HETATM 1 C ACE A 1 -4.369 -9.353 -3.753 1.00 0.00 C HETATM 2 O ACE A 1 -4.070 -10.097 -2.817 1.00 0.00 O HETATM 3 CH3 ACE A 1 -5.066 -9.907 -4.993 1.00 0.00 C HETATM 4 H1 ACE A 1 -4.489 -9.697 -5.913 1.00 0.00 H HETATM 5 H2 ACE A 1 -5.185 -11.004 -4.924 1.00 0.00 H HETATM 6 H3 ACE A 1 -6.075 -9.473 -5.114 1.00 0.00 H ATOM 7 N ILE A 2 -4.114 -8.039 -3.779 1.00 0.00 N ATOM 8 CA ILE A 2 -3.449 -7.311 -2.660 1.00 0.00 C ATOM 9 C ILE A 2 -4.099 -5.901 -2.632 1.00 0.00 C ATOM 10 O ILE A 2 -3.898 -5.080 -3.531 1.00 0.00 O ATOM 11 CB ILE A 2 -1.885 -7.367 -2.742 1.00 0.00 C ATOM 12 CG1 ILE A 2 -1.152 -7.063 -1.404 1.00 0.00 C ATOM 13 CG2 ILE A 2 -1.224 -6.651 -3.946 1.00 0.00 C ATOM 14 CD1 ILE A 2 -1.139 -5.612 -0.901 1.00 0.00 C ATOM 15 H ILE A 2 -4.480 -7.542 -4.595 1.00 0.00 H ATOM 16 HA ILE A 2 -3.712 -7.839 -1.719 1.00 0.00 H ATOM 17 HB ILE A 2 -1.685 -8.441 -2.896 1.00 0.00 H ATOM 18 HG12 ILE A 2 -1.573 -7.705 -0.606 1.00 0.00 H ATOM 19 HG13 ILE A 2 -0.100 -7.399 -1.493 1.00 0.00 H ATOM 20 HG21 ILE A 2 -1.331 -5.552 -3.892 1.00 0.00 H ATOM 21 HG22 ILE A 2 -0.141 -6.866 -4.008 1.00 0.00 H ATOM 22 HG23 ILE A 2 -1.668 -6.971 -4.907 1.00 0.00 H ATOM 23 HD11 ILE A 2 -2.153 -5.222 -0.701 1.00 0.00 H ATOM 24 HD12 ILE A 2 -0.576 -5.536 0.046 1.00 0.00 H ATOM 25 HD13 ILE A 2 -0.652 -4.931 -1.623 1.00 0.00 H ATOM 26 N TRP A 3 -4.901 -5.660 -1.586 1.00 0.00 N ATOM 27 CA TRP A 3 -5.644 -4.395 -1.384 1.00 0.00 C ATOM 28 C TRP A 3 -5.294 -3.809 0.012 1.00 0.00 C ATOM 29 O TRP A 3 -5.712 -4.334 1.049 1.00 0.00 O ATOM 30 CB TRP A 3 -7.172 -4.627 -1.569 1.00 0.00 C ATOM 31 CG TRP A 3 -7.620 -4.858 -3.023 1.00 0.00 C ATOM 32 CD1 TRP A 3 -7.476 -6.058 -3.758 1.00 0.00 C ATOM 33 CD2 TRP A 3 -8.198 -3.956 -3.902 1.00 0.00 C ATOM 34 NE1 TRP A 3 -7.944 -5.924 -5.078 1.00 0.00 N ATOM 35 CE2 TRP A 3 -8.388 -4.613 -5.144 1.00 0.00 C ATOM 36 CE3 TRP A 3 -8.576 -2.597 -3.742 1.00 0.00 C ATOM 37 CZ2 TRP A 3 -8.956 -3.914 -6.237 1.00 0.00 C ATOM 38 CZ3 TRP A 3 -9.135 -1.931 -4.834 1.00 0.00 C ATOM 39 CH2 TRP A 3 -9.323 -2.579 -6.062 1.00 0.00 C ATOM 40 H TRP A 3 -4.965 -6.440 -0.938 1.00 0.00 H ATOM 41 HA TRP A 3 -5.334 -3.679 -2.158 1.00 0.00 H ATOM 42 HB2 TRP A 3 -7.514 -5.470 -0.938 1.00 0.00 H ATOM 43 HB3 TRP A 3 -7.723 -3.754 -1.171 1.00 0.00 H ATOM 44 HD1 TRP A 3 -7.010 -6.957 -3.375 1.00 0.00 H ATOM 45 HE1 TRP A 3 -7.943 -6.627 -5.826 1.00 0.00 H ATOM 46 HE3 TRP A 3 -8.430 -2.082 -2.805 1.00 0.00 H ATOM 47 HZ2 TRP A 3 -9.102 -4.402 -7.189 1.00 0.00 H ATOM 48 HZ3 TRP A 3 -9.427 -0.896 -4.730 1.00 0.00 H ATOM 49 HH2 TRP A 3 -9.757 -2.035 -6.888 1.00 0.00 H ATOM 50 N GLY A 4 -4.521 -2.712 0.006 1.00 0.00 N ATOM 51 CA GLY A 4 -4.082 -2.015 1.235 1.00 0.00 C ATOM 52 C GLY A 4 -2.689 -1.414 0.991 1.00 0.00 C ATOM 53 O GLY A 4 -2.568 -0.385 0.319 1.00 0.00 O ATOM 54 H GLY A 4 -4.224 -2.398 -0.924 1.00 0.00 H ATOM 55 HA2 GLY A 4 -4.793 -1.201 1.468 1.00 0.00 H ATOM 56 HA3 GLY A 4 -4.090 -2.683 2.120 1.00 0.00 H HETATM 57 N BCX A 5 -1.652 -2.070 1.540 1.00 0.00 N HETATM 58 CC BCX A 5 0.457 -2.672 0.489 1.00 0.00 C HETATM 59 CA BCX A 5 -0.242 -1.638 1.375 1.00 0.00 C HETATM 60 C BCX A 5 1.863 -2.260 0.038 1.00 0.00 C HETATM 61 O BCX A 5 2.046 -1.366 -0.787 1.00 0.00 O HETATM 62 CB BCX A 5 0.428 -1.467 2.762 1.00 0.00 C HETATM 63 SG BCX A 5 2.080 -0.763 2.665 1.00 0.00 S HETATM 64 H BCX A 5 -1.905 -2.920 2.056 1.00 0.00 H HETATM 65 HC1 BCX A 5 -0.133 -2.828 -0.434 1.00 0.00 H HETATM 66 HC2 BCX A 5 0.443 -3.663 0.989 1.00 0.00 H HETATM 67 HA BCX A 5 -0.184 -0.699 0.802 1.00 0.00 H HETATM 68 HB2 BCX A 5 -0.151 -0.783 3.404 1.00 0.00 H HETATM 69 HB3 BCX A 5 0.527 -2.430 3.295 1.00 0.00 H ATOM 70 N SER A 6 2.823 -3.056 0.497 1.00 0.00 N ATOM 71 CA SER A 6 4.056 -3.347 -0.291 1.00 0.00 C ATOM 72 C SER A 6 3.676 -4.193 -1.551 1.00 0.00 C ATOM 73 O SER A 6 3.739 -5.426 -1.566 1.00 0.00 O ATOM 74 CB SER A 6 5.080 -3.969 0.685 1.00 0.00 C ATOM 75 OG SER A 6 6.303 -4.254 0.016 1.00 0.00 O ATOM 76 H SER A 6 2.372 -3.733 1.122 1.00 0.00 H ATOM 77 HA SER A 6 4.505 -2.387 -0.619 1.00 0.00 H ATOM 78 HB2 SER A 6 5.285 -3.269 1.524 1.00 0.00 H ATOM 79 HB3 SER A 6 4.686 -4.889 1.158 1.00 0.00 H ATOM 80 HG SER A 6 6.883 -4.656 0.669 1.00 0.00 H ATOM 81 N GLY A 7 3.255 -3.454 -2.593 1.00 0.00 N ATOM 82 CA GLY A 7 2.743 -4.018 -3.861 1.00 0.00 C ATOM 83 C GLY A 7 1.621 -3.101 -4.422 1.00 0.00 C ATOM 84 O GLY A 7 1.677 -2.723 -5.595 1.00 0.00 O ATOM 85 H GLY A 7 3.139 -2.450 -2.385 1.00 0.00 H ATOM 86 HA2 GLY A 7 3.568 -4.102 -4.592 1.00 0.00 H ATOM 87 HA3 GLY A 7 2.340 -5.041 -3.727 1.00 0.00 H ATOM 88 N LYS A 8 0.604 -2.760 -3.593 1.00 0.00 N ATOM 89 CA LYS A 8 -0.513 -1.858 -3.976 1.00 0.00 C ATOM 90 C LYS A 8 -0.047 -0.365 -3.983 1.00 0.00 C ATOM 91 O LYS A 8 0.030 0.249 -5.050 1.00 0.00 O ATOM 92 CB LYS A 8 -1.716 -2.126 -3.013 1.00 0.00 C ATOM 93 CG LYS A 8 -3.057 -1.448 -3.381 1.00 0.00 C ATOM 94 CD LYS A 8 -3.655 -1.863 -4.741 1.00 0.00 C ATOM 95 CE LYS A 8 -5.096 -1.363 -4.932 1.00 0.00 C ATOM 96 NZ LYS A 8 -5.635 -1.794 -6.235 1.00 0.00 N ATOM 97 H LYS A 8 0.736 -3.046 -2.618 1.00 0.00 H ATOM 98 HA LYS A 8 -0.833 -2.124 -5.002 1.00 0.00 H ATOM 99 HB2 LYS A 8 -1.890 -3.211 -2.899 1.00 0.00 H ATOM 100 HB3 LYS A 8 -1.449 -1.798 -1.985 1.00 0.00 H ATOM 101 HG2 LYS A 8 -3.783 -1.681 -2.580 1.00 0.00 H ATOM 102 HG3 LYS A 8 -2.941 -0.348 -3.346 1.00 0.00 H ATOM 103 HD2 LYS A 8 -3.015 -1.474 -5.557 1.00 0.00 H ATOM 104 HD3 LYS A 8 -3.628 -2.963 -4.840 1.00 0.00 H ATOM 105 HE2 LYS A 8 -5.746 -1.749 -4.125 1.00 0.00 H ATOM 106 HE3 LYS A 8 -5.137 -0.260 -4.866 1.00 0.00 H ATOM 107 HZ1 LYS A 8 -5.639 -2.818 -6.294 1.00 0.00 H ATOM 108 HZ2 LYS A 8 -6.617 -1.510 -6.327 1.00 0.00 H ATOM 109 N LEU A 9 0.258 0.197 -2.795 1.00 0.00 N ATOM 110 CA LEU A 9 0.698 1.598 -2.616 1.00 0.00 C ATOM 111 C LEU A 9 1.548 1.571 -1.315 1.00 0.00 C ATOM 112 O LEU A 9 1.000 1.381 -0.221 1.00 0.00 O ATOM 113 CB LEU A 9 -0.575 2.476 -2.502 1.00 0.00 C ATOM 114 CG LEU A 9 -0.409 4.021 -2.578 1.00 0.00 C ATOM 115 CD1 LEU A 9 -1.782 4.690 -2.781 1.00 0.00 C ATOM 116 CD2 LEU A 9 0.281 4.647 -1.349 1.00 0.00 C ATOM 117 H LEU A 9 0.076 -0.389 -1.975 1.00 0.00 H ATOM 118 HA LEU A 9 1.289 1.929 -3.493 1.00 0.00 H ATOM 119 HB2 LEU A 9 -1.235 2.169 -3.337 1.00 0.00 H ATOM 120 HB3 LEU A 9 -1.126 2.180 -1.588 1.00 0.00 H ATOM 121 HG LEU A 9 0.205 4.258 -3.469 1.00 0.00 H ATOM 122 HD11 LEU A 9 -1.692 5.787 -2.895 1.00 0.00 H ATOM 123 HD12 LEU A 9 -2.288 4.321 -3.693 1.00 0.00 H ATOM 124 HD13 LEU A 9 -2.465 4.504 -1.930 1.00 0.00 H ATOM 125 HD21 LEU A 9 0.307 5.752 -1.408 1.00 0.00 H ATOM 126 HD22 LEU A 9 -0.230 4.381 -0.404 1.00 0.00 H ATOM 127 HD23 LEU A 9 1.333 4.324 -1.256 1.00 0.00 H ATOM 128 N ILE A 10 2.876 1.766 -1.427 1.00 0.00 N ATOM 129 CA ILE A 10 3.818 1.740 -0.265 1.00 0.00 C ATOM 130 C ILE A 10 3.424 2.684 0.926 1.00 0.00 C ATOM 131 O ILE A 10 3.309 3.904 0.777 1.00 0.00 O ATOM 132 CB ILE A 10 5.326 1.901 -0.703 1.00 0.00 C ATOM 133 CG1 ILE A 10 5.685 2.947 -1.806 1.00 0.00 C ATOM 134 CG2 ILE A 10 5.921 0.535 -1.131 1.00 0.00 C ATOM 135 CD1 ILE A 10 5.312 4.410 -1.530 1.00 0.00 C ATOM 136 H ILE A 10 3.223 1.814 -2.389 1.00 0.00 H ATOM 137 HA ILE A 10 3.729 0.703 0.125 1.00 0.00 H ATOM 138 HB ILE A 10 5.905 2.188 0.198 1.00 0.00 H ATOM 139 HG12 ILE A 10 6.777 2.921 -1.986 1.00 0.00 H ATOM 140 HG13 ILE A 10 5.235 2.649 -2.773 1.00 0.00 H ATOM 141 HG21 ILE A 10 7.001 0.604 -1.361 1.00 0.00 H ATOM 142 HG22 ILE A 10 5.823 -0.223 -0.331 1.00 0.00 H ATOM 143 HG23 ILE A 10 5.419 0.128 -2.029 1.00 0.00 H ATOM 144 HD11 ILE A 10 5.711 4.763 -0.562 1.00 0.00 H ATOM 145 HD12 ILE A 10 5.714 5.078 -2.313 1.00 0.00 H ATOM 146 HD13 ILE A 10 4.217 4.557 -1.516 1.00 0.00 H ATOM 147 N CYS A 11 3.203 2.074 2.107 1.00 0.00 N ATOM 148 CA CYS A 11 2.807 2.786 3.348 1.00 0.00 C ATOM 149 C CYS A 11 4.055 3.236 4.162 1.00 0.00 C ATOM 150 O CYS A 11 4.464 2.593 5.135 1.00 0.00 O ATOM 151 CB CYS A 11 1.829 1.903 4.151 1.00 0.00 C ATOM 152 SG CYS A 11 2.451 0.224 4.362 1.00 0.00 S ATOM 153 H CYS A 11 3.348 1.061 2.097 1.00 0.00 H ATOM 154 HA CYS A 11 2.200 3.670 3.082 1.00 0.00 H ATOM 155 HB2 CYS A 11 1.620 2.343 5.143 1.00 0.00 H ATOM 156 HB3 CYS A 11 0.852 1.843 3.636 1.00 0.00 H ATOM 157 N THR A 12 4.642 4.374 3.748 1.00 0.00 N ATOM 158 CA THR A 12 5.847 4.959 4.393 1.00 0.00 C ATOM 159 C THR A 12 5.428 5.797 5.637 1.00 0.00 C ATOM 160 O THR A 12 4.920 6.916 5.506 1.00 0.00 O ATOM 161 CB THR A 12 6.690 5.800 3.387 1.00 0.00 C ATOM 162 OG1 THR A 12 5.904 6.848 2.825 1.00 0.00 O ATOM 163 CG2 THR A 12 7.327 4.992 2.242 1.00 0.00 C ATOM 164 H THR A 12 4.325 4.699 2.833 1.00 0.00 H ATOM 165 HA THR A 12 6.499 4.124 4.704 1.00 0.00 H ATOM 166 HB THR A 12 7.524 6.270 3.945 1.00 0.00 H ATOM 167 HG1 THR A 12 5.385 7.194 3.558 1.00 0.00 H ATOM 168 HG21 THR A 12 7.921 5.642 1.573 1.00 0.00 H ATOM 169 HG22 THR A 12 8.004 4.208 2.625 1.00 0.00 H ATOM 170 HG23 THR A 12 6.563 4.492 1.619 1.00 0.00 H ATOM 171 N THR A 13 5.638 5.229 6.835 1.00 0.00 N ATOM 172 CA THR A 13 5.284 5.872 8.125 1.00 0.00 C ATOM 173 C THR A 13 6.441 5.574 9.120 1.00 0.00 C ATOM 174 O THR A 13 6.548 4.471 9.669 1.00 0.00 O ATOM 175 CB THR A 13 3.901 5.384 8.658 1.00 0.00 C ATOM 176 OG1 THR A 13 3.778 3.967 8.578 1.00 0.00 O ATOM 177 CG2 THR A 13 2.688 6.003 7.943 1.00 0.00 C ATOM 178 H THR A 13 6.040 4.288 6.824 1.00 0.00 H ATOM 179 HA THR A 13 5.210 6.973 7.996 1.00 0.00 H ATOM 180 HB THR A 13 3.837 5.672 9.721 1.00 0.00 H ATOM 181 HG1 THR A 13 3.878 3.758 7.646 1.00 0.00 H ATOM 182 HG21 THR A 13 2.652 5.725 6.874 1.00 0.00 H ATOM 183 HG22 THR A 13 1.740 5.665 8.400 1.00 0.00 H ATOM 184 HG23 THR A 13 2.701 7.108 7.998 1.00 0.00 H ATOM 185 N ALA A 14 7.305 6.581 9.339 1.00 0.00 N ATOM 186 CA ALA A 14 8.466 6.473 10.255 1.00 0.00 C ATOM 187 C ALA A 14 8.082 6.901 11.690 1.00 0.00 C ATOM 188 O ALA A 14 7.736 8.041 12.002 1.00 0.00 O ATOM 189 CB ALA A 14 9.616 7.331 9.698 1.00 0.00 C ATOM 190 OXT ALA A 14 8.167 5.862 12.579 1.00 0.00 O ATOM 191 H ALA A 14 7.113 7.420 8.782 1.00 0.00 H ATOM 192 HA ALA A 14 8.833 5.427 10.278 1.00 0.00 H ATOM 193 HB1 ALA A 14 9.348 8.404 9.630 1.00 0.00 H ATOM 194 HB2 ALA A 14 10.518 7.262 10.334 1.00 0.00 H ATOM 195 HB3 ALA A 14 9.918 7.005 8.685 1.00 0.00 H ATOM 196 HXT ALA A 14 7.921 6.141 13.464 1.00 0.00 H TER 197 ALA A 14