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 -11.514 0.693 0.266 0.00 0.00 C+0 HETATM 2 C UNK 0 -10.170 1.290 0.614 0.00 0.00 C+0 HETATM 3 O UNK 0 -9.172 0.287 0.622 0.00 0.00 O+0 HETATM 4 C UNK 0 -7.928 0.932 0.540 0.00 0.00 C+0 HETATM 5 O UNK 0 -7.632 0.888 -0.829 0.00 0.00 O+0 HETATM 6 C UNK 0 -6.605 0.030 -1.064 0.00 0.00 C+0 HETATM 7 C UNK 0 -7.178 -1.385 -1.430 0.00 0.00 C+0 HETATM 8 C UNK 0 -5.980 -2.268 -1.156 0.00 0.00 C+0 HETATM 9 C UNK 0 -4.798 -1.694 -2.000 0.00 0.00 C+0 HETATM 10 O UNK 0 -3.915 -0.955 -1.270 0.00 0.00 O+0 HETATM 11 C UNK 0 -2.794 -1.535 -0.800 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.734 -1.665 -1.968 0.00 0.00 C+0 HETATM 13 O UNK 0 -2.082 -2.679 -2.788 0.00 0.00 O+0 HETATM 14 C UNK 0 -0.487 -2.127 -1.148 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.033 -0.766 -0.601 0.00 0.00 C+0 HETATM 16 C UNK 0 1.349 -0.825 -0.124 0.00 0.00 C+0 HETATM 17 C UNK 0 1.700 -1.651 0.922 0.00 0.00 C+0 HETATM 18 C UNK 0 2.941 -1.610 1.513 0.00 0.00 C+0 HETATM 19 C UNK 0 3.867 -0.719 1.048 0.00 0.00 C+0 HETATM 20 C UNK 0 3.544 0.121 -0.004 0.00 0.00 C+0 HETATM 21 C UNK 0 2.286 0.067 -0.582 0.00 0.00 C+0 HETATM 22 O UNK 0 2.078 0.964 -1.627 0.00 0.00 O+0 HETATM 23 C UNK 0 4.545 1.006 -0.574 0.00 0.00 C+0 HETATM 24 O UNK 0 4.275 1.787 -1.553 0.00 0.00 O+0 HETATM 25 C UNK 0 5.879 1.018 -0.040 0.00 0.00 C+0 HETATM 26 C UNK 0 6.813 1.855 -0.663 0.00 0.00 C+0 HETATM 27 C UNK 0 8.117 1.885 -0.238 0.00 0.00 C+0 HETATM 28 C UNK 0 8.451 1.068 0.808 0.00 0.00 C+0 HETATM 29 C UNK 0 9.883 1.023 1.208 0.00 0.00 C+0 HETATM 30 C UNK 0 10.676 -0.085 0.655 0.00 0.00 C+0 HETATM 31 C UNK 0 10.248 -1.463 1.021 0.00 0.00 C+0 HETATM 32 O UNK 0 10.715 0.010 -0.792 0.00 0.00 O+0 HETATM 33 C UNK 0 12.125 0.052 1.040 0.00 0.00 C+0 HETATM 34 C UNK 0 12.725 1.331 0.500 0.00 0.00 C+0 HETATM 35 O UNK 0 13.119 1.391 -0.702 0.00 0.00 O+0 HETATM 36 O UNK 0 12.831 2.412 1.334 0.00 0.00 O+0 HETATM 37 C UNK 0 7.558 0.218 1.468 0.00 0.00 C+0 HETATM 38 O UNK 0 7.925 -0.549 2.502 0.00 0.00 O+0 HETATM 39 C UNK 0 6.228 0.189 1.024 0.00 0.00 C+0 HETATM 40 C UNK 0 5.230 -0.709 1.606 0.00 0.00 C+0 HETATM 41 O UNK 0 5.482 -1.448 2.540 0.00 0.00 O+0 HETATM 42 O UNK 0 -0.892 -0.609 0.505 0.00 0.00 O+0 HETATM 43 C UNK 0 -2.191 -0.755 0.300 0.00 0.00 C+0 HETATM 44 C UNK 0 -2.893 -1.277 1.599 0.00 0.00 C+0 HETATM 45 O UNK 0 -5.366 -0.838 -2.915 0.00 0.00 O+0 HETATM 46 C UNK 0 -5.691 0.366 -2.151 0.00 0.00 C+0 HETATM 47 C UNK 0 -6.350 1.287 -3.175 0.00 0.00 C+0 HETATM 48 C UNK 0 -7.902 2.226 1.237 0.00 0.00 C+0 HETATM 49 C UNK 0 -8.791 2.177 2.522 0.00 0.00 C+0 HETATM 50 C UNK 0 -10.146 1.814 2.036 0.00 0.00 C+0 HETATM 51 O UNK 0 -11.162 1.913 2.690 0.00 0.00 O+0 HETATM 52 H UNK 0 -11.408 -0.166 -0.437 0.00 0.00 H+0 HETATM 53 H UNK 0 -11.995 0.427 1.228 0.00 0.00 H+0 HETATM 54 H UNK 0 -12.140 1.471 -0.208 0.00 0.00 H+0 HETATM 55 H UNK 0 -9.905 2.143 -0.037 0.00 0.00 H+0 HETATM 56 H UNK 0 -7.227 0.208 1.080 0.00 0.00 H+0 HETATM 57 H UNK 0 -6.068 -0.178 -0.089 0.00 0.00 H+0 HETATM 58 H UNK 0 -7.972 -1.682 -0.759 0.00 0.00 H+0 HETATM 59 H UNK 0 -7.393 -1.401 -2.487 0.00 0.00 H+0 HETATM 60 H UNK 0 -6.188 -3.287 -1.468 0.00 0.00 H+0 HETATM 61 H UNK 0 -5.758 -2.230 -0.078 0.00 0.00 H+0 HETATM 62 H UNK 0 -4.339 -2.595 -2.469 0.00 0.00 H+0 HETATM 63 H UNK 0 -2.864 -2.637 -0.601 0.00 0.00 H+0 HETATM 64 H UNK 0 -1.505 -0.695 -2.379 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.815 -2.434 -3.740 0.00 0.00 H+0 HETATM 66 H UNK 0 0.226 -2.576 -1.821 0.00 0.00 H+0 HETATM 67 H UNK 0 -0.780 -2.797 -0.350 0.00 0.00 H+0 HETATM 68 H UNK 0 -0.191 -0.009 -1.335 0.00 0.00 H+0 HETATM 69 H UNK 0 0.966 -2.376 1.308 0.00 0.00 H+0 HETATM 70 H UNK 0 3.259 -2.235 2.345 0.00 0.00 H+0 HETATM 71 H UNK 0 1.234 1.034 -2.159 0.00 0.00 H+0 HETATM 72 H UNK 0 6.511 2.499 -1.508 0.00 0.00 H+0 HETATM 73 H UNK 0 8.858 2.524 -0.694 0.00 0.00 H+0 HETATM 74 H UNK 0 10.423 1.985 0.940 0.00 0.00 H+0 HETATM 75 H UNK 0 9.874 0.960 2.318 0.00 0.00 H+0 HETATM 76 H UNK 0 10.029 -1.653 2.079 0.00 0.00 H+0 HETATM 77 H UNK 0 9.355 -1.778 0.424 0.00 0.00 H+0 HETATM 78 H UNK 0 11.099 -2.214 0.809 0.00 0.00 H+0 HETATM 79 H UNK 0 10.828 0.919 -1.087 0.00 0.00 H+0 HETATM 80 H UNK 0 12.755 -0.765 0.573 0.00 0.00 H+0 HETATM 81 H UNK 0 12.313 -0.038 2.121 0.00 0.00 H+0 HETATM 82 H UNK 0 13.533 3.143 1.153 0.00 0.00 H+0 HETATM 83 H UNK 0 7.493 -1.172 3.072 0.00 0.00 H+0 HETATM 84 H UNK 0 -2.641 0.328 0.232 0.00 0.00 H+0 HETATM 85 H UNK 0 -3.856 -1.739 1.360 0.00 0.00 H+0 HETATM 86 H UNK 0 -2.220 -1.980 2.122 0.00 0.00 H+0 HETATM 87 H UNK 0 -3.098 -0.434 2.292 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.703 0.769 -1.815 0.00 0.00 H+0 HETATM 89 H UNK 0 -7.285 1.745 -2.785 0.00 0.00 H+0 HETATM 90 H UNK 0 -5.682 2.144 -3.444 0.00 0.00 H+0 HETATM 91 H UNK 0 -6.624 0.748 -4.109 0.00 0.00 H+0 HETATM 92 H UNK 0 -6.883 2.471 1.683 0.00 0.00 H+0 HETATM 93 H UNK 0 -8.296 3.074 0.658 0.00 0.00 H+0 HETATM 94 H UNK 0 -8.400 1.293 3.112 0.00 0.00 H+0 HETATM 95 H UNK 0 -8.704 3.133 3.025 0.00 0.00 H+0 CONECT 1 2 52 53 54 CONECT 2 1 3 50 55 CONECT 3 2 4 CONECT 4 3 5 48 56 CONECT 5 4 6 CONECT 6 5 7 46 57 CONECT 7 6 8 58 59 CONECT 8 7 9 60 61 CONECT 9 8 10 45 62 CONECT 10 9 11 CONECT 11 10 12 43 63 CONECT 12 11 13 14 64 CONECT 13 12 65 CONECT 14 12 15 66 67 CONECT 15 14 16 42 68 CONECT 16 15 17 21 CONECT 17 16 18 69 CONECT 18 17 19 70 CONECT 19 18 20 40 CONECT 20 19 21 23 CONECT 21 20 22 16 CONECT 22 21 71 CONECT 23 20 24 25 CONECT 24 23 CONECT 25 23 26 39 CONECT 26 25 27 72 CONECT 27 26 28 73 CONECT 28 27 29 37 CONECT 29 28 30 74 75 CONECT 30 29 31 32 33 CONECT 31 30 76 77 78 CONECT 32 30 79 CONECT 33 30 34 80 81 CONECT 34 33 35 36 CONECT 35 34 CONECT 36 34 82 CONECT 37 28 38 39 CONECT 38 37 83 CONECT 39 37 40 25 CONECT 40 39 41 19 CONECT 41 40 CONECT 42 15 43 CONECT 43 42 44 11 84 CONECT 44 43 85 86 87 CONECT 45 9 46 CONECT 46 45 47 6 88 CONECT 47 46 89 90 91 CONECT 48 4 49 92 93 CONECT 49 48 50 94 95 CONECT 50 49 51 2 CONECT 51 50 CONECT 52 1 CONECT 53 1 CONECT 54 1 CONECT 55 2 CONECT 56 4 CONECT 57 6 CONECT 58 7 CONECT 59 7 CONECT 60 8 CONECT 61 8 CONECT 62 9 CONECT 63 11 CONECT 64 12 CONECT 65 13 CONECT 66 14 CONECT 67 14 CONECT 68 15 CONECT 69 17 CONECT 70 18 CONECT 71 22 CONECT 72 26 CONECT 73 27 CONECT 74 29 CONECT 75 29 CONECT 76 31 CONECT 77 31 CONECT 78 31 CONECT 79 32 CONECT 80 33 CONECT 81 33 CONECT 82 36 CONECT 83 38 CONECT 84 43 CONECT 85 44 CONECT 86 44 CONECT 87 44 CONECT 88 46 CONECT 89 47 CONECT 90 47 CONECT 91 47 CONECT 92 48 CONECT 93 48 CONECT 94 49 CONECT 95 49 MASTER 0 0 0 0 0 0 0 0 95 0 200 0 END