5.848 1.00 0.00 H ATOM 143 HD11 ILE A 10 1.055 -1.097 5.401 1.00 0.00 H ATOM 144 HD12 ILE A 10 1.621 -2.611 4.660 1.00 0.00 H ATOM 145 HD13 ILE A 10 2.435 -1.969 6.112 1.00 0.00 H ATOM 146 N ASP A 11 4.092 -2.484 0.569 1.00 0.00 N ATOM 147 CA ASP A 11 3.290 -2.816 -0.639 1.00 0.00 C ATOM 148 C ASP A 11 1.816 -3.206 -0.290 1.00 0.00 C ATOM 149 O ASP A 11 0.909 -2.478 -0.702 1.00 0.00 O ATOM 150 CB ASP A 11 4.068 -3.843 -1.519 1.00 0.00 C ATOM 151 CG ASP A 11 3.322 -4.288 -2.793 1.00 0.00 C ATOM 152 OD1 ASP A 11 2.793 -5.402 -2.824 1.00 0.00 O ATOM 153 H ASP A 11 4.773 -3.135 0.972 1.00 0.00 H ATOM 154 HA ASP A 11 3.226 -1.897 -1.257 1.00 0.00 H ATOM 155 HB2 ASP A 11 5.056 -3.431 -1.804 1.00 0.00 H ATOM 156 HB3 ASP A 11 4.301 -4.746 -0.923 1.00 0.00 H ATOM 157 N THR A 12 1.579 -4.308 0.458 1.00 0.00 N ATOM 158 CA THR A 12 0.209 -4.775 0.828 1.00 0.00 C ATOM 159 C THR A 12 -0.582 -3.717 1.667 1.00 0.00 C ATOM 160 O THR A 12 -0.292 -3.478 2.843 1.00 0.00 O ATOM 161 CB THR A 12 0.268 -6.203 1.452 1.00 0.00 C ATOM 162 OG1 THR A 12 -1.054 -6.707 1.609 1.00 0.00 O ATOM 163 CG2 THR A 12 0.994 -6.359 2.803 1.00 0.00 C ATOM 164 H THR A 12 2.421 -4.804 0.769 1.00 0.00 H ATOM 165 HA THR A 12 -0.322 -4.926 -0.135 1.00 0.00 H ATOM 166 HB THR A 12 0.784 -6.867 0.731 1.00 0.00 H ATOM 167 HG1 THR A 12 -1.440 -6.735 0.730 1.00 0.00 H ATOM 168 HG21 THR A 12 2.037 -5.996 2.756 1.00 0.00 H ATOM 169 HG22 THR A 12 0.486 -5.806 3.614 1.00 0.00 H ATOM 170 HG23 THR A 12 1.033 -7.419 3.113 1.00 0.00 H ATOM 171 N THR A 13 -1.558 -3.070 1.007 1.00 0.00 N ATOM 172 CA THR A 13 -2.400 -2.004 1.609 1.00 0.00 C ATOM 173 C THR A 13 -3.805 -2.108 0.948 1.00 0.00 C ATOM 174 O THR A 13 -3.974 -1.849 -0.249 1.00 0.00 O ATOM 175 CB THR A 13 -1.787 -0.576 1.429 1.00 0.00 C ATOM 176 OG1 THR A 13 -1.445 -0.329 0.068 1.00 0.00 O ATOM 177 CG2 THR A 13 -0.538 -0.285 2.277 1.00 0.00 C ATOM 178 H THR A 13 -1.741 -3.409 0.058 1.00 0.00 H ATOM 179 HA THR A 13 -2.496 -2.183 2.700 1.00 0.00 H ATOM 180 HB THR A 13 -2.549 0.167 1.731 1.00 0.00 H ATOM 181 HG1 THR A 13 -0.767 -0.973 -0.152 1.00 0.00 H ATOM 182 HG21 THR A 13 -0.724 -0.455 3.353 1.00 0.00 H ATOM 183 HG22 THR A 13 0.317 -0.921 1.983 1.00 0.00 H ATOM 184 HG23 THR A 13 -0.212 0.765 2.162 1.00 0.00 H ATOM 185 N ALA A 14 -4.807 -2.499 1.752 1.00 0.00 N ATOM 186 CA ALA A 14 -6.212 -2.647 1.295 1.00 0.00 C ATOM 187 C ALA A 14 -7.002 -1.317 1.348 1.00 0.00 C ATOM 188 O ALA A 14 -6.815 -0.425 2.178 1.00 0.00 O ATOM 189 CB ALA A 14 -6.887 -3.710 2.179 1.00 0.00 C ATOM 190 OXT ALA A 14 -7.956 -1.250 0.368 1.00 0.00 O ATOM 191 H ALA A 14 -4.502 -2.773 2.691 1.00 0.00 H ATOM 192 HA ALA A 14 -6.227 -3.022 0.252 1.00 0.00 H ATOM 193 HB1 ALA A 14 -7.939 -3.876 1.881 1.00 0.00 H ATOM 194 HB2 ALA A 14 -6.381 -4.691 2.100 1.00 0.00 H ATOM 195 HB3 ALA A 14 -6.897 -3.427 3.249 1.00 0.00 H ATOM 196 HXT ALA A 14 -8.428 -0.416 0.398 1.00 0.00 H TER 197 ALA A 14