HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 -2.630 0.002 2.436 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.159 -0.163 2.204 0.00 0.00 C+0 HETATM 3 O UNK 0 -0.383 -0.648 3.016 0.00 0.00 O+0 HETATM 4 O UNK 0 -0.815 0.343 0.984 0.00 0.00 O+0 HETATM 5 C UNK 0 0.569 0.223 0.676 0.00 0.00 C+0 HETATM 6 C UNK 0 0.964 0.782 -0.732 0.00 0.00 C+0 HETATM 7 C UNK 0 2.542 0.716 -0.810 0.00 0.00 C+0 HETATM 8 O UNK 0 3.024 -0.514 -0.220 0.00 0.00 O+0 HETATM 9 C UNK 0 4.206 -0.990 -0.675 0.00 0.00 C+0 HETATM 10 O UNK 0 4.916 -0.459 -1.512 0.00 0.00 O+0 HETATM 11 C UNK 0 4.510 -2.286 -0.034 0.00 0.00 C+0 HETATM 12 C UNK 0 3.761 -2.825 1.017 0.00 0.00 C+0 HETATM 13 C UNK 0 4.121 -4.062 1.550 0.00 0.00 C+0 HETATM 14 C UNK 0 5.215 -4.718 1.009 0.00 0.00 C+0 HETATM 15 N UNK 0 5.957 -4.227 -0.007 0.00 0.00 N+0 HETATM 16 C UNK 0 5.591 -3.018 -0.503 0.00 0.00 C+0 HETATM 17 C UNK 0 3.265 1.941 -0.161 0.00 0.00 C+0 HETATM 18 O UNK 0 3.291 1.760 1.276 0.00 0.00 O+0 HETATM 19 C UNK 0 4.255 2.447 1.952 0.00 0.00 C+0 HETATM 20 C UNK 0 4.122 2.201 3.422 0.00 0.00 C+0 HETATM 21 O UNK 0 5.103 3.162 1.438 0.00 0.00 O+0 HETATM 22 C UNK 0 2.568 3.289 -0.481 0.00 0.00 C+0 HETATM 23 C UNK 0 1.125 3.206 0.032 0.00 0.00 C+0 HETATM 24 O UNK 0 0.515 4.502 0.086 0.00 0.00 O+0 HETATM 25 C UNK 0 0.772 5.229 1.208 0.00 0.00 C+0 HETATM 26 C UNK 0 0.079 6.554 1.131 0.00 0.00 C+0 HETATM 27 O UNK 0 1.468 4.858 2.143 0.00 0.00 O+0 HETATM 28 C UNK 0 0.519 2.276 -1.047 0.00 0.00 C+0 HETATM 29 O UNK 0 1.240 2.660 -2.308 0.00 0.00 O+0 HETATM 30 C UNK 0 2.367 3.512 -1.988 0.00 0.00 C+0 HETATM 31 C UNK 0 3.573 3.153 -2.871 0.00 0.00 C+0 HETATM 32 C UNK 0 2.011 4.967 -2.359 0.00 0.00 C+0 HETATM 33 C UNK 0 -0.997 2.485 -1.412 0.00 0.00 C+0 HETATM 34 C UNK 0 -1.985 2.586 -0.246 0.00 0.00 C+0 HETATM 35 O UNK 0 -1.126 3.753 -2.098 0.00 0.00 O+0 HETATM 36 C UNK 0 -1.476 1.437 -2.438 0.00 0.00 C+0 HETATM 37 C UNK 0 -1.110 0.007 -2.074 0.00 0.00 C+0 HETATM 38 C UNK 0 0.398 -0.143 -1.863 0.00 0.00 C+0 HETATM 39 O UNK 0 0.692 -1.521 -1.562 0.00 0.00 O+0 HETATM 40 C UNK 0 0.962 -2.333 -2.611 0.00 0.00 C+0 HETATM 41 O UNK 0 0.967 -2.021 -3.791 0.00 0.00 O+0 HETATM 42 C UNK 0 1.376 -3.670 -2.146 0.00 0.00 C+0 HETATM 43 C UNK 0 0.827 -4.390 -1.155 0.00 0.00 C+0 HETATM 44 C UNK 0 -0.353 -4.038 -0.360 0.00 0.00 C+0 HETATM 45 C UNK 0 -1.587 -3.777 -0.969 0.00 0.00 C+0 HETATM 46 C UNK 0 -2.713 -3.495 -0.192 0.00 0.00 C+0 HETATM 47 C UNK 0 -2.615 -3.482 1.198 0.00 0.00 C+0 HETATM 48 C UNK 0 -1.392 -3.744 1.812 0.00 0.00 C+0 HETATM 49 C UNK 0 -0.266 -4.027 1.036 0.00 0.00 C+0 HETATM 50 H UNK 0 -2.854 1.050 2.646 0.00 0.00 H+0 HETATM 51 H UNK 0 -2.932 -0.610 3.291 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.188 -0.341 1.561 0.00 0.00 H+0 HETATM 53 H UNK 0 0.830 -0.840 0.749 0.00 0.00 H+0 HETATM 54 H UNK 0 1.128 0.730 1.467 0.00 0.00 H+0 HETATM 55 H UNK 0 2.797 0.681 -1.873 0.00 0.00 H+0 HETATM 56 H UNK 0 2.906 -2.297 1.430 0.00 0.00 H+0 HETATM 57 H UNK 0 3.563 -4.501 2.369 0.00 0.00 H+0 HETATM 58 H UNK 0 5.535 -5.684 1.392 0.00 0.00 H+0 HETATM 59 H UNK 0 6.215 -2.653 -1.317 0.00 0.00 H+0 HETATM 60 H UNK 0 4.302 1.947 -0.516 0.00 0.00 H+0 HETATM 61 H UNK 0 4.249 1.136 3.632 0.00 0.00 H+0 HETATM 62 H UNK 0 3.146 2.548 3.769 0.00 0.00 H+0 HETATM 63 H UNK 0 4.899 2.756 3.955 0.00 0.00 H+0 HETATM 64 H UNK 0 3.113 4.123 -0.028 0.00 0.00 H+0 HETATM 65 H UNK 0 1.028 2.768 1.027 0.00 0.00 H+0 HETATM 66 H UNK 0 -1.000 6.403 1.045 0.00 0.00 H+0 HETATM 67 H UNK 0 0.281 7.121 2.043 0.00 0.00 H+0 HETATM 68 H UNK 0 0.458 7.120 0.276 0.00 0.00 H+0 HETATM 69 H UNK 0 3.339 3.321 -3.930 0.00 0.00 H+0 HETATM 70 H UNK 0 3.868 2.106 -2.815 0.00 0.00 H+0 HETATM 71 H UNK 0 4.444 3.764 -2.612 0.00 0.00 H+0 HETATM 72 H UNK 0 1.046 5.300 -1.978 0.00 0.00 H+0 HETATM 73 H UNK 0 2.781 5.663 -2.010 0.00 0.00 H+0 HETATM 74 H UNK 0 1.925 5.075 -3.447 0.00 0.00 H+0 HETATM 75 H UNK 0 -2.793 3.291 -0.477 0.00 0.00 H+0 HETATM 76 H UNK 0 -1.514 2.951 0.670 0.00 0.00 H+0 HETATM 77 H UNK 0 -2.472 1.633 -0.029 0.00 0.00 H+0 HETATM 78 H UNK 0 -0.416 3.757 -2.770 0.00 0.00 H+0 HETATM 79 H UNK 0 -2.562 1.517 -2.579 0.00 0.00 H+0 HETATM 80 H UNK 0 -1.051 1.666 -3.425 0.00 0.00 H+0 HETATM 81 H UNK 0 -1.670 -0.336 -1.199 0.00 0.00 H+0 HETATM 82 H UNK 0 -1.431 -0.660 -2.885 0.00 0.00 H+0 HETATM 83 H UNK 0 0.892 0.133 -2.804 0.00 0.00 H+0 HETATM 84 H UNK 0 2.200 -4.087 -2.717 0.00 0.00 H+0 HETATM 85 H UNK 0 1.261 -5.358 -0.914 0.00 0.00 H+0 HETATM 86 H UNK 0 -1.687 -3.804 -2.051 0.00 0.00 H+0 HETATM 87 H UNK 0 -3.667 -3.297 -0.673 0.00 0.00 H+0 HETATM 88 H UNK 0 -3.493 -3.272 1.804 0.00 0.00 H+0 HETATM 89 H UNK 0 -1.312 -3.728 2.896 0.00 0.00 H+0 HETATM 90 H UNK 0 0.679 -4.235 1.533 0.00 0.00 H+0 CONECT 1 2 50 51 52 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 5 2 CONECT 5 6 4 53 54 CONECT 6 5 7 38 28 CONECT 7 8 17 6 55 CONECT 8 7 9 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 16 12 CONECT 12 13 11 56 CONECT 13 14 12 57 CONECT 14 15 13 58 CONECT 15 16 14 CONECT 16 11 15 59 CONECT 17 18 22 7 60 CONECT 18 17 19 CONECT 19 18 20 21 CONECT 20 19 61 62 63 CONECT 21 19 CONECT 22 17 23 30 64 CONECT 23 24 22 28 65 CONECT 24 23 25 CONECT 25 24 27 26 CONECT 26 25 66 67 68 CONECT 27 25 CONECT 28 23 29 33 6 CONECT 29 28 30 CONECT 30 22 29 31 32 CONECT 31 30 69 70 71 CONECT 32 30 72 73 74 CONECT 33 35 28 36 34 CONECT 34 33 75 76 77 CONECT 35 33 78 CONECT 36 33 37 79 80 CONECT 37 36 38 81 82 CONECT 38 39 6 37 83 CONECT 39 40 38 CONECT 40 39 42 41 CONECT 41 40 CONECT 42 40 43 84 CONECT 43 42 44 85 CONECT 44 43 45 49 CONECT 45 44 46 86 CONECT 46 45 47 87 CONECT 47 46 48 88 CONECT 48 47 49 89 CONECT 49 48 44 90 CONECT 50 1 CONECT 51 1 CONECT 52 1 CONECT 53 5 CONECT 54 5 CONECT 55 7 CONECT 56 12 CONECT 57 13 CONECT 58 14 CONECT 59 16 CONECT 60 17 CONECT 61 20 CONECT 62 20 CONECT 63 20 CONECT 64 22 CONECT 65 23 CONECT 66 26 CONECT 67 26 CONECT 68 26 CONECT 69 31 CONECT 70 31 CONECT 71 31 CONECT 72 32 CONECT 73 32 CONECT 74 32 CONECT 75 34 CONECT 76 34 CONECT 77 34 CONECT 78 35 CONECT 79 36 CONECT 80 36 CONECT 81 37 CONECT 82 37 CONECT 83 38 CONECT 84 42 CONECT 85 43 CONECT 86 45 CONECT 87 46 CONECT 88 47 CONECT 89 48 CONECT 90 49 MASTER 0 0 0 0 0 0 0 0 90 0 188 0 END