HETATM 1 C ACE A 6 -8.783 -5.053 1.116 1.00 0.00 C HETATM 2 O ACE A 6 -8.141 -4.793 0.104 1.00 0.00 O HETATM 3 CH3 ACE A 6 -8.504 -6.320 1.906 1.00 0.00 C HETATM 4 H1 ACE A 6 -9.400 -6.959 1.939 1.00 0.00 H HETATM 5 H2 ACE A 6 -7.694 -6.876 1.420 1.00 0.00 H HETATM 6 H3 ACE A 6 -8.198 -6.079 2.935 1.00 0.00 H ATOM 7 N SER A 5 -9.761 -4.217 1.609 1.00 0.00 N ATOM 8 CA SER A 5 -10.295 -3.068 0.831 1.00 0.00 C ATOM 9 C SER A 5 -9.387 -1.787 1.039 1.00 0.00 C ATOM 10 O SER A 5 -9.884 -0.722 1.397 1.00 0.00 O ATOM 11 CB SER A 5 -11.746 -2.738 1.216 1.00 0.00 C ATOM 12 OG SER A 5 -12.599 -3.865 1.079 1.00 0.00 O ATOM 13 H SER A 5 -10.319 -4.501 2.395 1.00 0.00 H ATOM 14 HA SER A 5 -10.265 -3.332 -0.241 1.00 0.00 H ATOM 15 HB2 SER A 5 -11.772 -2.367 2.258 1.00 0.00 H ATOM 16 HB3 SER A 5 -12.082 -1.915 0.559 1.00 0.00 H ATOM 17 HG SER A 5 -13.505 -3.549 1.206 1.00 0.00 H ATOM 18 N TYR A 4 -8.034 -1.926 0.767 1.00 0.00 N ATOM 19 CA TYR A 4 -7.054 -0.946 1.284 1.00 0.00 C ATOM 20 C TYR A 4 -5.900 -0.602 0.277 1.00 0.00 C ATOM 21 O TYR A 4 -5.519 -1.411 -0.565 1.00 0.00 O ATOM 22 CB TYR A 4 -6.372 -1.456 2.566 1.00 0.00 C ATOM 23 CG TYR A 4 -7.339 -1.951 3.632 1.00 0.00 C ATOM 24 CD1 TYR A 4 -8.313 -1.100 4.167 1.00 0.00 C ATOM 25 CD2 TYR A 4 -7.336 -3.284 4.046 1.00 0.00 C ATOM 26 CE1 TYR A 4 -9.250 -1.566 5.089 1.00 0.00 C ATOM 27 CE2 TYR A 4 -8.257 -3.766 4.981 1.00 0.00 C ATOM 28 CZ TYR A 4 -9.221 -2.901 5.510 1.00 0.00 C ATOM 29 OH TYR A 4 -10.164 -3.303 6.413 1.00 0.00 O ATOM 30 H TYR A 4 -7.689 -2.858 0.581 1.00 0.00 H ATOM 31 HA TYR A 4 -7.611 -0.028 1.525 1.00 0.00 H ATOM 32 HB2 TYR A 4 -5.675 -2.267 2.304 1.00 0.00 H ATOM 33 HB3 TYR A 4 -5.758 -0.636 2.975 1.00 0.00 H ATOM 34 HD1 TYR A 4 -8.375 -0.042 3.834 1.00 0.00 H ATOM 35 HD2 TYR A 4 -6.593 -3.987 3.614 1.00 0.00 H ATOM 36 HE1 TYR A 4 -10.026 -0.882 5.480 1.00 0.00 H ATOM 37 HE2 TYR A 4 -8.224 -4.828 5.281 1.00 0.00 H ATOM 38 HH TYR A 4 -9.990 -4.205 6.707 1.00 0.00 H ATOM 39 N VAL A 3 -5.279 0.629 0.430 1.00 0.00 N ATOM 40 CA VAL A 3 -4.041 0.928 -0.285 1.00 0.00 C ATOM 41 C VAL A 3 -2.852 0.181 0.450 1.00 0.00 C ATOM 42 O VAL A 3 -2.580 0.401 1.629 1.00 0.00 O ATOM 43 CB VAL A 3 -3.779 2.457 -0.352 1.00 0.00 C ATOM 44 CG1 VAL A 3 -4.673 3.133 -1.414 1.00 0.00 C ATOM 45 CG2 VAL A 3 -3.858 3.259 0.967 1.00 0.00 C ATOM 46 H VAL A 3 -5.507 1.298 1.138 1.00 0.00 H ATOM 47 HA VAL A 3 -4.127 0.548 -1.319 1.00 0.00 H ATOM 48 HB VAL A 3 -2.741 2.526 -0.701 1.00 0.00 H ATOM 49 HG11 VAL A 3 -4.576 2.648 -2.400 1.00 0.00 H ATOM 50 HG12 VAL A 3 -5.735 3.089 -1.124 1.00 0.00 H ATOM 51 HG13 VAL A 3 -4.406 4.195 -1.544 1.00 0.00 H ATOM 52 HG21 VAL A 3 -3.188 2.872 1.751 1.00 0.00 H ATOM 53 HG22 VAL A 3 -3.560 4.305 0.782 1.00 0.00 H ATOM 54 HG23 VAL A 3 -4.879 3.279 1.378 1.00 0.00 H ATOM 55 N LYS A 2 -2.092 -0.723 -0.287 1.00 0.00 N ATOM 56 CA LYS A 2 -1.042 -1.546 0.361 1.00 0.00 C ATOM 57 C LYS A 2 0.300 -0.710 0.391 1.00 0.00 C ATOM 58 O LYS A 2 1.297 -1.091 -0.216 1.00 0.00 O ATOM 59 CB LYS A 2 -0.879 -2.908 -0.348 1.00 0.00 C ATOM 60 CG LYS A 2 -2.155 -3.760 -0.571 1.00 0.00 C ATOM 61 CD LYS A 2 -3.086 -3.896 0.651 1.00 0.00 C ATOM 62 CE LYS A 2 -4.264 -4.873 0.476 1.00 0.00 C ATOM 63 NZ LYS A 2 -5.049 -4.492 -0.693 1.00 0.00 N ATOM 64 H LYS A 2 -2.426 -1.053 -1.177 1.00 0.00 H ATOM 65 HA LYS A 2 -1.337 -1.737 1.407 1.00 0.00 H ATOM 66 HB2 LYS A 2 -0.391 -2.759 -1.328 1.00 0.00 H ATOM 67 HB3 LYS A 2 -0.162 -3.489 0.260 1.00 0.00 H ATOM 68 HG2 LYS A 2 -2.730 -3.334 -1.412 1.00 0.00 H ATOM 69 HG3 LYS A 2 -1.841 -4.766 -0.906 1.00 0.00 H ATOM 70 HD2 LYS A 2 -2.492 -4.213 1.525 1.00 0.00 H ATOM 71 HD3 LYS A 2 -3.494 -2.900 0.904 1.00 0.00 H ATOM 72 HE2 LYS A 2 -3.872 -5.893 0.319 1.00 0.00 H ATOM 73 HE3 LYS A 2 -4.852 -4.899 1.412 1.00 0.00 H ATOM 74 HZ1 LYS A 2 -5.912 -5.013 -0.754 1.00 0.00 H ATOM 75 HZ2 LYS A 2 -5.310 -3.516 -0.646 1.00 0.00 H ATOM 76 N ALA A 1 0.294 0.449 1.148 1.00 0.00 N ATOM 77 CA ALA A 1 1.476 1.312 1.214 1.00 0.00 C ATOM 78 C ALA A 1 1.396 2.251 2.425 1.00 0.00 C ATOM 79 O ALA A 1 0.393 2.524 3.051 1.00 0.00 O ATOM 80 CB ALA A 1 1.663 2.172 -0.058 1.00 0.00 C ATOM 81 OXT ALA A 1 2.577 2.858 2.702 1.00 0.00 O ATOM 82 H ALA A 1 -0.555 0.744 1.613 1.00 0.00 H ATOM 83 HA ALA A 1 2.375 0.678 1.336 1.00 0.00 H ATOM 84 HB1 ALA A 1 1.751 1.544 -0.957 1.00 0.00 H ATOM 85 HB2 ALA A 1 0.819 2.862 -0.205 1.00 0.00 H ATOM 86 HB3 ALA A 1 2.588 2.762 0.026 1.00 0.00 H ATOM 87 HXT ALA A 1 2.405 3.444 3.459 1.00 0.00 H TER 88 ALA A 1