HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 -7.528 0.239 -1.721 0.00 0.00 C+0 HETATM 2 C UNK 0 -6.084 -0.120 -1.863 0.00 0.00 C+0 HETATM 3 O UNK 0 -5.865 -1.240 -2.374 0.00 0.00 O+0 HETATM 4 O UNK 0 -5.047 0.644 -1.496 0.00 0.00 O+0 HETATM 5 C UNK 0 -3.694 0.588 -1.484 0.00 0.00 C+0 HETATM 6 C UNK 0 -3.025 -0.312 -0.524 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.426 -1.718 -0.749 0.00 0.00 C+0 HETATM 8 C UNK 0 -3.471 -0.010 0.918 0.00 0.00 C+0 HETATM 9 O UNK 0 -4.866 -0.106 1.049 0.00 0.00 O+0 HETATM 10 C UNK 0 -5.654 0.993 1.401 0.00 0.00 C+0 HETATM 11 C UNK 0 -7.112 0.968 1.562 0.00 0.00 C+0 HETATM 12 O UNK 0 -5.052 2.080 1.593 0.00 0.00 O+0 HETATM 13 C UNK 0 -2.810 -1.000 1.829 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.370 -1.212 1.684 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.748 -1.030 0.328 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.424 -2.351 -0.273 0.00 0.00 C+0 HETATM 17 C UNK 0 0.621 -0.332 0.539 0.00 0.00 C+0 HETATM 18 C UNK 0 1.426 -0.924 1.630 0.00 0.00 C+0 HETATM 19 O UNK 0 1.277 -2.292 1.821 0.00 0.00 O+0 HETATM 20 C UNK 0 2.872 -0.640 1.526 0.00 0.00 C+0 HETATM 21 C UNK 0 3.320 0.264 0.598 0.00 0.00 C+0 HETATM 22 C UNK 0 4.691 0.510 0.546 0.00 0.00 C+0 HETATM 23 C UNK 0 5.582 -0.116 1.380 0.00 0.00 C+0 HETATM 24 C UNK 0 7.021 0.096 1.377 0.00 0.00 C+0 HETATM 25 C UNK 0 7.818 -0.590 2.260 0.00 0.00 C+0 HETATM 26 C UNK 0 9.169 -0.396 2.264 0.00 0.00 C+0 HETATM 27 C UNK 0 9.768 0.485 1.388 0.00 0.00 C+0 HETATM 28 N UNK 0 8.966 1.140 0.537 0.00 0.00 N+0 HETATM 29 C UNK 0 7.625 0.976 0.504 0.00 0.00 C+0 HETATM 30 O UNK 0 5.084 -0.974 2.247 0.00 0.00 O+0 HETATM 31 C UNK 0 3.813 -1.241 2.339 0.00 0.00 C+0 HETATM 32 O UNK 0 3.379 -2.080 3.196 0.00 0.00 O+0 HETATM 33 O UNK 0 2.416 0.884 -0.232 0.00 0.00 O+0 HETATM 34 C UNK 0 1.294 0.095 -0.685 0.00 0.00 C+0 HETATM 35 C UNK 0 1.828 -0.841 -1.679 0.00 0.00 C+0 HETATM 36 C UNK 0 0.365 1.040 -1.454 0.00 0.00 C+0 HETATM 37 O UNK 0 0.985 1.647 -2.526 0.00 0.00 O+0 HETATM 38 C UNK 0 1.238 2.976 -2.698 0.00 0.00 C+0 HETATM 39 C UNK 0 1.924 3.415 -3.941 0.00 0.00 C+0 HETATM 40 O UNK 0 0.880 3.766 -1.803 0.00 0.00 O+0 HETATM 41 C UNK 0 -0.916 0.312 -1.790 0.00 0.00 C+0 HETATM 42 C UNK 0 -1.536 -0.069 -0.453 0.00 0.00 C+0 HETATM 43 H UNK 0 -8.030 0.138 -2.723 0.00 0.00 H+0 HETATM 44 H UNK 0 -7.702 1.211 -1.262 0.00 0.00 H+0 HETATM 45 H UNK 0 -7.988 -0.538 -1.078 0.00 0.00 H+0 HETATM 46 H UNK 0 -3.322 1.659 -1.382 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.388 0.237 -2.526 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.853 -2.440 -0.090 0.00 0.00 H+0 HETATM 49 H UNK 0 -3.458 -2.067 -1.778 0.00 0.00 H+0 HETATM 50 H UNK 0 -4.445 -1.836 -0.316 0.00 0.00 H+0 HETATM 51 H UNK 0 -3.171 1.030 1.119 0.00 0.00 H+0 HETATM 52 H UNK 0 -7.583 0.037 1.211 0.00 0.00 H+0 HETATM 53 H UNK 0 -7.412 1.112 2.642 0.00 0.00 H+0 HETATM 54 H UNK 0 -7.565 1.849 1.044 0.00 0.00 H+0 HETATM 55 H UNK 0 -3.421 -1.927 1.779 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.033 -0.613 2.873 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.839 -0.552 2.436 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.131 -2.242 2.031 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.810 -2.526 -1.292 0.00 0.00 H+0 HETATM 60 H UNK 0 0.679 -2.561 -0.381 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.686 -3.190 0.446 0.00 0.00 H+0 HETATM 62 H UNK 0 0.251 0.662 0.981 0.00 0.00 H+0 HETATM 63 H UNK 0 1.157 -0.495 2.653 0.00 0.00 H+0 HETATM 64 H UNK 0 1.138 -2.568 2.754 0.00 0.00 H+0 HETATM 65 H UNK 0 5.053 1.215 -0.174 0.00 0.00 H+0 HETATM 66 H UNK 0 7.416 -1.301 2.980 0.00 0.00 H+0 HETATM 67 H UNK 0 9.839 -0.920 2.949 0.00 0.00 H+0 HETATM 68 H UNK 0 10.838 0.638 1.391 0.00 0.00 H+0 HETATM 69 H UNK 0 7.039 1.554 -0.228 0.00 0.00 H+0 HETATM 70 H UNK 0 2.624 -1.551 -1.305 0.00 0.00 H+0 HETATM 71 H UNK 0 1.107 -1.321 -2.365 0.00 0.00 H+0 HETATM 72 H UNK 0 2.442 -0.196 -2.392 0.00 0.00 H+0 HETATM 73 H UNK 0 0.092 1.831 -0.723 0.00 0.00 H+0 HETATM 74 H UNK 0 1.484 4.393 -4.280 0.00 0.00 H+0 HETATM 75 H UNK 0 3.000 3.603 -3.794 0.00 0.00 H+0 HETATM 76 H UNK 0 1.737 2.712 -4.784 0.00 0.00 H+0 HETATM 77 H UNK 0 -1.563 1.099 -2.246 0.00 0.00 H+0 HETATM 78 H UNK 0 -0.793 -0.579 -2.381 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.439 0.917 0.112 0.00 0.00 H+0 CONECT 1 2 43 44 45 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 CONECT 5 4 6 46 47 CONECT 6 5 7 8 42 CONECT 7 6 48 49 50 CONECT 8 6 9 13 51 CONECT 9 8 10 CONECT 10 9 11 12 CONECT 11 10 52 53 54 CONECT 12 10 CONECT 13 8 14 55 56 CONECT 14 13 15 57 58 CONECT 15 14 16 17 42 CONECT 16 15 59 60 61 CONECT 17 15 18 34 62 CONECT 18 17 19 20 63 CONECT 19 18 64 CONECT 20 18 21 31 CONECT 21 20 22 33 CONECT 22 21 23 65 CONECT 23 22 24 30 CONECT 24 23 25 29 CONECT 25 24 26 66 CONECT 26 25 27 67 CONECT 27 26 28 68 CONECT 28 27 29 CONECT 29 28 24 69 CONECT 30 23 31 CONECT 31 30 32 20 CONECT 32 31 CONECT 33 21 34 CONECT 34 33 35 36 17 CONECT 35 34 70 71 72 CONECT 36 34 37 41 73 CONECT 37 36 38 CONECT 38 37 39 40 CONECT 39 38 74 75 76 CONECT 40 38 CONECT 41 36 42 77 78 CONECT 42 41 6 15 79 CONECT 43 1 CONECT 44 1 CONECT 45 1 CONECT 46 5 CONECT 47 5 CONECT 48 7 CONECT 49 7 CONECT 50 7 CONECT 51 8 CONECT 52 11 CONECT 53 11 CONECT 54 11 CONECT 55 13 CONECT 56 13 CONECT 57 14 CONECT 58 14 CONECT 59 16 CONECT 60 16 CONECT 61 16 CONECT 62 17 CONECT 63 18 CONECT 64 19 CONECT 65 22 CONECT 66 25 CONECT 67 26 CONECT 68 27 CONECT 69 29 CONECT 70 35 CONECT 71 35 CONECT 72 35 CONECT 73 36 CONECT 74 39 CONECT 75 39 CONECT 76 39 CONECT 77 41 CONECT 78 41 CONECT 79 42 MASTER 0 0 0 0 0 0 0 0 79 0 166 0 END