HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 565 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 2.161 20.369 0.000 0.00 0.00 S+0 HETATM 2 S UNK 0 25.050 35.162 0.000 0.00 0.00 S+0 HETATM 3 O UNK 0 13.494 23.323 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 40.519 7.720 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 16.226 24.900 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 40.519 10.874 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 22.198 15.196 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 29.128 11.195 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 19.888 13.862 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 29.128 8.527 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 12.243 22.483 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 37.750 1.597 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 9.576 20.943 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 40.417 3.137 0.000 0.00 0.00 O+0 HETATM 15 O UNK 0 2.161 21.909 0.000 0.00 0.00 O-1 HETATM 16 O UNK 0 25.050 36.702 0.000 0.00 0.00 O-1 HETATM 17 O UNK 0 3.701 20.369 0.000 0.00 0.00 O+0 HETATM 18 O UNK 0 0.621 20.369 0.000 0.00 0.00 O+0 HETATM 19 O UNK 0 26.590 35.162 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 23.510 35.162 0.000 0.00 0.00 O+0 HETATM 21 N UNK 0 17.578 17.863 0.000 0.00 0.00 N+1 HETATM 22 N UNK 0 33.748 8.527 0.000 0.00 0.00 N+1 HETATM 23 C UNK 0 16.244 18.633 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 35.082 7.757 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 18.912 18.633 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 33.748 10.067 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 18.348 16.529 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 32.208 8.527 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 16.244 20.173 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 36.416 8.527 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 18.912 20.173 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 35.082 10.837 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 16.808 16.529 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 32.978 7.193 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 14.911 17.863 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 35.082 6.217 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 17.578 20.943 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 36.416 10.067 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 19.888 16.529 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 31.438 9.861 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 14.843 20.954 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 37.793 7.704 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 13.577 18.633 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 36.416 5.447 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 17.603 22.547 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 37.793 10.891 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 14.830 22.558 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 39.188 8.495 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 16.220 23.360 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 39.188 10.099 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 20.658 15.196 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 29.898 9.861 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 13.577 20.173 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 36.416 3.907 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 12.243 17.863 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 37.750 6.217 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 12.243 20.943 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 37.750 3.137 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 10.910 18.633 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 39.083 5.447 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 10.910 20.173 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 39.083 3.907 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 22.968 13.862 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 27.588 11.195 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 24.508 13.862 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 26.818 12.528 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 13.488 24.863 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 41.855 8.485 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 25.278 12.528 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 17.562 25.665 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 40.513 12.414 0.000 0.00 0.00 C+0 HETATM 72 C UNK 0 10.910 23.253 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 36.416 0.827 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 8.242 20.173 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 40.417 1.597 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 2.161 18.829 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 25.050 33.622 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 3.494 18.059 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 26.383 32.852 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 0.827 18.059 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 23.716 32.852 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 3.494 16.519 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 26.383 31.312 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 0.827 16.519 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 23.716 31.312 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 2.161 15.749 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 25.050 30.542 0.000 0.00 0.00 C+0 CONECT 1 15 17 18 76 CONECT 2 16 19 20 77 CONECT 3 47 67 CONECT 4 48 68 CONECT 5 49 70 CONECT 6 50 71 CONECT 7 51 63 CONECT 8 52 64 CONECT 9 51 CONECT 10 52 CONECT 11 57 72 CONECT 12 58 73 CONECT 13 61 74 CONECT 14 62 75 CONECT 15 1 CONECT 16 2 CONECT 17 1 CONECT 18 1 CONECT 19 2 CONECT 20 2 CONECT 21 23 25 27 33 CONECT 22 24 26 28 34 CONECT 23 21 29 35 CONECT 24 22 30 36 CONECT 25 21 31 CONECT 26 22 32 CONECT 27 21 39 CONECT 28 22 40 CONECT 29 23 37 41 CONECT 30 24 38 42 CONECT 31 25 37 CONECT 32 26 38 CONECT 33 21 CONECT 34 22 CONECT 35 23 43 CONECT 36 24 44 CONECT 37 29 31 45 CONECT 38 30 32 46 CONECT 39 27 51 CONECT 40 28 52 CONECT 41 29 47 CONECT 42 30 48 CONECT 43 35 53 55 CONECT 44 36 54 56 CONECT 45 37 49 CONECT 46 38 50 CONECT 47 3 41 49 CONECT 48 4 42 50 CONECT 49 5 45 47 CONECT 50 6 46 48 CONECT 51 7 9 39 CONECT 52 8 10 40 CONECT 53 43 57 CONECT 54 44 58 CONECT 55 43 59 CONECT 56 44 60 CONECT 57 11 53 61 CONECT 58 12 54 62 CONECT 59 55 61 CONECT 60 56 62 CONECT 61 13 57 59 CONECT 62 14 58 60 CONECT 63 7 65 CONECT 64 8 66 CONECT 65 63 69 CONECT 66 64 69 CONECT 67 3 CONECT 68 4 CONECT 69 65 66 CONECT 70 5 CONECT 71 6 CONECT 72 11 CONECT 73 12 CONECT 74 13 CONECT 75 14 CONECT 76 1 78 80 CONECT 77 2 79 81 CONECT 78 76 82 CONECT 79 77 83 CONECT 80 76 84 CONECT 81 77 85 CONECT 82 78 86 CONECT 83 79 87 CONECT 84 80 86 CONECT 85 81 87 CONECT 86 82 84 CONECT 87 83 85 MASTER 0 0 0 0 0 0 0 0 87 0 184 0 END