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 -2.785 2.238 1.887 0.00 0.00 C+0 HETATM 2 O UNK 0 -2.196 2.218 0.554 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.464 1.034 -0.180 0.00 0.00 C+0 HETATM 4 O UNK 0 -1.597 0.069 -0.226 0.00 0.00 O+0 HETATM 5 C UNK 0 -1.816 -1.040 -0.879 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.861 -2.192 -0.940 0.00 0.00 C+0 HETATM 7 C UNK 0 0.443 -1.924 -1.626 0.00 0.00 C+0 HETATM 8 C UNK 0 1.305 -1.212 -0.661 0.00 0.00 C+0 HETATM 9 C UNK 0 2.486 -0.720 -0.937 0.00 0.00 C+0 HETATM 10 C UNK 0 3.275 -0.025 0.055 0.00 0.00 C+0 HETATM 11 C UNK 0 4.594 -0.501 0.178 0.00 0.00 C+0 HETATM 12 C UNK 0 5.425 0.109 1.049 0.00 0.00 C+0 HETATM 13 C UNK 0 4.980 1.187 1.813 0.00 0.00 C+0 HETATM 14 N UNK 0 5.877 1.782 2.727 0.00 0.00 N+1 HETATM 15 O UNK 0 7.067 1.331 2.807 0.00 0.00 O+0 HETATM 16 O UNK 0 5.528 2.810 3.536 0.00 0.00 O-1 HETATM 17 C UNK 0 3.712 1.633 1.685 0.00 0.00 C+0 HETATM 18 C UNK 0 2.837 1.022 0.790 0.00 0.00 C+0 HETATM 19 C UNK 0 0.566 -1.240 0.602 0.00 0.00 C+0 HETATM 20 O UNK 0 -0.415 -2.210 0.464 0.00 0.00 O+0 HETATM 21 C UNK 0 -3.015 -1.284 -1.598 0.00 0.00 C+0 HETATM 22 C UNK 0 -3.208 -2.523 -2.383 0.00 0.00 C+0 HETATM 23 C UNK 0 -3.955 -0.277 -1.573 0.00 0.00 C+0 HETATM 24 O UNK 0 -5.058 -0.448 -2.202 0.00 0.00 O+0 HETATM 25 C UNK 0 -3.662 0.864 -0.866 0.00 0.00 C+0 HETATM 26 C UNK 0 -4.681 1.935 -0.805 0.00 0.00 C+0 HETATM 27 H UNK 0 -3.797 1.794 1.834 0.00 0.00 H+0 HETATM 28 H UNK 0 -2.167 1.726 2.627 0.00 0.00 H+0 HETATM 29 H UNK 0 -2.901 3.295 2.214 0.00 0.00 H+0 HETATM 30 H UNK 0 -1.323 -3.165 -1.046 0.00 0.00 H+0 HETATM 31 H UNK 0 0.968 -2.899 -1.918 0.00 0.00 H+0 HETATM 32 H UNK 0 0.346 -1.241 -2.533 0.00 0.00 H+0 HETATM 33 H UNK 0 2.919 -0.836 -1.959 0.00 0.00 H+0 HETATM 34 H UNK 0 4.867 -1.347 -0.439 0.00 0.00 H+0 HETATM 35 H UNK 0 6.418 -0.243 1.146 0.00 0.00 H+0 HETATM 36 H UNK 0 3.365 2.483 2.266 0.00 0.00 H+0 HETATM 37 H UNK 0 1.818 1.391 0.684 0.00 0.00 H+0 HETATM 38 H UNK 0 1.246 -1.600 1.439 0.00 0.00 H+0 HETATM 39 H UNK 0 0.219 -0.259 0.978 0.00 0.00 H+0 HETATM 40 H UNK 0 -4.138 -2.475 -2.987 0.00 0.00 H+0 HETATM 41 H UNK 0 -3.215 -3.466 -1.819 0.00 0.00 H+0 HETATM 42 H UNK 0 -2.349 -2.552 -3.155 0.00 0.00 H+0 HETATM 43 H UNK 0 -4.969 2.205 -1.845 0.00 0.00 H+0 HETATM 44 H UNK 0 -5.513 1.710 -0.136 0.00 0.00 H+0 HETATM 45 H UNK 0 -4.173 2.840 -0.362 0.00 0.00 H+0 CONECT 1 2 27 28 29 CONECT 2 1 3 CONECT 3 2 4 25 CONECT 4 3 5 CONECT 5 4 6 21 CONECT 6 5 7 20 30 CONECT 7 6 8 31 32 CONECT 8 7 9 19 CONECT 9 8 10 33 CONECT 10 9 11 18 CONECT 11 10 12 34 CONECT 12 11 13 35 CONECT 13 12 14 17 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 CONECT 17 13 18 36 CONECT 18 17 10 37 CONECT 19 8 20 38 39 CONECT 20 19 6 CONECT 21 5 22 23 CONECT 22 21 40 41 42 CONECT 23 21 24 25 CONECT 24 23 CONECT 25 23 26 3 CONECT 26 25 43 44 45 CONECT 27 1 CONECT 28 1 CONECT 29 1 CONECT 30 6 CONECT 31 7 CONECT 32 7 CONECT 33 9 CONECT 34 11 CONECT 35 12 CONECT 36 17 CONECT 37 18 CONECT 38 19 CONECT 39 19 CONECT 40 22 CONECT 41 22 CONECT 42 22 CONECT 43 26 CONECT 44 26 CONECT 45 26 MASTER 0 0 0 0 0 0 0 0 45 0 94 0 END