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 -12.299 -1.696 1.441 0.00 0.00 C+0 HETATM 2 C UNK 0 -11.945 -1.217 0.007 0.00 0.00 C+0 HETATM 3 O UNK 0 -10.686 -1.625 -0.252 0.00 0.00 O+0 HETATM 4 C UNK 0 -9.632 -0.836 -0.184 0.00 0.00 C+0 HETATM 5 O UNK 0 -8.880 -0.640 -1.359 0.00 0.00 O+0 HETATM 6 C UNK 0 -7.516 -0.714 -1.111 0.00 0.00 C+0 HETATM 7 C UNK 0 -6.858 -1.873 -1.786 0.00 0.00 C+0 HETATM 8 C UNK 0 -5.446 -1.957 -1.225 0.00 0.00 C+0 HETATM 9 C UNK 0 -4.866 -0.562 -1.135 0.00 0.00 C+0 HETATM 10 O UNK 0 -5.000 -0.065 0.037 0.00 0.00 O+0 HETATM 11 C UNK 0 -4.541 0.512 1.071 0.00 0.00 C+0 HETATM 12 C UNK 0 -4.055 1.990 0.735 0.00 0.00 C+0 HETATM 13 C UNK 0 -5.699 0.862 2.096 0.00 0.00 C+0 HETATM 14 C UNK 0 -6.393 -0.328 2.552 0.00 0.00 C+0 HETATM 15 O UNK 0 -6.103 -1.518 2.285 0.00 0.00 O+0 HETATM 16 O UNK 0 -7.536 -0.199 3.392 0.00 0.00 O+0 HETATM 17 C UNK 0 -3.495 -0.006 1.925 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.092 -0.240 1.656 0.00 0.00 C+0 HETATM 19 C UNK 0 -1.371 -0.689 2.812 0.00 0.00 C+0 HETATM 20 C UNK 0 -0.024 -0.830 2.808 0.00 0.00 C+0 HETATM 21 C UNK 0 0.714 -0.544 1.679 0.00 0.00 C+0 HETATM 22 C UNK 0 0.082 -0.121 0.552 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.319 0.028 0.553 0.00 0.00 C+0 HETATM 24 O UNK 0 -1.950 0.459 -0.567 0.00 0.00 O+0 HETATM 25 C UNK 0 0.910 0.214 -0.593 0.00 0.00 C+0 HETATM 26 O UNK 0 0.382 0.598 -1.655 0.00 0.00 O+0 HETATM 27 C UNK 0 2.391 0.108 -0.529 0.00 0.00 C+0 HETATM 28 C UNK 0 3.162 0.433 -1.608 0.00 0.00 C+0 HETATM 29 C UNK 0 4.579 0.358 -1.566 0.00 0.00 C+0 HETATM 30 C UNK 0 5.231 -0.041 -0.434 0.00 0.00 C+0 HETATM 31 C UNK 0 6.658 0.048 -0.164 0.00 0.00 C+0 HETATM 32 C UNK 0 7.671 -0.736 -0.927 0.00 0.00 C+0 HETATM 33 C UNK 0 8.961 -0.318 -0.216 0.00 0.00 C+0 HETATM 34 O UNK 0 10.011 -1.161 -0.143 0.00 0.00 O+0 HETATM 35 C UNK 0 10.878 -0.465 0.766 0.00 0.00 C+0 HETATM 36 C UNK 0 11.966 -1.339 1.227 0.00 0.00 C+0 HETATM 37 C UNK 0 13.269 -0.707 0.789 0.00 0.00 C+0 HETATM 38 O UNK 0 14.238 -0.614 1.493 0.00 0.00 O+0 HETATM 39 C UNK 0 13.308 -0.186 -0.600 0.00 0.00 C+0 HETATM 40 C UNK 0 14.570 0.552 -0.904 0.00 0.00 C+0 HETATM 41 O UNK 0 12.218 0.617 -0.930 0.00 0.00 O+0 HETATM 42 C UNK 0 11.354 0.830 0.159 0.00 0.00 C+0 HETATM 43 O UNK 0 10.307 1.623 -0.242 0.00 0.00 O+0 HETATM 44 C UNK 0 9.340 0.973 -0.897 0.00 0.00 C+0 HETATM 45 C UNK 0 8.043 1.764 -1.126 0.00 0.00 C+0 HETATM 46 C UNK 0 7.843 1.897 -2.611 0.00 0.00 C+0 HETATM 47 O UNK 0 6.987 1.444 -0.351 0.00 0.00 O+0 HETATM 48 C UNK 0 4.396 -0.380 0.680 0.00 0.00 C+0 HETATM 49 O UNK 0 5.060 -0.785 1.804 0.00 0.00 O+0 HETATM 50 C UNK 0 3.029 -0.308 0.612 0.00 0.00 C+0 HETATM 51 C UNK 0 2.191 -0.648 1.746 0.00 0.00 C+0 HETATM 52 O UNK 0 2.712 -1.048 2.828 0.00 0.00 O+0 HETATM 53 O UNK 0 -5.574 0.305 -2.050 0.00 0.00 O+0 HETATM 54 C UNK 0 -6.833 0.558 -1.533 0.00 0.00 C+0 HETATM 55 C UNK 0 -7.677 1.281 -2.530 0.00 0.00 C+0 HETATM 56 C UNK 0 -9.906 0.538 0.465 0.00 0.00 C+0 HETATM 57 C UNK 0 -11.102 1.189 -0.121 0.00 0.00 C+0 HETATM 58 C UNK 0 -12.217 0.226 -0.031 0.00 0.00 C+0 HETATM 59 O UNK 0 -13.364 0.660 0.009 0.00 0.00 O+0 HETATM 60 H UNK 0 -12.055 -0.845 2.114 0.00 0.00 H+0 HETATM 61 H UNK 0 -13.360 -1.902 1.557 0.00 0.00 H+0 HETATM 62 H UNK 0 -11.619 -2.538 1.714 0.00 0.00 H+0 HETATM 63 H UNK 0 -12.726 -1.749 -0.617 0.00 0.00 H+0 HETATM 64 H UNK 0 -8.869 -1.237 0.560 0.00 0.00 H+0 HETATM 65 H UNK 0 -7.375 -0.859 -0.031 0.00 0.00 H+0 HETATM 66 H UNK 0 -6.736 -1.738 -2.869 0.00 0.00 H+0 HETATM 67 H UNK 0 -7.347 -2.836 -1.530 0.00 0.00 H+0 HETATM 68 H UNK 0 -4.795 -2.506 -1.970 0.00 0.00 H+0 HETATM 69 H UNK 0 -5.365 -2.540 -0.304 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.882 -0.585 -1.590 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.705 2.723 1.238 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.050 2.135 1.137 0.00 0.00 H+0 HETATM 73 H UNK 0 -4.032 2.118 -0.359 0.00 0.00 H+0 HETATM 74 H UNK 0 -6.373 1.591 1.689 0.00 0.00 H+0 HETATM 75 H UNK 0 -5.164 1.307 2.956 0.00 0.00 H+0 HETATM 76 H UNK 0 -7.552 -0.505 4.339 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.878 -1.010 2.452 0.00 0.00 H+0 HETATM 78 H UNK 0 -3.503 0.613 2.951 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.932 -0.924 3.704 0.00 0.00 H+0 HETATM 80 H UNK 0 0.515 -1.178 3.693 0.00 0.00 H+0 HETATM 81 H UNK 0 -1.712 0.720 -1.459 0.00 0.00 H+0 HETATM 82 H UNK 0 2.652 0.760 -2.506 0.00 0.00 H+0 HETATM 83 H UNK 0 5.127 0.635 -2.437 0.00 0.00 H+0 HETATM 84 H UNK 0 6.863 -0.104 0.908 0.00 0.00 H+0 HETATM 85 H UNK 0 7.739 -0.686 -1.980 0.00 0.00 H+0 HETATM 86 H UNK 0 7.552 -1.840 -0.630 0.00 0.00 H+0 HETATM 87 H UNK 0 8.651 -0.072 0.863 0.00 0.00 H+0 HETATM 88 H UNK 0 10.193 -0.173 1.596 0.00 0.00 H+0 HETATM 89 H UNK 0 11.955 -2.398 0.831 0.00 0.00 H+0 HETATM 90 H UNK 0 12.029 -1.434 2.338 0.00 0.00 H+0 HETATM 91 H UNK 0 13.214 -1.103 -1.278 0.00 0.00 H+0 HETATM 92 H UNK 0 14.961 1.060 -0.006 0.00 0.00 H+0 HETATM 93 H UNK 0 15.296 -0.237 -1.284 0.00 0.00 H+0 HETATM 94 H UNK 0 14.485 1.302 -1.705 0.00 0.00 H+0 HETATM 95 H UNK 0 11.921 1.343 1.011 0.00 0.00 H+0 HETATM 96 H UNK 0 9.766 0.632 -1.908 0.00 0.00 H+0 HETATM 97 H UNK 0 8.333 2.830 -0.797 0.00 0.00 H+0 HETATM 98 H UNK 0 7.570 2.959 -2.885 0.00 0.00 H+0 HETATM 99 H UNK 0 8.884 1.754 -3.079 0.00 0.00 H+0 HETATM 100 H UNK 0 7.200 1.202 -3.121 0.00 0.00 H+0 HETATM 101 H UNK 0 4.856 -1.091 2.686 0.00 0.00 H+0 HETATM 102 H UNK 0 -6.692 1.187 -0.642 0.00 0.00 H+0 HETATM 103 H UNK 0 -8.261 2.119 -2.068 0.00 0.00 H+0 HETATM 104 H UNK 0 -7.126 1.733 -3.367 0.00 0.00 H+0 HETATM 105 H UNK 0 -8.461 0.616 -2.974 0.00 0.00 H+0 HETATM 106 H UNK 0 -10.067 0.316 1.533 0.00 0.00 H+0 HETATM 107 H UNK 0 -9.008 1.120 0.309 0.00 0.00 H+0 HETATM 108 H UNK 0 -11.276 2.129 0.485 0.00 0.00 H+0 HETATM 109 H UNK 0 -10.921 1.516 -1.173 0.00 0.00 H+0 CONECT 1 2 60 61 62 CONECT 2 1 3 58 63 CONECT 3 2 4 CONECT 4 3 5 56 64 CONECT 5 4 6 CONECT 6 5 7 54 65 CONECT 7 6 8 66 67 CONECT 8 7 9 68 69 CONECT 9 8 10 53 70 CONECT 10 9 11 CONECT 11 10 12 13 17 CONECT 12 11 71 72 73 CONECT 13 11 14 74 75 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 76 CONECT 17 11 18 77 78 CONECT 18 17 19 23 CONECT 19 18 20 79 CONECT 20 19 21 80 CONECT 21 20 22 51 CONECT 22 21 23 25 CONECT 23 22 24 18 CONECT 24 23 81 CONECT 25 22 26 27 CONECT 26 25 CONECT 27 25 28 50 CONECT 28 27 29 82 CONECT 29 28 30 83 CONECT 30 29 31 48 CONECT 31 30 32 47 84 CONECT 32 31 33 85 86 CONECT 33 32 34 44 87 CONECT 34 33 35 CONECT 35 34 36 42 88 CONECT 36 35 37 89 90 CONECT 37 36 38 39 CONECT 38 37 CONECT 39 37 40 41 91 CONECT 40 39 92 93 94 CONECT 41 39 42 CONECT 42 41 43 35 95 CONECT 43 42 44 CONECT 44 43 45 33 96 CONECT 45 44 46 47 97 CONECT 46 45 98 99 100 CONECT 47 45 31 CONECT 48 30 49 50 CONECT 49 48 101 CONECT 50 48 51 27 CONECT 51 50 52 21 CONECT 52 51 CONECT 53 9 54 CONECT 54 53 55 6 102 CONECT 55 54 103 104 105 CONECT 56 4 57 106 107 CONECT 57 56 58 108 109 CONECT 58 57 59 2 CONECT 59 58 CONECT 60 1 CONECT 61 1 CONECT 62 1 CONECT 63 2 CONECT 64 4 CONECT 65 6 CONECT 66 7 CONECT 67 7 CONECT 68 8 CONECT 69 8 CONECT 70 9 CONECT 71 12 CONECT 72 12 CONECT 73 12 CONECT 74 13 CONECT 75 13 CONECT 76 16 CONECT 77 17 CONECT 78 17 CONECT 79 19 CONECT 80 20 CONECT 81 24 CONECT 82 28 CONECT 83 29 CONECT 84 31 CONECT 85 32 CONECT 86 32 CONECT 87 33 CONECT 88 35 CONECT 89 36 CONECT 90 36 CONECT 91 39 CONECT 92 40 CONECT 93 40 CONECT 94 40 CONECT 95 42 CONECT 96 44 CONECT 97 45 CONECT 98 46 CONECT 99 46 CONECT 100 46 CONECT 101 49 CONECT 102 54 CONECT 103 55 CONECT 104 55 CONECT 105 55 CONECT 106 56 CONECT 107 56 CONECT 108 57 CONECT 109 57 MASTER 0 0 0 0 0 0 0 0 109 0 232 0 END