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 -6.609 1.795 1.105 0.00 0.00 C+0 HETATM 2 O UNK 0 -5.585 2.409 0.347 0.00 0.00 O+0 HETATM 3 C UNK 0 -4.483 1.567 0.021 0.00 0.00 C+0 HETATM 4 C UNK 0 -4.301 1.065 -1.183 0.00 0.00 C+0 HETATM 5 C UNK 0 -5.306 1.366 -2.234 0.00 0.00 C+0 HETATM 6 O UNK 0 -4.862 2.032 -3.337 0.00 0.00 O+0 HETATM 7 C UNK 0 -3.164 0.210 -1.486 0.00 0.00 C+0 HETATM 8 O UNK 0 -3.027 -0.267 -2.651 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.154 -0.144 -0.490 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.380 0.398 0.777 0.00 0.00 C+0 HETATM 11 C UNK 0 -1.545 0.086 1.865 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.515 -0.736 1.694 0.00 0.00 C+0 HETATM 13 O UNK 0 0.375 -1.159 2.686 0.00 0.00 O+0 HETATM 14 C UNK 0 0.227 -0.658 3.997 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.247 -1.290 0.416 0.00 0.00 C+0 HETATM 16 C UNK 0 0.828 -2.259 0.209 0.00 0.00 C+0 HETATM 17 S UNK 0 1.952 -1.559 -1.147 0.00 0.00 S+0 HETATM 18 C UNK 0 3.027 -0.366 -0.220 0.00 0.00 C+0 HETATM 19 C UNK 0 4.473 -0.545 -0.338 0.00 0.00 C+0 HETATM 20 N UNK 0 5.071 -0.214 -1.632 0.00 0.00 N+0 HETATM 21 C UNK 0 6.279 0.549 -1.507 0.00 0.00 C+0 HETATM 22 C UNK 0 7.125 1.092 -2.563 0.00 0.00 C+0 HETATM 23 O UNK 0 6.700 0.824 -0.303 0.00 0.00 O+0 HETATM 24 C UNK 0 4.951 -1.896 0.073 0.00 0.00 C+0 HETATM 25 O UNK 0 5.878 -2.483 -0.487 0.00 0.00 O+0 HETATM 26 O UNK 0 4.260 -2.481 1.169 0.00 0.00 O+0 HETATM 27 C UNK 0 -1.112 -0.950 -0.642 0.00 0.00 C+0 HETATM 28 O UNK 0 -0.773 -1.538 -1.876 0.00 0.00 O+0 HETATM 29 C UNK 0 -3.514 1.252 1.061 0.00 0.00 C+0 HETATM 30 O UNK 0 -3.682 1.753 2.224 0.00 0.00 O+0 HETATM 31 H UNK 0 -7.413 2.494 1.342 0.00 0.00 H+0 HETATM 32 H UNK 0 -7.119 0.967 0.445 0.00 0.00 H+0 HETATM 33 H UNK 0 -6.233 1.236 1.979 0.00 0.00 H+0 HETATM 34 H UNK 0 -5.810 0.370 -2.506 0.00 0.00 H+0 HETATM 35 H UNK 0 -6.160 1.960 -1.715 0.00 0.00 H+0 HETATM 36 H UNK 0 -5.738 2.361 -3.792 0.00 0.00 H+0 HETATM 37 H UNK 0 -1.719 0.543 2.844 0.00 0.00 H+0 HETATM 38 H UNK 0 0.647 -1.323 4.784 0.00 0.00 H+0 HETATM 39 H UNK 0 0.724 0.382 4.110 0.00 0.00 H+0 HETATM 40 H UNK 0 -0.834 -0.417 4.295 0.00 0.00 H+0 HETATM 41 H UNK 0 0.430 -3.219 -0.249 0.00 0.00 H+0 HETATM 42 H UNK 0 1.477 -2.462 1.049 0.00 0.00 H+0 HETATM 43 H UNK 0 2.720 -0.376 0.866 0.00 0.00 H+0 HETATM 44 H UNK 0 2.755 0.672 -0.624 0.00 0.00 H+0 HETATM 45 H UNK 0 4.953 0.168 0.404 0.00 0.00 H+0 HETATM 46 H UNK 0 4.733 -0.472 -2.551 0.00 0.00 H+0 HETATM 47 H UNK 0 7.508 2.146 -2.352 0.00 0.00 H+0 HETATM 48 H UNK 0 8.085 0.474 -2.567 0.00 0.00 H+0 HETATM 49 H UNK 0 6.654 1.072 -3.539 0.00 0.00 H+0 HETATM 50 H UNK 0 3.735 -3.354 1.000 0.00 0.00 H+0 HETATM 51 H UNK 0 -1.279 -1.075 -2.656 0.00 0.00 H+0 CONECT 1 2 31 32 33 CONECT 2 1 3 CONECT 3 2 4 29 CONECT 4 3 5 7 CONECT 5 4 6 34 35 CONECT 6 5 36 CONECT 7 4 8 9 CONECT 8 7 CONECT 9 7 10 27 CONECT 10 9 11 29 CONECT 11 10 12 37 CONECT 12 11 13 15 CONECT 13 12 14 CONECT 14 13 38 39 40 CONECT 15 12 16 27 CONECT 16 15 17 41 42 CONECT 17 16 18 CONECT 18 17 19 43 44 CONECT 19 18 20 24 45 CONECT 20 19 21 46 CONECT 21 20 22 23 CONECT 22 21 47 48 49 CONECT 23 21 CONECT 24 19 25 26 CONECT 25 24 CONECT 26 24 50 CONECT 27 15 28 9 CONECT 28 27 51 CONECT 29 10 30 3 CONECT 30 29 CONECT 31 1 CONECT 32 1 CONECT 33 1 CONECT 34 5 CONECT 35 5 CONECT 36 6 CONECT 37 11 CONECT 38 14 CONECT 39 14 CONECT 40 14 CONECT 41 16 CONECT 42 16 CONECT 43 18 CONECT 44 18 CONECT 45 19 CONECT 46 20 CONECT 47 22 CONECT 48 22 CONECT 49 22 CONECT 50 26 CONECT 51 28 MASTER 0 0 0 0 0 0 0 0 51 0 104 0 END