HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 3.430 2.705 -3.103 0.00 0.00 C+0 HETATM 2 O UNK 0 2.750 2.600 -1.896 0.00 0.00 O+0 HETATM 3 C UNK 0 3.506 1.809 -1.041 0.00 0.00 C+0 HETATM 4 C UNK 0 2.713 0.709 -0.400 0.00 0.00 C+0 HETATM 5 C UNK 0 2.374 -0.443 -1.296 0.00 0.00 C+0 HETATM 6 O UNK 0 1.647 -1.360 -0.496 0.00 0.00 O+0 HETATM 7 C UNK 0 0.419 -1.640 -1.038 0.00 0.00 C+0 HETATM 8 O UNK 0 -0.622 -1.263 -0.169 0.00 0.00 O+0 HETATM 9 C UNK 0 -1.929 -1.676 -0.505 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.046 -1.099 0.237 0.00 0.00 C+0 HETATM 11 O UNK 0 -2.788 -0.244 1.160 0.00 0.00 O+0 HETATM 12 N UNK 0 -4.386 -1.413 0.012 0.00 0.00 N+0 HETATM 13 C UNK 0 -5.483 -0.824 0.766 0.00 0.00 C+0 HETATM 14 C UNK 0 -6.250 -1.951 1.421 0.00 0.00 C+0 HETATM 15 S UNK 0 -7.524 -1.296 2.528 0.00 0.00 S+0 HETATM 16 C UNK 0 -7.401 0.510 2.633 0.00 0.00 C+0 HETATM 17 C UNK 0 -8.015 1.192 1.429 0.00 0.00 C+0 HETATM 18 C UNK 0 -7.593 2.642 1.472 0.00 0.00 C+0 HETATM 19 N UNK 0 -7.578 0.593 0.197 0.00 0.00 N+0 HETATM 20 C UNK 0 -6.406 -0.124 -0.158 0.00 0.00 C+0 HETATM 21 O UNK 0 -6.086 -0.194 -1.371 0.00 0.00 O+0 HETATM 22 C UNK 0 -2.135 -2.559 -1.462 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.020 -3.166 -2.236 0.00 0.00 C+0 HETATM 24 O UNK 0 -0.807 -2.497 -3.441 0.00 0.00 O+0 HETATM 25 C UNK 0 0.225 -3.110 -1.382 0.00 0.00 C+0 HETATM 26 O UNK 0 -0.070 -3.800 -0.188 0.00 0.00 O+0 HETATM 27 C UNK 0 3.561 -1.202 -1.744 0.00 0.00 C+0 HETATM 28 N UNK 0 3.819 -2.561 -1.390 0.00 0.00 N+0 HETATM 29 O UNK 0 4.432 -0.662 -2.487 0.00 0.00 O+0 HETATM 30 O UNK 0 3.505 0.345 0.673 0.00 0.00 O+0 HETATM 31 C UNK 0 4.128 1.451 1.171 0.00 0.00 C+0 HETATM 32 N UNK 0 5.571 1.325 1.291 0.00 0.00 N+0 HETATM 33 C UNK 0 6.288 2.397 1.626 0.00 0.00 C+0 HETATM 34 C UNK 0 7.678 2.349 1.759 0.00 0.00 C+0 HETATM 35 C UNK 0 8.327 1.153 1.536 0.00 0.00 C+0 HETATM 36 O UNK 0 9.591 1.038 1.640 0.00 0.00 O+0 HETATM 37 N UNK 0 7.584 0.085 1.200 0.00 0.00 N+0 HETATM 38 C UNK 0 6.236 0.178 1.082 0.00 0.00 C+0 HETATM 39 O UNK 0 5.582 -0.833 0.769 0.00 0.00 O+0 HETATM 40 C UNK 0 3.854 2.604 0.234 0.00 0.00 C+0 HETATM 41 O UNK 0 2.704 3.241 0.674 0.00 0.00 O+0 HETATM 42 H UNK 0 4.428 3.160 -2.962 0.00 0.00 H+0 HETATM 43 H UNK 0 2.837 3.271 -3.861 0.00 0.00 H+0 HETATM 44 H UNK 0 3.576 1.698 -3.534 0.00 0.00 H+0 HETATM 45 H UNK 0 4.433 1.433 -1.467 0.00 0.00 H+0 HETATM 46 H UNK 0 1.789 1.180 0.015 0.00 0.00 H+0 HETATM 47 H UNK 0 1.771 -0.185 -2.158 0.00 0.00 H+0 HETATM 48 H UNK 0 0.266 -1.085 -1.986 0.00 0.00 H+0 HETATM 49 H UNK 0 -4.653 -2.095 -0.718 0.00 0.00 H+0 HETATM 50 H UNK 0 -5.100 -0.120 1.524 0.00 0.00 H+0 HETATM 51 H UNK 0 -6.757 -2.556 0.625 0.00 0.00 H+0 HETATM 52 H UNK 0 -5.565 -2.652 1.930 0.00 0.00 H+0 HETATM 53 H UNK 0 -8.028 0.816 3.520 0.00 0.00 H+0 HETATM 54 H UNK 0 -6.360 0.858 2.792 0.00 0.00 H+0 HETATM 55 H UNK 0 -9.111 1.160 1.560 0.00 0.00 H+0 HETATM 56 H UNK 0 -7.562 3.061 0.436 0.00 0.00 H+0 HETATM 57 H UNK 0 -8.313 3.225 2.069 0.00 0.00 H+0 HETATM 58 H UNK 0 -6.577 2.706 1.925 0.00 0.00 H+0 HETATM 59 H UNK 0 -8.256 0.710 -0.588 0.00 0.00 H+0 HETATM 60 H UNK 0 -3.162 -2.881 -1.722 0.00 0.00 H+0 HETATM 61 H UNK 0 -1.284 -4.211 -2.505 0.00 0.00 H+0 HETATM 62 H UNK 0 -1.468 -1.782 -3.578 0.00 0.00 H+0 HETATM 63 H UNK 0 1.107 -3.519 -1.893 0.00 0.00 H+0 HETATM 64 H UNK 0 0.548 -4.550 -0.057 0.00 0.00 H+0 HETATM 65 H UNK 0 3.753 -3.270 -2.147 0.00 0.00 H+0 HETATM 66 H UNK 0 4.066 -2.883 -0.432 0.00 0.00 H+0 HETATM 67 H UNK 0 3.771 1.673 2.207 0.00 0.00 H+0 HETATM 68 H UNK 0 5.762 3.344 1.802 0.00 0.00 H+0 HETATM 69 H UNK 0 8.248 3.221 2.030 0.00 0.00 H+0 HETATM 70 H UNK 0 8.092 -0.823 1.032 0.00 0.00 H+0 HETATM 71 H UNK 0 4.697 3.267 0.070 0.00 0.00 H+0 HETATM 72 H UNK 0 2.271 2.820 1.437 0.00 0.00 H+0 CONECT 1 2 42 43 44 CONECT 2 1 3 CONECT 3 2 4 40 45 CONECT 4 3 5 30 46 CONECT 5 4 6 27 47 CONECT 6 5 7 CONECT 7 6 8 25 48 CONECT 8 7 9 CONECT 9 8 10 22 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 49 CONECT 13 12 14 20 50 CONECT 14 13 15 51 52 CONECT 15 14 16 CONECT 16 15 17 53 54 CONECT 17 16 18 19 55 CONECT 18 17 56 57 58 CONECT 19 17 20 59 CONECT 20 19 21 13 CONECT 21 20 CONECT 22 9 23 60 CONECT 23 22 24 25 61 CONECT 24 23 62 CONECT 25 23 26 7 63 CONECT 26 25 64 CONECT 27 5 28 29 CONECT 28 27 65 66 CONECT 29 27 CONECT 30 4 31 CONECT 31 30 32 40 67 CONECT 32 31 33 38 CONECT 33 32 34 68 CONECT 34 33 35 69 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 70 CONECT 38 37 39 32 CONECT 39 38 CONECT 40 31 41 3 71 CONECT 41 40 72 CONECT 42 1 CONECT 43 1 CONECT 44 1 CONECT 45 3 CONECT 46 4 CONECT 47 5 CONECT 48 7 CONECT 49 12 CONECT 50 13 CONECT 51 14 CONECT 52 14 CONECT 53 16 CONECT 54 16 CONECT 55 17 CONECT 56 18 CONECT 57 18 CONECT 58 18 CONECT 59 19 CONECT 60 22 CONECT 61 23 CONECT 62 24 CONECT 63 25 CONECT 64 26 CONECT 65 28 CONECT 66 28 CONECT 67 31 CONECT 68 33 CONECT 69 34 CONECT 70 37 CONECT 71 40 CONECT 72 41 MASTER 0 0 0 0 0 0 0 0 72 0 150 0 END