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 -4.512 -0.251 -0.400 0.00 0.00 C+0 HETATM 2 C UNK 0 -3.442 0.572 0.164 0.00 0.00 C+0 HETATM 3 C UNK 0 -2.209 0.114 0.467 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.175 1.020 1.038 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.434 1.799 0.007 0.00 0.00 C+0 HETATM 6 C UNK 0 0.708 1.553 -0.530 0.00 0.00 C+0 HETATM 7 C UNK 0 0.995 2.638 -1.484 0.00 0.00 C+0 HETATM 8 O UNK 0 2.027 2.781 -2.229 0.00 0.00 O+0 HETATM 9 O UNK 0 -0.035 3.566 -1.504 0.00 0.00 O+0 HETATM 10 C UNK 0 -0.939 3.063 -0.582 0.00 0.00 C+0 HETATM 11 O UNK 0 -2.031 3.660 -0.325 0.00 0.00 O+0 HETATM 12 C UNK 0 1.637 0.406 -0.282 0.00 0.00 C+0 HETATM 13 C UNK 0 2.430 0.656 0.979 0.00 0.00 C+0 HETATM 14 C UNK 0 3.405 -0.440 1.322 0.00 0.00 C+0 HETATM 15 C UNK 0 4.455 -0.638 0.265 0.00 0.00 C+0 HETATM 16 C UNK 0 0.966 -0.912 -0.237 0.00 0.00 C+0 HETATM 17 O UNK 0 1.899 -1.889 -0.673 0.00 0.00 O+0 HETATM 18 C UNK 0 -0.084 -0.922 -1.291 0.00 0.00 C+0 HETATM 19 O UNK 0 0.162 -0.304 -2.311 0.00 0.00 O+0 HETATM 20 C UNK 0 -1.345 -1.646 -1.092 0.00 0.00 C+0 HETATM 21 C UNK 0 -1.980 -1.325 0.216 0.00 0.00 C+0 HETATM 22 O UNK 0 -3.124 -2.108 0.354 0.00 0.00 O+0 HETATM 23 H UNK 0 -4.206 -0.866 -1.281 0.00 0.00 H+0 HETATM 24 H UNK 0 -5.299 0.436 -0.834 0.00 0.00 H+0 HETATM 25 H UNK 0 -5.082 -0.848 0.353 0.00 0.00 H+0 HETATM 26 H UNK 0 -3.637 1.618 0.365 0.00 0.00 H+0 HETATM 27 H UNK 0 -0.524 0.519 1.765 0.00 0.00 H+0 HETATM 28 H UNK 0 -1.776 1.714 1.712 0.00 0.00 H+0 HETATM 29 H UNK 0 2.406 0.315 -1.096 0.00 0.00 H+0 HETATM 30 H UNK 0 3.080 1.574 0.805 0.00 0.00 H+0 HETATM 31 H UNK 0 1.801 0.884 1.866 0.00 0.00 H+0 HETATM 32 H UNK 0 2.856 -1.426 1.404 0.00 0.00 H+0 HETATM 33 H UNK 0 3.849 -0.304 2.329 0.00 0.00 H+0 HETATM 34 H UNK 0 4.549 -1.704 -0.079 0.00 0.00 H+0 HETATM 35 H UNK 0 5.447 -0.386 0.743 0.00 0.00 H+0 HETATM 36 H UNK 0 4.316 -0.014 -0.631 0.00 0.00 H+0 HETATM 37 H UNK 0 0.654 -1.264 0.742 0.00 0.00 H+0 HETATM 38 H UNK 0 1.659 -2.778 -0.361 0.00 0.00 H+0 HETATM 39 H UNK 0 -1.081 -2.744 -1.052 0.00 0.00 H+0 HETATM 40 H UNK 0 -2.009 -1.541 -1.958 0.00 0.00 H+0 HETATM 41 H UNK 0 -1.294 -1.676 1.035 0.00 0.00 H+0 HETATM 42 H UNK 0 -3.086 -2.900 -0.246 0.00 0.00 H+0 CONECT 1 2 23 24 25 CONECT 2 1 3 26 CONECT 3 2 4 21 CONECT 4 3 5 27 28 CONECT 5 4 6 10 CONECT 6 5 7 12 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 CONECT 10 9 11 5 CONECT 11 10 CONECT 12 6 13 16 29 CONECT 13 12 14 30 31 CONECT 14 13 15 32 33 CONECT 15 14 34 35 36 CONECT 16 12 17 18 37 CONECT 17 16 38 CONECT 18 16 19 20 CONECT 19 18 CONECT 20 18 21 39 40 CONECT 21 20 22 3 41 CONECT 22 21 42 CONECT 23 1 CONECT 24 1 CONECT 25 1 CONECT 26 2 CONECT 27 4 CONECT 28 4 CONECT 29 12 CONECT 30 13 CONECT 31 13 CONECT 32 14 CONECT 33 14 CONECT 34 15 CONECT 35 15 CONECT 36 15 CONECT 37 16 CONECT 38 17 CONECT 39 20 CONECT 40 20 CONECT 41 21 CONECT 42 22 MASTER 0 0 0 0 0 0 0 0 42 0 86 0 END