HEADER PROTEIN 26-OCT-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 26-OCT-17 0 HETATM 1 H UNK 0 -0.744 1.408 0.000 0.00 0.00 H+0 HETATM 2 N UNK 0 -0.268 -0.057 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 -1.173 -1.303 0.000 0.00 0.00 C+0 HETATM 4 H UNK 0 -2.713 -1.303 0.000 0.00 0.00 H+0 HETATM 5 C UNK 0 -0.268 -2.549 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 1.197 -2.073 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 1.197 -0.533 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 2.530 0.237 0.000 0.00 0.00 C+0 HETATM 9 H UNK 0 2.530 1.777 0.000 0.00 0.00 H+0 HETATM 10 C UNK 0 3.864 -0.533 0.000 0.00 0.00 C+0 HETATM 11 H UNK 0 5.198 0.237 0.000 0.00 0.00 H+0 HETATM 12 C UNK 0 3.864 -2.073 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 2.530 -2.843 0.000 0.00 0.00 C+0 HETATM 14 H UNK 0 2.530 -4.383 0.000 0.00 0.00 H+0 HETATM 15 C UNK 0 5.198 -2.843 0.000 0.00 0.00 C+0 HETATM 16 H UNK 0 4.507 -4.219 0.000 0.00 0.00 H+0 HETATM 17 H UNK 0 5.889 -4.219 0.000 0.00 0.00 H+0 HETATM 18 S UNK 0 6.531 -2.073 0.000 0.00 0.00 S+0 HETATM 19 O UNK 0 5.761 -0.739 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 7.301 -3.407 0.000 0.00 0.00 O+0 HETATM 21 N UNK 0 7.865 -1.303 0.000 0.00 0.00 N+0 HETATM 22 C UNK 0 8.026 0.229 0.000 0.00 0.00 C+0 HETATM 23 H UNK 0 7.499 1.676 0.000 0.00 0.00 H+0 HETATM 24 H UNK 0 6.532 0.601 0.000 0.00 0.00 H+0 HETATM 25 C UNK 0 9.532 0.549 0.000 0.00 0.00 C+0 HETATM 26 H UNK 0 10.746 1.497 0.000 0.00 0.00 H+0 HETATM 27 H UNK 0 9.425 2.085 0.000 0.00 0.00 H+0 HETATM 28 C UNK 0 10.302 -0.785 0.000 0.00 0.00 C+0 HETATM 29 H UNK 0 11.579 -1.646 0.000 0.00 0.00 H+0 HETATM 30 H UNK 0 11.730 -0.208 0.000 0.00 0.00 H+0 HETATM 31 C UNK 0 9.272 -1.929 0.000 0.00 0.00 C+0 HETATM 32 H UNK 0 8.075 -2.898 0.000 0.00 0.00 H+0 HETATM 33 O UNK 0 9.592 -3.436 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 -0.744 -4.013 0.000 0.00 0.00 C+0 HETATM 35 H UNK 0 -2.234 -3.623 0.000 0.00 0.00 H+0 HETATM 36 H UNK 0 -1.946 -4.976 0.000 0.00 0.00 H+0 HETATM 37 C UNK 0 0.287 -5.158 0.000 0.00 0.00 C+0 HETATM 38 H UNK 0 1.777 -5.548 0.000 0.00 0.00 H+0 HETATM 39 H UNK 0 1.489 -4.196 0.000 0.00 0.00 H+0 HETATM 40 N UNK 0 -0.189 -6.622 0.000 0.00 0.00 N+0 HETATM 41 C UNK 0 0.841 -7.767 0.000 0.00 0.00 C+0 HETATM 42 H UNK 0 -0.303 -8.797 0.000 0.00 0.00 H+0 HETATM 43 H UNK 0 1.872 -8.911 0.000 0.00 0.00 H+0 HETATM 44 H UNK 0 1.986 -6.736 0.000 0.00 0.00 H+0 HETATM 45 C UNK 0 -1.696 -6.943 0.000 0.00 0.00 C+0 HETATM 46 H UNK 0 -2.016 -5.436 0.000 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.202 -7.263 0.000 0.00 0.00 H+0 HETATM 48 H UNK 0 -1.375 -8.449 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 7 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 34 CONECT 6 5 7 13 CONECT 7 6 2 8 CONECT 8 7 9 10 CONECT 9 8 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 13 15 CONECT 13 12 6 14 CONECT 14 13 CONECT 15 12 16 17 18 CONECT 16 15 CONECT 17 15 CONECT 18 15 19 20 21 CONECT 19 18 CONECT 20 18 CONECT 21 18 22 31 CONECT 22 21 23 24 25 CONECT 23 22 CONECT 24 22 CONECT 25 22 26 27 28 CONECT 26 25 CONECT 27 25 CONECT 28 25 29 30 31 CONECT 29 28 CONECT 30 28 CONECT 31 28 21 32 33 CONECT 32 31 CONECT 33 31 CONECT 34 5 35 36 37 CONECT 35 34 CONECT 36 34 CONECT 37 34 38 39 40 CONECT 38 37 CONECT 39 37 CONECT 40 37 41 45 CONECT 41 40 42 43 44 CONECT 42 41 CONECT 43 41 CONECT 44 41 CONECT 45 40 46 47 48 CONECT 46 45 CONECT 47 45 CONECT 48 45 MASTER 0 0 0 0 0 0 0 0 48 0 100 0 END