HEADER PROTEIN 10-MAY-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 10-MAY-21 0 HETATM 1 C UNK 0 -0.424 -0.669 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 11.804 -0.685 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 4.920 0.669 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -8.000 0.685 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 5.682 1.991 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -7.214 2.015 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 1.108 -0.661 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 13.352 -0.692 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 7.977 0.661 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -4.912 0.653 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 1.871 0.661 0.000 0.00 0.00 C+0 HETATM 12 S UNK 0 11.010 -6.417 0.000 0.00 0.00 S+0 HETATM 13 S UNK 0 -1.194 -3.531 0.000 0.00 0.00 S+0 HETATM 14 S UNK 0 1.847 -6.378 0.000 0.00 0.00 S+0 HETATM 15 S UNK 0 14.122 -3.578 0.000 0.00 0.00 S+0 HETATM 16 C UNK 0 -1.186 0.653 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 11.042 0.661 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -11.073 0.685 0.000 0.00 0.00 C+0 HETATM 19 O UNK 0 7.207 1.984 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 -5.674 2.007 0.000 0.00 0.00 O+0 HETATM 21 S UNK 0 -1.209 6.386 0.000 0.00 0.00 S+0 HETATM 22 S UNK 0 11.042 6.417 0.000 0.00 0.00 S+0 HETATM 23 S UNK 0 -14.161 6.409 0.000 0.00 0.00 S+0 HETATM 24 C UNK 0 7.207 -0.661 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -5.698 -0.677 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 5.674 -0.661 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -7.253 -0.661 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 -11.835 -0.638 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -13.367 -0.646 0.000 0.00 0.00 C+0 HETATM 30 O UNK 0 3.395 0.669 0.000 0.00 0.00 O+0 HETATM 31 O UNK 0 -9.548 0.692 0.000 0.00 0.00 O+0 HETATM 32 O UNK 0 1.101 1.984 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 -11.843 2.007 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 -0.424 1.984 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 11.819 1.991 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 9.501 0.661 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 -2.711 0.646 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 14.137 0.638 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 13.367 1.984 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 -13.367 2.007 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 -14.130 0.677 0.000 0.00 0.00 C+0 HETATM 42 O UNK 0 -1.186 -1.991 0.000 0.00 0.00 O+0 HETATM 43 O UNK 0 11.026 -2.015 0.000 0.00 0.00 O+0 HETATM 44 O UNK 0 1.871 -1.983 0.000 0.00 0.00 O+0 HETATM 45 O UNK 0 14.114 -2.038 0.000 0.00 0.00 O+0 HETATM 46 C UNK 0 -7.977 3.360 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 4.928 3.314 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -1.194 3.298 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 11.057 3.337 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 -14.137 3.321 0.000 0.00 0.00 C+0 HETATM 51 O UNK 0 11.042 4.877 0.000 0.00 0.00 O+0 HETATM 52 O UNK 0 -14.145 4.869 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 -1.209 4.846 0.000 0.00 0.00 O+0 HETATM 54 O UNK 0 -1.209 -5.071 0.000 0.00 0.00 O-1 HETATM 55 O UNK 0 1.847 -7.918 0.000 0.00 0.00 O-1 HETATM 56 O UNK 0 11.003 -7.957 0.000 0.00 0.00 O-1 HETATM 57 O UNK 0 14.114 -5.118 0.000 0.00 0.00 O-1 HETATM 58 O UNK 0 11.026 7.957 0.000 0.00 0.00 O-1 HETATM 59 O UNK 0 -1.217 7.926 0.000 0.00 0.00 O-1 HETATM 60 O UNK 0 -14.168 7.950 0.000 0.00 0.00 O-1 HETATM 61 O UNK 0 12.550 -6.417 0.000 0.00 0.00 O+0 HETATM 62 O UNK 0 0.346 -3.531 0.000 0.00 0.00 O+0 HETATM 63 O UNK 0 -2.734 -3.531 0.000 0.00 0.00 O+0 HETATM 64 O UNK 0 9.470 -6.417 0.000 0.00 0.00 O+0 HETATM 65 O UNK 0 3.388 -6.378 0.000 0.00 0.00 O+0 HETATM 66 O UNK 0 0.307 -6.378 0.000 0.00 0.00 O+0 HETATM 67 O UNK 0 12.582 -3.578 0.000 0.00 0.00 O+0 HETATM 68 O UNK 0 15.662 -3.578 0.000 0.00 0.00 O+0 HETATM 69 O UNK 0 12.582 6.417 0.000 0.00 0.00 O+0 HETATM 70 O UNK 0 0.331 6.386 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 -2.749 6.386 0.000 0.00 0.00 O+0 HETATM 72 O UNK 0 9.501 6.417 0.000 0.00 0.00 O+0 HETATM 73 O UNK 0 -12.621 6.409 0.000 0.00 0.00 O+0 HETATM 74 O UNK 0 -15.701 6.409 0.000 0.00 0.00 O+0 HETATM 75 O UNK 0 5.690 4.659 0.000 0.00 0.00 O-1 HETATM 76 O UNK 0 -7.214 4.706 0.000 0.00 0.00 O-1 HETATM 77 O UNK 0 -9.525 3.360 0.000 0.00 0.00 O+0 HETATM 78 O UNK 0 3.388 3.314 0.000 0.00 0.00 O+0 HETATM 79 O UNK 0 -11.065 -1.960 0.000 0.00 0.00 O+0 HETATM 80 O UNK 0 7.961 -1.983 0.000 0.00 0.00 O+0 HETATM 81 O UNK 0 -4.951 -2.022 0.000 0.00 0.00 O+0 HETATM 82 O UNK 0 -8.039 -1.991 0.000 0.00 0.00 O+0 HETATM 83 O UNK 0 4.912 -1.983 0.000 0.00 0.00 O+0 HETATM 84 O UNK 0 -14.130 -1.968 0.000 0.00 0.00 O+0 HETATM 85 O UNK 0 -15.654 0.669 0.000 0.00 0.00 O+0 HETATM 86 O UNK 0 15.677 0.630 0.000 0.00 0.00 O+0 HETATM 87 C UNK 0 -4.966 -3.555 0.000 0.00 0.00 C+0 HETATM 88 C UNK 0 -11.080 -3.500 0.000 0.00 0.00 C+0 HETATM 89 C UNK 0 7.961 -3.523 0.000 0.00 0.00 C+0 HETATM 90 C UNK 0 4.904 -3.523 0.000 0.00 0.00 C+0 HETATM 91 C UNK 0 -14.137 -3.508 0.000 0.00 0.00 C+0 HETATM 92 C UNK 0 -8.047 -3.531 0.000 0.00 0.00 C+0 HETATM 93 C UNK 0 -16.432 -0.661 0.000 0.00 0.00 C+0 HETATM 94 C UNK 0 16.432 1.976 0.000 0.00 0.00 C+0 HETATM 95 H UNK 0 9.058 -0.428 0.000 0.00 0.00 H+0 HETATM 96 H UNK 0 -9.991 -0.404 0.000 0.00 0.00 H+0 HETATM 97 H UNK 0 -3.831 -0.428 0.000 0.00 0.00 H+0 HETATM 98 H UNK 0 2.959 -0.428 0.000 0.00 0.00 H+0 HETATM 99 Na UNK 0 3.170 -7.918 0.000 0.00 0.00 Na+1 HETATM 100 Na UNK 0 0.113 -5.071 0.000 0.00 0.00 Na+1 HETATM 101 Na UNK 0 -12.675 7.926 0.000 0.00 0.00 Na+1 HETATM 102 Na UNK 0 -6.040 4.636 0.000 0.00 0.00 Na+1 HETATM 103 Na UNK 0 7.012 4.659 0.000 0.00 0.00 Na+1 HETATM 104 Na UNK 0 0.105 7.926 0.000 0.00 0.00 Na+1 HETATM 105 Na UNK 0 12.364 7.957 0.000 0.00 0.00 Na+1 HETATM 106 Na UNK 0 15.444 -5.118 0.000 0.00 0.00 Na+1 HETATM 107 Na UNK 0 12.325 -7.942 0.000 0.00 0.00 Na+1 CONECT 1 7 16 42 CONECT 2 17 8 43 CONECT 3 30 5 26 CONECT 4 27 31 6 CONECT 5 3 19 47 CONECT 6 20 46 4 CONECT 7 1 11 44 CONECT 8 2 45 38 CONECT 9 19 36 95 24 CONECT 10 37 20 25 97 CONECT 11 7 30 98 32 CONECT 12 43 56 61 64 CONECT 13 42 54 62 63 CONECT 14 44 55 65 66 CONECT 15 45 57 67 68 CONECT 16 1 34 37 CONECT 17 2 36 35 CONECT 18 31 28 33 96 CONECT 19 9 5 CONECT 20 6 10 CONECT 21 53 59 70 71 CONECT 22 51 58 69 72 CONECT 23 52 60 73 74 CONECT 24 26 80 9 CONECT 25 10 27 81 CONECT 26 24 3 83 CONECT 27 4 25 82 CONECT 28 18 29 79 CONECT 29 28 41 84 CONECT 30 3 11 CONECT 31 18 4 CONECT 32 34 11 CONECT 33 18 40 CONECT 34 32 16 48 CONECT 35 17 39 49 CONECT 36 17 9 CONECT 37 10 16 CONECT 38 39 86 8 CONECT 39 38 35 CONECT 40 33 50 41 CONECT 41 29 85 40 CONECT 42 13 1 CONECT 43 12 2 CONECT 44 14 7 CONECT 45 15 8 CONECT 46 6 76 77 CONECT 47 5 75 78 CONECT 48 34 53 CONECT 49 35 51 CONECT 50 40 52 CONECT 51 22 49 CONECT 52 23 50 CONECT 53 21 48 CONECT 54 13 CONECT 55 14 CONECT 56 12 CONECT 57 15 CONECT 58 22 CONECT 59 21 CONECT 60 23 CONECT 61 12 CONECT 62 13 CONECT 63 13 CONECT 64 12 CONECT 65 14 CONECT 66 14 CONECT 67 15 CONECT 68 15 CONECT 69 22 CONECT 70 21 CONECT 71 21 CONECT 72 22 CONECT 73 23 CONECT 74 23 CONECT 75 47 CONECT 76 46 CONECT 77 46 CONECT 78 47 CONECT 79 28 88 CONECT 80 24 89 CONECT 81 25 87 CONECT 82 27 92 CONECT 83 26 90 CONECT 84 29 91 CONECT 85 41 93 CONECT 86 38 94 CONECT 87 81 CONECT 88 79 CONECT 89 80 CONECT 90 83 CONECT 91 84 CONECT 92 82 CONECT 93 85 CONECT 94 86 CONECT 95 9 CONECT 96 18 CONECT 97 10 CONECT 98 11 MASTER 0 0 0 0 0 0 0 0 107 0 204 0 END