HETATM 1 C ACE A 6 -6.922 -4.682 -2.010 1.00 0.00 C HETATM 2 O ACE A 6 -7.137 -5.079 -0.870 1.00 0.00 O HETATM 3 CH3 ACE A 6 -5.723 -5.180 -2.798 1.00 0.00 C HETATM 4 H1 ACE A 6 -5.209 -5.958 -2.222 1.00 0.00 H HETATM 5 H2 ACE A 6 -6.033 -5.605 -3.764 1.00 0.00 H HETATM 6 H3 ACE A 6 -5.018 -4.354 -2.979 1.00 0.00 H ATOM 7 N SER A 5 -7.733 -3.767 -2.641 1.00 0.00 N ATOM 8 CA SER A 5 -8.920 -3.098 -2.052 1.00 0.00 C ATOM 9 C SER A 5 -8.495 -1.935 -1.096 1.00 0.00 C ATOM 10 O SER A 5 -8.891 -0.786 -1.267 1.00 0.00 O ATOM 11 CB SER A 5 -9.978 -3.924 -1.294 1.00 0.00 C ATOM 12 OG SER A 5 -10.581 -4.982 -2.020 1.00 0.00 O ATOM 13 H SER A 5 -7.466 -3.437 -3.554 1.00 0.00 H ATOM 14 HA SER A 5 -9.411 -2.604 -2.889 1.00 0.00 H ATOM 15 HB2 SER A 5 -9.587 -4.303 -0.334 1.00 0.00 H ATOM 16 HB3 SER A 5 -10.790 -3.224 -1.044 1.00 0.00 H ATOM 17 HG SER A 5 -9.889 -5.653 -2.118 1.00 0.00 H ATOM 18 N TYR A 4 -7.661 -2.298 -0.066 1.00 0.00 N ATOM 19 CA TYR A 4 -7.026 -1.339 0.838 1.00 0.00 C ATOM 20 C TYR A 4 -5.729 -0.686 0.232 1.00 0.00 C ATOM 21 O TYR A 4 -5.086 -1.245 -0.656 1.00 0.00 O ATOM 22 CB TYR A 4 -6.621 -2.017 2.156 1.00 0.00 C ATOM 23 CG TYR A 4 -7.756 -2.691 2.914 1.00 0.00 C ATOM 24 CD1 TYR A 4 -8.634 -1.943 3.707 1.00 0.00 C ATOM 25 CD2 TYR A 4 -7.975 -4.069 2.812 1.00 0.00 C ATOM 26 CE1 TYR A 4 -9.691 -2.553 4.384 1.00 0.00 C ATOM 27 CE2 TYR A 4 -9.030 -4.697 3.481 1.00 0.00 C ATOM 28 CZ TYR A 4 -9.895 -3.934 4.273 1.00 0.00 C ATOM 29 OH TYR A 4 -10.948 -4.474 4.956 1.00 0.00 O ATOM 30 H TYR A 4 -7.325 -3.249 -0.098 1.00 0.00 H ATOM 31 HA TYR A 4 -7.769 -0.550 1.046 1.00 0.00 H ATOM 32 HB2 TYR A 4 -5.834 -2.759 1.950 1.00 0.00 H ATOM 33 HB3 TYR A 4 -6.163 -1.250 2.803 1.00 0.00 H ATOM 34 HD1 TYR A 4 -8.495 -0.846 3.802 1.00 0.00 H ATOM 35 HD2 TYR A 4 -7.298 -4.686 2.184 1.00 0.00 H ATOM 36 HE1 TYR A 4 -10.384 -1.959 5.010 1.00 0.00 H ATOM 37 HE2 TYR A 4 -9.181 -5.788 3.381 1.00 0.00 H ATOM 38 HH TYR A 4 -11.008 -5.423 4.789 1.00 0.00 H ATOM 39 N VAL A 3 -5.317 0.518 0.786 1.00 0.00 N ATOM 40 CA VAL A 3 -4.131 1.235 0.264 1.00 0.00 C ATOM 41 C VAL A 3 -2.859 0.591 0.938 1.00 0.00 C ATOM 42 O VAL A 3 -2.267 1.113 1.878 1.00 0.00 O ATOM 43 CB VAL A 3 -4.239 2.779 0.396 1.00 0.00 C ATOM 44 CG1 VAL A 3 -4.500 3.343 1.810 1.00 0.00 C ATOM 45 CG2 VAL A 3 -3.036 3.504 -0.245 1.00 0.00 C ATOM 46 H VAL A 3 -5.858 0.983 1.494 1.00 0.00 H ATOM 47 HA VAL A 3 -4.066 1.026 -0.819 1.00 0.00 H ATOM 48 HB VAL A 3 -5.124 3.052 -0.213 1.00 0.00 H ATOM 49 HG11 VAL A 3 -5.392 2.908 2.287 1.00 0.00 H ATOM 50 HG12 VAL A 3 -3.646 3.179 2.486 1.00 0.00 H ATOM 51 HG13 VAL A 3 -4.663 4.433 1.752 1.00 0.00 H ATOM 52 HG21 VAL A 3 -2.867 3.176 -1.284 1.00 0.00 H ATOM 53 HG22 VAL A 3 -3.197 4.594 -0.266 1.00 0.00 H ATOM 54 HG23 VAL A 3 -2.106 3.318 0.317 1.00 0.00 H ATOM 55 N LYS A 2 -2.422 -0.603 0.382 1.00 0.00 N ATOM 56 CA LYS A 2 -1.321 -1.404 0.962 1.00 0.00 C ATOM 57 C LYS A 2 0.041 -0.860 0.384 1.00 0.00 C ATOM 58 O LYS A 2 0.760 -1.564 -0.320 1.00 0.00 O ATOM 59 CB LYS A 2 -1.569 -2.888 0.634 1.00 0.00 C ATOM 60 CG LYS A 2 -2.839 -3.480 1.294 1.00 0.00 C ATOM 61 CD LYS A 2 -3.607 -4.516 0.446 1.00 0.00 C ATOM 62 CE LYS A 2 -2.945 -5.886 0.239 1.00 0.00 C ATOM 63 NZ LYS A 2 -1.790 -5.779 -0.646 1.00 0.00 N ATOM 64 H LYS A 2 -3.041 -1.089 -0.260 1.00 0.00 H ATOM 65 HA LYS A 2 -1.309 -1.269 2.057 1.00 0.00 H ATOM 66 HB2 LYS A 2 -1.615 -2.991 -0.464 1.00 0.00 H ATOM 67 HB3 LYS A 2 -0.685 -3.465 0.957 1.00 0.00 H ATOM 68 HG2 LYS A 2 -2.577 -3.915 2.275 1.00 0.00 H ATOM 69 HG3 LYS A 2 -3.554 -2.670 1.525 1.00 0.00 H ATOM 70 HD2 LYS A 2 -4.584 -4.680 0.931 1.00 0.00 H ATOM 71 HD3 LYS A 2 -3.832 -4.066 -0.540 1.00 0.00 H ATOM 72 HE2 LYS A 2 -2.714 -6.338 1.221 1.00 0.00 H ATOM 73 HE3 LYS A 2 -3.684 -6.550 -0.240 1.00 0.00 H ATOM 74 HZ1 LYS A 2 -1.369 -6.679 -0.813 1.00 0.00 H ATOM 75 HZ2 LYS A 2 -1.079 -5.198 -0.230 1.00 0.00 H ATOM 76 N ALA A 1 0.385 0.433 0.740 1.00 0.00 N ATOM 77 CA ALA A 1 1.608 1.056 0.234 1.00 0.00 C ATOM 78 C ALA A 1 2.100 2.244 1.114 1.00 0.00 C ATOM 79 O ALA A 1 3.106 2.887 0.892 1.00 0.00 O ATOM 80 CB ALA A 1 1.508 1.506 -1.238 1.00 0.00 C ATOM 81 OXT ALA A 1 1.342 2.567 2.195 1.00 0.00 O ATOM 82 H ALA A 1 -0.254 0.987 1.293 1.00 0.00 H ATOM 83 HA ALA A 1 2.424 0.315 0.300 1.00 0.00 H ATOM 84 HB1 ALA A 1 1.245 0.664 -1.896 1.00 0.00 H ATOM 85 HB2 ALA A 1 0.753 2.294 -1.373 1.00 0.00 H ATOM 86 HB3 ALA A 1 2.483 1.896 -1.570 1.00 0.00 H ATOM 87 HXT ALA A 1 1.809 3.309 2.616 1.00 0.00 H TER 88 ALA A 1