ATOM 1 N AAA A 1 4.980 15.876 5.851 1.00 0.05 ATOM 2 C AAA A 2 6.024 15.145 6.265 1.00 0.05 ATOM 3 O AAA A 2 6.247 13.989 5.931 1.00 0.05 ATOM 4 C AAA A 3 6.950 15.822 7.196 1.00 0.05 ATOM 5 N AAA A 4 6.627 17.107 7.832 1.00 0.05 ATOM 6 C AAA A 5 8.147 15.337 7.554 1.00 0.05 ATOM 7 S AAA A 6 8.975 16.375 8.691 1.00 0.05 ATOM 8 C AAA A 7 7.603 17.495 8.679 1.00 0.05 ATOM 9 C AAA A 8 7.521 18.725 9.590 1.00 0.05 ATOM 10 C AAA A 9 6.992 19.971 8.844 1.00 0.05 ATOM 11 C AAA A 10 7.982 20.455 7.774 1.00 0.05 ATOM 12 C AAA A 11 6.668 21.114 9.820 1.00 0.05 ATOM 13 N AAA A 12 6.609 18.383 10.675 1.00 0.05 ATOM 14 C AAA A 13 7.043 18.159 11.929 1.00 0.05 ATOM 15 O AAA A 13 8.214 18.215 12.277 1.00 0.05 ATOM 16 C AAA A 14 5.915 17.795 12.918 1.00 0.05 ATOM 17 N AAA A 15 4.707 17.408 12.190 1.00 0.05 ATOM 18 C AAA A 16 6.271 16.560 13.792 1.00 0.05 ATOM 19 O AAA A 17 5.472 15.543 13.238 1.00 0.05 ATOM 20 C AAA A 18 5.889 16.737 15.265 1.00 0.05 ATOM 21 C AAA A 19 4.596 16.086 12.381 1.00 0.05 ATOM 22 C AAA A 20 3.559 15.238 11.635 1.00 0.05 ATOM 23 C AAA A 21 4.184 14.105 10.788 1.00 0.05 ATOM 24 C AAA A 22 4.816 13.001 11.654 1.00 0.05 ATOM 25 C AAA A 23 5.086 11.710 10.871 1.00 0.05 ATOM 26 C AAA A 24 5.167 14.641 9.733 1.00 0.05 ATOM 27 N AAA A 25 2.838 16.144 10.755 1.00 0.05 ATOM 28 C AAA A 26 1.579 15.953 10.346 1.00 0.05 ATOM 29 O AAA A 26 0.863 15.020 10.686 1.00 0.05 ATOM 30 C AAA A 27 1.081 16.981 9.410 1.00 0.05 ATOM 31 N AAA A 28 1.976 17.996 8.839 1.00 0.05 ATOM 32 C AAA A 29 -0.189 17.098 9.003 1.00 0.05 ATOM 33 S AAA A 30 -0.411 18.446 7.908 1.00 0.05 ATOM 34 C AAA A 31 1.314 18.834 8.019 1.00 0.05 ATOM 35 C AAA A 32 1.987 19.943 7.202 1.00 0.05 ATOM 36 C AAA A 33 3.125 20.640 7.984 1.00 0.05 ATOM 37 C AAA A 34 2.596 21.422 9.195 1.00 0.05 ATOM 38 C AAA A 35 3.946 21.569 7.075 1.00 0.05 ATOM 39 N AAA A 36 2.551 19.294 6.027 1.00 0.05 ATOM 40 C AAA A 36 2.027 19.447 4.798 1.00 0.05 ATOM 41 O AAA A 36 1.075 20.167 4.536 1.00 0.05 ATOM 42 C AAA A 37 2.722 18.591 3.716 1.00 0.05 ATOM 43 N AAA A 38 3.759 17.746 4.316 1.00 0.05 ATOM 44 C AAA A 39 1.728 17.593 3.064 1.00 0.05 ATOM 45 O AAA A 40 2.048 16.382 3.704 1.00 0.05 ATOM 46 C AAA A 41 1.946 17.425 1.556 1.00 0.05 ATOM 47 C AAA A 42 3.226 16.517 4.332 1.00 0.05 ATOM 48 C AAA A 43 3.865 15.341 5.074 1.00 0.05 ATOM 49 C AAA A 44 2.790 14.719 5.998 1.00 0.05 ATOM 50 C AAA A 45 3.204 13.431 6.732 1.00 0.05 ATOM 51 C AAA A 46 2.114 13.006 7.725 1.00 0.05 ATOM 52 C AAA A 47 3.508 12.287 5.754 1.00 0.05 ATOM 53 H AAA A 48 4.968 16.828 6.149 1.00 0.00 ATOM 54 H AAA A 49 8.542 14.411 7.179 1.00 0.00 ATOM 55 H AAA A 50 8.512 18.925 10.004 1.00 0.00 ATOM 56 H AAA A 51 6.063 19.712 8.336 1.00 0.00 ATOM 57 HA AAA A 52 8.939 20.729 8.220 1.00 0.00 ATOM 58 HB AAA A 52 7.595 21.329 7.251 1.00 0.00 ATOM 59 HC AAA A 52 8.171 19.687 7.024 1.00 0.00 ATOM 60 HA AAA A 53 5.844 20.858 10.486 1.00 0.00 ATOM 61 HB AAA A 53 6.374 22.017 9.285 1.00 0.00 ATOM 62 HC AAA A 53 7.532 21.361 10.437 1.00 0.00 ATOM 63 H AAA A 54 5.629 18.307 10.505 1.00 0.00 ATOM 64 H AAA A 55 5.669 18.672 13.517 1.00 0.00 ATOM 65 H AAA A 56 7.324 16.282 13.715 1.00 0.00 ATOM 66 HA AAA A 57 6.470 17.537 15.724 1.00 0.00 ATOM 67 HB AAA A 57 6.078 15.821 15.825 1.00 0.00 ATOM 68 HC AAA A 57 4.832 16.982 15.371 1.00 0.00 ATOM 69 H AAA A 58 2.847 14.845 12.362 1.00 0.00 ATOM 70 H AAA A 59 3.357 13.638 10.252 1.00 0.00 ATOM 71 HA AAA A 60 4.145 12.768 12.482 1.00 0.00 ATOM 72 HB AAA A 60 5.746 13.351 12.102 1.00 0.00 ATOM 73 HA AAA A 61 4.176 11.339 10.401 1.00 0.00 ATOM 74 HB AAA A 61 5.463 10.929 11.531 1.00 0.00 ATOM 75 HC AAA A 61 5.829 11.865 10.089 1.00 0.00 ATOM 76 HA AAA A 62 4.691 15.371 9.079 1.00 0.00 ATOM 77 HB AAA A 62 5.541 13.842 9.094 1.00 0.00 ATOM 78 HC AAA A 62 6.032 15.117 10.196 1.00 0.00 ATOM 79 H AAA A 63 -0.973 16.435 9.319 1.00 0.00 ATOM 80 H AAA A 64 3.292 16.969 10.422 1.00 0.00 ATOM 81 H AAA A 65 1.233 20.668 6.889 1.00 0.00 ATOM 82 H AAA A 66 3.809 19.878 8.361 1.00 0.00 ATOM 83 HA AAA A 67 1.904 22.205 8.886 1.00 0.00 ATOM 84 HB AAA A 67 3.413 21.896 9.740 1.00 0.00 ATOM 85 HC AAA A 67 2.076 20.773 9.899 1.00 0.00 ATOM 86 HA AAA A 68 4.460 21.018 6.287 1.00 0.00 ATOM 87 HB AAA A 68 4.711 22.098 7.642 1.00 0.00 ATOM 88 HC AAA A 68 3.310 22.316 6.598 1.00 0.00 ATOM 89 H AAA A 69 3.352 18.709 6.127 1.00 0.00 ATOM 90 H AAA A 70 3.202 19.246 2.990 1.00 0.00 ATOM 91 H AAA A 71 0.684 17.850 3.258 1.00 0.00 ATOM 92 HA AAA A 72 1.732 18.353 1.026 1.00 0.00 ATOM 93 HB AAA A 72 1.291 16.651 1.156 1.00 0.00 ATOM 94 HC AAA A 72 2.975 17.140 1.335 1.00 0.00 ATOM 95 H AAA A 73 4.257 14.633 4.342 1.00 0.00 ATOM 96 HA AAA A 74 1.893 14.496 5.418 1.00 0.00 ATOM 97 HB AAA A 74 2.486 15.464 6.735 1.00 0.00 ATOM 98 H AAA A 75 4.101 13.626 7.315 1.00 0.00 ATOM 99 HA AAA A 76 1.895 13.804 8.434 1.00 0.00 ATOM 100 HB AAA A 76 2.425 12.134 8.300 1.00 0.00 ATOM 101 HC AAA A 76 1.186 12.757 7.211 1.00 0.00 ATOM 102 HA AAA A 77 2.643 12.057 5.132 1.00 0.00 ATOM 103 HB AAA A 77 3.787 11.381 6.291 1.00 0.00 ATOM 104 HC AAA A 77 4.339 12.536 5.094 1.00 0.00 END