HETATM 1 C ACE A 0 -5.100 -5.173 -0.930 1.00 0.00 C HETATM 2 O ACE A 0 -6.250 -5.269 -0.549 1.00 0.00 O HETATM 3 CH3 ACE A 0 -4.632 -5.898 -2.175 1.00 0.00 C HETATM 4 H1 ACE A 0 -4.896 -6.939 -2.082 1.00 0.00 H HETATM 5 H2 ACE A 0 -3.559 -5.800 -2.257 1.00 0.00 H HETATM 6 H3 ACE A 0 -5.125 -5.468 -3.033 1.00 0.00 H ATOM 7 N PHE A 1 -4.178 -4.464 -0.340 1.00 0.00 N ATOM 8 CA PHE A 1 -4.464 -3.699 0.883 1.00 0.00 C ATOM 9 C PHE A 1 -4.058 -2.250 0.647 1.00 0.00 C ATOM 10 O PHE A 1 -4.838 -1.475 0.130 1.00 0.00 O ATOM 11 CB PHE A 1 -3.685 -4.381 2.074 1.00 0.00 C ATOM 12 CG PHE A 1 -2.187 -4.624 1.784 1.00 0.00 C ATOM 13 CD1 PHE A 1 -1.783 -5.415 0.731 1.00 0.00 C ATOM 14 CD2 PHE A 1 -1.223 -4.048 2.586 1.00 0.00 C ATOM 15 CE1 PHE A 1 -0.447 -5.633 0.480 1.00 0.00 C ATOM 16 CE2 PHE A 1 0.116 -4.260 2.342 1.00 0.00 C ATOM 17 CZ PHE A 1 0.508 -5.054 1.287 1.00 0.00 C ATOM 18 H PHE A 1 -3.275 -4.419 -0.702 1.00 0.00 H ATOM 19 HA PHE A 1 -5.504 -3.750 1.070 1.00 0.00 H ATOM 20 HB2 PHE A 1 -3.772 -3.757 2.952 1.00 0.00 H ATOM 21 HB3 PHE A 1 -4.144 -5.334 2.295 1.00 0.00 H ATOM 22 HD1 PHE A 1 -2.526 -5.861 0.090 1.00 0.00 H ATOM 23 HD2 PHE A 1 -1.525 -3.419 3.409 1.00 0.00 H ATOM 24 HE1 PHE A 1 -0.155 -6.257 -0.351 1.00 0.00 H ATOM 25 HE2 PHE A 1 0.860 -3.801 2.978 1.00 0.00 H ATOM 26 HZ PHE A 1 1.559 -5.218 1.096 1.00 0.00 H ATOM 27 N THR A 2 -2.857 -1.935 1.027 1.00 0.00 N ATOM 28 CA THR A 2 -2.301 -0.575 0.872 1.00 0.00 C ATOM 29 C THR A 2 -1.109 -0.512 -0.071 1.00 0.00 C ATOM 30 O THR A 2 -0.016 -0.143 0.314 1.00 0.00 O ATOM 31 CB THR A 2 -1.933 -0.103 2.267 1.00 0.00 C ATOM 32 OG1 THR A 2 -1.034 -1.072 2.789 1.00 0.00 O ATOM 33 CG2 THR A 2 -3.153 -0.238 3.149 1.00 0.00 C ATOM 34 H THR A 2 -2.302 -2.603 1.449 1.00 0.00 H ATOM 35 HA THR A 2 -3.069 0.077 0.488 1.00 0.00 H ATOM 36 HB THR A 2 -1.479 0.873 2.252 1.00 0.00 H ATOM 37 HG1 THR A 2 -0.354 -0.594 3.279 1.00 0.00 H ATOM 38 HG21 THR A 2 -3.459 -1.279 3.136 1.00 0.00 H ATOM 39 HG22 THR A 2 -2.929 0.077 4.156 1.00 0.00 H ATOM 40 HG23 THR A 2 -3.935 0.381 2.738 1.00 0.00 H ATOM 41 N LEU A 3 -1.338 -0.873 -1.305 1.00 0.00 N ATOM 42 CA LEU A 3 -0.218 -0.827 -2.305 1.00 0.00 C ATOM 43 C LEU A 3 -0.259 0.589 -2.920 1.00 0.00 C ATOM 44 O LEU A 3 -0.106 0.809 -4.105 1.00 0.00 O ATOM 45 CB LEU A 3 -0.446 -1.898 -3.403 1.00 0.00 C ATOM 46 CG LEU A 3 -0.418 -3.366 -2.864 1.00 0.00 C ATOM 47 CD1 LEU A 3 0.863 -3.620 -2.029 1.00 0.00 C ATOM 48 CD2 LEU A 3 -1.657 -3.683 -2.003 1.00 0.00 C ATOM 49 H LEU A 3 -2.236 -1.179 -1.552 1.00 0.00 H ATOM 50 HA LEU A 3 0.734 -0.962 -1.811 1.00 0.00 H ATOM 51 HB2 LEU A 3 -1.395 -1.710 -3.883 1.00 0.00 H ATOM 52 HB3 LEU A 3 0.326 -1.790 -4.152 1.00 0.00 H ATOM 53 HG LEU A 3 -0.411 -4.036 -3.710 1.00 0.00 H ATOM 54 HD11 LEU A 3 1.743 -3.431 -2.628 1.00 0.00 H ATOM 55 HD12 LEU A 3 0.891 -2.981 -1.157 1.00 0.00 H ATOM 56 HD13 LEU A 3 0.892 -4.646 -1.697 1.00 0.00 H ATOM 57 HD21 LEU A 3 -2.561 -3.501 -2.566 1.00 0.00 H ATOM 58 HD22 LEU A 3 -1.634 -4.724 -1.720 1.00 0.00 H ATOM 59 HD23 LEU A 3 -1.682 -3.093 -1.098 1.00 0.00 H ATOM 60 N ASP A 4 -0.471 1.487 -2.000 1.00 0.00 N ATOM 61 CA ASP A 4 -0.578 2.955 -2.183 1.00 0.00 C ATOM 62 C ASP A 4 0.335 3.608 -1.145 1.00 0.00 C ATOM 63 O ASP A 4 1.063 4.536 -1.438 1.00 0.00 O ATOM 64 CB ASP A 4 -2.067 3.357 -1.993 1.00 0.00 C ATOM 65 CG ASP A 4 -2.729 2.501 -0.894 1.00 0.00 C ATOM 66 OD1 ASP A 4 -2.413 2.706 0.265 1.00 0.00 O ATOM 67 OD2 ASP A 4 -3.523 1.665 -1.287 1.00 0.00 O ATOM 68 H ASP A 4 -0.572 1.171 -1.087 1.00 0.00 H ATOM 69 HA ASP A 4 -0.220 3.208 -3.159 1.00 0.00 H ATOM 70 HB2 ASP A 4 -2.136 4.396 -1.708 1.00 0.00 H ATOM 71 HB3 ASP A 4 -2.601 3.222 -2.923 1.00 0.00 H ATOM 72 N ALA A 5 0.254 3.079 0.046 1.00 0.00 N ATOM 73 CA ALA A 5 1.069 3.575 1.197 1.00 0.00 C ATOM 74 C ALA A 5 2.221 2.618 1.442 1.00 0.00 C ATOM 75 O ALA A 5 3.367 3.018 1.482 1.00 0.00 O ATOM 76 CB ALA A 5 0.227 3.624 2.469 1.00 0.00 C ATOM 77 H ALA A 5 -0.374 2.337 0.181 1.00 0.00 H ATOM 78 HA ALA A 5 1.466 4.547 0.969 1.00 0.00 H ATOM 79 HB1 ALA A 5 -0.152 2.635 2.682 1.00 0.00 H ATOM 80 HB2 ALA A 5 0.843 3.919 3.308 1.00 0.00 H ATOM 81 HB3 ALA A 5 -0.605 4.304 2.367 1.00 0.00 H ATOM 82 N ASP A 6 1.800 1.392 1.591 1.00 0.00 N ATOM 83 CA ASP A 6 2.631 0.170 1.856 1.00 0.00 C ATOM 84 C ASP A 6 2.060 -0.436 3.135 1.00 0.00 C ATOM 85 O ASP A 6 2.052 -1.635 3.331 1.00 0.00 O ATOM 86 CB ASP A 6 4.129 0.493 2.116 1.00 0.00 C ATOM 87 CG ASP A 6 4.896 -0.801 2.435 1.00 0.00 C ATOM 88 OD1 ASP A 6 4.967 -1.627 1.538 1.00 0.00 O ATOM 89 OD2 ASP A 6 5.363 -0.891 3.558 1.00 0.00 O ATOM 90 H ASP A 6 0.832 1.268 1.522 1.00 0.00 H ATOM 91 HA ASP A 6 2.501 -0.527 1.051 1.00 0.00 H ATOM 92 HB2 ASP A 6 4.568 0.937 1.234 1.00 0.00 H ATOM 93 HB3 ASP A 6 4.225 1.181 2.943 1.00 0.00 H ATOM 94 N PHE A 7 1.593 0.463 3.958 1.00 0.00 N ATOM 95 CA PHE A 7 0.993 0.116 5.270 1.00 0.00 C ATOM 96 C PHE A 7 -0.439 0.643 5.432 1.00 0.00 C ATOM 97 O PHE A 7 -0.810 1.476 4.626 1.00 0.00 O ATOM 98 CB PHE A 7 1.890 0.684 6.381 1.00 0.00 C ATOM 99 CG PHE A 7 1.861 2.222 6.389 1.00 0.00 C ATOM 100 CD1 PHE A 7 2.329 2.961 5.320 1.00 0.00 C ATOM 101 CD2 PHE A 7 1.360 2.881 7.490 1.00 0.00 C ATOM 102 CE1 PHE A 7 2.300 4.340 5.356 1.00 0.00 C ATOM 103 CE2 PHE A 7 1.328 4.259 7.531 1.00 0.00 C ATOM 104 CZ PHE A 7 1.798 4.991 6.462 1.00 0.00 C ATOM 105 OXT PHE A 7 -1.082 0.186 6.361 1.00 0.00 O ATOM 106 H PHE A 7 1.637 1.396 3.686 1.00 0.00 H ATOM 107 HA PHE A 7 0.978 -0.942 5.351 1.00 0.00 H ATOM 108 HB2 PHE A 7 1.549 0.315 7.337 1.00 0.00 H ATOM 109 HB3 PHE A 7 2.908 0.358 6.227 1.00 0.00 H ATOM 110 HD1 PHE A 7 2.713 2.452 4.448 1.00 0.00 H ATOM 111 HD2 PHE A 7 0.988 2.300 8.320 1.00 0.00 H ATOM 112 HE1 PHE A 7 2.671 4.908 4.515 1.00 0.00 H ATOM 113 HE2 PHE A 7 0.932 4.763 8.400 1.00 0.00 H ATOM 114 HZ PHE A 7 1.774 6.071 6.491 1.00 0.00 H TER 115 PHE A 7