HEADER PROTEIN 20-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 20-JUN-21 0 HETATM 1 C UNK 0 0.999 -2.929 1.197 0.00 0.00 C+0 HETATM 2 O UNK 0 1.285 -1.904 0.245 0.00 0.00 O+0 HETATM 3 C UNK 0 0.471 -0.820 0.319 0.00 0.00 C+0 HETATM 4 O UNK 0 -0.436 -0.724 1.142 0.00 0.00 O+0 HETATM 5 N UNK 0 0.729 0.161 -0.628 0.00 0.00 N+0 HETATM 6 C UNK 0 1.811 0.255 -1.529 0.00 0.00 C+0 HETATM 7 C UNK 0 2.935 -0.548 -1.647 0.00 0.00 C+0 HETATM 8 C UNK 0 3.892 -0.237 -2.619 0.00 0.00 C+0 HETATM 9 C UNK 0 3.715 0.862 -3.465 0.00 0.00 C+0 HETATM 10 C UNK 0 2.582 1.666 -3.347 0.00 0.00 C+0 HETATM 11 C UNK 0 1.642 1.364 -2.365 0.00 0.00 C+0 HETATM 12 C UNK 0 0.317 2.039 -2.105 0.00 0.00 C+0 HETATM 13 C UNK 0 0.330 3.566 -2.241 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.044 4.214 -2.395 0.00 0.00 C+0 HETATM 15 N UNK 0 -1.827 4.428 -1.192 0.00 0.00 N+0 HETATM 16 C UNK 0 -2.671 5.530 -1.114 0.00 0.00 C+0 HETATM 17 O UNK 0 -2.813 6.432 -1.919 0.00 0.00 O+0 HETATM 18 C UNK 0 -3.405 5.439 0.147 0.00 0.00 C+0 HETATM 19 C UNK 0 -3.004 4.311 0.737 0.00 0.00 C+0 HETATM 20 C UNK 0 -1.968 3.535 -0.049 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.686 3.473 0.783 0.00 0.00 C+0 HETATM 22 C UNK 0 0.219 2.281 0.497 0.00 0.00 C+0 HETATM 23 C UNK 0 -0.100 1.421 -0.742 0.00 0.00 C+0 HETATM 24 C UNK 0 -1.582 1.130 -0.959 0.00 0.00 C+0 HETATM 25 C UNK 0 -2.555 2.154 -0.373 0.00 0.00 C+0 HETATM 26 C UNK 0 -1.712 1.051 -2.454 0.00 0.00 C+0 HETATM 27 O UNK 0 -2.704 0.665 -3.051 0.00 0.00 O+0 HETATM 28 O UNK 0 -0.589 1.495 -3.074 0.00 0.00 O+0 HETATM 29 H UNK 0 -0.013 -3.320 1.049 0.00 0.00 H+0 HETATM 30 H UNK 0 1.125 -2.551 2.217 0.00 0.00 H+0 HETATM 31 H UNK 0 1.711 -3.745 1.040 0.00 0.00 H+0 HETATM 32 H UNK 0 3.114 -1.404 -1.010 0.00 0.00 H+0 HETATM 33 H UNK 0 4.777 -0.859 -2.722 0.00 0.00 H+0 HETATM 34 H UNK 0 4.460 1.082 -4.227 0.00 0.00 H+0 HETATM 35 H UNK 0 2.441 2.493 -4.035 0.00 0.00 H+0 HETATM 36 H UNK 0 0.917 4.044 -1.450 0.00 0.00 H+0 HETATM 37 H UNK 0 0.854 3.816 -3.173 0.00 0.00 H+0 HETATM 38 H UNK 0 -0.885 5.199 -2.854 0.00 0.00 H+0 HETATM 39 H UNK 0 -1.681 3.679 -3.107 0.00 0.00 H+0 HETATM 40 H UNK 0 -4.124 6.166 0.477 0.00 0.00 H+0 HETATM 41 H UNK 0 -3.387 3.977 1.693 0.00 0.00 H+0 HETATM 42 H UNK 0 -0.108 4.400 0.667 0.00 0.00 H+0 HETATM 43 H UNK 0 -0.931 3.433 1.854 0.00 0.00 H+0 HETATM 44 H UNK 0 1.263 2.621 0.462 0.00 0.00 H+0 HETATM 45 H UNK 0 0.179 1.651 1.394 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.865 0.136 -0.597 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.437 2.259 -1.020 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.928 1.718 0.566 0.00 0.00 H+0 CONECT 1 2 29 30 31 CONECT 2 3 1 CONECT 3 5 2 4 CONECT 4 3 CONECT 5 6 23 3 CONECT 6 7 5 11 CONECT 7 6 8 32 CONECT 8 9 7 33 CONECT 9 8 10 34 CONECT 10 11 9 35 CONECT 11 12 10 6 CONECT 12 11 28 23 13 CONECT 13 14 12 36 37 CONECT 14 13 15 38 39 CONECT 15 14 20 16 CONECT 16 18 15 17 CONECT 17 16 CONECT 18 19 16 40 CONECT 19 20 18 41 CONECT 20 15 19 25 21 CONECT 21 20 22 42 43 CONECT 22 21 23 44 45 CONECT 23 5 24 12 22 CONECT 24 23 25 26 46 CONECT 25 20 24 47 48 CONECT 26 24 28 27 CONECT 27 26 CONECT 28 12 26 CONECT 29 1 CONECT 30 1 CONECT 31 1 CONECT 32 7 CONECT 33 8 CONECT 34 9 CONECT 35 10 CONECT 36 13 CONECT 37 13 CONECT 38 14 CONECT 39 14 CONECT 40 18 CONECT 41 19 CONECT 42 21 CONECT 43 21 CONECT 44 22 CONECT 45 22 CONECT 46 24 CONECT 47 25 CONECT 48 25 MASTER 0 0 0 0 0 0 0 0 48 0 106 0 END