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 -1.313 0.813 -1.343 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.031 2.236 -0.766 0.00 0.00 C+0 HETATM 3 C UNK 0 -1.973 3.216 -1.527 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.436 3.184 -1.074 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.574 3.483 0.435 0.00 0.00 C+0 HETATM 6 C UNK 0 -3.006 4.879 0.782 0.00 0.00 C+0 HETATM 7 O UNK 0 -2.205 5.109 1.676 0.00 0.00 O+0 HETATM 8 O UNK 0 -3.506 5.891 0.034 0.00 0.00 O+0 HETATM 9 C UNK 0 -5.065 3.528 0.857 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.751 2.167 0.933 0.00 0.00 C+0 HETATM 11 C UNK 0 -5.008 1.159 1.832 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.048 1.604 3.309 0.00 0.00 C+0 HETATM 13 C UNK 0 -5.708 -0.221 1.756 0.00 0.00 C+0 HETATM 14 O UNK 0 -5.750 -0.730 0.428 0.00 0.00 O+0 HETATM 15 C UNK 0 -3.550 1.046 1.335 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.799 2.396 1.237 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.365 2.161 0.736 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.405 1.901 1.648 0.00 0.00 C+0 HETATM 19 C UNK 0 1.051 1.683 1.362 0.00 0.00 C+0 HETATM 20 C UNK 0 1.430 1.669 -0.137 0.00 0.00 C+0 HETATM 21 C UNK 0 2.999 1.691 -0.424 0.00 0.00 C+0 HETATM 22 C UNK 0 3.693 2.946 0.165 0.00 0.00 C+0 HETATM 23 C UNK 0 3.638 0.443 0.254 0.00 0.00 C+0 HETATM 24 C UNK 0 5.072 0.156 -0.184 0.00 0.00 C+0 HETATM 25 C UNK 0 5.200 0.016 -1.699 0.00 0.00 C+0 HETATM 26 O UNK 0 6.575 -0.216 -2.004 0.00 0.00 O+0 HETATM 27 S UNK 0 7.080 -1.736 -2.281 0.00 0.00 S+0 HETATM 28 O UNK 0 6.184 -2.325 -3.262 0.00 0.00 O+0 HETATM 29 O UNK 0 7.338 -2.374 -1.013 0.00 0.00 O+0 HETATM 30 O UNK 0 8.480 -1.512 -3.042 0.00 0.00 O+0 HETATM 31 C UNK 0 4.649 1.256 -2.489 0.00 0.00 C+0 HETATM 32 C UNK 0 5.604 2.464 -2.360 0.00 0.00 C+0 HETATM 33 C UNK 0 4.600 0.879 -4.013 0.00 0.00 C+0 HETATM 34 O UNK 0 5.887 0.487 -4.452 0.00 0.00 O+0 HETATM 35 S UNK 0 6.079 -0.438 -5.763 0.00 0.00 S+0 HETATM 36 O UNK 0 5.642 0.301 -6.922 0.00 0.00 O+0 HETATM 37 O UNK 0 7.413 -0.995 -5.638 0.00 0.00 O+0 HETATM 38 O UNK 0 5.058 -1.657 -5.510 0.00 0.00 O+0 HETATM 39 C UNK 0 3.185 1.555 -1.982 0.00 0.00 C+0 HETATM 40 C UNK 0 2.457 2.700 -2.717 0.00 0.00 C+0 HETATM 41 C UNK 0 0.948 2.642 -2.459 0.00 0.00 C+0 HETATM 42 C UNK 0 0.535 2.671 -0.962 0.00 0.00 C+0 HETATM 43 C UNK 0 0.744 4.136 -0.464 0.00 0.00 C+0 HETATM 44 H UNK 0 -2.378 0.572 -1.341 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.010 0.712 -2.387 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.822 0.019 -0.772 0.00 0.00 H+0 HETATM 47 H UNK 0 -1.640 4.251 -1.432 0.00 0.00 H+0 HETATM 48 H UNK 0 -1.939 3.000 -2.602 0.00 0.00 H+0 HETATM 49 H UNK 0 -3.995 3.911 -1.674 0.00 0.00 H+0 HETATM 50 H UNK 0 -3.879 2.213 -1.319 0.00 0.00 H+0 HETATM 51 H UNK 0 -4.182 5.637 -0.619 0.00 0.00 H+0 HETATM 52 H UNK 0 -5.634 4.157 0.160 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.158 4.027 1.831 0.00 0.00 H+0 HETATM 54 H UNK 0 -6.776 2.307 1.299 0.00 0.00 H+0 HETATM 55 H UNK 0 -5.846 1.769 -0.085 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.582 2.579 3.473 0.00 0.00 H+0 HETATM 57 H UNK 0 -6.082 1.675 3.667 0.00 0.00 H+0 HETATM 58 H UNK 0 -4.526 0.882 3.948 0.00 0.00 H+0 HETATM 59 H UNK 0 -6.744 -0.142 2.104 0.00 0.00 H+0 HETATM 60 H UNK 0 -5.206 -0.960 2.391 0.00 0.00 H+0 HETATM 61 H UNK 0 -4.901 -1.172 0.257 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.995 0.368 1.999 0.00 0.00 H+0 HETATM 63 H UNK 0 -3.553 0.562 0.357 0.00 0.00 H+0 HETATM 64 H UNK 0 -2.716 2.763 2.270 0.00 0.00 H+0 HETATM 65 H UNK 0 -0.667 1.867 2.705 0.00 0.00 H+0 HETATM 66 H UNK 0 1.593 2.460 1.907 0.00 0.00 H+0 HETATM 67 H UNK 0 1.340 0.728 1.816 0.00 0.00 H+0 HETATM 68 H UNK 0 1.134 0.671 -0.488 0.00 0.00 H+0 HETATM 69 H UNK 0 4.715 2.745 0.495 0.00 0.00 H+0 HETATM 70 H UNK 0 3.191 3.333 1.054 0.00 0.00 H+0 HETATM 71 H UNK 0 3.764 3.771 -0.546 0.00 0.00 H+0 HETATM 72 H UNK 0 3.034 -0.447 0.030 0.00 0.00 H+0 HETATM 73 H UNK 0 3.626 0.555 1.345 0.00 0.00 H+0 HETATM 74 H UNK 0 5.403 -0.776 0.293 0.00 0.00 H+0 HETATM 75 H UNK 0 5.768 0.914 0.190 0.00 0.00 H+0 HETATM 76 H UNK 0 4.602 -0.856 -1.998 0.00 0.00 H+0 HETATM 77 H UNK 0 8.313 -1.288 -3.989 0.00 0.00 H+0 HETATM 78 H UNK 0 6.567 2.274 -2.847 0.00 0.00 H+0 HETATM 79 H UNK 0 5.182 3.357 -2.833 0.00 0.00 H+0 HETATM 80 H UNK 0 5.840 2.710 -1.325 0.00 0.00 H+0 HETATM 81 H UNK 0 3.877 0.071 -4.170 0.00 0.00 H+0 HETATM 82 H UNK 0 4.297 1.732 -4.627 0.00 0.00 H+0 HETATM 83 H UNK 0 5.399 -2.189 -4.747 0.00 0.00 H+0 HETATM 84 H UNK 0 2.628 0.643 -2.256 0.00 0.00 H+0 HETATM 85 H UNK 0 2.854 3.681 -2.446 0.00 0.00 H+0 HETATM 86 H UNK 0 2.592 2.615 -3.799 0.00 0.00 H+0 HETATM 87 H UNK 0 0.598 1.726 -2.941 0.00 0.00 H+0 HETATM 88 H UNK 0 0.468 3.465 -3.003 0.00 0.00 H+0 HETATM 89 H UNK 0 1.785 4.449 -0.504 0.00 0.00 H+0 HETATM 90 H UNK 0 0.403 4.291 0.562 0.00 0.00 H+0 HETATM 91 H UNK 0 0.223 4.863 -1.094 0.00 0.00 H+0 CONECT 1 2 44 45 46 CONECT 2 42 1 17 3 CONECT 3 2 4 47 48 CONECT 4 3 5 49 50 CONECT 5 9 6 4 16 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 51 CONECT 9 5 10 52 53 CONECT 10 9 11 54 55 CONECT 11 10 15 13 12 CONECT 12 11 56 57 58 CONECT 13 11 14 59 60 CONECT 14 13 61 CONECT 15 16 11 62 63 CONECT 16 15 17 5 64 CONECT 17 18 2 16 CONECT 18 17 19 65 CONECT 19 20 18 66 67 CONECT 20 19 21 42 68 CONECT 21 23 39 22 20 CONECT 22 21 69 70 71 CONECT 23 21 24 72 73 CONECT 24 25 23 74 75 CONECT 25 26 24 31 76 CONECT 26 25 27 CONECT 27 26 30 28 29 CONECT 28 27 CONECT 29 27 CONECT 30 27 77 CONECT 31 39 32 33 25 CONECT 32 31 78 79 80 CONECT 33 31 34 81 82 CONECT 34 33 35 CONECT 35 34 36 37 38 CONECT 36 35 CONECT 37 35 CONECT 38 35 83 CONECT 39 31 21 40 84 CONECT 40 39 41 85 86 CONECT 41 40 42 87 88 CONECT 42 43 2 41 20 CONECT 43 42 89 90 91 CONECT 44 1 CONECT 45 1 CONECT 46 1 CONECT 47 3 CONECT 48 3 CONECT 49 4 CONECT 50 4 CONECT 51 8 CONECT 52 9 CONECT 53 9 CONECT 54 10 CONECT 55 10 CONECT 56 12 CONECT 57 12 CONECT 58 12 CONECT 59 13 CONECT 60 13 CONECT 61 14 CONECT 62 15 CONECT 63 15 CONECT 64 16 CONECT 65 18 CONECT 66 19 CONECT 67 19 CONECT 68 20 CONECT 69 22 CONECT 70 22 CONECT 71 22 CONECT 72 23 CONECT 73 23 CONECT 74 24 CONECT 75 24 CONECT 76 25 CONECT 77 30 CONECT 78 32 CONECT 79 32 CONECT 80 32 CONECT 81 33 CONECT 82 33 CONECT 83 38 CONECT 84 39 CONECT 85 40 CONECT 86 40 CONECT 87 41 CONECT 88 41 CONECT 89 43 CONECT 90 43 CONECT 91 43 MASTER 0 0 0 0 0 0 0 0 91 0 190 0 END