HETATM 1 C ACE A 6 -7.754 -3.627 -2.918 1.00 0.00 C HETATM 2 O ACE A 6 -7.814 -4.377 -1.951 1.00 0.00 O HETATM 3 CH3 ACE A 6 -6.786 -3.897 -4.057 1.00 0.00 C HETATM 4 H1 ACE A 6 -6.232 -4.819 -3.849 1.00 0.00 H HETATM 5 H2 ACE A 6 -7.326 -4.017 -5.008 1.00 0.00 H HETATM 6 H3 ACE A 6 -6.068 -3.068 -4.155 1.00 0.00 H ATOM 7 N SER A 5 -8.541 -2.504 -3.037 1.00 0.00 N ATOM 8 CA SER A 5 -9.509 -2.006 -2.028 1.00 0.00 C ATOM 9 C SER A 5 -8.773 -1.273 -0.859 1.00 0.00 C ATOM 10 O SER A 5 -9.015 -0.103 -0.578 1.00 0.00 O ATOM 11 CB SER A 5 -10.521 -2.970 -1.378 1.00 0.00 C ATOM 12 OG SER A 5 -11.383 -3.660 -2.266 1.00 0.00 O ATOM 13 H SER A 5 -8.404 -1.901 -3.831 1.00 0.00 H ATOM 14 HA SER A 5 -10.068 -1.223 -2.536 1.00 0.00 H ATOM 15 HB2 SER A 5 -10.025 -3.689 -0.703 1.00 0.00 H ATOM 16 HB3 SER A 5 -11.171 -2.347 -0.745 1.00 0.00 H ATOM 17 HG SER A 5 -10.823 -4.310 -2.717 1.00 0.00 H ATOM 18 N TYR A 4 -7.849 -2.032 -0.182 1.00 0.00 N ATOM 19 CA TYR A 4 -6.964 -1.487 0.848 1.00 0.00 C ATOM 20 C TYR A 4 -5.741 -0.724 0.215 1.00 0.00 C ATOM 21 O TYR A 4 -5.165 -1.147 -0.787 1.00 0.00 O ATOM 22 CB TYR A 4 -6.381 -2.589 1.744 1.00 0.00 C ATOM 23 CG TYR A 4 -7.408 -3.451 2.463 1.00 0.00 C ATOM 24 CD1 TYR A 4 -8.028 -3.001 3.635 1.00 0.00 C ATOM 25 CD2 TYR A 4 -7.789 -4.698 1.956 1.00 0.00 C ATOM 26 CE1 TYR A 4 -8.989 -3.777 4.286 1.00 0.00 C ATOM 27 CE2 TYR A 4 -8.751 -5.488 2.593 1.00 0.00 C ATOM 28 CZ TYR A 4 -9.357 -5.024 3.766 1.00 0.00 C ATOM 29 OH TYR A 4 -10.305 -5.737 4.444 1.00 0.00 O ATOM 30 H TYR A 4 -7.663 -2.942 -0.574 1.00 0.00 H ATOM 31 HA TYR A 4 -7.565 -0.797 1.463 1.00 0.00 H ATOM 32 HB2 TYR A 4 -5.721 -3.233 1.141 1.00 0.00 H ATOM 33 HB3 TYR A 4 -5.734 -2.095 2.489 1.00 0.00 H ATOM 34 HD1 TYR A 4 -7.754 -2.013 4.061 1.00 0.00 H ATOM 35 HD2 TYR A 4 -7.317 -5.076 1.024 1.00 0.00 H ATOM 36 HE1 TYR A 4 -9.476 -3.419 5.212 1.00 0.00 H ATOM 37 HE2 TYR A 4 -9.034 -6.469 2.169 1.00 0.00 H ATOM 38 HH TYR A 4 -10.490 -6.570 3.992 1.00 0.00 H ATOM 39 N VAL A 3 -5.283 0.405 0.877 1.00 0.00 N ATOM 40 CA VAL A 3 -4.135 1.182 0.359 1.00 0.00 C ATOM 41 C VAL A 3 -2.853 0.527 1.003 1.00 0.00 C ATOM 42 O VAL A 3 -2.275 1.049 1.953 1.00 0.00 O ATOM 43 CB VAL A 3 -4.270 2.695 0.654 1.00 0.00 C ATOM 44 CG1 VAL A 3 -3.113 3.510 0.041 1.00 0.00 C ATOM 45 CG2 VAL A 3 -5.610 3.282 0.154 1.00 0.00 C ATOM 46 H VAL A 3 -5.800 0.832 1.624 1.00 0.00 H ATOM 47 HA VAL A 3 -4.088 1.054 -0.736 1.00 0.00 H ATOM 48 HB VAL A 3 -4.234 2.836 1.750 1.00 0.00 H ATOM 49 HG11 VAL A 3 -2.127 3.181 0.406 1.00 0.00 H ATOM 50 HG12 VAL A 3 -3.109 3.416 -1.057 1.00 0.00 H ATOM 51 HG13 VAL A 3 -3.211 4.579 0.289 1.00 0.00 H ATOM 52 HG21 VAL A 3 -5.717 3.143 -0.935 1.00 0.00 H ATOM 53 HG22 VAL A 3 -6.486 2.814 0.633 1.00 0.00 H ATOM 54 HG23 VAL A 3 -5.669 4.363 0.364 1.00 0.00 H ATOM 55 N LYS A 2 -2.397 -0.656 0.439 1.00 0.00 N ATOM 56 CA LYS A 2 -1.250 -1.402 0.999 1.00 0.00 C ATOM 57 C LYS A 2 0.095 -0.840 0.398 1.00 0.00 C ATOM 58 O LYS A 2 0.901 -1.577 -0.161 1.00 0.00 O ATOM 59 CB LYS A 2 -1.431 -2.933 0.865 1.00 0.00 C ATOM 60 CG LYS A 2 -1.542 -3.622 -0.518 1.00 0.00 C ATOM 61 CD LYS A 2 -2.784 -3.312 -1.377 1.00 0.00 C ATOM 62 CE LYS A 2 -2.921 -4.192 -2.631 1.00 0.00 C ATOM 63 NZ LYS A 2 -3.152 -5.584 -2.255 1.00 0.00 N ATOM 64 H LYS A 2 -2.948 -1.125 -0.267 1.00 0.00 H ATOM 65 HA LYS A 2 -1.210 -1.198 2.084 1.00 0.00 H ATOM 66 HB2 LYS A 2 -0.566 -3.383 1.387 1.00 0.00 H ATOM 67 HB3 LYS A 2 -2.318 -3.212 1.463 1.00 0.00 H ATOM 68 HG2 LYS A 2 -0.641 -3.411 -1.120 1.00 0.00 H ATOM 69 HG3 LYS A 2 -1.517 -4.708 -0.316 1.00 0.00 H ATOM 70 HD2 LYS A 2 -3.699 -3.418 -0.767 1.00 0.00 H ATOM 71 HD3 LYS A 2 -2.740 -2.264 -1.716 1.00 0.00 H ATOM 72 HE2 LYS A 2 -3.711 -3.777 -3.284 1.00 0.00 H ATOM 73 HE3 LYS A 2 -1.982 -4.133 -3.209 1.00 0.00 H ATOM 74 HZ1 LYS A 2 -4.038 -5.679 -1.784 1.00 0.00 H ATOM 75 HZ2 LYS A 2 -3.180 -6.185 -3.062 1.00 0.00 H ATOM 76 N ALA A 1 0.334 0.512 0.576 1.00 0.00 N ATOM 77 CA ALA A 1 1.555 1.135 0.060 1.00 0.00 C ATOM 78 C ALA A 1 1.809 2.483 0.749 1.00 0.00 C ATOM 79 O ALA A 1 0.990 3.131 1.368 1.00 0.00 O ATOM 80 CB ALA A 1 1.506 1.370 -1.467 1.00 0.00 C ATOM 81 OXT ALA A 1 3.056 2.964 0.527 1.00 0.00 O ATOM 82 H ALA A 1 -0.337 1.083 1.073 1.00 0.00 H ATOM 83 HA ALA A 1 2.416 0.476 0.280 1.00 0.00 H ATOM 84 HB1 ALA A 1 1.348 0.427 -2.013 1.00 0.00 H ATOM 85 HB2 ALA A 1 0.697 2.062 -1.742 1.00 0.00 H ATOM 86 HB3 ALA A 1 2.462 1.795 -1.809 1.00 0.00 H ATOM 87 HXT ALA A 1 3.095 3.824 0.981 1.00 0.00 H TER 88 ALA A 1