HETATM 1 C ACE A 1 -1.028 6.765 5.091 1.00 0.00 C HETATM 2 O ACE A 1 -1.357 6.526 6.255 1.00 0.00 O HETATM 3 CH3 ACE A 1 -0.956 8.205 4.591 1.00 0.00 C HETATM 4 H1 ACE A 1 0.062 8.464 4.247 1.00 0.00 H HETATM 5 H2 ACE A 1 -1.656 8.379 3.754 1.00 0.00 H HETATM 6 H3 ACE A 1 -1.221 8.917 5.394 1.00 0.00 H ATOM 7 N ILE A 2 -0.720 5.827 4.183 1.00 0.00 N ATOM 8 CA ILE A 2 -0.730 4.363 4.485 1.00 0.00 C ATOM 9 C ILE A 2 0.737 3.825 4.452 1.00 0.00 C ATOM 10 O ILE A 2 1.596 4.221 3.658 1.00 0.00 O ATOM 11 CB ILE A 2 -1.774 3.582 3.599 1.00 0.00 C ATOM 12 CG1 ILE A 2 -3.257 3.956 3.914 1.00 0.00 C ATOM 13 CG2 ILE A 2 -1.639 2.036 3.607 1.00 0.00 C ATOM 14 CD1 ILE A 2 -3.736 3.716 5.363 1.00 0.00 C ATOM 15 H ILE A 2 -0.378 6.211 3.295 1.00 0.00 H ATOM 16 HA ILE A 2 -1.078 4.227 5.531 1.00 0.00 H ATOM 17 HB ILE A 2 -1.588 3.861 2.549 1.00 0.00 H ATOM 18 HG12 ILE A 2 -3.427 5.020 3.665 1.00 0.00 H ATOM 19 HG13 ILE A 2 -3.929 3.407 3.226 1.00 0.00 H ATOM 20 HG21 ILE A 2 -2.414 1.547 2.990 1.00 0.00 H ATOM 21 HG22 ILE A 2 -0.666 1.699 3.206 1.00 0.00 H ATOM 22 HG23 ILE A 2 -1.726 1.620 4.627 1.00 0.00 H ATOM 23 HD11 ILE A 2 -4.827 3.857 5.457 1.00 0.00 H ATOM 24 HD12 ILE A 2 -3.509 2.694 5.717 1.00 0.00 H ATOM 25 HD13 ILE A 2 -3.257 4.411 6.077 1.00 0.00 H ATOM 26 N TRP A 3 0.948 2.860 5.350 1.00 0.00 N ATOM 27 CA TRP A 3 2.233 2.162 5.586 1.00 0.00 C ATOM 28 C TRP A 3 2.259 0.802 4.830 1.00 0.00 C ATOM 29 O TRP A 3 1.703 -0.204 5.281 1.00 0.00 O ATOM 30 CB TRP A 3 2.509 2.014 7.116 1.00 0.00 C ATOM 31 CG TRP A 3 1.321 1.759 8.077 1.00 0.00 C ATOM 32 CD1 TRP A 3 0.664 0.531 8.299 1.00 0.00 C ATOM 33 CD2 TRP A 3 0.543 2.710 8.723 1.00 0.00 C ATOM 34 NE1 TRP A 3 -0.484 0.682 9.099 1.00 0.00 N ATOM 35 CE2 TRP A 3 -0.551 2.045 9.333 1.00 0.00 C ATOM 36 CE3 TRP A 3 0.619 4.129 8.742 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -1.570 2.791 9.972 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -0.394 4.842 9.384 1.00 0.00 C ATOM 39 CH2 TRP A 3 -1.470 4.184 9.992 1.00 0.00 C ATOM 40 H TRP A 3 0.084 2.528 5.783 1.00 0.00 H ATOM 41 HA TRP A 3 3.062 2.807 5.228 1.00 0.00 H ATOM 42 HB2 TRP A 3 3.280 1.234 7.266 1.00 0.00 H ATOM 43 HB3 TRP A 3 3.018 2.940 7.441 1.00 0.00 H ATOM 44 HD1 TRP A 3 0.921 -0.390 7.802 1.00 0.00 H ATOM 45 HE1 TRP A 3 -1.161 -0.035 9.382 1.00 0.00 H ATOM 46 HE3 TRP A 3 1.425 4.652 8.248 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -2.420 2.297 10.420 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -0.354 5.922 9.399 1.00 0.00 H ATOM 49 HH2 TRP A 3 -2.245 4.765 10.471 1.00 0.00 H ATOM 50 N GLY A 4 2.903 0.815 3.654 1.00 0.00 N ATOM 51 CA GLY A 4 3.061 -0.378 2.790 1.00 0.00 C ATOM 52 C GLY A 4 1.786 -0.845 2.043 1.00 0.00 C ATOM 53 O GLY A 4 1.529 -0.347 0.943 1.00 0.00 O ATOM 54 H GLY A 4 3.329 1.722 3.445 1.00 0.00 H ATOM 55 HA2 GLY A 4 3.829 -0.117 2.032 1.00 0.00 H ATOM 56 HA3 GLY A 4 3.540 -1.202 3.353 1.00 0.00 H ATOM 57 N GLU A 5 1.009 -1.798 2.610 1.00 0.00 N ATOM 58 CA GLU A 5 -0.231 -2.314 1.968 1.00 0.00 C ATOM 59 C GLU A 5 -1.265 -2.649 3.084 1.00 0.00 C ATOM 60 O GLU A 5 -1.404 -3.797 3.517 1.00 0.00 O ATOM 61 CB GLU A 5 0.132 -3.508 1.037 1.00 0.00 C ATOM 62 CG GLU A 5 -1.035 -4.101 0.206 1.00 0.00 C ATOM 63 CD GLU A 5 -0.542 -5.159 -0.797 1.00 0.00 C ATOM 64 OE1 GLU A 5 -0.002 -6.193 -0.394 1.00 0.00 O ATOM 65 H GLU A 5 1.208 -2.063 3.584 1.00 0.00 H ATOM 66 HA GLU A 5 -0.673 -1.529 1.320 1.00 0.00 H ATOM 67 HB2 GLU A 5 0.922 -3.175 0.334 1.00 0.00 H ATOM 68 HB3 GLU A 5 0.603 -4.315 1.633 1.00 0.00 H ATOM 69 HG2 GLU A 5 -1.775 -4.574 0.877 1.00 0.00 H ATOM 70 HG3 GLU A 5 -1.582 -3.283 -0.304 1.00 0.00 H ATOM 71 N SER A 6 -1.977 -1.609 3.550 1.00 0.00 N ATOM 72 CA SER A 6 -3.031 -1.725 4.599 1.00 0.00 C ATOM 73 C SER A 6 -4.095 -0.631 4.286 1.00 0.00 C ATOM 74 O SER A 6 -4.186 0.394 4.967 1.00 0.00 O ATOM 75 CB SER A 6 -2.413 -1.644 6.021 1.00 0.00 C ATOM 76 OG SER A 6 -1.690 -0.432 6.231 1.00 0.00 O ATOM 77 H SER A 6 -1.724 -0.703 3.143 1.00 0.00 H ATOM 78 HA SER A 6 -3.530 -2.712 4.523 1.00 0.00 H ATOM 79 HB2 SER A 6 -3.208 -1.731 6.785 1.00 0.00 H ATOM 80 HB3 SER A 6 -1.738 -2.503 6.192 1.00 0.00 H ATOM 81 HG SER A 6 -1.354 -0.466 7.131 1.00 0.00 H ATOM 82 N GLY A 7 -4.909 -0.874 3.243 1.00 0.00 N ATOM 83 CA GLY A 7 -5.929 0.091 2.763 1.00 0.00 C ATOM 84 C GLY A 7 -5.745 0.303 1.246 1.00 0.00 C ATOM 85 O GLY A 7 -6.598 -0.122 0.463 1.00 0.00 O ATOM 86 H GLY A 7 -4.738 -1.765 2.764 1.00 0.00 H ATOM 87 HA2 GLY A 7 -6.938 -0.312 2.969 1.00 0.00 H ATOM 88 HA3 GLY A 7 -5.883 1.066 3.286 1.00 0.00 H ATOM 89 N LYS A 8 -4.634 0.956 0.838 1.00 0.00 N ATOM 90 CA LYS A 8 -4.315 1.196 -0.596 1.00 0.00 C ATOM 91 C LYS A 8 -3.814 -0.108 -1.297 1.00 0.00 C ATOM 92 O LYS A 8 -3.036 -0.878 -0.720 1.00 0.00 O ATOM 93 CB LYS A 8 -3.324 2.388 -0.748 1.00 0.00 C ATOM 94 CG LYS A 8 -1.838 2.159 -0.362 1.00 0.00 C ATOM 95 CD LYS A 8 -0.969 3.426 -0.529 1.00 0.00 C ATOM 96 CE LYS A 8 0.555 3.206 -0.426 1.00 0.00 C ATOM 97 NZ LYS A 8 1.007 2.788 0.918 1.00 0.00 N ATOM 98 H LYS A 8 -4.003 1.240 1.594 1.00 0.00 H ATOM 99 HA LYS A 8 -5.255 1.525 -1.087 1.00 0.00 H ATOM 100 HB2 LYS A 8 -3.353 2.713 -1.806 1.00 0.00 H ATOM 101 HB3 LYS A 8 -3.718 3.258 -0.187 1.00 0.00 H ATOM 102 HG2 LYS A 8 -1.773 1.792 0.678 1.00 0.00 H ATOM 103 HG3 LYS A 8 -1.420 1.347 -0.987 1.00 0.00 H ATOM 104 HD2 LYS A 8 -1.170 3.865 -1.526 1.00 0.00 H ATOM 105 HD3 LYS A 8 -1.291 4.203 0.190 1.00 0.00 H ATOM 106 HE2 LYS A 8 0.884 2.460 -1.174 1.00 0.00 H ATOM 107 HE3 LYS A 8 1.075 4.143 -0.703 1.00 0.00 H ATOM 108 HZ1 LYS A 8 2.027 2.680 0.964 1.00 0.00 H ATOM 109 HZ2 LYS A 8 0.750 3.466 1.645 1.00 0.00 H ATOM 110 HZ3 LYS A 8 0.606 1.883 1.192 1.00 0.00 H ATOM 111 N LEU A 9 -4.237 -0.326 -2.556 1.00 0.00 N ATOM 112 CA LEU A 9 -3.844 -1.530 -3.352 1.00 0.00 C ATOM 113 C LEU A 9 -2.474 -1.427 -4.111 1.00 0.00 C ATOM 114 O LEU A 9 -2.368 -1.798 -5.284 1.00 0.00 O ATOM 115 CB LEU A 9 -5.060 -1.989 -4.222 1.00 0.00 C ATOM 116 CG LEU A 9 -5.815 -0.979 -5.142 1.00 0.00 C ATOM 117 CD1 LEU A 9 -4.951 -0.356 -6.255 1.00 0.00 C ATOM 118 CD2 LEU A 9 -7.051 -1.653 -5.771 1.00 0.00 C ATOM 119 H LEU A 9 -4.884 0.379 -2.925 1.00 0.00 H ATOM 120 HA LEU A 9 -3.692 -2.373 -2.648 1.00 0.00 H ATOM 121 HB2 LEU A 9 -4.751 -2.865 -4.825 1.00 0.00 H ATOM 122 HB3 LEU A 9 -5.805 -2.412 -3.519 1.00 0.00 H ATOM 123 HG LEU A 9 -6.191 -0.151 -4.512 1.00 0.00 H ATOM 124 HD11 LEU A 9 -4.512 -1.123 -6.919 1.00 0.00 H ATOM 125 HD12 LEU A 9 -5.534 0.336 -6.891 1.00 0.00 H ATOM 126 HD13 LEU A 9 -4.116 0.236 -5.837 1.00 0.00 H ATOM 127 HD21 LEU A 9 -7.642 -0.942 -6.378 1.00 0.00 H ATOM 128 HD22 LEU A 9 -6.775 -2.497 -6.431 1.00 0.00 H ATOM 129 HD23 LEU A 9 -7.736 -2.053 -4.999 1.00 0.00 H ATOM 130 N ILE A 10 -1.404 -0.983 -3.417 1.00 0.00 N ATOM 131 CA ILE A 10 -0.033 -0.844 -4.004 1.00 0.00 C ATOM 132 C ILE A 10 0.757 -2.038 -3.401 1.00 0.00 C ATOM 133 O ILE A 10 1.404 -1.898 -2.356 1.00 0.00 O ATOM 134 CB ILE A 10 0.587 0.574 -3.733 1.00 0.00 C ATOM 135 CG1 ILE A 10 -0.325 1.772 -4.143 1.00 0.00 C ATOM 136 CG2 ILE A 10 1.989 0.755 -4.371 1.00 0.00 C ATOM 137 CD1 ILE A 10 -0.906 1.701 -5.565 1.00 0.00 C ATOM 138 H ILE A 10 -1.611 -0.765 -2.435 1.00 0.00 H ATOM 139 HA ILE A 10 -0.067 -0.934 -5.109 1.00 0.00 H ATOM 140 HB ILE A 10 0.745 0.656 -2.642 1.00 0.00 H ATOM 141 HG12 ILE A 10 -1.172 1.839 -3.435 1.00 0.00 H ATOM 142 HG13 ILE A 10 0.215 2.729 -4.013 1.00 0.00 H ATOM 143 HG21 ILE A 10 2.705 -0.017 -4.035 1.00 0.00 H ATOM 144 HG22 ILE A 10 1.959 0.706 -5.475 1.00 0.00 H ATOM 145 HG23 ILE A 10 2.440 1.730 -4.103 1.00 0.00 H ATOM 146 HD11 ILE A 10 -1.504 2.597 -5.799 1.00 0.00 H ATOM 147 HD12 ILE A 10 -0.112 1.599 -6.326 1.00 0.00 H ATOM 148 HD13 ILE A 10 -1.577 0.829 -5.683 1.00 0.00 H HETATM 149 N SET A 11 0.692 -3.210 -4.065 1.00 0.00 N HETATM 150 CA SET A 11 1.345 -4.452 -3.551 1.00 0.00 C HETATM 151 CB SET A 11 2.434 -5.017 -4.515 1.00 0.00 C HETATM 152 OG SET A 11 2.435 -6.204 -4.851 1.00 0.00 O HETATM 153 NT SET A 11 -0.678 -4.862 -2.096 1.00 0.00 N HETATM 154 C SET A 11 0.210 -5.448 -3.143 1.00 0.00 C HETATM 155 H SET A 11 -0.026 -3.278 -4.795 1.00 0.00 H HETATM 156 HA SET A 11 1.887 -4.254 -2.601 1.00 0.00 H HETATM 157 HB2 SET A 11 -0.403 -5.714 -4.025 1.00 0.00 H HETATM 158 HB3 SET A 11 0.651 -6.407 -2.807 1.00 0.00 H HETATM 159 HNT2 SET A 11 -1.126 -3.951 -2.285 1.00 0.00 H ATOM 160 N THR A 12 3.382 -4.146 -4.921 1.00 0.00 N ATOM 161 CA THR A 12 4.529 -4.500 -5.806 1.00 0.00 C ATOM 162 C THR A 12 5.802 -4.149 -4.978 1.00 0.00 C ATOM 163 O THR A 12 6.415 -5.060 -4.413 1.00 0.00 O ATOM 164 CB THR A 12 4.438 -3.871 -7.232 1.00 0.00 C ATOM 165 OG1 THR A 12 4.244 -2.459 -7.174 1.00 0.00 O ATOM 166 CG2 THR A 12 3.324 -4.468 -8.109 1.00 0.00 C ATOM 167 H THR A 12 3.163 -3.161 -4.732 1.00 0.00 H ATOM 168 HA THR A 12 4.568 -5.598 -5.955 1.00 0.00 H ATOM 169 HB THR A 12 5.397 -4.061 -7.751 1.00 0.00 H ATOM 170 HG1 THR A 12 4.157 -2.166 -8.084 1.00 0.00 H ATOM 171 HG21 THR A 12 3.439 -5.562 -8.224 1.00 0.00 H ATOM 172 HG22 THR A 12 2.321 -4.284 -7.681 1.00 0.00 H ATOM 173 HG23 THR A 12 3.332 -4.032 -9.125 1.00 0.00 H ATOM 174 N THR A 13 6.183 -2.856 -4.879 1.00 0.00 N ATOM 175 CA THR A 13 7.354 -2.401 -4.071 1.00 0.00 C ATOM 176 C THR A 13 6.859 -1.468 -2.910 1.00 0.00 C ATOM 177 O THR A 13 7.272 -0.309 -2.801 1.00 0.00 O ATOM 178 CB THR A 13 8.447 -1.758 -4.982 1.00 0.00 C ATOM 179 OG1 THR A 13 7.916 -0.681 -5.752 1.00 0.00 O ATOM 180 CG2 THR A 13 9.148 -2.739 -5.938 1.00 0.00 C ATOM 181 H THR A 13 5.667 -2.203 -5.477 1.00 0.00 H ATOM 182 HA THR A 13 7.840 -3.261 -3.568 1.00 0.00 H ATOM 183 HB THR A 13 9.231 -1.344 -4.324 1.00 0.00 H ATOM 184 HG1 THR A 13 8.649 -0.339 -6.269 1.00 0.00 H ATOM 185 HG21 THR A 13 8.445 -3.171 -6.675 1.00 0.00 H ATOM 186 HG22 THR A 13 9.954 -2.241 -6.509 1.00 0.00 H ATOM 187 HG23 THR A 13 9.610 -3.581 -5.391 1.00 0.00 H ATOM 188 N ALA A 14 5.974 -1.990 -2.028 1.00 0.00 N ATOM 189 CA ALA A 14 5.411 -1.237 -0.877 1.00 0.00 C ATOM 190 C ALA A 14 4.759 -2.240 0.098 1.00 0.00 C ATOM 191 O ALA A 14 5.235 -2.503 1.202 1.00 0.00 O ATOM 192 CB ALA A 14 4.424 -0.125 -1.303 1.00 0.00 C ATOM 193 OXT ALA A 14 3.597 -2.796 -0.387 1.00 0.00 O ATOM 194 H ALA A 14 5.714 -2.964 -2.220 1.00 0.00 H ATOM 195 HA ALA A 14 6.246 -0.752 -0.333 1.00 0.00 H ATOM 196 HB1 ALA A 14 3.563 -0.523 -1.869 1.00 0.00 H ATOM 197 HB2 ALA A 14 4.018 0.416 -0.429 1.00 0.00 H ATOM 198 HB3 ALA A 14 4.912 0.632 -1.945 1.00 0.00 H ATOM 199 HXT ALA A 14 3.365 -2.448 -1.251 1.00 0.00 H TER 200 ALA A 14