HEADER PROTEIN 29-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 29-APR-22 0 HETATM 1 C UNK 0 -1.733 14.158 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.260 15.623 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 0.245 15.947 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 1.278 14.805 0.000 0.00 0.00 C+0 HETATM 5 N UNK 0 2.784 15.129 0.000 0.00 0.00 N+0 HETATM 6 C UNK 0 3.968 13.930 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 3.302 12.541 0.000 0.00 0.00 O+0 HETATM 8 C UNK 0 5.500 13.772 0.000 0.00 0.00 C+0 HETATM 9 N UNK 0 5.824 12.267 0.000 0.00 0.00 N+0 HETATM 10 C UNK 0 4.492 11.494 0.000 0.00 0.00 C+0 HETATM 11 O UNK 0 3.065 12.073 0.000 0.00 0.00 O+0 HETATM 12 C UNK 0 3.906 9.914 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 2.400 9.590 0.000 0.00 0.00 C+0 HETATM 14 O UNK 0 1.928 8.124 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 0.422 7.800 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 -0.611 8.942 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 -0.050 6.334 0.000 0.00 0.00 C+0 HETATM 18 N UNK 0 -1.556 6.011 0.000 0.00 0.00 N+0 HETATM 19 C UNK 0 -2.589 7.153 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -3.617 6.006 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 -2.117 8.618 0.000 0.00 0.00 C+0 HETATM 22 N UNK 0 -3.150 9.760 0.000 0.00 0.00 N+0 HETATM 23 C UNK 0 -2.677 11.226 0.000 0.00 0.00 C+0 HETATM 24 O UNK 0 -4.185 11.543 0.000 0.00 0.00 O+0 HETATM 25 C UNK 0 -1.172 11.550 0.000 0.00 0.00 C+0 HETATM 26 N UNK 0 -0.699 13.016 0.000 0.00 0.00 N+0 HETATM 27 C UNK 0 0.806 13.339 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 1.839 12.197 0.000 0.00 0.00 O+0 HETATM 29 C UNK 0 -2.205 12.692 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -3.711 12.368 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -4.744 13.510 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -3.113 13.936 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -4.655 9.437 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.622 8.295 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 -4.095 6.829 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 -3.061 5.687 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 -3.534 4.221 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -5.039 3.897 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 -6.072 5.039 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -5.600 6.505 0.000 0.00 0.00 C+0 HETATM 41 Br UNK 0 -7.578 4.715 0.000 0.00 0.00 Br+0 HETATM 42 O UNK 0 -5.512 2.432 0.000 0.00 0.00 O+0 HETATM 43 C UNK 0 -7.017 2.108 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 0.983 5.192 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 0.511 3.727 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 2.489 5.516 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 1.367 10.732 0.000 0.00 0.00 C+0 HETATM 48 N UNK 0 4.914 8.749 0.000 0.00 0.00 N+0 HETATM 49 C UNK 0 6.426 9.040 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 6.930 10.496 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 7.434 7.876 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 6.930 6.421 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 5.418 6.130 0.000 0.00 0.00 C+0 HETATM 54 S UNK 0 4.914 4.675 0.000 0.00 0.00 S+0 HETATM 55 O UNK 0 5.922 3.511 0.000 0.00 0.00 O+0 HETATM 56 C UNK 0 3.402 4.384 0.000 0.00 0.00 C+0 HETATM 57 N UNK 0 8.947 8.167 0.000 0.00 0.00 N+0 HETATM 58 C UNK 0 9.955 7.003 0.000 0.00 0.00 C+0 HETATM 59 O UNK 0 9.451 5.548 0.000 0.00 0.00 O+0 HETATM 60 C UNK 0 11.467 7.294 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 12.475 6.130 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 13.987 6.421 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 6.528 14.919 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 8.035 14.603 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 9.062 15.750 0.000 0.00 0.00 C+0 HETATM 66 N UNK 0 10.569 15.433 0.000 0.00 0.00 N+0 HETATM 67 C UNK 0 11.597 16.580 0.000 0.00 0.00 C+0 HETATM 68 N UNK 0 13.104 16.263 0.000 0.00 0.00 N+0 HETATM 69 N UNK 0 11.118 18.043 0.000 0.00 0.00 N+0 HETATM 70 O UNK 0 -3.141 14.781 0.000 0.00 0.00 O+0 CONECT 1 2 26 70 CONECT 2 1 3 CONECT 3 2 4 CONECT 4 3 5 27 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 63 CONECT 9 8 10 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 48 CONECT 13 12 14 47 CONECT 14 13 15 CONECT 15 14 16 17 CONECT 16 15 CONECT 17 15 18 44 CONECT 18 17 19 CONECT 19 18 20 21 CONECT 20 19 CONECT 21 19 22 34 CONECT 22 21 23 33 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 29 CONECT 26 25 1 27 CONECT 27 26 4 28 CONECT 28 27 CONECT 29 25 30 32 CONECT 30 29 31 CONECT 31 30 CONECT 32 29 CONECT 33 22 CONECT 34 21 35 CONECT 35 34 36 40 CONECT 36 35 37 CONECT 37 36 38 CONECT 38 37 39 42 CONECT 39 38 40 41 CONECT 40 39 35 CONECT 41 39 CONECT 42 38 43 CONECT 43 42 CONECT 44 17 45 46 CONECT 45 44 CONECT 46 44 CONECT 47 13 CONECT 48 12 49 CONECT 49 48 50 51 CONECT 50 49 CONECT 51 49 52 57 CONECT 52 51 53 CONECT 53 52 54 CONECT 54 53 55 56 CONECT 55 54 CONECT 56 54 CONECT 57 51 58 CONECT 58 57 59 60 CONECT 59 58 CONECT 60 58 61 CONECT 61 60 62 CONECT 62 61 CONECT 63 8 64 CONECT 64 63 65 CONECT 65 64 66 CONECT 66 65 67 CONECT 67 66 68 69 CONECT 68 67 CONECT 69 67 CONECT 70 1 MASTER 0 0 0 0 0 0 0 0 70 0 144 0 END