HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 O UNK 0 -4.701 -1.673 0.447 0.00 0.00 O+0 HETATM 2 C UNK 0 -3.712 -1.235 -0.141 0.00 0.00 C+0 HETATM 3 C UNK 0 -3.553 -1.480 -1.679 0.00 0.00 C+0 HETATM 4 O UNK 0 -3.971 -2.809 -1.998 0.00 0.00 O+0 HETATM 5 C UNK 0 -2.124 -1.198 -2.240 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.042 -1.208 -3.752 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.361 -0.256 -4.417 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.610 0.879 -3.751 0.00 0.00 C+0 HETATM 9 N UNK 0 -0.440 0.681 -2.308 0.00 0.00 N+0 HETATM 10 C UNK 0 0.089 1.866 -1.607 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.118 1.867 -0.096 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.847 0.918 0.514 0.00 0.00 C+0 HETATM 13 C UNK 0 -1.491 0.911 1.824 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.186 1.594 2.988 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.067 1.412 4.035 0.00 0.00 C+0 HETATM 16 C UNK 0 -3.194 0.611 3.934 0.00 0.00 C+0 HETATM 17 C UNK 0 -3.523 -0.074 2.780 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.642 0.081 1.724 0.00 0.00 C+0 HETATM 19 N UNK 0 -2.719 -0.473 0.433 0.00 0.00 N+0 HETATM 20 C UNK 0 -1.465 -0.206 -0.261 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.622 -1.496 -0.331 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.091 -2.177 -1.623 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.694 0.190 -1.710 0.00 0.00 C+0 HETATM 24 O UNK 0 -3.915 0.593 5.090 0.00 0.00 O+0 HETATM 25 C UNK 0 -3.122 1.459 5.926 0.00 0.00 C+0 HETATM 26 O UNK 0 -1.955 1.989 5.264 0.00 0.00 O+0 HETATM 27 H UNK 0 -4.266 -0.799 -2.163 0.00 0.00 H+0 HETATM 28 H UNK 0 -4.771 -2.972 -1.459 0.00 0.00 H+0 HETATM 29 H UNK 0 -2.531 -2.018 -4.288 0.00 0.00 H+0 HETATM 30 H UNK 0 -1.325 -0.287 -5.503 0.00 0.00 H+0 HETATM 31 H UNK 0 0.379 0.959 -4.215 0.00 0.00 H+0 HETATM 32 H UNK 0 -1.155 1.808 -3.962 0.00 0.00 H+0 HETATM 33 H UNK 0 1.162 1.947 -1.811 0.00 0.00 H+0 HETATM 34 H UNK 0 -0.391 2.777 -1.989 0.00 0.00 H+0 HETATM 35 H UNK 0 0.225 2.742 0.446 0.00 0.00 H+0 HETATM 36 H UNK 0 -0.320 2.236 3.078 0.00 0.00 H+0 HETATM 37 H UNK 0 -4.410 -0.691 2.723 0.00 0.00 H+0 HETATM 38 H UNK 0 -0.768 -2.150 0.536 0.00 0.00 H+0 HETATM 39 H UNK 0 0.452 -1.280 -0.399 0.00 0.00 H+0 HETATM 40 H UNK 0 -0.228 -2.337 -2.281 0.00 0.00 H+0 HETATM 41 H UNK 0 -1.516 -3.165 -1.416 0.00 0.00 H+0 HETATM 42 H UNK 0 -2.494 0.938 -1.823 0.00 0.00 H+0 HETATM 43 H UNK 0 -3.747 2.297 6.255 0.00 0.00 H+0 HETATM 44 H UNK 0 -2.798 0.895 6.808 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 19 3 CONECT 3 2 4 5 27 CONECT 4 3 28 CONECT 5 3 23 6 22 CONECT 6 7 5 29 CONECT 7 8 6 30 CONECT 8 9 7 31 32 CONECT 9 8 23 10 CONECT 10 11 9 33 34 CONECT 11 12 10 35 CONECT 12 11 20 13 CONECT 13 14 18 12 CONECT 14 13 15 36 CONECT 15 14 16 26 CONECT 16 15 24 17 CONECT 17 16 18 37 CONECT 18 19 13 17 CONECT 19 18 20 2 CONECT 20 19 23 12 21 CONECT 21 20 22 38 39 CONECT 22 5 21 40 41 CONECT 23 20 5 9 42 CONECT 24 16 25 CONECT 25 24 26 43 44 CONECT 26 15 25 CONECT 27 3 CONECT 28 4 CONECT 29 6 CONECT 30 7 CONECT 31 8 CONECT 32 8 CONECT 33 10 CONECT 34 10 CONECT 35 11 CONECT 36 14 CONECT 37 17 CONECT 38 21 CONECT 39 21 CONECT 40 22 CONECT 41 22 CONECT 42 23 CONECT 43 25 CONECT 44 25 MASTER 0 0 0 0 0 0 0 0 44 0 100 0 END