HETATM 1 C ACE A 1 2.211 0.142 -6.805 1.00 0.00 C HETATM 2 O ACE A 1 2.733 -0.597 -5.968 1.00 0.00 O HETATM 3 CH3 ACE A 1 1.814 -0.397 -8.176 1.00 0.00 C HETATM 4 H1 ACE A 1 0.716 -0.395 -8.308 1.00 0.00 H HETATM 5 H2 ACE A 1 2.259 0.198 -8.995 1.00 0.00 H HETATM 6 H3 ACE A 1 2.159 -1.439 -8.307 1.00 0.00 H ATOM 7 N ILE A 2 1.945 1.439 -6.601 1.00 0.00 N ATOM 8 CA ILE A 2 2.257 2.150 -5.328 1.00 0.00 C ATOM 9 C ILE A 2 1.004 2.162 -4.401 1.00 0.00 C ATOM 10 O ILE A 2 -0.147 2.240 -4.848 1.00 0.00 O ATOM 11 CB ILE A 2 2.886 3.574 -5.574 1.00 0.00 C ATOM 12 CG1 ILE A 2 2.026 4.623 -6.348 1.00 0.00 C ATOM 13 CG2 ILE A 2 4.300 3.474 -6.202 1.00 0.00 C ATOM 14 CD1 ILE A 2 1.002 5.391 -5.493 1.00 0.00 C ATOM 15 H ILE A 2 1.403 1.898 -7.336 1.00 0.00 H ATOM 16 HA ILE A 2 3.043 1.576 -4.791 1.00 0.00 H ATOM 17 HB ILE A 2 3.078 4.009 -4.578 1.00 0.00 H ATOM 18 HG12 ILE A 2 2.682 5.390 -6.803 1.00 0.00 H ATOM 19 HG13 ILE A 2 1.517 4.151 -7.208 1.00 0.00 H ATOM 20 HG21 ILE A 2 4.807 4.457 -6.235 1.00 0.00 H ATOM 21 HG22 ILE A 2 4.963 2.805 -5.620 1.00 0.00 H ATOM 22 HG23 ILE A 2 4.273 3.087 -7.238 1.00 0.00 H ATOM 23 HD11 ILE A 2 0.506 6.183 -6.083 1.00 0.00 H ATOM 24 HD12 ILE A 2 0.202 4.741 -5.100 1.00 0.00 H ATOM 25 HD13 ILE A 2 1.481 5.883 -4.626 1.00 0.00 H ATOM 26 N TRP A 3 1.260 2.094 -3.087 1.00 0.00 N ATOM 27 CA TRP A 3 0.211 2.102 -2.039 1.00 0.00 C ATOM 28 C TRP A 3 -0.097 3.559 -1.588 1.00 0.00 C ATOM 29 O TRP A 3 0.600 4.146 -0.756 1.00 0.00 O ATOM 30 CB TRP A 3 0.527 1.137 -0.862 1.00 0.00 C ATOM 31 CG TRP A 3 1.965 1.019 -0.315 1.00 0.00 C ATOM 32 CD1 TRP A 3 2.709 2.026 0.337 1.00 0.00 C ATOM 33 CD2 TRP A 3 2.805 -0.084 -0.358 1.00 0.00 C ATOM 34 NE1 TRP A 3 3.990 1.582 0.706 1.00 0.00 N ATOM 35 CE2 TRP A 3 4.027 0.269 0.271 1.00 0.00 C ATOM 36 CE3 TRP A 3 2.621 -1.392 -0.879 1.00 0.00 C ATOM 37 CZ2 TRP A 3 5.065 -0.684 0.396 1.00 0.00 C ATOM 38 CZ3 TRP A 3 3.658 -2.315 -0.739 1.00 0.00 C ATOM 39 CH2 TRP A 3 4.861 -1.967 -0.113 1.00 0.00 C ATOM 40 H TRP A 3 2.250 2.034 -2.848 1.00 0.00 H ATOM 41 HA TRP A 3 -0.710 1.663 -2.474 1.00 0.00 H ATOM 42 HB2 TRP A 3 -0.156 1.371 -0.024 1.00 0.00 H ATOM 43 HB3 TRP A 3 0.198 0.135 -1.190 1.00 0.00 H ATOM 44 HD1 TRP A 3 2.360 3.032 0.508 1.00 0.00 H ATOM 45 HE1 TRP A 3 4.730 2.109 1.182 1.00 0.00 H ATOM 46 HE3 TRP A 3 1.699 -1.682 -1.363 1.00 0.00 H ATOM 47 HZ2 TRP A 3 5.995 -0.428 0.881 1.00 0.00 H ATOM 48 HZ3 TRP A 3 3.532 -3.317 -1.114 1.00 0.00 H ATOM 49 HH2 TRP A 3 5.642 -2.707 -0.020 1.00 0.00 H ATOM 50 N GLY A 4 -1.163 4.130 -2.164 1.00 0.00 N ATOM 51 CA GLY A 4 -1.615 5.509 -1.844 1.00 0.00 C ATOM 52 C GLY A 4 -2.626 5.573 -0.672 1.00 0.00 C ATOM 53 O GLY A 4 -3.779 5.954 -0.889 1.00 0.00 O ATOM 54 H GLY A 4 -1.593 3.532 -2.874 1.00 0.00 H ATOM 55 HA2 GLY A 4 -0.759 6.188 -1.661 1.00 0.00 H ATOM 56 HA3 GLY A 4 -2.093 5.927 -2.753 1.00 0.00 H ATOM 57 N GLU A 5 -2.197 5.213 0.557 1.00 0.00 N ATOM 58 CA GLU A 5 -3.069 5.214 1.762 1.00 0.00 C ATOM 59 C GLU A 5 -2.175 5.395 3.023 1.00 0.00 C ATOM 60 O GLU A 5 -1.249 4.607 3.253 1.00 0.00 O ATOM 61 CB GLU A 5 -3.983 3.949 1.869 1.00 0.00 C ATOM 62 CG GLU A 5 -3.333 2.535 1.785 1.00 0.00 C ATOM 63 CD GLU A 5 -3.316 1.874 0.385 1.00 0.00 C ATOM 64 OE1 GLU A 5 -3.573 2.528 -0.630 1.00 0.00 O ATOM 65 H GLU A 5 -1.242 4.840 0.615 1.00 0.00 H ATOM 66 HA GLU A 5 -3.751 6.087 1.693 1.00 0.00 H ATOM 67 HB2 GLU A 5 -4.537 4.007 2.825 1.00 0.00 H ATOM 68 HB3 GLU A 5 -4.790 4.021 1.113 1.00 0.00 H ATOM 69 HG2 GLU A 5 -2.304 2.571 2.189 1.00 0.00 H ATOM 70 HG3 GLU A 5 -3.882 1.879 2.486 1.00 0.00 H ATOM 71 N SER A 6 -2.461 6.422 3.851 1.00 0.00 N ATOM 72 CA SER A 6 -1.686 6.689 5.093 1.00 0.00 C ATOM 73 C SER A 6 -2.199 5.777 6.249 1.00 0.00 C ATOM 74 O SER A 6 -3.230 6.048 6.874 1.00 0.00 O ATOM 75 CB SER A 6 -1.772 8.196 5.420 1.00 0.00 C ATOM 76 OG SER A 6 -0.933 8.518 6.525 1.00 0.00 O ATOM 77 H SER A 6 -3.189 7.070 3.531 1.00 0.00 H ATOM 78 HA SER A 6 -0.615 6.477 4.893 1.00 0.00 H ATOM 79 HB2 SER A 6 -1.458 8.805 4.550 1.00 0.00 H ATOM 80 HB3 SER A 6 -2.813 8.499 5.648 1.00 0.00 H ATOM 81 HG SER A 6 -1.045 9.458 6.687 1.00 0.00 H ATOM 82 N GLY A 7 -1.458 4.687 6.497 1.00 0.00 N ATOM 83 CA GLY A 7 -1.802 3.698 7.541 1.00 0.00 C ATOM 84 C GLY A 7 -1.122 2.359 7.217 1.00 0.00 C ATOM 85 O GLY A 7 -0.029 2.088 7.721 1.00 0.00 O ATOM 86 H GLY A 7 -0.646 4.570 5.880 1.00 0.00 H ATOM 87 HA2 GLY A 7 -1.455 4.063 8.526 1.00 0.00 H ATOM 88 HA3 GLY A 7 -2.899 3.567 7.635 1.00 0.00 H ATOM 89 N LYS A 8 -1.774 1.533 6.376 1.00 0.00 N ATOM 90 CA LYS A 8 -1.227 0.215 5.958 1.00 0.00 C ATOM 91 C LYS A 8 -0.320 0.349 4.698 1.00 0.00 C ATOM 92 O LYS A 8 -0.694 1.003 3.717 1.00 0.00 O ATOM 93 CB LYS A 8 -2.358 -0.835 5.746 1.00 0.00 C ATOM 94 CG LYS A 8 -3.341 -0.628 4.563 1.00 0.00 C ATOM 95 CD LYS A 8 -4.247 -1.848 4.307 1.00 0.00 C ATOM 96 CE LYS A 8 -5.140 -1.664 3.066 1.00 0.00 C ATOM 97 NZ LYS A 8 -5.935 -2.880 2.800 1.00 0.00 N ATOM 98 H LYS A 8 -2.657 1.902 6.006 1.00 0.00 H ATOM 99 HA LYS A 8 -0.619 -0.185 6.796 1.00 0.00 H ATOM 100 HB2 LYS A 8 -1.870 -1.822 5.624 1.00 0.00 H ATOM 101 HB3 LYS A 8 -2.939 -0.935 6.683 1.00 0.00 H ATOM 102 HG2 LYS A 8 -3.955 0.276 4.743 1.00 0.00 H ATOM 103 HG3 LYS A 8 -2.773 -0.421 3.638 1.00 0.00 H ATOM 104 HD2 LYS A 8 -3.612 -2.747 4.177 1.00 0.00 H ATOM 105 HD3 LYS A 8 -4.869 -2.042 5.203 1.00 0.00 H ATOM 106 HE2 LYS A 8 -5.816 -0.797 3.201 1.00 0.00 H ATOM 107 HE3 LYS A 8 -4.520 -1.433 2.177 1.00 0.00 H ATOM 108 HZ1 LYS A 8 -6.540 -3.124 3.592 1.00 0.00 H ATOM 109 HZ2 LYS A 8 -6.543 -2.775 1.979 1.00 0.00 H ATOM 110 HZ3 LYS A 8 -5.334 -3.695 2.623 1.00 0.00 H ATOM 111 N LEU A 9 0.862 -0.294 4.725 1.00 0.00 N ATOM 112 CA LEU A 9 1.806 -0.284 3.567 1.00 0.00 C ATOM 113 C LEU A 9 1.644 -1.608 2.734 1.00 0.00 C ATOM 114 O LEU A 9 2.613 -2.332 2.485 1.00 0.00 O ATOM 115 CB LEU A 9 3.265 -0.032 4.074 1.00 0.00 C ATOM 116 CG LEU A 9 3.711 1.399 4.514 1.00 0.00 C ATOM 117 CD1 LEU A 9 2.974 1.953 5.751 1.00 0.00 C ATOM 118 CD2 LEU A 9 5.228 1.406 4.789 1.00 0.00 C ATOM 119 H LEU A 9 1.077 -0.784 5.600 1.00 0.00 H ATOM 120 HA LEU A 9 1.550 0.527 2.856 1.00 0.00 H ATOM 121 HB2 LEU A 9 3.503 -0.758 4.877 1.00 0.00 H ATOM 122 HB3 LEU A 9 3.946 -0.321 3.250 1.00 0.00 H ATOM 123 HG LEU A 9 3.550 2.112 3.683 1.00 0.00 H ATOM 124 HD11 LEU A 9 3.384 2.929 6.073 1.00 0.00 H ATOM 125 HD12 LEU A 9 1.903 2.127 5.545 1.00 0.00 H ATOM 126 HD13 LEU A 9 3.038 1.269 6.617 1.00 0.00 H ATOM 127 HD21 LEU A 9 5.805 1.083 3.902 1.00 0.00 H ATOM 128 HD22 LEU A 9 5.594 2.418 5.049 1.00 0.00 H ATOM 129 HD23 LEU A 9 5.506 0.734 5.622 1.00 0.00 H ATOM 130 N ILE A 10 0.403 -1.898 2.282 1.00 0.00 N ATOM 131 CA ILE A 10 0.047 -3.101 1.479 1.00 0.00 C ATOM 132 C ILE A 10 -1.382 -2.818 0.908 1.00 0.00 C ATOM 133 O ILE A 10 -2.388 -3.274 1.463 1.00 0.00 O ATOM 134 CB ILE A 10 0.230 -4.461 2.253 1.00 0.00 C ATOM 135 CG1 ILE A 10 0.221 -5.732 1.356 1.00 0.00 C ATOM 136 CG2 ILE A 10 -0.607 -4.647 3.545 1.00 0.00 C ATOM 137 CD1 ILE A 10 -1.099 -6.125 0.671 1.00 0.00 C ATOM 138 H ILE A 10 -0.317 -1.233 2.583 1.00 0.00 H ATOM 139 HA ILE A 10 0.764 -3.161 0.634 1.00 0.00 H ATOM 140 HB ILE A 10 1.273 -4.427 2.613 1.00 0.00 H ATOM 141 HG12 ILE A 10 0.998 -5.625 0.576 1.00 0.00 H ATOM 142 HG13 ILE A 10 0.562 -6.595 1.960 1.00 0.00 H ATOM 143 HG21 ILE A 10 -0.279 -5.536 4.115 1.00 0.00 H ATOM 144 HG22 ILE A 10 -0.507 -3.781 4.225 1.00 0.00 H ATOM 145 HG23 ILE A 10 -1.684 -4.777 3.340 1.00 0.00 H ATOM 146 HD11 ILE A 10 -1.006 -7.100 0.162 1.00 0.00 H ATOM 147 HD12 ILE A 10 -1.930 -6.208 1.395 1.00 0.00 H ATOM 148 HD13 ILE A 10 -1.397 -5.391 -0.099 1.00 0.00 H HETATM 149 N SET A 11 -1.471 -2.047 -0.195 1.00 0.00 N HETATM 150 CA SET A 11 -2.779 -1.702 -0.841 1.00 0.00 C HETATM 151 CB SET A 11 -3.011 -2.424 -2.207 1.00 0.00 C HETATM 152 OG SET A 11 -4.082 -3.018 -2.365 1.00 0.00 O HETATM 153 NT SET A 11 -3.026 0.563 0.326 1.00 0.00 N HETATM 154 C SET A 11 -3.019 -0.172 -0.963 1.00 0.00 C HETATM 155 H SET A 11 -0.624 -1.489 -0.348 1.00 0.00 H HETATM 156 HA SET A 11 -3.607 -2.055 -0.195 1.00 0.00 H HETATM 157 HB2 SET A 11 -2.278 0.284 -1.642 1.00 0.00 H HETATM 158 HB3 SET A 11 -3.999 0.000 -1.455 1.00 0.00 H HETATM 159 HNT2 SET A 11 -2.826 0.093 1.215 1.00 0.00 H ATOM 160 N THR A 12 -2.075 -2.373 -3.188 1.00 0.00 N ATOM 161 CA THR A 12 -2.239 -3.030 -4.518 1.00 0.00 C ATOM 162 C THR A 12 -1.113 -4.087 -4.723 1.00 0.00 C ATOM 163 O THR A 12 -1.371 -5.277 -4.514 1.00 0.00 O ATOM 164 CB THR A 12 -2.493 -1.977 -5.647 1.00 0.00 C ATOM 165 OG1 THR A 12 -2.696 -2.651 -6.883 1.00 0.00 O ATOM 166 CG2 THR A 12 -1.434 -0.879 -5.875 1.00 0.00 C ATOM 167 H THR A 12 -1.175 -1.948 -2.947 1.00 0.00 H ATOM 168 HA THR A 12 -3.169 -3.632 -4.513 1.00 0.00 H ATOM 169 HB THR A 12 -3.439 -1.457 -5.399 1.00 0.00 H ATOM 170 HG1 THR A 12 -2.862 -1.966 -7.535 1.00 0.00 H ATOM 171 HG21 THR A 12 -1.216 -0.316 -4.949 1.00 0.00 H ATOM 172 HG22 THR A 12 -0.478 -1.287 -6.248 1.00 0.00 H ATOM 173 HG23 THR A 12 -1.777 -0.141 -6.623 1.00 0.00 H ATOM 174 N THR A 13 0.117 -3.680 -5.098 1.00 0.00 N ATOM 175 CA THR A 13 1.257 -4.620 -5.313 1.00 0.00 C ATOM 176 C THR A 13 2.046 -4.731 -3.974 1.00 0.00 C ATOM 177 O THR A 13 2.639 -3.751 -3.511 1.00 0.00 O ATOM 178 CB THR A 13 2.156 -4.176 -6.510 1.00 0.00 C ATOM 179 OG1 THR A 13 1.362 -3.978 -7.676 1.00 0.00 O ATOM 180 CG2 THR A 13 3.241 -5.200 -6.889 1.00 0.00 C ATOM 181 H THR A 13 0.191 -2.670 -5.261 1.00 0.00 H ATOM 182 HA THR A 13 0.852 -5.614 -5.596 1.00 0.00 H ATOM 183 HB THR A 13 2.669 -3.224 -6.271 1.00 0.00 H ATOM 184 HG1 THR A 13 1.979 -3.792 -8.388 1.00 0.00 H ATOM 185 HG21 THR A 13 3.946 -5.379 -6.057 1.00 0.00 H ATOM 186 HG22 THR A 13 2.805 -6.177 -7.171 1.00 0.00 H ATOM 187 HG23 THR A 13 3.844 -4.850 -7.748 1.00 0.00 H ATOM 188 N ALA A 14 2.057 -5.938 -3.378 1.00 0.00 N ATOM 189 CA ALA A 14 2.756 -6.203 -2.095 1.00 0.00 C ATOM 190 C ALA A 14 4.299 -6.248 -2.215 1.00 0.00 C ATOM 191 O ALA A 14 5.044 -5.564 -1.514 1.00 0.00 O ATOM 192 CB ALA A 14 2.202 -7.510 -1.499 1.00 0.00 C ATOM 193 OXT ALA A 14 4.741 -7.127 -3.175 1.00 0.00 O ATOM 194 H ALA A 14 1.486 -6.652 -3.844 1.00 0.00 H ATOM 195 HA ALA A 14 2.500 -5.396 -1.383 1.00 0.00 H ATOM 196 HB1 ALA A 14 2.642 -7.720 -0.506 1.00 0.00 H ATOM 197 HB2 ALA A 14 1.106 -7.462 -1.351 1.00 0.00 H ATOM 198 HB3 ALA A 14 2.407 -8.390 -2.139 1.00 0.00 H ATOM 199 HXT ALA A 14 4.011 -7.557 -3.624 1.00 0.00 H TER 200 ALA A 14