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 -2.209 2.832 -1.325 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.814 1.835 -2.408 0.00 0.00 C+0 HETATM 3 O UNK 0 -1.653 0.554 -1.778 0.00 0.00 O+0 HETATM 4 C UNK 0 -0.955 -0.425 -2.541 0.00 0.00 C+0 HETATM 5 O UNK 0 -1.613 -1.694 -2.470 0.00 0.00 O+0 HETATM 6 C UNK 0 -1.730 -2.295 -1.168 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.028 -1.836 -0.471 0.00 0.00 C+0 HETATM 8 O UNK 0 -4.111 -2.679 -0.900 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.924 -1.865 1.061 0.00 0.00 C+0 HETATM 10 O UNK 0 -2.338 -0.600 1.466 0.00 0.00 O+0 HETATM 11 C UNK 0 -2.563 -0.222 2.747 0.00 0.00 C+0 HETATM 12 O UNK 0 -3.228 -0.838 3.564 0.00 0.00 O+0 HETATM 13 C UNK 0 -1.882 1.046 3.078 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.096 1.729 2.230 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.410 2.988 2.567 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.951 3.922 3.467 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.282 5.116 3.748 0.00 0.00 C+0 HETATM 18 C UNK 0 0.923 5.380 3.119 0.00 0.00 C+0 HETATM 19 O UNK 0 1.580 6.545 3.394 0.00 0.00 O+0 HETATM 20 C UNK 0 1.465 4.477 2.210 0.00 0.00 C+0 HETATM 21 O UNK 0 2.655 4.815 1.627 0.00 0.00 O+0 HETATM 22 C UNK 0 0.804 3.287 1.923 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.020 -3.009 1.551 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.682 -4.386 1.395 0.00 0.00 C+0 HETATM 25 O UNK 0 -1.836 -5.389 1.962 0.00 0.00 O+0 HETATM 26 O UNK 0 -0.726 -3.077 0.911 0.00 0.00 O+0 HETATM 27 C UNK 0 -0.523 -2.209 -0.208 0.00 0.00 C+0 HETATM 28 O UNK 0 0.657 -2.606 -0.922 0.00 0.00 O+0 HETATM 29 C UNK 0 1.788 -2.763 -0.057 0.00 0.00 C+0 HETATM 30 C UNK 0 3.063 -2.320 -0.777 0.00 0.00 C+0 HETATM 31 C UNK 0 3.255 -0.819 -0.710 0.00 0.00 C+0 HETATM 32 C UNK 0 3.668 -0.219 0.496 0.00 0.00 C+0 HETATM 33 C UNK 0 3.823 1.164 0.589 0.00 0.00 C+0 HETATM 34 C UNK 0 3.566 1.943 -0.527 0.00 0.00 C+0 HETATM 35 O UNK 0 3.671 3.303 -0.434 0.00 0.00 O+0 HETATM 36 C UNK 0 3.172 1.365 -1.730 0.00 0.00 C+0 HETATM 37 O UNK 0 2.936 2.208 -2.780 0.00 0.00 O+0 HETATM 38 C UNK 0 3.014 -0.013 -1.832 0.00 0.00 C+0 HETATM 39 C UNK 0 -0.865 -0.098 -4.046 0.00 0.00 C+0 HETATM 40 O UNK 0 -0.104 -1.087 -4.763 0.00 0.00 O+0 HETATM 41 C UNK 0 -0.234 1.275 -4.281 0.00 0.00 C+0 HETATM 42 O UNK 0 1.195 1.135 -4.445 0.00 0.00 O+0 HETATM 43 C UNK 0 -0.531 2.256 -3.138 0.00 0.00 C+0 HETATM 44 O UNK 0 -0.632 3.577 -3.664 0.00 0.00 O+0 HETATM 45 H UNK 0 -1.390 2.978 -0.614 0.00 0.00 H+0 HETATM 46 H UNK 0 -3.065 2.459 -0.752 0.00 0.00 H+0 HETATM 47 H UNK 0 -2.474 3.804 -1.751 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.652 1.770 -3.114 0.00 0.00 H+0 HETATM 49 H UNK 0 0.060 -0.519 -2.147 0.00 0.00 H+0 HETATM 50 H UNK 0 -1.851 -3.360 -1.408 0.00 0.00 H+0 HETATM 51 H UNK 0 -3.312 -0.828 -0.787 0.00 0.00 H+0 HETATM 52 H UNK 0 -4.171 -2.581 -1.869 0.00 0.00 H+0 HETATM 53 H UNK 0 -3.929 -1.953 1.494 0.00 0.00 H+0 HETATM 54 H UNK 0 -2.058 1.376 4.096 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.914 1.356 1.225 0.00 0.00 H+0 HETATM 56 H UNK 0 -1.906 3.742 3.955 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.700 5.834 4.447 0.00 0.00 H+0 HETATM 58 H UNK 0 2.386 6.502 2.841 0.00 0.00 H+0 HETATM 59 H UNK 0 2.922 4.115 0.993 0.00 0.00 H+0 HETATM 60 H UNK 0 1.226 2.588 1.209 0.00 0.00 H+0 HETATM 61 H UNK 0 -1.787 -2.871 2.612 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.826 -4.656 0.345 0.00 0.00 H+0 HETATM 63 H UNK 0 -3.648 -4.425 1.907 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.934 -5.185 1.649 0.00 0.00 H+0 HETATM 65 H UNK 0 -0.356 -1.184 0.140 0.00 0.00 H+0 HETATM 66 H UNK 0 1.660 -2.215 0.885 0.00 0.00 H+0 HETATM 67 H UNK 0 1.860 -3.830 0.178 0.00 0.00 H+0 HETATM 68 H UNK 0 3.934 -2.792 -0.307 0.00 0.00 H+0 HETATM 69 H UNK 0 3.046 -2.648 -1.823 0.00 0.00 H+0 HETATM 70 H UNK 0 3.870 -0.831 1.373 0.00 0.00 H+0 HETATM 71 H UNK 0 4.138 1.621 1.522 0.00 0.00 H+0 HETATM 72 H UNK 0 3.573 3.607 -1.364 0.00 0.00 H+0 HETATM 73 H UNK 0 2.475 1.703 -3.489 0.00 0.00 H+0 HETATM 74 H UNK 0 2.707 -0.467 -2.769 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.879 -0.105 -4.468 0.00 0.00 H+0 HETATM 76 H UNK 0 -0.450 -1.950 -4.455 0.00 0.00 H+0 HETATM 77 H UNK 0 -0.593 1.674 -5.238 0.00 0.00 H+0 HETATM 78 H UNK 0 1.276 0.326 -5.003 0.00 0.00 H+0 HETATM 79 H UNK 0 0.297 2.256 -2.420 0.00 0.00 H+0 HETATM 80 H UNK 0 0.244 3.800 -4.034 0.00 0.00 H+0 CONECT 1 2 45 46 47 CONECT 2 43 3 1 48 CONECT 3 2 4 CONECT 4 3 39 5 49 CONECT 5 4 6 CONECT 6 27 7 5 50 CONECT 7 6 9 8 51 CONECT 8 7 52 CONECT 9 7 23 10 53 CONECT 10 9 11 CONECT 11 13 10 12 CONECT 12 11 CONECT 13 14 11 54 CONECT 14 15 13 55 CONECT 15 16 22 14 CONECT 16 17 15 56 CONECT 17 18 16 57 CONECT 18 20 17 19 CONECT 19 18 58 CONECT 20 18 22 21 CONECT 21 20 59 CONECT 22 15 20 60 CONECT 23 9 26 24 61 CONECT 24 25 23 62 63 CONECT 25 24 64 CONECT 26 23 27 CONECT 27 6 26 28 65 CONECT 28 29 27 CONECT 29 30 28 66 67 CONECT 30 31 29 68 69 CONECT 31 32 38 30 CONECT 32 31 33 70 CONECT 33 32 34 71 CONECT 34 33 36 35 CONECT 35 34 72 CONECT 36 34 38 37 CONECT 37 36 73 CONECT 38 36 31 74 CONECT 39 41 4 40 75 CONECT 40 39 76 CONECT 41 42 39 43 77 CONECT 42 41 78 CONECT 43 44 41 2 79 CONECT 44 43 80 CONECT 45 1 CONECT 46 1 CONECT 47 1 CONECT 48 2 CONECT 49 4 CONECT 50 6 CONECT 51 7 CONECT 52 8 CONECT 53 9 CONECT 54 13 CONECT 55 14 CONECT 56 16 CONECT 57 17 CONECT 58 19 CONECT 59 21 CONECT 60 22 CONECT 61 23 CONECT 62 24 CONECT 63 24 CONECT 64 25 CONECT 65 27 CONECT 66 29 CONECT 67 29 CONECT 68 30 CONECT 69 30 CONECT 70 32 CONECT 71 33 CONECT 72 35 CONECT 73 37 CONECT 74 38 CONECT 75 39 CONECT 76 40 CONECT 77 41 CONECT 78 42 CONECT 79 43 CONECT 80 44 MASTER 0 0 0 0 0 0 0 0 80 0 166 0 END