HETATM 1 C ACE A 1 -7.114 11.096 -6.898 1.00 0.00 C HETATM 2 O ACE A 1 -7.474 11.080 -5.721 1.00 0.00 O HETATM 3 CH3 ACE A 1 -6.501 12.321 -7.486 1.00 0.00 C HETATM 4 H1 ACE A 1 -5.459 12.390 -7.173 1.00 0.00 H HETATM 5 H2 ACE A 1 -6.552 12.266 -8.573 1.00 0.00 H HETATM 6 H3 ACE A 1 -7.044 13.200 -7.140 1.00 0.00 H ATOM 7 N ILE A 2 -7.230 10.073 -7.731 1.00 0.00 N ATOM 8 CA ILE A 2 -7.810 8.814 -7.295 1.00 0.00 C ATOM 9 C ILE A 2 -6.963 7.656 -7.826 1.00 0.00 C ATOM 10 O ILE A 2 -7.495 6.699 -8.387 1.00 0.00 O ATOM 11 CB ILE A 2 -9.284 8.734 -7.700 1.00 0.00 C ATOM 12 CG1 ILE A 2 -9.448 8.921 -9.210 1.00 0.00 C ATOM 13 CG2 ILE A 2 -10.125 9.734 -6.903 1.00 0.00 C ATOM 14 CD1 ILE A 2 -9.160 10.366 -9.618 1.00 0.00 C ATOM 15 H ILE A 2 -6.935 10.094 -8.686 1.00 0.00 H ATOM 16 HA ILE A 2 -7.774 8.798 -6.206 1.00 0.00 H ATOM 17 HB ILE A 2 -9.651 7.737 -7.457 1.00 0.00 H ATOM 18 HG13 ILE A 2 -10.462 8.651 -9.504 1.00 0.00 H ATOM 19 HG21 ILE A 2 -10.903 10.146 -7.545 1.00 0.00 H ATOM 20 HG22 ILE A 2 -10.586 9.226 -6.055 1.00 0.00 H ATOM 21 HG23 ILE A 2 -9.487 10.539 -6.542 1.00 0.00 H ATOM 22 HD11 ILE A 2 -9.123 10.995 -8.728 1.00 0.00 H ATOM 23 HD12 ILE A 2 -8.203 10.414 -10.137 1.00 0.00 H ATOM 24 HD13 ILE A 2 -9.951 10.721 -10.279 1.00 0.00 H ATOM 25 N TRP A 3 -5.659 7.780 -7.629 1.00 0.00 N ATOM 26 CA TRP A 3 -4.733 6.754 -8.081 1.00 0.00 C ATOM 27 C TRP A 3 -5.033 5.471 -7.305 1.00 0.00 C ATOM 28 O TRP A 3 -5.622 5.517 -6.227 1.00 0.00 O ATOM 29 CB TRP A 3 -3.283 7.220 -7.929 1.00 0.00 C ATOM 30 CG TRP A 3 -2.706 7.879 -9.184 1.00 0.00 C ATOM 31 CD1 TRP A 3 -2.050 9.044 -9.277 1.00 0.00 C ATOM 32 CD2 TRP A 3 -2.761 7.361 -10.529 1.00 0.00 C ATOM 33 NE1 TRP A 3 -1.679 9.313 -10.578 1.00 0.00 N ATOM 34 CE2 TRP A 3 -2.125 8.257 -11.365 1.00 0.00 C ATOM 35 CE3 TRP A 3 -3.329 6.174 -11.026 1.00 0.00 C ATOM 36 CZ2 TRP A 3 -1.998 8.061 -12.745 1.00 0.00 C ATOM 37 CZ3 TRP A 3 -3.192 5.993 -12.407 1.00 0.00 C ATOM 38 CH2 TRP A 3 -2.555 6.885 -13.261 1.00 0.00 C ATOM 39 H TRP A 3 -5.233 8.561 -7.172 1.00 0.00 H ATOM 40 HA TRP A 3 -4.905 6.596 -9.146 1.00 0.00 H ATOM 41 HB3 TRP A 3 -2.663 6.363 -7.663 1.00 0.00 H ATOM 42 HD1 TRP A 3 -1.835 9.696 -8.430 1.00 0.00 H ATOM 43 HE1 TRP A 3 -1.137 10.193 -10.926 1.00 0.00 H ATOM 44 HE3 TRP A 3 -3.836 5.450 -10.387 1.00 0.00 H ATOM 45 HZ2 TRP A 3 -1.490 8.785 -13.383 1.00 0.00 H ATOM 46 HZ3 TRP A 3 -3.616 5.088 -12.844 1.00 0.00 H ATOM 47 HH2 TRP A 3 -2.491 6.671 -14.328 1.00 0.00 H ATOM 48 N GLY A 4 -4.613 4.355 -7.884 1.00 0.00 N ATOM 49 CA GLY A 4 -4.830 3.061 -7.260 1.00 0.00 C ATOM 50 C GLY A 4 -4.073 2.958 -5.935 1.00 0.00 C ATOM 51 O GLY A 4 -4.360 2.084 -5.119 1.00 0.00 O ATOM 52 H GLY A 4 -4.134 4.326 -8.762 1.00 0.00 H ATOM 53 HA2 GLY A 4 -5.896 2.911 -7.087 1.00 0.00 H ATOM 54 HA3 GLY A 4 -4.502 2.269 -7.934 1.00 0.00 H ATOM 55 N CYS A 5 -3.121 3.862 -5.762 1.00 0.00 N ATOM 56 CA CYS A 5 -2.320 3.884 -4.550 1.00 0.00 C ATOM 57 C CYS A 5 -2.699 5.128 -3.746 1.00 0.00 C ATOM 58 O CYS A 5 -2.888 6.221 -4.279 1.00 0.00 O ATOM 59 CB CYS A 5 -0.822 3.840 -4.861 1.00 0.00 C ATOM 60 SG CYS A 5 0.144 2.688 -3.818 1.00 0.00 S ATOM 61 H CYS A 5 -2.893 4.570 -6.431 1.00 0.00 H ATOM 62 HA CYS A 5 -2.564 2.976 -3.998 1.00 0.00 H ATOM 63 HB3 CYS A 5 -0.412 4.843 -4.744 1.00 0.00 H HETATM 64 N B3S A 6 -2.811 4.937 -2.426 1.00 0.00 N HETATM 65 OD B3S A 6 -4.733 4.674 -0.386 1.00 0.00 O HETATM 66 CG B3S A 6 -3.613 5.531 -0.149 1.00 0.00 C HETATM 67 CB B3S A 6 -2.972 6.049 -1.459 1.00 0.00 C HETATM 68 CA B3S A 6 -1.599 6.713 -1.183 1.00 0.00 C HETATM 69 C B3S A 6 -0.567 5.839 -0.464 1.00 0.00 C HETATM 70 O B3S A 6 -0.029 6.280 0.551 1.00 0.00 O HETATM 71 H B3S A 6 -2.623 3.973 -2.135 1.00 0.00 H HETATM 72 HD B3S A 6 -5.415 4.949 0.237 1.00 0.00 H HETATM 73 HG2 B3S A 6 -3.931 6.389 0.476 1.00 0.00 H HETATM 74 HB B3S A 6 -3.652 6.823 -1.878 1.00 0.00 H HETATM 75 HA1 B3S A 6 -1.162 7.079 -2.130 1.00 0.00 H HETATM 76 HA2 B3S A 6 -1.741 7.632 -0.585 1.00 0.00 H ATOM 77 N GLY A 7 -0.308 4.653 -0.995 1.00 0.00 N ATOM 78 CA GLY A 7 0.667 3.760 -0.394 1.00 0.00 C ATOM 79 C GLY A 7 2.093 4.265 -0.629 1.00 0.00 C ATOM 80 O GLY A 7 2.871 3.629 -1.338 1.00 0.00 O ATOM 81 H GLY A 7 -0.750 4.302 -1.820 1.00 0.00 H ATOM 82 HA2 GLY A 7 0.479 3.679 0.677 1.00 0.00 H ATOM 83 HA3 GLY A 7 0.558 2.760 -0.813 1.00 0.00 H ATOM 84 N LYS A 8 2.390 5.404 -0.022 1.00 0.00 N ATOM 85 CA LYS A 8 3.707 6.002 -0.158 1.00 0.00 C ATOM 86 C LYS A 8 4.731 5.146 0.592 1.00 0.00 C ATOM 87 O LYS A 8 5.411 5.632 1.494 1.00 0.00 O ATOM 88 CB LYS A 8 3.682 7.464 0.293 1.00 0.00 C ATOM 89 CG LYS A 8 3.212 8.379 -0.839 1.00 0.00 C ATOM 90 CD LYS A 8 4.402 8.919 -1.636 1.00 0.00 C ATOM 91 CE LYS A 8 4.789 10.321 -1.162 1.00 0.00 C ATOM 92 NZ LYS A 8 3.654 11.256 -1.328 1.00 0.00 N ATOM 93 H LYS A 8 1.750 5.916 0.552 1.00 0.00 H ATOM 94 HA LYS A 8 3.961 5.997 -1.217 1.00 0.00 H ATOM 95 HB3 LYS A 8 4.676 7.765 0.621 1.00 0.00 H ATOM 96 HG3 LYS A 8 2.639 9.210 -0.427 1.00 0.00 H ATOM 97 HD3 LYS A 8 4.152 8.946 -2.697 1.00 0.00 H ATOM 98 HE3 LYS A 8 5.648 10.678 -1.729 1.00 0.00 H ATOM 99 HZ1 LYS A 8 2.805 10.777 -1.607 1.00 0.00 H ATOM 100 HZ2 LYS A 8 3.441 11.752 -0.469 1.00 0.00 H ATOM 101 N LEU A 9 4.807 3.886 0.189 1.00 0.00 N ATOM 102 CA LEU A 9 5.735 2.957 0.811 1.00 0.00 C ATOM 103 C LEU A 9 5.863 1.708 -0.063 1.00 0.00 C ATOM 104 O LEU A 9 6.970 1.294 -0.403 1.00 0.00 O ATOM 105 CB LEU A 9 5.312 2.659 2.251 1.00 0.00 C ATOM 106 CG LEU A 9 5.779 1.320 2.824 1.00 0.00 C ATOM 107 CD1 LEU A 9 4.690 0.253 2.681 1.00 0.00 C ATOM 108 CD2 LEU A 9 7.098 0.880 2.186 1.00 0.00 C ATOM 109 H LEU A 9 4.249 3.498 -0.545 1.00 0.00 H ATOM 110 HA LEU A 9 6.708 3.448 0.856 1.00 0.00 H ATOM 111 HB3 LEU A 9 4.224 2.695 2.303 1.00 0.00 H ATOM 112 HG LEU A 9 5.964 1.450 3.889 1.00 0.00 H ATOM 113 HD11 LEU A 9 5.153 -0.731 2.616 1.00 0.00 H ATOM 114 HD12 LEU A 9 4.032 0.289 3.549 1.00 0.00 H ATOM 115 HD13 LEU A 9 4.111 0.443 1.777 1.00 0.00 H ATOM 116 HD21 LEU A 9 7.573 1.736 1.707 1.00 0.00 H ATOM 117 HD22 LEU A 9 7.759 0.481 2.956 1.00 0.00 H ATOM 118 HD23 LEU A 9 6.902 0.109 1.441 1.00 0.00 H ATOM 119 N ILE A 10 4.713 1.143 -0.403 1.00 0.00 N ATOM 120 CA ILE A 10 4.683 -0.051 -1.232 1.00 0.00 C ATOM 121 C ILE A 10 3.341 -0.124 -1.962 1.00 0.00 C ATOM 122 O ILE A 10 2.309 -0.392 -1.349 1.00 0.00 O ATOM 123 CB ILE A 10 4.995 -1.293 -0.393 1.00 0.00 C ATOM 124 CG1 ILE A 10 6.458 -1.713 -0.561 1.00 0.00 C ATOM 125 CG2 ILE A 10 4.030 -2.433 -0.723 1.00 0.00 C ATOM 126 CD1 ILE A 10 6.750 -2.115 -2.007 1.00 0.00 C ATOM 127 H ILE A 10 3.817 1.485 -0.122 1.00 0.00 H ATOM 128 HA ILE A 10 5.476 0.045 -1.972 1.00 0.00 H ATOM 129 HB ILE A 10 4.851 -1.041 0.657 1.00 0.00 H ATOM 130 HG13 ILE A 10 6.677 -2.547 0.105 1.00 0.00 H ATOM 131 HG21 ILE A 10 4.388 -3.355 -0.265 1.00 0.00 H ATOM 132 HG22 ILE A 10 3.041 -2.195 -0.334 1.00 0.00 H ATOM 133 HG23 ILE A 10 3.975 -2.562 -1.803 1.00 0.00 H ATOM 134 HD11 ILE A 10 7.573 -2.830 -2.025 1.00 0.00 H ATOM 135 HD12 ILE A 10 5.862 -2.571 -2.445 1.00 0.00 H ATOM 136 HD13 ILE A 10 7.026 -1.231 -2.582 1.00 0.00 H ATOM 137 N CYS A 11 3.398 0.119 -3.264 1.00 0.00 N ATOM 138 CA CYS A 11 2.201 0.084 -4.085 1.00 0.00 C ATOM 139 C CYS A 11 1.992 -1.353 -4.568 1.00 0.00 C ATOM 140 O CYS A 11 1.740 -1.583 -5.750 1.00 0.00 O ATOM 141 CB CYS A 11 2.285 1.072 -5.251 1.00 0.00 C ATOM 142 SG CYS A 11 1.997 2.821 -4.797 1.00 0.00 S ATOM 143 H CYS A 11 4.242 0.337 -3.756 1.00 0.00 H ATOM 144 HA CYS A 11 1.375 0.402 -3.449 1.00 0.00 H ATOM 145 HB3 CYS A 11 1.555 0.782 -6.007 1.00 0.00 H ATOM 146 N THR A 12 2.102 -2.281 -3.629 1.00 0.00 N ATOM 147 CA THR A 12 1.929 -3.689 -3.945 1.00 0.00 C ATOM 148 C THR A 12 1.739 -4.502 -2.663 1.00 0.00 C ATOM 149 O THR A 12 1.951 -3.993 -1.563 1.00 0.00 O ATOM 150 CB THR A 12 3.130 -4.138 -4.778 1.00 0.00 C ATOM 151 OG1 THR A 12 2.572 -5.026 -5.742 1.00 0.00 O ATOM 152 CG2 THR A 12 4.100 -5.014 -3.982 1.00 0.00 C ATOM 153 H THR A 12 2.307 -2.084 -2.671 1.00 0.00 H ATOM 154 HA THR A 12 1.017 -3.800 -4.532 1.00 0.00 H ATOM 155 HB THR A 12 3.646 -3.282 -5.212 1.00 0.00 H ATOM 156 HG1 THR A 12 2.293 -5.880 -5.300 1.00 0.00 H ATOM 157 HG21 THR A 12 4.970 -5.244 -4.597 1.00 0.00 H ATOM 158 HG22 THR A 12 4.419 -4.483 -3.086 1.00 0.00 H ATOM 159 HG23 THR A 12 3.602 -5.941 -3.697 1.00 0.00 H ATOM 160 N THR A 13 1.343 -5.753 -2.848 1.00 0.00 N ATOM 161 CA THR A 13 1.122 -6.642 -1.720 1.00 0.00 C ATOM 162 C THR A 13 1.130 -8.101 -2.182 1.00 0.00 C ATOM 163 O THR A 13 0.074 -8.708 -2.355 1.00 0.00 O ATOM 164 CB THR A 13 -0.185 -6.228 -1.039 1.00 0.00 C ATOM 165 OG1 THR A 13 -1.028 -5.833 -2.118 1.00 0.00 O ATOM 166 CG2 THR A 13 -0.031 -4.957 -0.202 1.00 0.00 C ATOM 167 H THR A 13 1.172 -6.159 -3.745 1.00 0.00 H ATOM 168 HA THR A 13 1.949 -6.523 -1.022 1.00 0.00 H ATOM 169 HB THR A 13 -0.586 -7.044 -0.440 1.00 0.00 H ATOM 170 HG1 THR A 13 -1.966 -5.714 -1.793 1.00 0.00 H ATOM 171 HG21 THR A 13 0.949 -4.952 0.274 1.00 0.00 H ATOM 172 HG22 THR A 13 -0.126 -4.084 -0.846 1.00 0.00 H ATOM 173 HG23 THR A 13 -0.808 -4.930 0.564 1.00 0.00 H ATOM 174 N ALA A 14 2.334 -8.622 -2.367 1.00 0.00 N ATOM 175 CA ALA A 14 2.495 -9.999 -2.805 1.00 0.00 C ATOM 176 C ALA A 14 2.533 -10.917 -1.582 1.00 0.00 C ATOM 177 O ALA A 14 3.017 -10.524 -0.522 1.00 0.00 O ATOM 178 CB ALA A 14 3.755 -10.117 -3.665 1.00 0.00 C ATOM 179 H ALA A 14 3.188 -8.122 -2.224 1.00 0.00 H ATOM 180 HA ALA A 14 1.628 -10.255 -3.416 1.00 0.00 H ATOM 181 HB1 ALA A 14 4.220 -9.137 -3.765 1.00 0.00 H ATOM 182 HB2 ALA A 14 4.455 -10.805 -3.190 1.00 0.00 H ATOM 183 HB3 ALA A 14 3.488 -10.496 -4.651 1.00 0.00 H TER 184 ALA A 14