HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 7.600 -0.030 -0.089 0.00 0.00 C+0 HETATM 2 C UNK 0 6.574 0.956 0.481 0.00 0.00 C+0 HETATM 3 C UNK 0 5.824 1.541 -0.670 0.00 0.00 C+0 HETATM 4 C UNK 0 4.393 1.950 -0.278 0.00 0.00 C+0 HETATM 5 C UNK 0 3.622 0.844 0.313 0.00 0.00 C+0 HETATM 6 C UNK 0 4.518 -0.343 0.533 0.00 0.00 C+0 HETATM 7 C UNK 0 3.734 -1.245 1.447 0.00 0.00 C+0 HETATM 8 C UNK 0 2.535 -1.516 0.948 0.00 0.00 C+0 HETATM 9 C UNK 0 2.207 -0.893 -0.388 0.00 0.00 C+0 HETATM 10 C UNK 0 1.200 -1.800 -0.939 0.00 0.00 C+0 HETATM 11 C UNK 0 1.972 -3.190 -0.976 0.00 0.00 C+0 HETATM 12 C UNK 0 0.769 -1.730 -2.329 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.470 -1.399 -2.614 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.081 -0.215 -2.004 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.108 -0.433 -0.942 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.446 -1.910 -0.790 0.00 0.00 C+0 HETATM 17 C UNK 0 -3.400 0.171 -1.470 0.00 0.00 C+0 HETATM 18 C UNK 0 -4.477 0.284 -0.645 0.00 0.00 C+0 HETATM 19 C UNK 0 -5.678 0.900 -1.285 0.00 0.00 C+0 HETATM 20 O UNK 0 -6.094 2.058 -0.646 0.00 0.00 O+0 HETATM 21 C UNK 0 -4.324 -0.172 0.722 0.00 0.00 C+0 HETATM 22 C UNK 0 -5.335 0.129 1.760 0.00 0.00 C+0 HETATM 23 C UNK 0 -6.700 -0.425 1.686 0.00 0.00 C+0 HETATM 24 C UNK 0 -7.522 0.066 2.927 0.00 0.00 C+0 HETATM 25 O UNK 0 -7.458 -0.285 0.576 0.00 0.00 O+0 HETATM 26 C UNK 0 -2.937 -0.125 1.305 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.922 0.293 0.320 0.00 0.00 C+0 HETATM 28 O UNK 0 -2.188 1.682 0.156 0.00 0.00 O+0 HETATM 29 C UNK 0 -0.971 2.278 -0.154 0.00 0.00 C+0 HETATM 30 O UNK 0 -0.875 3.371 -0.737 0.00 0.00 O+0 HETATM 31 C UNK 0 0.096 1.348 0.351 0.00 0.00 C+0 HETATM 32 C UNK 0 1.403 1.528 0.149 0.00 0.00 C+0 HETATM 33 O UNK 0 1.919 2.784 0.430 0.00 0.00 O+0 HETATM 34 C UNK 0 2.286 0.505 -0.345 0.00 0.00 C+0 HETATM 35 C UNK 0 2.516 0.982 -1.822 0.00 0.00 C+0 HETATM 36 C UNK 0 -0.522 0.263 0.945 0.00 0.00 C+0 HETATM 37 O UNK 0 -0.464 -0.723 1.756 0.00 0.00 O+0 HETATM 38 C UNK 0 5.664 0.185 1.404 0.00 0.00 C+0 HETATM 39 H UNK 0 7.370 -1.075 0.239 0.00 0.00 H+0 HETATM 40 H UNK 0 8.636 0.268 0.178 0.00 0.00 H+0 HETATM 41 H UNK 0 7.565 -0.055 -1.197 0.00 0.00 H+0 HETATM 42 H UNK 0 7.134 1.684 1.086 0.00 0.00 H+0 HETATM 43 H UNK 0 6.337 2.511 -0.934 0.00 0.00 H+0 HETATM 44 H UNK 0 5.853 0.920 -1.563 0.00 0.00 H+0 HETATM 45 H UNK 0 4.576 2.795 0.459 0.00 0.00 H+0 HETATM 46 H UNK 0 4.006 2.452 -1.160 0.00 0.00 H+0 HETATM 47 H UNK 0 3.393 1.139 1.391 0.00 0.00 H+0 HETATM 48 H UNK 0 4.964 -0.807 -0.318 0.00 0.00 H+0 HETATM 49 H UNK 0 4.060 -1.635 2.375 0.00 0.00 H+0 HETATM 50 H UNK 0 1.840 -2.155 1.493 0.00 0.00 H+0 HETATM 51 H UNK 0 3.109 -1.174 -1.049 0.00 0.00 H+0 HETATM 52 H UNK 0 0.445 -2.190 -0.223 0.00 0.00 H+0 HETATM 53 H UNK 0 2.267 -3.470 0.031 0.00 0.00 H+0 HETATM 54 H UNK 0 1.328 -3.918 -1.491 0.00 0.00 H+0 HETATM 55 H UNK 0 2.896 -2.939 -1.540 0.00 0.00 H+0 HETATM 56 H UNK 0 1.457 -1.962 -3.183 0.00 0.00 H+0 HETATM 57 H UNK 0 -1.044 -2.023 -3.339 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.618 0.267 -2.923 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.421 0.586 -1.745 0.00 0.00 H+0 HETATM 60 H UNK 0 -1.621 -2.464 -1.343 0.00 0.00 H+0 HETATM 61 H UNK 0 -3.380 -2.218 -1.244 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.338 -2.263 0.249 0.00 0.00 H+0 HETATM 63 H UNK 0 -3.438 0.499 -2.499 0.00 0.00 H+0 HETATM 64 H UNK 0 -5.328 1.323 -2.309 0.00 0.00 H+0 HETATM 65 H UNK 0 -6.455 0.210 -1.599 0.00 0.00 H+0 HETATM 66 H UNK 0 -5.444 2.770 -0.788 0.00 0.00 H+0 HETATM 67 H UNK 0 -4.475 -1.354 0.612 0.00 0.00 H+0 HETATM 68 H UNK 0 -5.363 1.258 1.959 0.00 0.00 H+0 HETATM 69 H UNK 0 -4.898 -0.231 2.761 0.00 0.00 H+0 HETATM 70 H UNK 0 -6.689 -1.559 1.898 0.00 0.00 H+0 HETATM 71 H UNK 0 -8.379 -0.600 3.043 0.00 0.00 H+0 HETATM 72 H UNK 0 -6.859 0.152 3.787 0.00 0.00 H+0 HETATM 73 H UNK 0 -7.862 1.081 2.632 0.00 0.00 H+0 HETATM 74 H UNK 0 -8.397 -0.001 0.737 0.00 0.00 H+0 HETATM 75 H UNK 0 -2.994 0.668 2.113 0.00 0.00 H+0 HETATM 76 H UNK 0 -2.668 -1.044 1.876 0.00 0.00 H+0 HETATM 77 H UNK 0 1.477 3.636 0.116 0.00 0.00 H+0 HETATM 78 H UNK 0 2.228 2.024 -1.971 0.00 0.00 H+0 HETATM 79 H UNK 0 1.846 0.420 -2.506 0.00 0.00 H+0 HETATM 80 H UNK 0 3.532 0.719 -2.124 0.00 0.00 H+0 HETATM 81 H UNK 0 5.289 0.788 2.242 0.00 0.00 H+0 HETATM 82 H UNK 0 6.202 -0.716 1.765 0.00 0.00 H+0 CONECT 1 2 39 40 41 CONECT 2 1 3 38 42 CONECT 3 2 4 43 44 CONECT 4 3 5 45 46 CONECT 5 4 6 34 47 CONECT 6 5 7 38 48 CONECT 7 6 8 49 CONECT 8 7 9 50 CONECT 9 8 10 34 51 CONECT 10 9 11 12 52 CONECT 11 10 53 54 55 CONECT 12 10 13 56 CONECT 13 12 14 57 CONECT 14 13 15 58 59 CONECT 15 14 16 17 27 CONECT 16 15 60 61 62 CONECT 17 15 18 63 CONECT 18 17 19 21 CONECT 19 18 20 64 65 CONECT 20 19 66 CONECT 21 18 22 26 67 CONECT 22 21 23 68 69 CONECT 23 22 24 25 70 CONECT 24 23 71 72 73 CONECT 25 23 74 CONECT 26 21 27 75 76 CONECT 27 26 28 15 36 CONECT 28 27 29 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 36 CONECT 32 31 33 34 CONECT 33 32 77 CONECT 34 32 35 5 9 CONECT 35 34 78 79 80 CONECT 36 31 37 27 CONECT 37 36 CONECT 38 6 2 81 82 CONECT 39 1 CONECT 40 1 CONECT 41 1 CONECT 42 2 CONECT 43 3 CONECT 44 3 CONECT 45 4 CONECT 46 4 CONECT 47 5 CONECT 48 6 CONECT 49 7 CONECT 50 8 CONECT 51 9 CONECT 52 10 CONECT 53 11 CONECT 54 11 CONECT 55 11 CONECT 56 12 CONECT 57 13 CONECT 58 14 CONECT 59 14 CONECT 60 16 CONECT 61 16 CONECT 62 16 CONECT 63 17 CONECT 64 19 CONECT 65 19 CONECT 66 20 CONECT 67 21 CONECT 68 22 CONECT 69 22 CONECT 70 23 CONECT 71 24 CONECT 72 24 CONECT 73 24 CONECT 74 25 CONECT 75 26 CONECT 76 26 CONECT 77 33 CONECT 78 35 CONECT 79 35 CONECT 80 35 CONECT 81 38 CONECT 82 38 MASTER 0 0 0 0 0 0 0 0 82 0 172 0 END