HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 C UNK 0 4.498 0.099 7.245 0.00 0.00 C+0 HETATM 2 C UNK 0 5.637 0.740 6.445 0.00 0.00 C+0 HETATM 3 C UNK 0 5.126 1.877 5.556 0.00 0.00 C+0 HETATM 4 O UNK 0 5.637 2.994 5.580 0.00 0.00 O+0 HETATM 5 N UNK 0 4.080 1.569 4.719 0.00 0.00 N+0 HETATM 6 C UNK 0 3.582 2.504 3.727 0.00 0.00 C+0 HETATM 7 C UNK 0 2.798 3.659 4.314 0.00 0.00 C+0 HETATM 8 S UNK 0 2.035 4.606 3.006 0.00 0.00 S+0 HETATM 9 O UNK 0 1.299 5.714 3.569 0.00 0.00 O+0 HETATM 10 O UNK 0 2.948 4.760 1.898 0.00 0.00 O+0 HETATM 11 O UNK 0 0.913 3.530 2.565 0.00 0.00 O+0 HETATM 12 C UNK 0 6.508 -0.295 5.677 0.00 0.00 C+0 HETATM 13 C UNK 0 7.787 0.373 5.144 0.00 0.00 C+0 HETATM 14 C UNK 0 5.739 -1.101 4.641 0.00 0.00 C+0 HETATM 15 C UNK 0 5.898 -1.060 3.306 0.00 0.00 C+0 HETATM 16 C UNK 0 5.092 -1.812 2.250 0.00 0.00 C+0 HETATM 17 C UNK 0 4.406 -3.059 2.815 0.00 0.00 C+0 HETATM 18 C UNK 0 4.105 -0.816 1.579 0.00 0.00 C+0 HETATM 19 C UNK 0 4.849 0.371 0.888 0.00 0.00 C+0 HETATM 20 C UNK 0 3.880 0.955 -0.152 0.00 0.00 C+0 HETATM 21 O UNK 0 4.411 0.846 -1.467 0.00 0.00 O+0 HETATM 22 C UNK 0 2.613 0.115 0.001 0.00 0.00 C+0 HETATM 23 C UNK 0 1.582 0.094 -1.144 0.00 0.00 C+0 HETATM 24 O UNK 0 2.174 -0.465 -2.311 0.00 0.00 O+0 HETATM 25 C UNK 0 1.129 1.516 -1.509 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.032 1.531 -2.509 0.00 0.00 C+0 HETATM 27 O UNK 0 -0.443 2.890 -2.682 0.00 0.00 O+0 HETATM 28 C UNK 0 -1.222 0.713 -1.980 0.00 0.00 C+0 HETATM 29 C UNK 0 -2.471 0.840 -2.868 0.00 0.00 C+0 HETATM 30 C UNK 0 -3.678 0.159 -2.215 0.00 0.00 C+0 HETATM 31 O UNK 0 -4.788 0.150 -3.120 0.00 0.00 O+0 HETATM 32 C UNK 0 -5.579 1.341 -3.060 0.00 0.00 C+0 HETATM 33 O UNK 0 -6.281 1.440 -1.817 0.00 0.00 O+0 HETATM 34 C UNK 0 -7.523 0.734 -1.810 0.00 0.00 C+0 HETATM 35 C UNK 0 -8.521 1.343 -2.805 0.00 0.00 C+0 HETATM 36 O UNK 0 -9.393 2.269 -2.145 0.00 0.00 O+0 HETATM 37 C UNK 0 -7.800 2.073 -3.943 0.00 0.00 C+0 HETATM 38 O UNK 0 -8.668 2.147 -5.084 0.00 0.00 O+0 HETATM 39 C UNK 0 -6.517 1.331 -4.291 0.00 0.00 C+0 HETATM 40 O UNK 0 -5.902 1.946 -5.437 0.00 0.00 O+0 HETATM 41 C UNK 0 -3.374 -1.296 -1.860 0.00 0.00 C+0 HETATM 42 C UNK 0 -2.090 -1.452 -1.042 0.00 0.00 C+0 HETATM 43 C UNK 0 -0.844 -0.775 -1.688 0.00 0.00 C+0 HETATM 44 C UNK 0 -0.499 -1.554 -2.982 0.00 0.00 C+0 HETATM 45 C UNK 0 0.359 -0.760 -0.668 0.00 0.00 C+0 HETATM 46 C UNK 0 0.800 -2.155 -0.165 0.00 0.00 C+0 HETATM 47 C UNK 0 1.892 -2.082 0.922 0.00 0.00 C+0 HETATM 48 C UNK 0 3.128 -1.289 0.458 0.00 0.00 C+0 HETATM 49 C UNK 0 3.893 -2.118 -0.601 0.00 0.00 C+0 HETATM 50 H UNK 0 3.777 -0.426 6.612 0.00 0.00 H+0 HETATM 51 H UNK 0 3.943 0.865 7.800 0.00 0.00 H+0 HETATM 52 H UNK 0 4.895 -0.619 7.970 0.00 0.00 H+0 HETATM 53 H UNK 0 6.286 1.223 7.190 0.00 0.00 H+0 HETATM 54 H UNK 0 3.757 0.611 4.677 0.00 0.00 H+0 HETATM 55 H UNK 0 4.440 2.879 3.158 0.00 0.00 H+0 HETATM 56 H UNK 0 2.959 1.921 3.040 0.00 0.00 H+0 HETATM 57 H UNK 0 2.005 3.322 4.990 0.00 0.00 H+0 HETATM 58 H UNK 0 3.446 4.345 4.867 0.00 0.00 H+0 HETATM 59 H UNK 0 0.044 3.991 2.568 0.00 0.00 H+0 HETATM 60 H UNK 0 6.851 -1.032 6.418 0.00 0.00 H+0 HETATM 61 H UNK 0 8.343 0.844 5.962 0.00 0.00 H+0 HETATM 62 H UNK 0 8.451 -0.367 4.683 0.00 0.00 H+0 HETATM 63 H UNK 0 7.570 1.147 4.401 0.00 0.00 H+0 HETATM 64 H UNK 0 4.984 -1.764 5.060 0.00 0.00 H+0 HETATM 65 H UNK 0 6.661 -0.404 2.889 0.00 0.00 H+0 HETATM 66 H UNK 0 5.817 -2.160 1.503 0.00 0.00 H+0 HETATM 67 H UNK 0 4.075 -3.724 2.014 0.00 0.00 H+0 HETATM 68 H UNK 0 5.097 -3.648 3.430 0.00 0.00 H+0 HETATM 69 H UNK 0 3.536 -2.802 3.429 0.00 0.00 H+0 HETATM 70 H UNK 0 3.490 -0.391 2.387 0.00 0.00 H+0 HETATM 71 H UNK 0 5.113 1.132 1.628 0.00 0.00 H+0 HETATM 72 H UNK 0 5.780 0.039 0.414 0.00 0.00 H+0 HETATM 73 H UNK 0 3.678 2.014 0.041 0.00 0.00 H+0 HETATM 74 H UNK 0 5.235 1.367 -1.485 0.00 0.00 H+0 HETATM 75 H UNK 0 2.085 0.554 0.866 0.00 0.00 H+0 HETATM 76 H UNK 0 3.072 -0.069 -2.383 0.00 0.00 H+0 HETATM 77 H UNK 0 0.833 2.065 -0.605 0.00 0.00 H+0 HETATM 78 H UNK 0 1.958 2.087 -1.946 0.00 0.00 H+0 HETATM 79 H UNK 0 0.289 1.163 -3.489 0.00 0.00 H+0 HETATM 80 H UNK 0 0.307 3.368 -3.078 0.00 0.00 H+0 HETATM 81 H UNK 0 -1.506 1.178 -1.021 0.00 0.00 H+0 HETATM 82 H UNK 0 -2.709 1.897 -3.035 0.00 0.00 H+0 HETATM 83 H UNK 0 -2.293 0.429 -3.869 0.00 0.00 H+0 HETATM 84 H UNK 0 -3.944 0.686 -1.290 0.00 0.00 H+0 HETATM 85 H UNK 0 -4.918 2.212 -3.128 0.00 0.00 H+0 HETATM 86 H UNK 0 -7.920 0.770 -0.790 0.00 0.00 H+0 HETATM 87 H UNK 0 -7.324 -0.316 -2.055 0.00 0.00 H+0 HETATM 88 H UNK 0 -9.172 0.548 -3.189 0.00 0.00 H+0 HETATM 89 H UNK 0 -9.936 2.669 -2.851 0.00 0.00 H+0 HETATM 90 H UNK 0 -7.581 3.113 -3.670 0.00 0.00 H+0 HETATM 91 H UNK 0 -8.083 2.404 -5.826 0.00 0.00 H+0 HETATM 92 H UNK 0 -6.753 0.305 -4.599 0.00 0.00 H+0 HETATM 93 H UNK 0 -5.068 1.460 -5.587 0.00 0.00 H+0 HETATM 94 H UNK 0 -3.326 -1.904 -2.772 0.00 0.00 H+0 HETATM 95 H UNK 0 -4.218 -1.711 -1.294 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.262 -1.024 -0.045 0.00 0.00 H+0 HETATM 97 H UNK 0 -1.912 -2.524 -0.894 0.00 0.00 H+0 HETATM 98 H UNK 0 -1.347 -1.613 -3.671 0.00 0.00 H+0 HETATM 99 H UNK 0 -0.212 -2.586 -2.761 0.00 0.00 H+0 HETATM 100 H UNK 0 0.310 -1.098 -3.555 0.00 0.00 H+0 HETATM 101 H UNK 0 -0.030 -0.248 0.228 0.00 0.00 H+0 HETATM 102 H UNK 0 1.151 -2.772 -0.998 0.00 0.00 H+0 HETATM 103 H UNK 0 -0.054 -2.684 0.272 0.00 0.00 H+0 HETATM 104 H UNK 0 1.463 -1.616 1.819 0.00 0.00 H+0 HETATM 105 H UNK 0 2.157 -3.104 1.204 0.00 0.00 H+0 HETATM 106 H UNK 0 4.245 -3.063 -0.174 0.00 0.00 H+0 HETATM 107 H UNK 0 4.775 -1.605 -0.991 0.00 0.00 H+0 HETATM 108 H UNK 0 3.275 -2.393 -1.458 0.00 0.00 H+0 CONECT 1 2 50 51 52 CONECT 2 1 12 3 53 CONECT 3 5 4 2 CONECT 4 3 CONECT 5 3 6 54 CONECT 6 5 7 55 56 CONECT 7 6 8 57 58 CONECT 8 7 9 10 11 CONECT 9 8 CONECT 10 8 CONECT 11 8 59 CONECT 12 14 13 2 60 CONECT 13 12 61 62 63 CONECT 14 15 12 64 CONECT 15 16 14 65 CONECT 16 18 17 15 66 CONECT 17 16 67 68 69 CONECT 18 19 48 16 70 CONECT 19 20 18 71 72 CONECT 20 22 19 21 73 CONECT 21 20 74 CONECT 22 23 48 20 75 CONECT 23 22 25 45 24 CONECT 24 23 76 CONECT 25 26 23 77 78 CONECT 26 28 25 27 79 CONECT 27 26 80 CONECT 28 26 29 43 81 CONECT 29 28 30 82 83 CONECT 30 29 41 31 84 CONECT 31 30 32 CONECT 32 39 33 31 85 CONECT 33 34 32 CONECT 34 35 33 86 87 CONECT 35 37 34 36 88 CONECT 36 35 89 CONECT 37 39 35 38 90 CONECT 38 37 91 CONECT 39 40 32 37 92 CONECT 40 39 93 CONECT 41 42 30 94 95 CONECT 42 43 41 96 97 CONECT 43 45 42 44 28 CONECT 44 43 98 99 100 CONECT 45 43 23 46 101 CONECT 46 47 45 102 103 CONECT 47 48 46 104 105 CONECT 48 47 22 18 49 CONECT 49 48 106 107 108 CONECT 50 1 CONECT 51 1 CONECT 52 1 CONECT 53 2 CONECT 54 5 CONECT 55 6 CONECT 56 6 CONECT 57 7 CONECT 58 7 CONECT 59 11 CONECT 60 12 CONECT 61 13 CONECT 62 13 CONECT 63 13 CONECT 64 14 CONECT 65 15 CONECT 66 16 CONECT 67 17 CONECT 68 17 CONECT 69 17 CONECT 70 18 CONECT 71 19 CONECT 72 19 CONECT 73 20 CONECT 74 21 CONECT 75 22 CONECT 76 24 CONECT 77 25 CONECT 78 25 CONECT 79 26 CONECT 80 27 CONECT 81 28 CONECT 82 29 CONECT 83 29 CONECT 84 30 CONECT 85 32 CONECT 86 34 CONECT 87 34 CONECT 88 35 CONECT 89 36 CONECT 90 37 CONECT 91 38 CONECT 92 39 CONECT 93 40 CONECT 94 41 CONECT 95 41 CONECT 96 42 CONECT 97 42 CONECT 98 44 CONECT 99 44 CONECT 100 44 CONECT 101 45 CONECT 102 46 CONECT 103 46 CONECT 104 47 CONECT 105 47 CONECT 106 49 CONECT 107 49 CONECT 108 49 MASTER 0 0 0 0 0 0 0 0 108 0 224 0 END