HETATM 1 C ACE A 1 -8.082 -4.566 3.702 1.00 0.00 C HETATM 2 O ACE A 1 -8.787 -4.866 2.736 1.00 0.00 O HETATM 3 CH3 ACE A 1 -7.411 -5.651 4.538 1.00 0.00 C HETATM 4 H1 ACE A 1 -7.804 -5.664 5.571 1.00 0.00 H HETATM 5 H2 ACE A 1 -7.587 -6.653 4.106 1.00 0.00 H HETATM 6 H3 ACE A 1 -6.315 -5.507 4.591 1.00 0.00 H ATOM 7 N ILE A 2 -7.837 -3.309 4.091 1.00 0.00 N ATOM 8 CA ILE A 2 -8.409 -2.112 3.401 1.00 0.00 C ATOM 9 C ILE A 2 -7.509 -1.640 2.212 1.00 0.00 C ATOM 10 O ILE A 2 -6.276 -1.704 2.277 1.00 0.00 O ATOM 11 CB ILE A 2 -8.722 -0.942 4.405 1.00 0.00 C ATOM 12 CG1 ILE A 2 -7.493 -0.399 5.199 1.00 0.00 C ATOM 13 CG2 ILE A 2 -9.897 -1.297 5.352 1.00 0.00 C ATOM 14 CD1 ILE A 2 -7.671 1.014 5.776 1.00 0.00 C ATOM 15 H ILE A 2 -7.219 -3.224 4.905 1.00 0.00 H ATOM 16 HA ILE A 2 -9.389 -2.409 2.971 1.00 0.00 H ATOM 17 HB ILE A 2 -9.095 -0.100 3.789 1.00 0.00 H ATOM 18 HG12 ILE A 2 -7.219 -1.100 6.010 1.00 0.00 H ATOM 19 HG13 ILE A 2 -6.605 -0.368 4.541 1.00 0.00 H ATOM 20 HG21 ILE A 2 -10.217 -0.431 5.961 1.00 0.00 H ATOM 21 HG22 ILE A 2 -10.789 -1.629 4.789 1.00 0.00 H ATOM 22 HG23 ILE A 2 -9.633 -2.110 6.054 1.00 0.00 H ATOM 23 HD11 ILE A 2 -8.487 1.060 6.519 1.00 0.00 H ATOM 24 HD12 ILE A 2 -6.749 1.355 6.280 1.00 0.00 H ATOM 25 HD13 ILE A 2 -7.900 1.749 4.982 1.00 0.00 H ATOM 26 N TRP A 3 -8.150 -1.142 1.137 1.00 0.00 N ATOM 27 CA TRP A 3 -7.440 -0.636 -0.070 1.00 0.00 C ATOM 28 C TRP A 3 -7.256 0.904 0.020 1.00 0.00 C ATOM 29 O TRP A 3 -8.199 1.670 0.248 1.00 0.00 O ATOM 30 CB TRP A 3 -8.173 -1.047 -1.376 1.00 0.00 C ATOM 31 CG TRP A 3 -7.779 -2.444 -1.866 1.00 0.00 C ATOM 32 CD1 TRP A 3 -8.300 -3.655 -1.380 1.00 0.00 C ATOM 33 CD2 TRP A 3 -6.769 -2.798 -2.744 1.00 0.00 C ATOM 34 NE1 TRP A 3 -7.671 -4.770 -1.964 1.00 0.00 N ATOM 35 CE2 TRP A 3 -6.712 -4.213 -2.797 1.00 0.00 C ATOM 36 CE3 TRP A 3 -5.821 -2.013 -3.449 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -5.707 -4.855 -3.560 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -4.847 -2.668 -4.204 1.00 0.00 C ATOM 39 CH2 TRP A 3 -4.789 -4.067 -4.258 1.00 0.00 C ATOM 40 H TRP A 3 -9.172 -1.116 1.214 1.00 0.00 H ATOM 41 HA TRP A 3 -6.435 -1.109 -0.114 1.00 0.00 H ATOM 42 HB2 TRP A 3 -9.271 -0.971 -1.261 1.00 0.00 H ATOM 43 HB3 TRP A 3 -7.940 -0.331 -2.188 1.00 0.00 H ATOM 44 HD1 TRP A 3 -9.018 -3.702 -0.577 1.00 0.00 H ATOM 45 HE1 TRP A 3 -7.811 -5.761 -1.739 1.00 0.00 H ATOM 46 HE3 TRP A 3 -5.837 -0.934 -3.396 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -5.638 -5.932 -3.591 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -4.121 -2.084 -4.749 1.00 0.00 H ATOM 49 HH2 TRP A 3 -4.017 -4.544 -4.844 1.00 0.00 H ATOM 50 N GLY A 4 -6.006 1.319 -0.199 1.00 0.00 N ATOM 51 CA GLY A 4 -5.600 2.739 -0.152 1.00 0.00 C ATOM 52 C GLY A 4 -4.069 2.859 -0.279 1.00 0.00 C ATOM 53 O GLY A 4 -3.328 2.130 0.390 1.00 0.00 O ATOM 54 H GLY A 4 -5.347 0.547 -0.362 1.00 0.00 H ATOM 55 HA2 GLY A 4 -6.125 3.303 -0.948 1.00 0.00 H ATOM 56 HA3 GLY A 4 -5.912 3.195 0.807 1.00 0.00 H HETATM 57 N SET A 5 -3.591 3.810 -1.105 1.00 0.00 N HETATM 58 CA SET A 5 -2.131 4.012 -1.327 1.00 0.00 C HETATM 59 CB SET A 5 -1.489 4.822 -0.159 1.00 0.00 C HETATM 60 OG SET A 5 -1.539 6.056 -0.137 1.00 0.00 O HETATM 61 NT SET A 5 -0.595 4.172 -3.309 1.00 0.00 N HETATM 62 C SET A 5 -1.882 4.639 -2.735 1.00 0.00 C HETATM 63 H SET A 5 -4.304 4.363 -1.593 1.00 0.00 H HETATM 64 HA SET A 5 -1.675 3.000 -1.346 1.00 0.00 H HETATM 65 HB2 SET A 5 -2.716 4.410 -3.431 1.00 0.00 H HETATM 66 HB3 SET A 5 -1.880 5.744 -2.686 1.00 0.00 H HETATM 67 HNT2 SET A 5 0.303 4.402 -2.870 1.00 0.00 H ATOM 68 N SER A 6 -0.913 4.100 0.822 1.00 0.00 N ATOM 69 CA SER A 6 -0.268 4.695 2.021 1.00 0.00 C ATOM 70 C SER A 6 0.644 3.604 2.645 1.00 0.00 C ATOM 71 O SER A 6 0.168 2.539 3.060 1.00 0.00 O ATOM 72 CB SER A 6 -1.301 5.180 3.073 1.00 0.00 C ATOM 73 OG SER A 6 -1.988 6.343 2.626 1.00 0.00 O ATOM 74 H SER A 6 -0.878 3.087 0.654 1.00 0.00 H ATOM 75 HA SER A 6 0.341 5.568 1.711 1.00 0.00 H ATOM 76 HB2 SER A 6 -2.035 4.384 3.309 1.00 0.00 H ATOM 77 HB3 SER A 6 -0.801 5.423 4.029 1.00 0.00 H ATOM 78 HG SER A 6 -2.198 6.190 1.699 1.00 0.00 H ATOM 79 N GLY A 7 1.954 3.881 2.713 1.00 0.00 N ATOM 80 CA GLY A 7 2.928 2.929 3.286 1.00 0.00 C ATOM 81 C GLY A 7 4.350 3.502 3.229 1.00 0.00 C ATOM 82 O GLY A 7 4.749 4.250 4.126 1.00 0.00 O ATOM 83 H GLY A 7 2.229 4.800 2.347 1.00 0.00 H ATOM 84 HA2 GLY A 7 2.671 2.722 4.343 1.00 0.00 H ATOM 85 HA3 GLY A 7 2.865 1.951 2.769 1.00 0.00 H ATOM 86 N LYS A 8 5.110 3.129 2.184 1.00 0.00 N ATOM 87 CA LYS A 8 6.507 3.609 1.991 1.00 0.00 C ATOM 88 C LYS A 8 6.831 3.584 0.467 1.00 0.00 C ATOM 89 O LYS A 8 6.663 4.612 -0.195 1.00 0.00 O ATOM 90 CB LYS A 8 7.507 2.867 2.935 1.00 0.00 C ATOM 91 CG LYS A 8 8.940 3.446 2.937 1.00 0.00 C ATOM 92 CD LYS A 8 9.887 2.696 3.896 1.00 0.00 C ATOM 93 CE LYS A 8 11.312 3.278 3.889 1.00 0.00 C ATOM 94 NZ LYS A 8 12.192 2.537 4.817 1.00 0.00 N ATOM 95 H LYS A 8 4.605 2.589 1.470 1.00 0.00 H ATOM 96 HA LYS A 8 6.539 4.679 2.282 1.00 0.00 H ATOM 97 HB2 LYS A 8 7.121 2.903 3.972 1.00 0.00 H ATOM 98 HB3 LYS A 8 7.536 1.790 2.680 1.00 0.00 H ATOM 99 HG2 LYS A 8 9.355 3.416 1.911 1.00 0.00 H ATOM 100 HG3 LYS A 8 8.901 4.518 3.214 1.00 0.00 H ATOM 101 HD2 LYS A 8 9.470 2.730 4.921 1.00 0.00 H ATOM 102 HD3 LYS A 8 9.915 1.624 3.617 1.00 0.00 H ATOM 103 HE2 LYS A 8 11.739 3.241 2.867 1.00 0.00 H ATOM 104 HE3 LYS A 8 11.293 4.348 4.172 1.00 0.00 H ATOM 105 HZ1 LYS A 8 12.262 1.544 4.568 1.00 0.00 H ATOM 106 HZ2 LYS A 8 13.148 2.911 4.827 1.00 0.00 H ATOM 107 HZ3 LYS A 8 11.847 2.576 5.783 1.00 0.00 H ATOM 108 N LEU A 9 7.283 2.436 -0.083 1.00 0.00 N ATOM 109 CA LEU A 9 7.627 2.295 -1.527 1.00 0.00 C ATOM 110 C LEU A 9 6.475 1.662 -2.375 1.00 0.00 C ATOM 111 O LEU A 9 6.217 2.183 -3.464 1.00 0.00 O ATOM 112 CB LEU A 9 9.034 1.615 -1.636 1.00 0.00 C ATOM 113 CG LEU A 9 9.723 1.437 -3.022 1.00 0.00 C ATOM 114 CD1 LEU A 9 9.160 0.275 -3.862 1.00 0.00 C ATOM 115 CD2 LEU A 9 9.802 2.735 -3.849 1.00 0.00 C ATOM 116 H LEU A 9 7.384 1.658 0.577 1.00 0.00 H ATOM 117 HA LEU A 9 7.777 3.308 -1.949 1.00 0.00 H ATOM 118 HB2 LEU A 9 9.746 2.216 -1.031 1.00 0.00 H ATOM 119 HB3 LEU A 9 9.031 0.635 -1.123 1.00 0.00 H ATOM 120 HG LEU A 9 10.769 1.153 -2.798 1.00 0.00 H ATOM 121 HD11 LEU A 9 8.142 0.475 -4.242 1.00 0.00 H ATOM 122 HD12 LEU A 9 9.794 0.072 -4.745 1.00 0.00 H ATOM 123 HD13 LEU A 9 9.115 -0.665 -3.281 1.00 0.00 H ATOM 124 HD21 LEU A 9 10.417 2.602 -4.759 1.00 0.00 H ATOM 125 HD22 LEU A 9 8.805 3.080 -4.178 1.00 0.00 H ATOM 126 HD23 LEU A 9 10.261 3.559 -3.271 1.00 0.00 H ATOM 127 N ILE A 10 5.790 0.578 -1.933 1.00 0.00 N ATOM 128 CA ILE A 10 4.689 -0.061 -2.714 1.00 0.00 C ATOM 129 C ILE A 10 3.311 0.544 -2.302 1.00 0.00 C ATOM 130 O ILE A 10 3.010 0.708 -1.114 1.00 0.00 O ATOM 131 CB ILE A 10 4.729 -1.634 -2.659 1.00 0.00 C ATOM 132 CG1 ILE A 10 4.563 -2.304 -1.257 1.00 0.00 C ATOM 133 CG2 ILE A 10 5.992 -2.189 -3.365 1.00 0.00 C ATOM 134 CD1 ILE A 10 3.115 -2.634 -0.858 1.00 0.00 C ATOM 135 H ILE A 10 5.909 0.337 -0.943 1.00 0.00 H ATOM 136 HA ILE A 10 4.848 0.181 -3.786 1.00 0.00 H ATOM 137 HB ILE A 10 3.892 -1.989 -3.292 1.00 0.00 H ATOM 138 HG12 ILE A 10 5.120 -3.260 -1.214 1.00 0.00 H ATOM 139 HG13 ILE A 10 5.030 -1.682 -0.471 1.00 0.00 H ATOM 140 HG21 ILE A 10 6.919 -1.942 -2.813 1.00 0.00 H ATOM 141 HG22 ILE A 10 5.956 -3.290 -3.465 1.00 0.00 H ATOM 142 HG23 ILE A 10 6.104 -1.784 -4.388 1.00 0.00 H ATOM 143 HD11 ILE A 10 2.639 -3.319 -1.584 1.00 0.00 H ATOM 144 HD12 ILE A 10 3.077 -3.131 0.128 1.00 0.00 H ATOM 145 HD13 ILE A 10 2.475 -1.738 -0.789 1.00 0.00 H ATOM 146 N ASP A 11 2.481 0.870 -3.308 1.00 0.00 N ATOM 147 CA ASP A 11 1.125 1.447 -3.089 1.00 0.00 C ATOM 148 C ASP A 11 -0.005 0.397 -2.799 1.00 0.00 C ATOM 149 O ASP A 11 -0.860 0.680 -1.956 1.00 0.00 O ATOM 150 CB ASP A 11 0.803 2.397 -4.284 1.00 0.00 C ATOM 151 CG ASP A 11 -0.542 3.142 -4.169 1.00 0.00 C ATOM 152 OD1 ASP A 11 -1.520 2.722 -4.793 1.00 0.00 O ATOM 153 H ASP A 11 2.893 0.785 -4.245 1.00 0.00 H ATOM 154 HA ASP A 11 1.175 2.098 -2.192 1.00 0.00 H ATOM 155 HB2 ASP A 11 1.614 3.140 -4.414 1.00 0.00 H ATOM 156 HB3 ASP A 11 0.798 1.820 -5.229 1.00 0.00 H ATOM 157 N THR A 12 -0.034 -0.774 -3.473 1.00 0.00 N ATOM 158 CA THR A 12 -1.087 -1.816 -3.280 1.00 0.00 C ATOM 159 C THR A 12 -1.165 -2.381 -1.825 1.00 0.00 C ATOM 160 O THR A 12 -0.160 -2.839 -1.271 1.00 0.00 O ATOM 161 CB THR A 12 -0.928 -2.981 -4.307 1.00 0.00 C ATOM 162 OG1 THR A 12 0.323 -3.648 -4.149 1.00 0.00 O ATOM 163 CG2 THR A 12 -1.072 -2.576 -5.785 1.00 0.00 C ATOM 164 H THR A 12 0.702 -0.884 -4.176 1.00 0.00 H ATOM 165 HA THR A 12 -2.053 -1.326 -3.521 1.00 0.00 H ATOM 166 HB THR A 12 -1.724 -3.724 -4.108 1.00 0.00 H ATOM 167 HG1 THR A 12 1.000 -2.986 -4.306 1.00 0.00 H ATOM 168 HG21 THR A 12 -2.041 -2.082 -5.982 1.00 0.00 H ATOM 169 HG22 THR A 12 -0.276 -1.878 -6.104 1.00 0.00 H ATOM 170 HG23 THR A 12 -1.016 -3.458 -6.449 1.00 0.00 H ATOM 171 N THR A 13 -2.369 -2.328 -1.226 1.00 0.00 N ATOM 172 CA THR A 13 -2.623 -2.823 0.156 1.00 0.00 C ATOM 173 C THR A 13 -3.838 -3.787 0.067 1.00 0.00 C ATOM 174 O THR A 13 -4.994 -3.355 0.005 1.00 0.00 O ATOM 175 CB THR A 13 -2.833 -1.676 1.194 1.00 0.00 C ATOM 176 OG1 THR A 13 -3.924 -0.837 0.831 1.00 0.00 O ATOM 177 CG2 THR A 13 -1.601 -0.784 1.430 1.00 0.00 C ATOM 178 H THR A 13 -3.133 -1.982 -1.814 1.00 0.00 H ATOM 179 HA THR A 13 -1.748 -3.399 0.522 1.00 0.00 H ATOM 180 HB THR A 13 -3.079 -2.140 2.168 1.00 0.00 H ATOM 181 HG1 THR A 13 -4.717 -1.360 0.983 1.00 0.00 H ATOM 182 HG21 THR A 13 -0.722 -1.374 1.749 1.00 0.00 H ATOM 183 HG22 THR A 13 -1.315 -0.229 0.518 1.00 0.00 H ATOM 184 HG23 THR A 13 -1.795 -0.032 2.217 1.00 0.00 H ATOM 185 N ALA A 14 -3.558 -5.103 0.065 1.00 0.00 N ATOM 186 CA ALA A 14 -4.597 -6.158 -0.028 1.00 0.00 C ATOM 187 C ALA A 14 -5.464 -6.279 1.247 1.00 0.00 C ATOM 188 O ALA A 14 -5.019 -6.545 2.364 1.00 0.00 O ATOM 189 CB ALA A 14 -3.910 -7.493 -0.365 1.00 0.00 C ATOM 190 OXT ALA A 14 -6.789 -6.040 0.990 1.00 0.00 O ATOM 191 H ALA A 14 -2.556 -5.316 0.031 1.00 0.00 H ATOM 192 HA ALA A 14 -5.258 -5.920 -0.882 1.00 0.00 H ATOM 193 HB1 ALA A 14 -3.210 -7.819 0.428 1.00 0.00 H ATOM 194 HB2 ALA A 14 -4.649 -8.306 -0.499 1.00 0.00 H ATOM 195 HB3 ALA A 14 -3.335 -7.433 -1.309 1.00 0.00 H ATOM 196 HXT ALA A 14 -7.318 -6.071 1.791 1.00 0.00 H TER 197 ALA A 14