HEADER PROTEIN 13-APR-18 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 13-APR-18 0 HETATM 1 N UNK 0 -3.178 -5.923 0.000 0.00 0.00 N+0 HETATM 2 C UNK 0 -2.089 -4.834 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -0.601 -5.233 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.601 -6.773 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 0.487 -4.144 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 0.886 -5.632 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -2.089 -3.294 0.000 0.00 0.00 C+0 HETATM 8 O UNK 0 -2.859 -1.961 0.000 0.00 0.00 O+0 HETATM 9 N UNK 0 -1.001 -2.206 0.000 0.00 0.00 N+0 HETATM 10 C UNK 0 0.357 -0.116 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -1.081 -0.668 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 0.487 -2.604 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 1.326 -1.313 0.000 0.00 0.00 C+0 HETATM 14 O UNK 0 2.659 -2.083 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 3.993 -1.313 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 6.570 -0.622 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 6.171 0.865 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 4.683 1.264 0.000 0.00 0.00 C+0 HETATM 19 N UNK 0 3.594 0.175 0.000 0.00 0.00 N+0 HETATM 20 C UNK 0 5.481 -1.711 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 5.879 -3.199 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 7.367 -3.597 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 8.456 -2.508 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 8.057 -1.021 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 7.260 1.954 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 -2.415 0.102 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 -2.415 1.642 0.000 0.00 0.00 O+0 HETATM 28 N UNK 0 -3.748 -0.668 0.000 0.00 0.00 N+0 HETATM 29 C UNK 0 -5.082 0.102 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -6.171 -0.987 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -6.570 0.501 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -7.659 -1.385 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -8.748 -0.296 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 -5.082 1.642 0.000 0.00 0.00 C+0 HETATM 35 N UNK 0 -4.312 2.976 0.000 0.00 0.00 N+0 HETATM 36 O UNK 0 -6.416 2.412 0.000 0.00 0.00 O+0 HETATM 37 S UNK 0 -4.312 4.515 0.000 0.00 0.00 S+0 HETATM 38 O UNK 0 -5.852 4.515 0.000 0.00 0.00 O+0 HETATM 39 O UNK 0 -5.401 5.605 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 -2.978 5.286 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 -2.580 6.773 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 -1.810 5.439 0.000 0.00 0.00 C+0 HETATM 43 Cl UNK 0 7.807 -5.082 0.000 0.00 0.00 Cl+0 HETATM 44 C UNK 0 8.748 2.353 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 7 3 CONECT 3 4 5 6 2 CONECT 4 3 CONECT 5 3 CONECT 6 3 CONECT 7 2 8 9 CONECT 8 7 CONECT 9 7 11 12 CONECT 10 11 13 CONECT 11 9 10 26 CONECT 12 9 13 CONECT 13 10 12 14 CONECT 14 15 13 CONECT 15 14 19 20 CONECT 16 17 20 24 CONECT 17 16 18 25 CONECT 18 17 19 CONECT 19 15 18 CONECT 20 15 16 21 CONECT 21 20 22 CONECT 22 21 23 43 CONECT 23 22 24 CONECT 24 16 23 CONECT 25 17 44 CONECT 26 11 27 28 CONECT 27 26 CONECT 28 26 29 CONECT 29 30 31 28 34 CONECT 30 29 31 32 CONECT 31 30 29 CONECT 32 33 30 CONECT 33 32 CONECT 34 35 36 29 CONECT 35 34 37 CONECT 36 34 CONECT 37 35 38 39 40 CONECT 38 37 CONECT 39 37 CONECT 40 37 41 42 CONECT 41 40 42 CONECT 42 41 40 CONECT 43 22 CONECT 44 25 MASTER 0 0 0 0 0 0 0 0 44 0 96 0 END