HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 4.086 -0.451 -0.099 0.00 0.00 C+0 HETATM 2 C UNK 0 2.676 -0.228 0.256 0.00 0.00 C+0 HETATM 3 O UNK 0 2.390 0.066 1.441 0.00 0.00 O+0 HETATM 4 N UNK 0 1.630 -0.336 -0.697 0.00 0.00 N+0 HETATM 5 C UNK 0 0.271 -0.128 -0.387 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.421 1.095 -0.450 0.00 0.00 C+0 HETATM 7 S UNK 0 -0.032 2.704 -0.868 0.00 0.00 S+0 HETATM 8 S UNK 0 -1.926 3.468 -0.530 0.00 0.00 S+0 HETATM 9 C UNK 0 -2.627 1.988 -0.057 0.00 0.00 C+0 HETATM 10 C UNK 0 -1.792 0.906 -0.059 0.00 0.00 C+0 HETATM 11 N UNK 0 -1.849 -0.445 0.223 0.00 0.00 N+0 HETATM 12 C UNK 0 -3.023 -1.154 0.666 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.669 -1.028 0.033 0.00 0.00 C+0 HETATM 14 O UNK 0 -0.406 -2.256 0.208 0.00 0.00 O+0 HETATM 15 H UNK 0 4.567 0.446 -0.530 0.00 0.00 H+0 HETATM 16 H UNK 0 4.707 -0.768 0.760 0.00 0.00 H+0 HETATM 17 H UNK 0 4.201 -1.274 -0.861 0.00 0.00 H+0 HETATM 18 H UNK 0 1.895 -0.583 -1.681 0.00 0.00 H+0 HETATM 19 H UNK 0 -3.712 1.936 0.234 0.00 0.00 H+0 HETATM 20 H UNK 0 -3.130 -2.149 0.193 0.00 0.00 H+0 HETATM 21 H UNK 0 -2.925 -1.248 1.785 0.00 0.00 H+0 HETATM 22 H UNK 0 -3.914 -0.559 0.420 0.00 0.00 H+0 CONECT 1 2 15 16 17 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 18 CONECT 5 4 6 13 CONECT 6 5 7 10 CONECT 7 6 8 CONECT 8 7 9 CONECT 9 8 10 19 CONECT 10 9 11 6 CONECT 11 10 12 13 CONECT 12 11 20 21 22 CONECT 13 11 14 5 CONECT 14 13 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 18 4 CONECT 19 9 CONECT 20 12 CONECT 21 12 CONECT 22 12 MASTER 0 0 0 0 0 0 0 0 22 0 46 0 END