HETATM 1 C ACE A 6 -7.032 -4.430 -2.577 1.00 0.00 C HETATM 2 O ACE A 6 -6.486 -4.809 -1.547 1.00 0.00 O HETATM 3 CH3 ACE A 6 -6.316 -4.512 -3.915 1.00 0.00 C HETATM 4 H1 ACE A 6 -6.931 -5.027 -4.668 1.00 0.00 H HETATM 5 H2 ACE A 6 -6.076 -3.500 -4.276 1.00 0.00 H HETATM 6 H3 ACE A 6 -5.381 -5.070 -3.790 1.00 0.00 H ATOM 7 N SER A 5 -8.300 -3.891 -2.596 1.00 0.00 N ATOM 8 CA SER A 5 -9.187 -3.710 -1.423 1.00 0.00 C ATOM 9 C SER A 5 -8.772 -2.503 -0.539 1.00 0.00 C ATOM 10 O SER A 5 -9.606 -1.688 -0.150 1.00 0.00 O ATOM 11 CB SER A 5 -9.437 -4.926 -0.508 1.00 0.00 C ATOM 12 OG SER A 5 -10.451 -4.680 0.460 1.00 0.00 O ATOM 13 H SER A 5 -8.664 -3.560 -3.474 1.00 0.00 H ATOM 14 HA SER A 5 -10.150 -3.412 -1.841 1.00 0.00 H ATOM 15 HB2 SER A 5 -9.800 -5.767 -1.115 1.00 0.00 H ATOM 16 HB3 SER A 5 -8.513 -5.268 -0.012 1.00 0.00 H ATOM 17 HG SER A 5 -10.078 -4.062 1.111 1.00 0.00 H ATOM 18 N TYR A 4 -7.448 -2.438 -0.189 1.00 0.00 N ATOM 19 CA TYR A 4 -6.866 -1.481 0.770 1.00 0.00 C ATOM 20 C TYR A 4 -5.679 -0.640 0.182 1.00 0.00 C ATOM 21 O TYR A 4 -5.051 -1.032 -0.800 1.00 0.00 O ATOM 22 CB TYR A 4 -6.328 -2.224 2.006 1.00 0.00 C ATOM 23 CG TYR A 4 -7.331 -3.180 2.635 1.00 0.00 C ATOM 24 CD1 TYR A 4 -8.491 -2.696 3.250 1.00 0.00 C ATOM 25 CD2 TYR A 4 -7.163 -4.565 2.547 1.00 0.00 C ATOM 26 CE1 TYR A 4 -9.449 -3.568 3.766 1.00 0.00 C ATOM 27 CE2 TYR A 4 -8.112 -5.454 3.060 1.00 0.00 C ATOM 28 CZ TYR A 4 -9.265 -4.954 3.674 1.00 0.00 C ATOM 29 OH TYR A 4 -10.242 -5.755 4.190 1.00 0.00 O ATOM 30 H TYR A 4 -6.869 -3.192 -0.529 1.00 0.00 H ATOM 31 HA TYR A 4 -7.676 -0.801 1.077 1.00 0.00 H ATOM 32 HB2 TYR A 4 -5.420 -2.781 1.724 1.00 0.00 H ATOM 33 HB3 TYR A 4 -6.017 -1.475 2.754 1.00 0.00 H ATOM 34 HD1 TYR A 4 -8.664 -1.602 3.324 1.00 0.00 H ATOM 35 HD2 TYR A 4 -6.259 -4.976 2.048 1.00 0.00 H ATOM 36 HE1 TYR A 4 -10.368 -3.176 4.241 1.00 0.00 H ATOM 37 HE2 TYR A 4 -7.955 -6.544 2.961 1.00 0.00 H ATOM 38 HH TYR A 4 -10.048 -6.685 4.016 1.00 0.00 H ATOM 39 N VAL A 3 -5.323 0.512 0.867 1.00 0.00 N ATOM 40 CA VAL A 3 -4.173 1.332 0.430 1.00 0.00 C ATOM 41 C VAL A 3 -2.891 0.666 1.070 1.00 0.00 C ATOM 42 O VAL A 3 -2.276 1.195 1.991 1.00 0.00 O ATOM 43 CB VAL A 3 -4.340 2.828 0.793 1.00 0.00 C ATOM 44 CG1 VAL A 3 -3.204 3.696 0.217 1.00 0.00 C ATOM 45 CG2 VAL A 3 -5.692 3.413 0.321 1.00 0.00 C ATOM 46 H VAL A 3 -5.869 0.885 1.623 1.00 0.00 H ATOM 47 HA VAL A 3 -4.091 1.256 -0.668 1.00 0.00 H ATOM 48 HB VAL A 3 -4.307 2.919 1.895 1.00 0.00 H ATOM 49 HG11 VAL A 3 -2.208 3.372 0.559 1.00 0.00 H ATOM 50 HG12 VAL A 3 -3.205 3.655 -0.885 1.00 0.00 H ATOM 51 HG13 VAL A 3 -3.324 4.750 0.516 1.00 0.00 H ATOM 52 HG21 VAL A 3 -5.800 3.319 -0.772 1.00 0.00 H ATOM 53 HG22 VAL A 3 -6.559 2.913 0.783 1.00 0.00 H ATOM 54 HG23 VAL A 3 -5.767 4.483 0.577 1.00 0.00 H ATOM 55 N LYS A 2 -2.491 -0.544 0.527 1.00 0.00 N ATOM 56 CA LYS A 2 -1.378 -1.351 1.072 1.00 0.00 C ATOM 57 C LYS A 2 -0.021 -0.915 0.400 1.00 0.00 C ATOM 58 O LYS A 2 0.739 -1.739 -0.100 1.00 0.00 O ATOM 59 CB LYS A 2 -1.704 -2.869 1.002 1.00 0.00 C ATOM 60 CG LYS A 2 -2.353 -3.478 -0.266 1.00 0.00 C ATOM 61 CD LYS A 2 -1.625 -3.250 -1.604 1.00 0.00 C ATOM 62 CE LYS A 2 -2.369 -3.802 -2.833 1.00 0.00 C ATOM 63 NZ LYS A 2 -2.565 -5.246 -2.842 1.00 0.00 N ATOM 64 H LYS A 2 -3.072 -0.980 -0.179 1.00 0.00 H ATOM 65 HA LYS A 2 -1.268 -1.101 2.141 1.00 0.00 H ATOM 66 HB2 LYS A 2 -0.768 -3.413 1.229 1.00 0.00 H ATOM 67 HB3 LYS A 2 -2.383 -3.097 1.844 1.00 0.00 H ATOM 68 HG2 LYS A 2 -2.447 -4.566 -0.091 1.00 0.00 H ATOM 69 HG3 LYS A 2 -3.389 -3.107 -0.358 1.00 0.00 H ATOM 70 HD2 LYS A 2 -1.477 -2.169 -1.770 1.00 0.00 H ATOM 71 HD3 LYS A 2 -0.616 -3.699 -1.556 1.00 0.00 H ATOM 72 HE2 LYS A 2 -3.355 -3.313 -2.918 1.00 0.00 H ATOM 73 HE3 LYS A 2 -1.822 -3.521 -3.750 1.00 0.00 H ATOM 74 HZ1 LYS A 2 -1.681 -5.723 -2.771 1.00 0.00 H ATOM 75 HZ2 LYS A 2 -3.130 -5.531 -2.058 1.00 0.00 H ATOM 76 N ALA A 1 0.288 0.434 0.461 1.00 0.00 N ATOM 77 CA ALA A 1 1.543 0.948 -0.086 1.00 0.00 C ATOM 78 C ALA A 1 1.970 2.308 0.542 1.00 0.00 C ATOM 79 O ALA A 1 2.987 2.905 0.253 1.00 0.00 O ATOM 80 CB ALA A 1 1.536 1.059 -1.623 1.00 0.00 C ATOM 81 OXT ALA A 1 1.137 2.844 1.475 1.00 0.00 O ATOM 82 H ALA A 1 -0.336 1.067 0.938 1.00 0.00 H ATOM 83 HA ALA A 1 2.356 0.254 0.195 1.00 0.00 H ATOM 84 HB1 ALA A 1 1.319 0.089 -2.093 1.00 0.00 H ATOM 85 HB2 ALA A 1 0.788 1.785 -1.975 1.00 0.00 H ATOM 86 HB3 ALA A 1 2.529 1.384 -1.973 1.00 0.00 H ATOM 87 HXT ALA A 1 1.574 3.667 1.756 1.00 0.00 H TER 88 ALA A 1