HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 -6.350 -1.154 1.812 0.00 0.00 C+0 HETATM 2 S UNK 0 -7.618 0.028 1.298 0.00 0.00 S+0 HETATM 3 C UNK 0 -9.258 -0.664 1.491 0.00 0.00 C+0 HETATM 4 C UNK 0 -10.292 0.098 1.277 0.00 0.00 C+0 HETATM 5 C UNK 0 -10.309 1.508 0.879 0.00 0.00 C+0 HETATM 6 C UNK 0 -9.057 2.185 0.594 0.00 0.00 C+0 HETATM 7 C UNK 0 -8.861 2.704 -0.643 0.00 0.00 C+0 HETATM 8 C UNK 0 -9.933 2.550 -1.632 0.00 0.00 C+0 HETATM 9 C UNK 0 -7.618 3.412 -0.986 0.00 0.00 C+0 HETATM 10 C UNK 0 -6.866 2.808 -2.154 0.00 0.00 C+0 HETATM 11 C UNK 0 -6.385 1.437 -1.937 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.088 1.141 -2.183 0.00 0.00 C+0 HETATM 13 C UNK 0 -4.193 2.208 -2.669 0.00 0.00 C+0 HETATM 14 C UNK 0 -4.594 -0.235 -2.008 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.528 -0.404 -0.963 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.306 0.380 -1.180 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.138 -0.241 -1.424 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.112 -1.723 -1.467 0.00 0.00 C+0 HETATM 19 C UNK 0 0.045 0.603 -1.647 0.00 0.00 C+0 HETATM 20 C UNK 0 1.173 0.390 -0.656 0.00 0.00 C+0 HETATM 21 C UNK 0 2.236 1.363 -1.043 0.00 0.00 C+0 HETATM 22 C UNK 0 2.660 2.334 -0.237 0.00 0.00 C+0 HETATM 23 C UNK 0 2.055 2.460 1.118 0.00 0.00 C+0 HETATM 24 C UNK 0 3.681 3.318 -0.652 0.00 0.00 C+0 HETATM 25 C UNK 0 4.897 3.297 0.216 0.00 0.00 C+0 HETATM 26 C UNK 0 5.524 1.935 0.134 0.00 0.00 C+0 HETATM 27 C UNK 0 6.734 1.770 -0.385 0.00 0.00 C+0 HETATM 28 C UNK 0 7.423 3.002 -0.879 0.00 0.00 C+0 HETATM 29 C UNK 0 7.347 0.437 -0.429 0.00 0.00 C+0 HETATM 30 C UNK 0 8.671 0.383 0.303 0.00 0.00 C+0 HETATM 31 C UNK 0 9.204 -1.006 0.178 0.00 0.00 C+0 HETATM 32 C UNK 0 10.333 -1.208 -0.516 0.00 0.00 C+0 HETATM 33 C UNK 0 11.010 -0.031 -1.135 0.00 0.00 C+0 HETATM 34 C UNK 0 10.901 -2.546 -0.667 0.00 0.00 C+0 HETATM 35 C UNK 0 12.327 -2.674 -0.124 0.00 0.00 C+0 HETATM 36 C UNK 0 12.422 -2.375 1.319 0.00 0.00 C+0 HETATM 37 C UNK 0 12.847 -3.239 2.229 0.00 0.00 C+0 HETATM 38 C UNK 0 13.277 -4.620 1.860 0.00 0.00 C+0 HETATM 39 C UNK 0 12.897 -2.824 3.660 0.00 0.00 C+0 HETATM 40 C UNK 0 -11.617 -0.551 1.465 0.00 0.00 C+0 HETATM 41 O UNK 0 -12.658 0.127 1.276 0.00 0.00 O+0 HETATM 42 C UNK 0 -11.766 -1.933 1.859 0.00 0.00 C+0 HETATM 43 C UNK 0 -13.017 -2.523 2.024 0.00 0.00 C+0 HETATM 44 C UNK 0 -13.139 -3.846 2.394 0.00 0.00 C+0 HETATM 45 C UNK 0 -12.022 -4.620 2.610 0.00 0.00 C+0 HETATM 46 C UNK 0 -10.778 -4.054 2.452 0.00 0.00 C+0 HETATM 47 C UNK 0 -10.656 -2.713 2.077 0.00 0.00 C+0 HETATM 48 C UNK 0 -9.364 -2.087 1.896 0.00 0.00 C+0 HETATM 49 O UNK 0 -8.333 -2.763 2.085 0.00 0.00 O+0 HETATM 50 H UNK 0 -6.532 -1.520 2.848 0.00 0.00 H+0 HETATM 51 H UNK 0 -5.386 -0.606 1.837 0.00 0.00 H+0 HETATM 52 H UNK 0 -6.319 -1.973 1.079 0.00 0.00 H+0 HETATM 53 H UNK 0 -11.073 1.656 0.063 0.00 0.00 H+0 HETATM 54 H UNK 0 -10.799 2.086 1.741 0.00 0.00 H+0 HETATM 55 H UNK 0 -8.257 2.342 1.298 0.00 0.00 H+0 HETATM 56 H UNK 0 -10.153 1.481 -1.901 0.00 0.00 H+0 HETATM 57 H UNK 0 -9.583 3.000 -2.603 0.00 0.00 H+0 HETATM 58 H UNK 0 -10.858 3.107 -1.377 0.00 0.00 H+0 HETATM 59 H UNK 0 -7.868 4.472 -1.167 0.00 0.00 H+0 HETATM 60 H UNK 0 -6.890 3.354 -0.117 0.00 0.00 H+0 HETATM 61 H UNK 0 -7.465 2.878 -3.102 0.00 0.00 H+0 HETATM 62 H UNK 0 -5.984 3.469 -2.323 0.00 0.00 H+0 HETATM 63 H UNK 0 -7.048 0.632 -1.577 0.00 0.00 H+0 HETATM 64 H UNK 0 -3.290 1.715 -3.136 0.00 0.00 H+0 HETATM 65 H UNK 0 -4.637 2.753 -3.546 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.946 2.962 -1.921 0.00 0.00 H+0 HETATM 67 H UNK 0 -5.444 -0.932 -1.764 0.00 0.00 H+0 HETATM 68 H UNK 0 -4.193 -0.540 -3.025 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.952 -0.161 0.060 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.234 -1.484 -0.861 0.00 0.00 H+0 HETATM 71 H UNK 0 -2.304 1.482 -1.115 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.370 -2.202 -0.511 0.00 0.00 H+0 HETATM 73 H UNK 0 -1.779 -2.135 -2.258 0.00 0.00 H+0 HETATM 74 H UNK 0 -0.073 -2.055 -1.741 0.00 0.00 H+0 HETATM 75 H UNK 0 0.489 0.317 -2.647 0.00 0.00 H+0 HETATM 76 H UNK 0 -0.242 1.649 -1.726 0.00 0.00 H+0 HETATM 77 H UNK 0 1.585 -0.627 -0.810 0.00 0.00 H+0 HETATM 78 H UNK 0 0.870 0.478 0.387 0.00 0.00 H+0 HETATM 79 H UNK 0 2.692 1.289 -2.019 0.00 0.00 H+0 HETATM 80 H UNK 0 0.949 2.498 0.983 0.00 0.00 H+0 HETATM 81 H UNK 0 2.330 3.447 1.536 0.00 0.00 H+0 HETATM 82 H UNK 0 2.349 1.679 1.821 0.00 0.00 H+0 HETATM 83 H UNK 0 4.022 3.084 -1.699 0.00 0.00 H+0 HETATM 84 H UNK 0 3.237 4.346 -0.620 0.00 0.00 H+0 HETATM 85 H UNK 0 5.579 4.096 -0.179 0.00 0.00 H+0 HETATM 86 H UNK 0 4.626 3.520 1.271 0.00 0.00 H+0 HETATM 87 H UNK 0 4.930 1.130 0.518 0.00 0.00 H+0 HETATM 88 H UNK 0 8.454 2.780 -1.226 0.00 0.00 H+0 HETATM 89 H UNK 0 7.552 3.669 -0.000 0.00 0.00 H+0 HETATM 90 H UNK 0 6.786 3.437 -1.669 0.00 0.00 H+0 HETATM 91 H UNK 0 6.682 -0.271 0.150 0.00 0.00 H+0 HETATM 92 H UNK 0 7.434 -0.005 -1.441 0.00 0.00 H+0 HETATM 93 H UNK 0 8.507 0.612 1.389 0.00 0.00 H+0 HETATM 94 H UNK 0 9.423 1.076 -0.061 0.00 0.00 H+0 HETATM 95 H UNK 0 8.733 -1.865 0.617 0.00 0.00 H+0 HETATM 96 H UNK 0 11.461 0.653 -0.395 0.00 0.00 H+0 HETATM 97 H UNK 0 11.824 -0.380 -1.808 0.00 0.00 H+0 HETATM 98 H UNK 0 10.280 0.492 -1.807 0.00 0.00 H+0 HETATM 99 H UNK 0 10.961 -2.820 -1.753 0.00 0.00 H+0 HETATM 100 H UNK 0 10.253 -3.332 -0.208 0.00 0.00 H+0 HETATM 101 H UNK 0 13.003 -1.990 -0.717 0.00 0.00 H+0 HETATM 102 H UNK 0 12.657 -3.691 -0.363 0.00 0.00 H+0 HETATM 103 H UNK 0 12.126 -1.376 1.686 0.00 0.00 H+0 HETATM 104 H UNK 0 12.448 -5.330 1.787 0.00 0.00 H+0 HETATM 105 H UNK 0 13.865 -4.600 0.931 0.00 0.00 H+0 HETATM 106 H UNK 0 13.984 -4.963 2.671 0.00 0.00 H+0 HETATM 107 H UNK 0 12.082 -3.353 4.178 0.00 0.00 H+0 HETATM 108 H UNK 0 13.894 -3.118 4.091 0.00 0.00 H+0 HETATM 109 H UNK 0 12.829 -1.739 3.711 0.00 0.00 H+0 HETATM 110 H UNK 0 -13.860 -1.861 1.839 0.00 0.00 H+0 HETATM 111 H UNK 0 -14.149 -4.256 2.508 0.00 0.00 H+0 HETATM 112 H UNK 0 -12.117 -5.653 2.897 0.00 0.00 H+0 HETATM 113 H UNK 0 -9.892 -4.647 2.619 0.00 0.00 H+0 CONECT 1 2 50 51 52 CONECT 2 1 3 CONECT 3 2 4 48 CONECT 4 3 5 40 CONECT 5 4 6 53 54 CONECT 6 5 7 55 CONECT 7 6 8 9 CONECT 8 7 56 57 58 CONECT 9 7 10 59 60 CONECT 10 9 11 61 62 CONECT 11 10 12 63 CONECT 12 11 13 14 CONECT 13 12 64 65 66 CONECT 14 12 15 67 68 CONECT 15 14 16 69 70 CONECT 16 15 17 71 CONECT 17 16 18 19 CONECT 18 17 72 73 74 CONECT 19 17 20 75 76 CONECT 20 19 21 77 78 CONECT 21 20 22 79 CONECT 22 21 23 24 CONECT 23 22 80 81 82 CONECT 24 22 25 83 84 CONECT 25 24 26 85 86 CONECT 26 25 27 87 CONECT 27 26 28 29 CONECT 28 27 88 89 90 CONECT 29 27 30 91 92 CONECT 30 29 31 93 94 CONECT 31 30 32 95 CONECT 32 31 33 34 CONECT 33 32 96 97 98 CONECT 34 32 35 99 100 CONECT 35 34 36 101 102 CONECT 36 35 37 103 CONECT 37 36 38 39 CONECT 38 37 104 105 106 CONECT 39 37 107 108 109 CONECT 40 4 41 42 CONECT 41 40 CONECT 42 40 43 47 CONECT 43 42 44 110 CONECT 44 43 45 111 CONECT 45 44 46 112 CONECT 46 45 47 113 CONECT 47 46 48 42 CONECT 48 47 49 3 CONECT 49 48 CONECT 50 1 CONECT 51 1 CONECT 52 1 CONECT 53 5 CONECT 54 5 CONECT 55 6 CONECT 56 8 CONECT 57 8 CONECT 58 8 CONECT 59 9 CONECT 60 9 CONECT 61 10 CONECT 62 10 CONECT 63 11 CONECT 64 13 CONECT 65 13 CONECT 66 13 CONECT 67 14 CONECT 68 14 CONECT 69 15 CONECT 70 15 CONECT 71 16 CONECT 72 18 CONECT 73 18 CONECT 74 18 CONECT 75 19 CONECT 76 19 CONECT 77 20 CONECT 78 20 CONECT 79 21 CONECT 80 23 CONECT 81 23 CONECT 82 23 CONECT 83 24 CONECT 84 24 CONECT 85 25 CONECT 86 25 CONECT 87 26 CONECT 88 28 CONECT 89 28 CONECT 90 28 CONECT 91 29 CONECT 92 29 CONECT 93 30 CONECT 94 30 CONECT 95 31 CONECT 96 33 CONECT 97 33 CONECT 98 33 CONECT 99 34 CONECT 100 34 CONECT 101 35 CONECT 102 35 CONECT 103 36 CONECT 104 38 CONECT 105 38 CONECT 106 38 CONECT 107 39 CONECT 108 39 CONECT 109 39 CONECT 110 43 CONECT 111 44 CONECT 112 45 CONECT 113 46 MASTER 0 0 0 0 0 0 0 0 113 0 228 0 END