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 2.037 -1.579 -1.312 0.00 0.00 C+0 HETATM 2 C UNK 0 1.666 -1.272 -0.090 0.00 0.00 C+0 HETATM 3 C UNK 0 1.176 -2.384 0.806 0.00 0.00 C+0 HETATM 4 C UNK 0 0.008 -1.816 1.630 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.540 -0.662 0.866 0.00 0.00 C+0 HETATM 6 C UNK 0 0.339 0.531 0.995 0.00 0.00 C+0 HETATM 7 C UNK 0 0.493 1.102 2.353 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.174 1.674 0.104 0.00 0.00 C+0 HETATM 9 C UNK 0 -1.636 1.972 0.459 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.384 0.688 0.132 0.00 0.00 C+0 HETATM 11 C UNK 0 -3.845 0.905 -0.112 0.00 0.00 C+0 HETATM 12 C UNK 0 -4.562 1.539 1.040 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.945 1.896 -1.280 0.00 0.00 C+0 HETATM 14 C UNK 0 -4.923 1.476 -2.319 0.00 0.00 C+0 HETATM 15 C UNK 0 -6.211 0.920 -1.784 0.00 0.00 C+0 HETATM 16 C UNK 0 -5.866 -0.327 -0.997 0.00 0.00 C+0 HETATM 17 C UNK 0 -6.086 -1.501 -1.966 0.00 0.00 C+0 HETATM 18 C UNK 0 -6.849 -0.532 0.123 0.00 0.00 C+0 HETATM 19 C UNK 0 -4.439 -0.379 -0.585 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.222 -1.446 0.429 0.00 0.00 C+0 HETATM 21 C UNK 0 -2.716 -1.683 0.553 0.00 0.00 C+0 HETATM 22 C UNK 0 -2.021 -0.413 1.070 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.425 -0.254 2.483 0.00 0.00 C+0 HETATM 24 C UNK 0 1.707 0.140 0.448 0.00 0.00 C+0 HETATM 25 C UNK 0 2.777 0.196 1.497 0.00 0.00 C+0 HETATM 26 C UNK 0 4.123 -0.162 0.928 0.00 0.00 C+0 HETATM 27 C UNK 0 4.601 0.732 -0.168 0.00 0.00 C+0 HETATM 28 C UNK 0 4.734 2.174 0.282 0.00 0.00 C+0 HETATM 29 C UNK 0 5.918 0.228 -0.614 0.00 0.00 C+0 HETATM 30 C UNK 0 6.934 0.121 0.304 0.00 0.00 C+0 HETATM 31 C UNK 0 8.194 -0.343 -0.039 0.00 0.00 C+0 HETATM 32 C UNK 0 8.427 -0.706 -1.346 0.00 0.00 C+0 HETATM 33 C UNK 0 9.752 -1.204 -1.753 0.00 0.00 C+0 HETATM 34 C UNK 0 7.420 -0.613 -2.314 0.00 0.00 C+0 HETATM 35 C UNK 0 6.167 -0.138 -1.913 0.00 0.00 C+0 HETATM 36 H UNK 0 2.392 -0.820 -1.985 0.00 0.00 H+0 HETATM 37 H UNK 0 1.988 -2.595 -1.650 0.00 0.00 H+0 HETATM 38 H UNK 0 0.802 -3.233 0.199 0.00 0.00 H+0 HETATM 39 H UNK 0 1.974 -2.769 1.454 0.00 0.00 H+0 HETATM 40 H UNK 0 -0.669 -2.648 1.803 0.00 0.00 H+0 HETATM 41 H UNK 0 0.453 -1.541 2.607 0.00 0.00 H+0 HETATM 42 H UNK 0 -0.475 -0.960 -0.229 0.00 0.00 H+0 HETATM 43 H UNK 0 -0.452 1.448 2.815 0.00 0.00 H+0 HETATM 44 H UNK 0 1.017 0.508 3.091 0.00 0.00 H+0 HETATM 45 H UNK 0 1.080 2.062 2.231 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.186 1.367 -0.960 0.00 0.00 H+0 HETATM 47 H UNK 0 0.409 2.574 0.310 0.00 0.00 H+0 HETATM 48 H UNK 0 -1.946 2.789 -0.189 0.00 0.00 H+0 HETATM 49 H UNK 0 -1.762 2.281 1.495 0.00 0.00 H+0 HETATM 50 H UNK 0 -1.962 0.374 -0.873 0.00 0.00 H+0 HETATM 51 H UNK 0 -4.907 0.847 1.809 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.866 2.336 1.442 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.445 2.150 0.685 0.00 0.00 H+0 HETATM 54 H UNK 0 -4.233 2.909 -0.925 0.00 0.00 H+0 HETATM 55 H UNK 0 -2.960 2.031 -1.787 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.476 0.678 -2.966 0.00 0.00 H+0 HETATM 57 H UNK 0 -5.162 2.384 -2.932 0.00 0.00 H+0 HETATM 58 H UNK 0 -6.838 0.677 -2.692 0.00 0.00 H+0 HETATM 59 H UNK 0 -6.814 1.643 -1.214 0.00 0.00 H+0 HETATM 60 H UNK 0 -6.311 -2.424 -1.413 0.00 0.00 H+0 HETATM 61 H UNK 0 -5.163 -1.645 -2.577 0.00 0.00 H+0 HETATM 62 H UNK 0 -6.898 -1.256 -2.683 0.00 0.00 H+0 HETATM 63 H UNK 0 -7.006 0.333 0.764 0.00 0.00 H+0 HETATM 64 H UNK 0 -7.845 -0.733 -0.374 0.00 0.00 H+0 HETATM 65 H UNK 0 -6.608 -1.472 0.655 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.847 -0.677 -1.501 0.00 0.00 H+0 HETATM 67 H UNK 0 -4.622 -2.421 0.034 0.00 0.00 H+0 HETATM 68 H UNK 0 -4.713 -1.281 1.384 0.00 0.00 H+0 HETATM 69 H UNK 0 -2.323 -1.997 -0.413 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.641 -2.504 1.326 0.00 0.00 H+0 HETATM 71 H UNK 0 -1.576 -0.642 3.121 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.275 -0.940 2.782 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.731 0.734 2.810 0.00 0.00 H+0 HETATM 74 H UNK 0 2.023 0.799 -0.385 0.00 0.00 H+0 HETATM 75 H UNK 0 2.602 -0.511 2.334 0.00 0.00 H+0 HETATM 76 H UNK 0 2.892 1.205 1.942 0.00 0.00 H+0 HETATM 77 H UNK 0 4.167 -1.205 0.557 0.00 0.00 H+0 HETATM 78 H UNK 0 4.871 -0.090 1.759 0.00 0.00 H+0 HETATM 79 H UNK 0 3.936 0.749 -1.054 0.00 0.00 H+0 HETATM 80 H UNK 0 5.418 2.667 -0.436 0.00 0.00 H+0 HETATM 81 H UNK 0 5.125 2.250 1.309 0.00 0.00 H+0 HETATM 82 H UNK 0 3.745 2.649 0.148 0.00 0.00 H+0 HETATM 83 H UNK 0 6.808 0.393 1.349 0.00 0.00 H+0 HETATM 84 H UNK 0 9.005 -0.435 0.664 0.00 0.00 H+0 HETATM 85 H UNK 0 10.215 -0.451 -2.434 0.00 0.00 H+0 HETATM 86 H UNK 0 10.418 -1.271 -0.874 0.00 0.00 H+0 HETATM 87 H UNK 0 9.710 -2.214 -2.218 0.00 0.00 H+0 HETATM 88 H UNK 0 7.625 -0.903 -3.333 0.00 0.00 H+0 HETATM 89 H UNK 0 5.416 -0.081 -2.690 0.00 0.00 H+0 CONECT 1 2 36 37 CONECT 2 1 3 24 CONECT 3 2 4 38 39 CONECT 4 3 5 40 41 CONECT 5 4 6 22 42 CONECT 6 5 7 8 24 CONECT 7 6 43 44 45 CONECT 8 6 9 46 47 CONECT 9 8 10 48 49 CONECT 10 9 11 22 50 CONECT 11 10 12 13 19 CONECT 12 11 51 52 53 CONECT 13 11 14 54 55 CONECT 14 13 15 56 57 CONECT 15 14 16 58 59 CONECT 16 15 17 18 19 CONECT 17 16 60 61 62 CONECT 18 16 63 64 65 CONECT 19 16 20 11 66 CONECT 20 19 21 67 68 CONECT 21 20 22 69 70 CONECT 22 21 23 5 10 CONECT 23 22 71 72 73 CONECT 24 6 25 2 74 CONECT 25 24 26 75 76 CONECT 26 25 27 77 78 CONECT 27 26 28 29 79 CONECT 28 27 80 81 82 CONECT 29 27 30 35 CONECT 30 29 31 83 CONECT 31 30 32 84 CONECT 32 31 33 34 CONECT 33 32 85 86 87 CONECT 34 32 35 88 CONECT 35 34 29 89 CONECT 36 1 CONECT 37 1 CONECT 38 3 CONECT 39 3 CONECT 40 4 CONECT 41 4 CONECT 42 5 CONECT 43 7 CONECT 44 7 CONECT 45 7 CONECT 46 8 CONECT 47 8 CONECT 48 9 CONECT 49 9 CONECT 50 10 CONECT 51 12 CONECT 52 12 CONECT 53 12 CONECT 54 13 CONECT 55 13 CONECT 56 14 CONECT 57 14 CONECT 58 15 CONECT 59 15 CONECT 60 17 CONECT 61 17 CONECT 62 17 CONECT 63 18 CONECT 64 18 CONECT 65 18 CONECT 66 19 CONECT 67 20 CONECT 68 20 CONECT 69 21 CONECT 70 21 CONECT 71 23 CONECT 72 23 CONECT 73 23 CONECT 74 24 CONECT 75 25 CONECT 76 25 CONECT 77 26 CONECT 78 26 CONECT 79 27 CONECT 80 28 CONECT 81 28 CONECT 82 28 CONECT 83 30 CONECT 84 31 CONECT 85 33 CONECT 86 33 CONECT 87 33 CONECT 88 34 CONECT 89 35 MASTER 0 0 0 0 0 0 0 0 89 0 186 0 END