HETATM 1 C ACE A 6 -9.415 -3.663 -1.671 1.00 0.00 C HETATM 2 O ACE A 6 -8.859 -4.225 -0.734 1.00 0.00 O HETATM 3 CH3 ACE A 6 -9.108 -4.053 -3.107 1.00 0.00 C HETATM 4 H1 ACE A 6 -8.658 -3.206 -3.646 1.00 0.00 H HETATM 5 H2 ACE A 6 -8.395 -4.887 -3.108 1.00 0.00 H HETATM 6 H3 ACE A 6 -10.021 -4.371 -3.631 1.00 0.00 H ATOM 7 N SER A 5 -10.327 -2.645 -1.493 1.00 0.00 N ATOM 8 CA SER A 5 -10.758 -2.086 -0.189 1.00 0.00 C ATOM 9 C SER A 5 -9.697 -1.138 0.431 1.00 0.00 C ATOM 10 O SER A 5 -10.017 -0.038 0.877 1.00 0.00 O ATOM 11 CB SER A 5 -11.242 -3.064 0.901 1.00 0.00 C ATOM 12 OG SER A 5 -11.806 -2.391 2.021 1.00 0.00 O ATOM 13 H SER A 5 -10.710 -2.196 -2.308 1.00 0.00 H ATOM 14 HA SER A 5 -11.590 -1.425 -0.429 1.00 0.00 H ATOM 15 HB2 SER A 5 -12.045 -3.693 0.492 1.00 0.00 H ATOM 16 HB3 SER A 5 -10.442 -3.746 1.232 1.00 0.00 H ATOM 17 HG SER A 5 -11.071 -1.971 2.499 1.00 0.00 H ATOM 18 N TYR A 4 -8.415 -1.620 0.489 1.00 0.00 N ATOM 19 CA TYR A 4 -7.292 -0.963 1.185 1.00 0.00 C ATOM 20 C TYR A 4 -6.051 -0.699 0.257 1.00 0.00 C ATOM 21 O TYR A 4 -5.812 -1.421 -0.707 1.00 0.00 O ATOM 22 CB TYR A 4 -6.806 -1.817 2.368 1.00 0.00 C ATOM 23 CG TYR A 4 -7.920 -2.258 3.306 1.00 0.00 C ATOM 24 CD1 TYR A 4 -8.605 -1.324 4.093 1.00 0.00 C ATOM 25 CD2 TYR A 4 -8.343 -3.589 3.349 1.00 0.00 C ATOM 26 CE1 TYR A 4 -9.674 -1.711 4.901 1.00 0.00 C ATOM 27 CE2 TYR A 4 -9.412 -3.996 4.154 1.00 0.00 C ATOM 28 CZ TYR A 4 -10.083 -3.051 4.937 1.00 0.00 C ATOM 29 OH TYR A 4 -11.141 -3.366 5.740 1.00 0.00 O ATOM 30 H TYR A 4 -8.281 -2.557 0.140 1.00 0.00 H ATOM 31 HA TYR A 4 -7.671 -0.001 1.564 1.00 0.00 H ATOM 32 HB2 TYR A 4 -6.283 -2.705 1.979 1.00 0.00 H ATOM 33 HB3 TYR A 4 -6.057 -1.232 2.928 1.00 0.00 H ATOM 34 HD1 TYR A 4 -8.304 -0.256 4.072 1.00 0.00 H ATOM 35 HD2 TYR A 4 -7.827 -4.347 2.720 1.00 0.00 H ATOM 36 HE1 TYR A 4 -10.215 -0.965 5.513 1.00 0.00 H ATOM 37 HE2 TYR A 4 -9.729 -5.054 4.154 1.00 0.00 H ATOM 38 HH TYR A 4 -11.380 -4.296 5.640 1.00 0.00 H ATOM 39 N VAL A 3 -5.212 0.339 0.620 1.00 0.00 N ATOM 40 CA VAL A 3 -4.014 0.701 -0.171 1.00 0.00 C ATOM 41 C VAL A 3 -2.748 0.111 0.579 1.00 0.00 C ATOM 42 O VAL A 3 -2.402 0.539 1.680 1.00 0.00 O ATOM 43 CB VAL A 3 -3.883 2.232 -0.314 1.00 0.00 C ATOM 44 CG1 VAL A 3 -2.630 2.622 -1.117 1.00 0.00 C ATOM 45 CG2 VAL A 3 -5.138 2.878 -0.941 1.00 0.00 C ATOM 46 H VAL A 3 -5.451 1.006 1.329 1.00 0.00 H ATOM 47 HA VAL A 3 -4.105 0.255 -1.175 1.00 0.00 H ATOM 48 HB VAL A 3 -3.765 2.657 0.701 1.00 0.00 H ATOM 49 HG11 VAL A 3 -1.712 2.228 -0.651 1.00 0.00 H ATOM 50 HG12 VAL A 3 -2.683 2.224 -2.142 1.00 0.00 H ATOM 51 HG13 VAL A 3 -2.523 3.717 -1.179 1.00 0.00 H ATOM 52 HG21 VAL A 3 -5.336 2.463 -1.943 1.00 0.00 H ATOM 53 HG22 VAL A 3 -6.044 2.713 -0.333 1.00 0.00 H ATOM 54 HG23 VAL A 3 -5.015 3.969 -1.043 1.00 0.00 H ATOM 55 N LYS A 2 -2.007 -0.881 -0.054 1.00 0.00 N ATOM 56 CA LYS A 2 -0.863 -1.547 0.599 1.00 0.00 C ATOM 57 C LYS A 2 0.418 -0.641 0.395 1.00 0.00 C ATOM 58 O LYS A 2 1.343 -1.003 -0.326 1.00 0.00 O ATOM 59 CB LYS A 2 -0.665 -2.964 0.022 1.00 0.00 C ATOM 60 CG LYS A 2 -1.820 -3.980 0.190 1.00 0.00 C ATOM 61 CD LYS A 2 -3.194 -3.743 -0.480 1.00 0.00 C ATOM 62 CE LYS A 2 -3.271 -3.612 -2.012 1.00 0.00 C ATOM 63 NZ LYS A 2 -2.569 -2.430 -2.511 1.00 0.00 N ATOM 64 H LYS A 2 -2.385 -1.372 -0.860 1.00 0.00 H ATOM 65 HA LYS A 2 -1.062 -1.631 1.681 1.00 0.00 H ATOM 66 HB2 LYS A 2 -0.372 -2.894 -1.038 1.00 0.00 H ATOM 67 HB3 LYS A 2 0.214 -3.390 0.542 1.00 0.00 H ATOM 68 HG2 LYS A 2 -1.442 -4.955 -0.163 1.00 0.00 H ATOM 69 HG3 LYS A 2 -2.010 -4.095 1.272 1.00 0.00 H ATOM 70 HD2 LYS A 2 -3.828 -4.606 -0.201 1.00 0.00 H ATOM 71 HD3 LYS A 2 -3.688 -2.871 -0.019 1.00 0.00 H ATOM 72 HE2 LYS A 2 -2.933 -4.553 -2.486 1.00 0.00 H ATOM 73 HE3 LYS A 2 -4.341 -3.509 -2.269 1.00 0.00 H ATOM 74 HZ1 LYS A 2 -2.841 -2.240 -3.465 1.00 0.00 H ATOM 75 HZ2 LYS A 2 -1.575 -2.606 -2.538 1.00 0.00 H ATOM 76 N ALA A 1 0.448 0.557 1.088 1.00 0.00 N ATOM 77 CA ALA A 1 1.581 1.475 0.963 1.00 0.00 C ATOM 78 C ALA A 1 1.720 2.448 2.172 1.00 0.00 C ATOM 79 O ALA A 1 2.594 3.284 2.278 1.00 0.00 O ATOM 80 CB ALA A 1 1.592 2.275 -0.354 1.00 0.00 C ATOM 81 OXT ALA A 1 0.796 2.337 3.164 1.00 0.00 O ATOM 82 H ALA A 1 -0.358 0.843 1.627 1.00 0.00 H ATOM 83 HA ALA A 1 2.509 0.875 0.994 1.00 0.00 H ATOM 84 HB1 ALA A 1 1.570 1.608 -1.229 1.00 0.00 H ATOM 85 HB2 ALA A 1 0.735 2.960 -0.425 1.00 0.00 H ATOM 86 HB3 ALA A 1 2.518 2.870 -0.414 1.00 0.00 H ATOM 87 HXT ALA A 1 1.055 3.006 3.821 1.00 0.00 H TER 88 ALA A 1