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 3.441 -0.942 0.592 0.00 0.00 C+0 HETATM 2 C UNK 0 3.234 -0.272 -0.717 0.00 0.00 C+0 HETATM 3 C UNK 0 4.328 0.090 -1.362 0.00 0.00 C+0 HETATM 4 C UNK 0 5.694 -0.162 -0.805 0.00 0.00 C+0 HETATM 5 C UNK 0 6.694 -0.530 -1.678 0.00 0.00 C+0 HETATM 6 S UNK 0 8.031 -0.699 -0.628 0.00 0.00 S+0 HETATM 7 C UNK 0 7.255 -0.299 0.839 0.00 0.00 C+0 HETATM 8 C UNK 0 7.828 -0.232 2.237 0.00 0.00 C+0 HETATM 9 O UNK 0 8.301 1.034 2.506 0.00 0.00 O+0 HETATM 10 N UNK 0 6.017 -0.058 0.448 0.00 0.00 N+0 HETATM 11 C UNK 0 1.864 -0.032 -1.250 0.00 0.00 C+0 HETATM 12 C UNK 0 1.051 0.831 -0.296 0.00 0.00 C+0 HETATM 13 C UNK 0 1.631 2.189 -0.117 0.00 0.00 C+0 HETATM 14 O UNK 0 1.414 2.825 1.159 0.00 0.00 O+0 HETATM 15 C UNK 0 0.779 3.303 -0.076 0.00 0.00 C+0 HETATM 16 C UNK 0 1.314 4.697 -0.412 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.696 3.179 -0.128 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.308 2.643 1.171 0.00 0.00 C+0 HETATM 19 C UNK 0 -2.796 2.517 0.948 0.00 0.00 C+0 HETATM 20 C UNK 0 -3.156 1.267 0.189 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.792 1.700 -1.131 0.00 0.00 C+0 HETATM 22 C UNK 0 -4.175 0.477 0.986 0.00 0.00 C+0 HETATM 23 O UNK 0 -4.312 0.958 2.273 0.00 0.00 O+0 HETATM 24 C UNK 0 -3.792 -0.999 1.060 0.00 0.00 C+0 HETATM 25 C UNK 0 -4.861 -1.663 1.926 0.00 0.00 C+0 HETATM 26 C UNK 0 -3.860 -1.617 -0.296 0.00 0.00 C+0 HETATM 27 O UNK 0 -4.674 -1.112 -1.058 0.00 0.00 O+0 HETATM 28 C UNK 0 -2.999 -2.771 -0.703 0.00 0.00 C+0 HETATM 29 C UNK 0 -3.785 -3.529 -1.788 0.00 0.00 C+0 HETATM 30 C UNK 0 -2.835 -3.752 0.431 0.00 0.00 C+0 HETATM 31 C UNK 0 -1.719 -2.361 -1.341 0.00 0.00 C+0 HETATM 32 O UNK 0 -1.957 -1.224 -2.104 0.00 0.00 O+0 HETATM 33 C UNK 0 -0.573 -2.182 -0.381 0.00 0.00 C+0 HETATM 34 C UNK 0 0.673 -2.251 -1.184 0.00 0.00 C+0 HETATM 35 O UNK 0 1.176 -3.393 -1.336 0.00 0.00 O+0 HETATM 36 O UNK 0 1.223 -1.158 -1.713 0.00 0.00 O+0 HETATM 37 H UNK 0 4.234 -1.708 0.535 0.00 0.00 H+0 HETATM 38 H UNK 0 2.494 -1.317 1.025 0.00 0.00 H+0 HETATM 39 H UNK 0 3.812 -0.172 1.326 0.00 0.00 H+0 HETATM 40 H UNK 0 4.223 0.576 -2.307 0.00 0.00 H+0 HETATM 41 H UNK 0 6.636 -0.676 -2.772 0.00 0.00 H+0 HETATM 42 H UNK 0 6.992 -0.500 2.913 0.00 0.00 H+0 HETATM 43 H UNK 0 8.613 -1.010 2.290 0.00 0.00 H+0 HETATM 44 H UNK 0 8.251 1.587 1.692 0.00 0.00 H+0 HETATM 45 H UNK 0 1.989 0.643 -2.157 0.00 0.00 H+0 HETATM 46 H UNK 0 0.023 0.929 -0.693 0.00 0.00 H+0 HETATM 47 H UNK 0 0.969 0.377 0.708 0.00 0.00 H+0 HETATM 48 H UNK 0 2.696 2.337 -0.420 0.00 0.00 H+0 HETATM 49 H UNK 0 1.366 4.854 -1.507 0.00 0.00 H+0 HETATM 50 H UNK 0 0.619 5.455 0.003 0.00 0.00 H+0 HETATM 51 H UNK 0 2.301 4.876 0.037 0.00 0.00 H+0 HETATM 52 H UNK 0 -1.122 2.583 -0.935 0.00 0.00 H+0 HETATM 53 H UNK 0 -1.180 4.196 -0.241 0.00 0.00 H+0 HETATM 54 H UNK 0 -1.177 3.471 1.917 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.828 1.735 1.527 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.103 3.450 0.394 0.00 0.00 H+0 HETATM 57 H UNK 0 -3.326 2.593 1.928 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.271 0.655 -0.054 0.00 0.00 H+0 HETATM 59 H UNK 0 -3.382 1.129 -1.986 0.00 0.00 H+0 HETATM 60 H UNK 0 -4.897 1.651 -1.071 0.00 0.00 H+0 HETATM 61 H UNK 0 -3.549 2.778 -1.350 0.00 0.00 H+0 HETATM 62 H UNK 0 -5.176 0.516 0.503 0.00 0.00 H+0 HETATM 63 H UNK 0 -3.494 0.702 2.771 0.00 0.00 H+0 HETATM 64 H UNK 0 -2.829 -1.156 1.563 0.00 0.00 H+0 HETATM 65 H UNK 0 -5.767 -1.889 1.328 0.00 0.00 H+0 HETATM 66 H UNK 0 -4.457 -2.559 2.450 0.00 0.00 H+0 HETATM 67 H UNK 0 -5.118 -0.932 2.721 0.00 0.00 H+0 HETATM 68 H UNK 0 -4.700 -3.977 -1.381 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.985 -2.762 -2.579 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.092 -4.261 -2.235 0.00 0.00 H+0 HETATM 71 H UNK 0 -2.210 -4.587 0.031 0.00 0.00 H+0 HETATM 72 H UNK 0 -2.457 -3.317 1.351 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.843 -4.204 0.607 0.00 0.00 H+0 HETATM 74 H UNK 0 -1.409 -3.160 -2.059 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.202 -1.017 -2.716 0.00 0.00 H+0 HETATM 76 H UNK 0 -0.664 -1.298 0.252 0.00 0.00 H+0 HETATM 77 H UNK 0 -0.643 -3.061 0.330 0.00 0.00 H+0 CONECT 1 2 37 38 39 CONECT 2 1 3 11 CONECT 3 2 4 40 CONECT 4 3 5 10 CONECT 5 4 6 41 CONECT 6 5 7 CONECT 7 6 8 10 CONECT 8 7 9 42 43 CONECT 9 8 44 CONECT 10 7 4 CONECT 11 2 12 36 45 CONECT 12 11 13 46 47 CONECT 13 12 14 15 48 CONECT 14 13 15 CONECT 15 14 16 17 13 CONECT 16 15 49 50 51 CONECT 17 15 18 52 53 CONECT 18 17 19 54 55 CONECT 19 18 20 56 57 CONECT 20 19 21 22 58 CONECT 21 20 59 60 61 CONECT 22 20 23 24 62 CONECT 23 22 63 CONECT 24 22 25 26 64 CONECT 25 24 65 66 67 CONECT 26 24 27 28 CONECT 27 26 CONECT 28 26 29 30 31 CONECT 29 28 68 69 70 CONECT 30 28 71 72 73 CONECT 31 28 32 33 74 CONECT 32 31 75 CONECT 33 31 34 76 77 CONECT 34 33 35 36 CONECT 35 34 CONECT 36 34 11 CONECT 37 1 CONECT 38 1 CONECT 39 1 CONECT 40 3 CONECT 41 5 CONECT 42 8 CONECT 43 8 CONECT 44 9 CONECT 45 11 CONECT 46 12 CONECT 47 12 CONECT 48 13 CONECT 49 16 CONECT 50 16 CONECT 51 16 CONECT 52 17 CONECT 53 17 CONECT 54 18 CONECT 55 18 CONECT 56 19 CONECT 57 19 CONECT 58 20 CONECT 59 21 CONECT 60 21 CONECT 61 21 CONECT 62 22 CONECT 63 23 CONECT 64 24 CONECT 65 25 CONECT 66 25 CONECT 67 25 CONECT 68 29 CONECT 69 29 CONECT 70 29 CONECT 71 30 CONECT 72 30 CONECT 73 30 CONECT 74 31 CONECT 75 32 CONECT 76 33 CONECT 77 33 MASTER 0 0 0 0 0 0 0 0 77 0 158 0 END