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 -6.252 -1.145 -0.933 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.816 0.098 -1.072 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.743 0.502 -2.006 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.277 0.244 -3.433 0.00 0.00 C+0 HETATM 5 C UNK 0 -4.555 1.998 -1.932 0.00 0.00 C+0 HETATM 6 N UNK 0 -3.524 -0.216 -1.901 0.00 0.00 N+0 HETATM 7 C UNK 0 -2.813 -0.155 -0.682 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.153 -1.468 -0.392 0.00 0.00 C+0 HETATM 9 C UNK 0 -3.046 -2.624 -0.274 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.354 -3.410 -1.360 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.189 -4.498 -1.215 0.00 0.00 C+0 HETATM 12 C UNK 0 -4.721 -4.807 0.018 0.00 0.00 C+0 HETATM 13 C UNK 0 -4.431 -4.043 1.109 0.00 0.00 C+0 HETATM 14 C UNK 0 -3.588 -2.951 0.946 0.00 0.00 C+0 HETATM 15 C UNK 0 -1.686 0.840 -0.814 0.00 0.00 C+0 HETATM 16 O UNK 0 -1.615 1.448 -1.912 0.00 0.00 O+0 HETATM 17 N UNK 0 -0.790 1.048 0.247 0.00 0.00 N+0 HETATM 18 C UNK 0 0.347 2.028 0.182 0.00 0.00 C+0 HETATM 19 C UNK 0 0.135 3.044 1.184 0.00 0.00 C+0 HETATM 20 C UNK 0 1.045 4.186 1.341 0.00 0.00 C+0 HETATM 21 C UNK 0 1.963 4.395 2.328 0.00 0.00 C+0 HETATM 22 C UNK 0 2.789 5.497 2.367 0.00 0.00 C+0 HETATM 23 C UNK 0 2.730 6.489 1.374 0.00 0.00 C+0 HETATM 24 C UNK 0 1.816 6.294 0.383 0.00 0.00 C+0 HETATM 25 C UNK 0 1.004 5.200 0.352 0.00 0.00 C+0 HETATM 26 C UNK 0 1.490 1.247 -0.123 0.00 0.00 C+0 HETATM 27 O UNK 0 1.192 0.370 -1.110 0.00 0.00 O+0 HETATM 28 N UNK 0 2.813 1.085 0.259 0.00 0.00 N+0 HETATM 29 C UNK 0 3.508 1.732 1.340 0.00 0.00 C+0 HETATM 30 C UNK 0 4.769 0.868 1.529 0.00 0.00 C+0 HETATM 31 C UNK 0 5.126 0.691 0.055 0.00 0.00 C+0 HETATM 32 C UNK 0 3.791 0.209 -0.452 0.00 0.00 C+0 HETATM 33 C UNK 0 3.614 -1.221 -0.064 0.00 0.00 C+0 HETATM 34 N UNK 0 4.489 -2.120 0.308 0.00 0.00 N+0 HETATM 35 C UNK 0 4.133 -3.333 0.592 0.00 0.00 C+0 HETATM 36 C UNK 0 5.084 -4.397 1.026 0.00 0.00 C+0 HETATM 37 O UNK 0 4.734 -5.551 1.284 0.00 0.00 O+0 HETATM 38 O UNK 0 6.421 -4.064 1.145 0.00 0.00 O+0 HETATM 39 C UNK 0 7.438 -4.950 1.545 0.00 0.00 C+0 HETATM 40 C UNK 0 2.795 -3.631 0.483 0.00 0.00 C+0 HETATM 41 S UNK 0 2.144 -2.139 -0.020 0.00 0.00 S+0 HETATM 42 H UNK 0 -5.827 -1.948 -1.516 0.00 0.00 H+0 HETATM 43 H UNK 0 -7.037 -1.357 -0.234 0.00 0.00 H+0 HETATM 44 H UNK 0 -6.299 0.870 -0.446 0.00 0.00 H+0 HETATM 45 H UNK 0 -4.397 0.054 -4.074 0.00 0.00 H+0 HETATM 46 H UNK 0 -5.778 1.152 -3.836 0.00 0.00 H+0 HETATM 47 H UNK 0 -5.929 -0.641 -3.417 0.00 0.00 H+0 HETATM 48 H UNK 0 -4.028 2.330 -2.843 0.00 0.00 H+0 HETATM 49 H UNK 0 -4.050 2.363 -1.042 0.00 0.00 H+0 HETATM 50 H UNK 0 -5.579 2.453 -2.002 0.00 0.00 H+0 HETATM 51 H UNK 0 -2.942 -0.087 -2.735 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.432 0.201 0.179 0.00 0.00 H+0 HETATM 53 H UNK 0 -1.442 -1.413 0.462 0.00 0.00 H+0 HETATM 54 H UNK 0 -1.483 -1.677 -1.281 0.00 0.00 H+0 HETATM 55 H UNK 0 -2.968 -3.220 -2.354 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.424 -5.111 -2.076 0.00 0.00 H+0 HETATM 57 H UNK 0 -5.390 -5.680 0.133 0.00 0.00 H+0 HETATM 58 H UNK 0 -4.864 -4.314 2.060 0.00 0.00 H+0 HETATM 59 H UNK 0 -3.394 -2.381 1.849 0.00 0.00 H+0 HETATM 60 H UNK 0 -0.874 0.531 1.126 0.00 0.00 H+0 HETATM 61 H UNK 0 0.079 2.575 -0.836 0.00 0.00 H+0 HETATM 62 H UNK 0 -0.118 2.605 2.212 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.878 3.542 0.949 0.00 0.00 H+0 HETATM 64 H UNK 0 2.010 3.643 3.123 0.00 0.00 H+0 HETATM 65 H UNK 0 3.498 5.634 3.151 0.00 0.00 H+0 HETATM 66 H UNK 0 3.362 7.345 1.392 0.00 0.00 H+0 HETATM 67 H UNK 0 1.752 7.062 -0.409 0.00 0.00 H+0 HETATM 68 H UNK 0 0.287 5.056 -0.432 0.00 0.00 H+0 HETATM 69 H UNK 0 3.919 2.730 1.090 0.00 0.00 H+0 HETATM 70 H UNK 0 2.918 1.703 2.285 0.00 0.00 H+0 HETATM 71 H UNK 0 5.525 1.438 2.070 0.00 0.00 H+0 HETATM 72 H UNK 0 4.486 -0.083 2.016 0.00 0.00 H+0 HETATM 73 H UNK 0 5.927 -0.030 -0.091 0.00 0.00 H+0 HETATM 74 H UNK 0 5.367 1.710 -0.321 0.00 0.00 H+0 HETATM 75 H UNK 0 3.676 0.308 -1.546 0.00 0.00 H+0 HETATM 76 H UNK 0 8.315 -4.861 0.856 0.00 0.00 H+0 HETATM 77 H UNK 0 7.824 -4.700 2.573 0.00 0.00 H+0 HETATM 78 H UNK 0 7.075 -5.992 1.582 0.00 0.00 H+0 HETATM 79 H UNK 0 2.296 -4.599 0.679 0.00 0.00 H+0 CONECT 1 2 42 43 CONECT 2 1 3 44 CONECT 3 2 4 5 6 CONECT 4 3 45 46 47 CONECT 5 3 48 49 50 CONECT 6 3 7 51 CONECT 7 6 8 15 52 CONECT 8 7 9 53 54 CONECT 9 8 10 14 CONECT 10 9 11 55 CONECT 11 10 12 56 CONECT 12 11 13 57 CONECT 13 12 14 58 CONECT 14 13 9 59 CONECT 15 7 16 17 CONECT 16 15 CONECT 17 15 18 60 CONECT 18 17 19 26 61 CONECT 19 18 20 62 63 CONECT 20 19 21 25 CONECT 21 20 22 64 CONECT 22 21 23 65 CONECT 23 22 24 66 CONECT 24 23 25 67 CONECT 25 24 20 68 CONECT 26 18 27 28 CONECT 27 26 CONECT 28 26 29 32 CONECT 29 28 30 69 70 CONECT 30 29 31 71 72 CONECT 31 30 32 73 74 CONECT 32 31 33 28 75 CONECT 33 32 34 41 CONECT 34 33 35 CONECT 35 34 36 40 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 76 77 78 CONECT 40 35 41 79 CONECT 41 40 33 CONECT 42 1 CONECT 43 1 CONECT 44 2 CONECT 45 4 CONECT 46 4 CONECT 47 4 CONECT 48 5 CONECT 49 5 CONECT 50 5 CONECT 51 6 CONECT 52 7 CONECT 53 8 CONECT 54 8 CONECT 55 10 CONECT 56 11 CONECT 57 12 CONECT 58 13 CONECT 59 14 CONECT 60 17 CONECT 61 18 CONECT 62 19 CONECT 63 19 CONECT 64 21 CONECT 65 22 CONECT 66 23 CONECT 67 24 CONECT 68 25 CONECT 69 29 CONECT 70 29 CONECT 71 30 CONECT 72 30 CONECT 73 31 CONECT 74 31 CONECT 75 32 CONECT 76 39 CONECT 77 39 CONECT 78 39 CONECT 79 40 MASTER 0 0 0 0 0 0 0 0 79 0 164 0 END