HEADER PROTEIN 26-OCT-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 26-OCT-17 0 HETATM 1 H UNK 0 5.198 -0.237 0.000 0.00 0.00 H+0 HETATM 2 N UNK 0 5.198 1.303 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 6.531 2.073 0.000 0.00 0.00 C+0 HETATM 4 O UNK 0 6.531 3.613 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 7.865 1.303 0.000 0.00 0.00 O+0 HETATM 6 C UNK 0 9.199 2.073 0.000 0.00 0.00 C+0 HETATM 7 H UNK 0 9.279 0.535 0.000 0.00 0.00 H+0 HETATM 8 C UNK 0 9.360 3.604 0.000 0.00 0.00 C+0 HETATM 9 H UNK 0 8.833 5.052 0.000 0.00 0.00 H+0 HETATM 10 H UNK 0 7.866 3.977 0.000 0.00 0.00 H+0 HETATM 11 C UNK 0 10.866 3.925 0.000 0.00 0.00 C+0 HETATM 12 H UNK 0 12.080 4.873 0.000 0.00 0.00 H+0 HETATM 13 H UNK 0 10.759 5.461 0.000 0.00 0.00 H+0 HETATM 14 C UNK 0 11.636 2.591 0.000 0.00 0.00 C+0 HETATM 15 H UNK 0 12.188 1.153 0.000 0.00 0.00 H+0 HETATM 16 O UNK 0 13.168 2.430 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 10.606 1.446 0.000 0.00 0.00 C+0 HETATM 18 H UNK 0 10.926 -0.060 0.000 0.00 0.00 H+0 HETATM 19 H UNK 0 10.285 2.953 0.000 0.00 0.00 H+0 HETATM 20 C UNK 0 3.864 2.073 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 2.530 1.303 0.000 0.00 0.00 C+0 HETATM 22 H UNK 0 2.530 -0.237 0.000 0.00 0.00 H+0 HETATM 23 C UNK 0 1.197 2.073 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 1.197 3.613 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 2.530 4.383 0.000 0.00 0.00 C+0 HETATM 26 H UNK 0 2.530 5.923 0.000 0.00 0.00 H+0 HETATM 27 C UNK 0 3.864 3.613 0.000 0.00 0.00 C+0 HETATM 28 H UNK 0 5.198 4.383 0.000 0.00 0.00 H+0 HETATM 29 N UNK 0 -0.268 4.089 0.000 0.00 0.00 N+0 HETATM 30 C UNK 0 -1.173 2.843 0.000 0.00 0.00 C+0 HETATM 31 H UNK 0 -2.713 2.843 0.000 0.00 0.00 H+0 HETATM 32 C UNK 0 -0.268 1.597 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -0.744 0.132 0.000 0.00 0.00 C+0 HETATM 34 H UNK 0 -0.337 -1.353 0.000 0.00 0.00 H+0 HETATM 35 H UNK 0 0.691 -0.428 0.000 0.00 0.00 H+0 HETATM 36 C UNK 0 -2.250 -0.188 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 -2.726 -1.652 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 -1.696 -2.797 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -2.171 -4.262 0.000 0.00 0.00 C+0 HETATM 40 H UNK 0 -3.636 -3.786 0.000 0.00 0.00 H+0 HETATM 41 H UNK 0 -2.647 -5.726 0.000 0.00 0.00 H+0 HETATM 42 H UNK 0 -0.707 -4.737 0.000 0.00 0.00 H+0 HETATM 43 C UNK 0 -4.232 -1.973 0.000 0.00 0.00 C+0 HETATM 44 H UNK 0 -4.708 -3.437 0.000 0.00 0.00 H+0 HETATM 45 C UNK 0 -5.263 -0.828 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -4.787 0.636 0.000 0.00 0.00 C+0 HETATM 47 H UNK 0 -5.817 1.781 0.000 0.00 0.00 H+0 HETATM 48 C UNK 0 -3.281 0.957 0.000 0.00 0.00 C+0 HETATM 49 H UNK 0 -2.805 2.421 0.000 0.00 0.00 H+0 HETATM 50 C UNK 0 -6.769 -1.148 0.000 0.00 0.00 C+0 HETATM 51 O UNK 0 -7.800 -0.004 0.000 0.00 0.00 O+0 HETATM 52 N UNK 0 -7.245 -2.613 0.000 0.00 0.00 N+0 HETATM 53 H UNK 0 -6.215 -3.757 0.000 0.00 0.00 H+0 HETATM 54 S UNK 0 -8.751 -2.933 0.000 0.00 0.00 S+0 HETATM 55 O UNK 0 -9.072 -1.427 0.000 0.00 0.00 O+0 HETATM 56 O UNK 0 -8.431 -4.440 0.000 0.00 0.00 O+0 HETATM 57 C UNK 0 -10.258 -3.253 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 -10.734 -4.718 0.000 0.00 0.00 C+0 HETATM 59 H UNK 0 -9.703 -5.862 0.000 0.00 0.00 H+0 HETATM 60 C UNK 0 -12.240 -5.038 0.000 0.00 0.00 C+0 HETATM 61 H UNK 0 -12.716 -6.503 0.000 0.00 0.00 H+0 HETATM 62 C UNK 0 -13.270 -3.894 0.000 0.00 0.00 C+0 HETATM 63 H UNK 0 -14.777 -4.214 0.000 0.00 0.00 H+0 HETATM 64 C UNK 0 -12.795 -2.429 0.000 0.00 0.00 C+0 HETATM 65 H UNK 0 -13.825 -1.285 0.000 0.00 0.00 H+0 HETATM 66 C UNK 0 -11.288 -2.109 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 -10.812 -0.644 0.000 0.00 0.00 C+0 HETATM 68 H UNK 0 -9.348 -1.120 0.000 0.00 0.00 H+0 HETATM 69 H UNK 0 -10.336 0.820 0.000 0.00 0.00 H+0 HETATM 70 H UNK 0 -12.277 -0.168 0.000 0.00 0.00 H+0 HETATM 71 C UNK 0 -0.744 5.553 0.000 0.00 0.00 C+0 HETATM 72 H UNK 0 0.721 6.029 0.000 0.00 0.00 H+0 HETATM 73 H UNK 0 -1.220 7.018 0.000 0.00 0.00 H+0 HETATM 74 H UNK 0 -2.208 5.077 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 20 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 CONECT 6 5 7 8 17 CONECT 7 6 CONECT 8 6 9 10 11 CONECT 9 8 CONECT 10 8 CONECT 11 8 12 13 14 CONECT 12 11 CONECT 13 11 CONECT 14 11 15 16 17 CONECT 15 14 CONECT 16 14 CONECT 17 14 6 18 19 CONECT 18 17 CONECT 19 17 CONECT 20 2 21 27 CONECT 21 20 22 23 CONECT 22 21 CONECT 23 21 24 32 CONECT 24 23 25 29 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 20 28 CONECT 28 27 CONECT 29 24 30 71 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 23 33 CONECT 33 32 34 35 36 CONECT 34 33 CONECT 35 33 CONECT 36 33 37 48 CONECT 37 36 38 43 CONECT 38 37 39 CONECT 39 38 40 41 42 CONECT 40 39 CONECT 41 39 CONECT 42 39 CONECT 43 37 44 45 CONECT 44 43 CONECT 45 43 46 50 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 36 49 CONECT 49 48 CONECT 50 45 51 52 CONECT 51 50 CONECT 52 50 53 54 CONECT 53 52 CONECT 54 52 55 56 57 CONECT 55 54 CONECT 56 54 CONECT 57 54 58 66 CONECT 58 57 59 60 CONECT 59 58 CONECT 60 58 61 62 CONECT 61 60 CONECT 62 60 63 64 CONECT 63 62 CONECT 64 62 65 66 CONECT 65 64 CONECT 66 64 57 67 CONECT 67 66 68 69 70 CONECT 68 67 CONECT 69 67 CONECT 70 67 CONECT 71 29 72 73 74 CONECT 72 71 CONECT 73 71 CONECT 74 71 MASTER 0 0 0 0 0 0 0 0 74 0 156 0 END