HETATM 1 C ACE A 1 -4.506 -2.698 0.447 1.00 0.00 C HETATM 2 O ACE A 1 -5.099 -2.300 -0.558 1.00 0.00 O HETATM 3 CH3 ACE A 1 -4.538 -4.177 0.821 1.00 0.00 C HETATM 4 H1 ACE A 1 -5.364 -4.384 1.527 1.00 0.00 H HETATM 5 H2 ACE A 1 -4.703 -4.805 -0.074 1.00 0.00 H HETATM 6 H3 ACE A 1 -3.598 -4.520 1.291 1.00 0.00 H ATOM 7 N ILE A 2 -3.823 -1.898 1.278 1.00 0.00 N ATOM 8 CA ILE A 2 -3.691 -0.430 1.065 1.00 0.00 C ATOM 9 C ILE A 2 -2.302 0.029 1.617 1.00 0.00 C ATOM 10 O ILE A 2 -2.120 0.123 2.835 1.00 0.00 O ATOM 11 CB ILE A 2 -4.951 0.358 1.604 1.00 0.00 C ATOM 12 CG1 ILE A 2 -5.112 1.762 0.956 1.00 0.00 C ATOM 13 CG2 ILE A 2 -5.089 0.477 3.145 1.00 0.00 C ATOM 14 CD1 ILE A 2 -5.708 1.716 -0.459 1.00 0.00 C ATOM 15 H ILE A 2 -3.345 -2.389 2.038 1.00 0.00 H ATOM 16 HA ILE A 2 -3.671 -0.266 -0.030 1.00 0.00 H ATOM 17 HB ILE A 2 -5.846 -0.221 1.300 1.00 0.00 H ATOM 18 HG12 ILE A 2 -5.780 2.402 1.565 1.00 0.00 H ATOM 19 HG13 ILE A 2 -4.143 2.296 0.941 1.00 0.00 H ATOM 20 HG21 ILE A 2 -4.339 1.160 3.583 1.00 0.00 H ATOM 21 HG22 ILE A 2 -6.082 0.873 3.435 1.00 0.00 H ATOM 22 HG23 ILE A 2 -4.981 -0.502 3.646 1.00 0.00 H ATOM 23 HD11 ILE A 2 -5.779 2.727 -0.900 1.00 0.00 H ATOM 24 HD12 ILE A 2 -5.102 1.096 -1.139 1.00 0.00 H ATOM 25 HD13 ILE A 2 -6.729 1.287 -0.451 1.00 0.00 H ATOM 26 N TRP A 3 -1.316 0.289 0.731 1.00 0.00 N ATOM 27 CA TRP A 3 0.043 0.746 1.150 1.00 0.00 C ATOM 28 C TRP A 3 0.360 2.045 0.361 1.00 0.00 C ATOM 29 O TRP A 3 0.930 2.013 -0.737 1.00 0.00 O ATOM 30 CB TRP A 3 1.156 -0.316 0.947 1.00 0.00 C ATOM 31 CG TRP A 3 0.965 -1.669 1.638 1.00 0.00 C ATOM 32 CD1 TRP A 3 1.551 -2.096 2.844 1.00 0.00 C ATOM 33 CD2 TRP A 3 0.288 -2.764 1.142 1.00 0.00 C ATOM 34 NE1 TRP A 3 1.262 -3.450 3.110 1.00 0.00 N ATOM 35 CE2 TRP A 3 0.484 -3.846 2.032 1.00 0.00 C ATOM 36 CE3 TRP A 3 -0.474 -2.927 -0.038 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -0.062 -5.117 1.728 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -1.002 -4.187 -0.320 1.00 0.00 C ATOM 39 CH2 TRP A 3 -0.797 -5.268 0.549 1.00 0.00 C ATOM 40 H TRP A 3 -1.503 0.001 -0.238 1.00 0.00 H ATOM 41 HA TRP A 3 0.062 0.983 2.234 1.00 0.00 H ATOM 42 HB2 TRP A 3 1.298 -0.501 -0.132 1.00 0.00 H ATOM 43 HB3 TRP A 3 2.125 0.110 1.270 1.00 0.00 H ATOM 44 HD1 TRP A 3 2.170 -1.469 3.469 1.00 0.00 H ATOM 45 HE1 TRP A 3 1.579 -4.021 3.901 1.00 0.00 H ATOM 46 HE3 TRP A 3 -0.649 -2.073 -0.681 1.00 0.00 H ATOM 47 HZ2 TRP A 3 0.088 -5.957 2.391 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -1.585 -4.331 -1.217 1.00 0.00 H ATOM 49 HH2 TRP A 3 -1.220 -6.232 0.306 1.00 0.00 H ATOM 50 N GLY A 4 -0.048 3.186 0.936 1.00 0.00 N ATOM 51 CA GLY A 4 0.179 4.519 0.316 1.00 0.00 C ATOM 52 C GLY A 4 -0.963 5.051 -0.578 1.00 0.00 C ATOM 53 O GLY A 4 -1.545 6.087 -0.250 1.00 0.00 O ATOM 54 H GLY A 4 -0.596 3.018 1.790 1.00 0.00 H ATOM 55 HA2 GLY A 4 0.355 5.252 1.126 1.00 0.00 H ATOM 56 HA3 GLY A 4 1.132 4.543 -0.249 1.00 0.00 H ATOM 57 N GLU A 5 -1.256 4.369 -1.707 1.00 0.00 N ATOM 58 CA GLU A 5 -2.331 4.795 -2.663 1.00 0.00 C ATOM 59 C GLU A 5 -3.307 3.682 -3.164 1.00 0.00 C ATOM 60 O GLU A 5 -4.479 3.986 -3.406 1.00 0.00 O ATOM 61 CB GLU A 5 -1.769 5.788 -3.744 1.00 0.00 C ATOM 62 CG GLU A 5 -1.717 5.427 -5.254 1.00 0.00 C ATOM 63 CD GLU A 5 -0.807 4.265 -5.695 1.00 0.00 C ATOM 64 OE1 GLU A 5 -1.321 3.249 -6.165 1.00 0.00 O ATOM 65 H GLU A 5 -0.703 3.510 -1.819 1.00 0.00 H ATOM 66 HA GLU A 5 -3.030 5.405 -2.067 1.00 0.00 H ATOM 67 HB2 GLU A 5 -2.388 6.704 -3.683 1.00 0.00 H ATOM 68 HB3 GLU A 5 -0.768 6.160 -3.450 1.00 0.00 H ATOM 69 HG2 GLU A 5 -2.746 5.229 -5.613 1.00 0.00 H ATOM 70 HG3 GLU A 5 -1.430 6.328 -5.831 1.00 0.00 H ATOM 71 N SER A 6 -2.850 2.429 -3.343 1.00 0.00 N ATOM 72 CA SER A 6 -3.706 1.293 -3.804 1.00 0.00 C ATOM 73 C SER A 6 -3.173 -0.069 -3.237 1.00 0.00 C ATOM 74 O SER A 6 -2.393 -0.098 -2.276 1.00 0.00 O ATOM 75 CB SER A 6 -3.890 1.348 -5.352 1.00 0.00 C ATOM 76 OG SER A 6 -2.709 0.956 -6.046 1.00 0.00 O ATOM 77 H SER A 6 -1.910 2.291 -2.958 1.00 0.00 H ATOM 78 HA SER A 6 -4.715 1.419 -3.368 1.00 0.00 H ATOM 79 HB2 SER A 6 -4.716 0.678 -5.654 1.00 0.00 H ATOM 80 HB3 SER A 6 -4.201 2.355 -5.686 1.00 0.00 H ATOM 81 HG SER A 6 -2.099 1.699 -5.974 1.00 0.00 H ATOM 82 N GLY A 7 -3.616 -1.211 -3.809 1.00 0.00 N ATOM 83 CA GLY A 7 -3.160 -2.558 -3.375 1.00 0.00 C ATOM 84 C GLY A 7 -1.829 -3.006 -4.023 1.00 0.00 C ATOM 85 O GLY A 7 -1.797 -3.935 -4.832 1.00 0.00 O ATOM 86 H GLY A 7 -4.241 -1.077 -4.611 1.00 0.00 H ATOM 87 HA2 GLY A 7 -3.082 -2.614 -2.273 1.00 0.00 H ATOM 88 HA3 GLY A 7 -3.947 -3.292 -3.634 1.00 0.00 H ATOM 89 N LYS A 8 -0.742 -2.326 -3.630 1.00 0.00 N ATOM 90 CA LYS A 8 0.635 -2.577 -4.117 1.00 0.00 C ATOM 91 C LYS A 8 1.566 -2.139 -2.953 1.00 0.00 C ATOM 92 O LYS A 8 1.507 -0.986 -2.510 1.00 0.00 O ATOM 93 CB LYS A 8 0.901 -1.779 -5.425 1.00 0.00 C ATOM 94 CG LYS A 8 2.268 -2.062 -6.093 1.00 0.00 C ATOM 95 CD LYS A 8 2.558 -1.227 -7.357 1.00 0.00 C ATOM 96 CE LYS A 8 1.700 -1.597 -8.582 1.00 0.00 C ATOM 97 NZ LYS A 8 2.081 -0.791 -9.757 1.00 0.00 N ATOM 98 H LYS A 8 -0.947 -1.552 -2.987 1.00 0.00 H ATOM 99 HA LYS A 8 0.760 -3.660 -4.326 1.00 0.00 H ATOM 100 HB2 LYS A 8 0.102 -2.014 -6.154 1.00 0.00 H ATOM 101 HB3 LYS A 8 0.801 -0.693 -5.232 1.00 0.00 H ATOM 102 HG2 LYS A 8 3.073 -1.855 -5.362 1.00 0.00 H ATOM 103 HG3 LYS A 8 2.360 -3.139 -6.326 1.00 0.00 H ATOM 104 HD2 LYS A 8 2.447 -0.151 -7.124 1.00 0.00 H ATOM 105 HD3 LYS A 8 3.628 -1.357 -7.613 1.00 0.00 H ATOM 106 HE2 LYS A 8 1.814 -2.670 -8.824 1.00 0.00 H ATOM 107 HE3 LYS A 8 0.626 -1.438 -8.369 1.00 0.00 H ATOM 108 HZ1 LYS A 8 1.477 -1.016 -10.556 1.00 0.00 H ATOM 109 HZ2 LYS A 8 1.932 0.206 -9.568 1.00 0.00 H ATOM 110 N LEU A 9 2.448 -3.048 -2.493 1.00 0.00 N ATOM 111 CA LEU A 9 3.395 -2.782 -1.364 1.00 0.00 C ATOM 112 C LEU A 9 4.299 -1.503 -1.387 1.00 0.00 C ATOM 113 O LEU A 9 4.668 -1.029 -0.309 1.00 0.00 O ATOM 114 CB LEU A 9 4.138 -4.092 -0.968 1.00 0.00 C ATOM 115 CG LEU A 9 5.093 -4.778 -1.992 1.00 0.00 C ATOM 116 CD1 LEU A 9 6.480 -4.112 -2.079 1.00 0.00 C ATOM 117 CD2 LEU A 9 5.276 -6.269 -1.645 1.00 0.00 C ATOM 118 H LEU A 9 2.394 -3.967 -2.944 1.00 0.00 H ATOM 119 HA LEU A 9 2.733 -2.595 -0.497 1.00 0.00 H ATOM 120 HB2 LEU A 9 4.684 -3.925 -0.018 1.00 0.00 H ATOM 121 HB3 LEU A 9 3.351 -4.817 -0.679 1.00 0.00 H ATOM 122 HG LEU A 9 4.630 -4.735 -2.996 1.00 0.00 H ATOM 123 HD11 LEU A 9 6.994 -4.092 -1.100 1.00 0.00 H ATOM 124 HD12 LEU A 9 7.146 -4.641 -2.788 1.00 0.00 H ATOM 125 HD13 LEU A 9 6.418 -3.072 -2.436 1.00 0.00 H ATOM 126 HD21 LEU A 9 4.310 -6.808 -1.638 1.00 0.00 H ATOM 127 HD22 LEU A 9 5.918 -6.788 -2.382 1.00 0.00 H ATOM 128 HD23 LEU A 9 5.737 -6.412 -0.650 1.00 0.00 H ATOM 129 N ILE A 10 4.645 -0.957 -2.571 1.00 0.00 N ATOM 130 CA ILE A 10 5.473 0.283 -2.688 1.00 0.00 C ATOM 131 C ILE A 10 4.831 1.269 -3.719 1.00 0.00 C ATOM 132 O ILE A 10 5.196 1.268 -4.899 1.00 0.00 O ATOM 133 CB ILE A 10 7.016 -0.020 -2.856 1.00 0.00 C ATOM 134 CG1 ILE A 10 7.929 1.215 -2.602 1.00 0.00 C ATOM 135 CG2 ILE A 10 7.464 -0.679 -4.189 1.00 0.00 C ATOM 136 CD1 ILE A 10 7.944 1.731 -1.155 1.00 0.00 C ATOM 137 H ILE A 10 4.225 -1.445 -3.369 1.00 0.00 H ATOM 138 HA ILE A 10 5.400 0.811 -1.717 1.00 0.00 H ATOM 139 HB ILE A 10 7.276 -0.757 -2.070 1.00 0.00 H ATOM 140 HG12 ILE A 10 8.978 0.967 -2.859 1.00 0.00 H ATOM 141 HG13 ILE A 10 7.657 2.041 -3.286 1.00 0.00 H ATOM 142 HG21 ILE A 10 6.869 -1.574 -4.443 1.00 0.00 H ATOM 143 HG22 ILE A 10 7.405 0.014 -5.051 1.00 0.00 H ATOM 144 HG23 ILE A 10 8.521 -1.010 -4.143 1.00 0.00 H ATOM 145 HD11 ILE A 10 6.967 2.144 -0.851 1.00 0.00 H ATOM 146 HD12 ILE A 10 8.208 0.928 -0.443 1.00 0.00 H ATOM 147 HD13 ILE A 10 8.689 2.537 -1.035 1.00 0.00 H HETATM 148 N DAB A 11 3.859 2.107 -3.282 1.00 0.00 N HETATM 149 CA DAB A 11 3.203 3.113 -4.155 1.00 0.00 C HETATM 150 C DAB A 11 2.684 4.230 -3.216 1.00 0.00 C HETATM 151 O DAB A 11 1.574 4.122 -2.690 1.00 0.00 O HETATM 152 CB DAB A 11 2.085 2.493 -5.047 1.00 0.00 C HETATM 153 CG DAB A 11 1.488 3.428 -6.131 1.00 0.00 C HETATM 154 ND DAB A 11 0.522 4.435 -5.617 1.00 0.00 N HETATM 155 H DAB A 11 3.533 2.000 -2.313 1.00 0.00 H HETATM 156 HA DAB A 11 3.964 3.546 -4.837 1.00 0.00 H HETATM 157 HB2 DAB A 11 2.514 1.621 -5.575 1.00 0.00 H HETATM 158 HB3 DAB A 11 1.275 2.064 -4.424 1.00 0.00 H HETATM 159 HG2 DAB A 11 2.305 3.958 -6.655 1.00 0.00 H HETATM 160 HG3 DAB A 11 1.023 2.806 -6.920 1.00 0.00 H HETATM 161 HD2 DAB A 11 0.824 5.323 -5.197 1.00 0.00 H ATOM 162 N THR A 12 3.480 5.294 -3.010 1.00 0.00 N ATOM 163 CA THR A 12 3.078 6.439 -2.142 1.00 0.00 C ATOM 164 C THR A 12 2.890 7.676 -3.065 1.00 0.00 C ATOM 165 O THR A 12 3.863 8.306 -3.490 1.00 0.00 O ATOM 166 CB THR A 12 4.089 6.650 -0.973 1.00 0.00 C ATOM 167 OG1 THR A 12 4.225 5.444 -0.225 1.00 0.00 O ATOM 168 CG2 THR A 12 3.667 7.742 0.027 1.00 0.00 C ATOM 169 H THR A 12 4.409 5.219 -3.441 1.00 0.00 H ATOM 170 HA THR A 12 2.104 6.219 -1.659 1.00 0.00 H ATOM 171 HB THR A 12 5.083 6.924 -1.376 1.00 0.00 H ATOM 172 HG1 THR A 12 4.445 4.761 -0.862 1.00 0.00 H ATOM 173 HG21 THR A 12 2.687 7.519 0.487 1.00 0.00 H ATOM 174 HG22 THR A 12 4.401 7.837 0.848 1.00 0.00 H ATOM 175 HG23 THR A 12 3.591 8.734 -0.454 1.00 0.00 H ATOM 176 N THR A 13 1.619 7.996 -3.371 1.00 0.00 N ATOM 177 CA THR A 13 1.250 9.146 -4.242 1.00 0.00 C ATOM 178 C THR A 13 0.001 9.808 -3.590 1.00 0.00 C ATOM 179 O THR A 13 -1.094 9.233 -3.595 1.00 0.00 O ATOM 180 CB THR A 13 1.005 8.685 -5.713 1.00 0.00 C ATOM 181 OG1 THR A 13 2.140 7.988 -6.219 1.00 0.00 O ATOM 182 CG2 THR A 13 0.718 9.837 -6.692 1.00 0.00 C ATOM 183 H THR A 13 0.908 7.385 -2.953 1.00 0.00 H ATOM 184 HA THR A 13 2.084 9.879 -4.264 1.00 0.00 H ATOM 185 HB THR A 13 0.143 7.990 -5.738 1.00 0.00 H ATOM 186 HG1 THR A 13 2.876 8.601 -6.159 1.00 0.00 H ATOM 187 HG21 THR A 13 -0.197 10.393 -6.415 1.00 0.00 H ATOM 188 HG22 THR A 13 1.550 10.564 -6.728 1.00 0.00 H ATOM 189 HG23 THR A 13 0.566 9.460 -7.720 1.00 0.00 H ATOM 190 N ALA A 14 0.173 11.028 -3.046 1.00 0.00 N ATOM 191 CA ALA A 14 -0.922 11.781 -2.388 1.00 0.00 C ATOM 192 C ALA A 14 -1.725 12.600 -3.427 1.00 0.00 C ATOM 193 O ALA A 14 -1.476 13.768 -3.734 1.00 0.00 O ATOM 194 CB ALA A 14 -0.314 12.652 -1.273 1.00 0.00 C ATOM 195 OXT ALA A 14 -2.741 11.866 -3.983 1.00 0.00 O ATOM 196 H ALA A 14 1.129 11.398 -3.100 1.00 0.00 H ATOM 197 HA ALA A 14 -1.618 11.077 -1.889 1.00 0.00 H ATOM 198 HB1 ALA A 14 0.407 13.395 -1.664 1.00 0.00 H ATOM 199 HB2 ALA A 14 -1.096 13.215 -0.731 1.00 0.00 H ATOM 200 HB3 ALA A 14 0.218 12.042 -0.518 1.00 0.00 H ATOM 201 HXT ALA A 14 -2.754 10.965 -3.652 1.00 0.00 H TER 202 ALA A 14