HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 C UNK 0 37.696 -29.576 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 36.917 -30.905 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 37.680 -32.243 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 39.223 -32.244 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 39.994 -30.915 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 39.239 -29.585 0.000 0.00 0.00 C+0 HETATM 7 N UNK 0 39.717 -28.107 0.000 0.00 0.00 N+0 HETATM 8 C UNK 0 38.473 -27.207 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 37.221 -28.107 0.000 0.00 0.00 C+0 HETATM 10 N UNK 0 29.230 -20.388 0.000 0.00 0.00 N+0 HETATM 11 C UNK 0 30.567 -21.159 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 30.567 -22.710 0.000 0.00 0.00 C+0 HETATM 13 O UNK 0 29.226 -23.481 0.000 0.00 0.00 O+0 HETATM 14 C UNK 0 39.920 -23.483 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 39.918 -25.017 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 38.580 -22.710 0.000 0.00 0.00 O+0 HETATM 17 N UNK 0 38.576 -25.802 0.000 0.00 0.00 N+0 HETATM 18 C UNK 0 37.236 -25.021 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 35.894 -25.799 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 37.238 -23.479 0.000 0.00 0.00 O+0 HETATM 21 N UNK 0 34.562 -25.018 0.000 0.00 0.00 N+0 HETATM 22 C UNK 0 33.220 -25.796 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 31.880 -25.015 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 30.538 -25.792 0.000 0.00 0.00 C+0 HETATM 25 N UNK 0 31.882 -23.473 0.000 0.00 0.00 N+0 HETATM 26 O UNK 0 33.218 -27.338 0.000 0.00 0.00 O+0 HETATM 27 C UNK 0 30.536 -27.335 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 27.899 -21.161 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 26.565 -20.392 0.000 0.00 0.00 C+0 HETATM 30 O UNK 0 27.901 -22.695 0.000 0.00 0.00 O+0 HETATM 31 N UNK 0 26.563 -18.850 0.000 0.00 0.00 N+0 HETATM 32 C UNK 0 25.233 -21.165 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 29.208 -28.099 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 29.206 -29.633 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 30.538 -30.406 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 31.871 -29.636 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 31.873 -28.102 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 35.890 -27.341 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 41.252 -25.785 0.000 0.00 0.00 C+0 HETATM 40 N UNK 0 41.253 -22.711 0.000 0.00 0.00 N+0 HETATM 41 C UNK 0 42.584 -25.011 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 43.918 -25.780 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 45.249 -25.014 0.000 0.00 0.00 C+0 HETATM 44 N UNK 0 46.584 -25.775 0.000 0.00 0.00 N+0 HETATM 45 C UNK 0 41.240 -21.175 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 39.901 -20.416 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 42.566 -20.393 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 43.905 -21.153 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 42.553 -18.851 0.000 0.00 0.00 C+0 HETATM 50 N UNK 0 38.574 -21.190 0.000 0.00 0.00 N+0 HETATM 51 O UNK 0 39.887 -18.874 0.000 0.00 0.00 O+0 HETATM 52 C UNK 0 37.235 -20.430 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 35.909 -21.213 0.000 0.00 0.00 C+0 HETATM 54 S UNK 0 34.570 -20.453 0.000 0.00 0.00 S+0 HETATM 55 C UNK 0 31.900 -20.387 0.000 0.00 0.00 C+0 HETATM 56 S UNK 0 33.233 -21.157 0.000 0.00 0.00 S+0 HETATM 57 C UNK 0 37.222 -18.896 0.000 0.00 0.00 C+0 HETATM 58 O UNK 0 38.548 -18.114 0.000 0.00 0.00 O+0 HETATM 59 N UNK 0 35.883 -18.137 0.000 0.00 0.00 N+0 HETATM 60 C UNK 0 35.870 -16.594 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 34.530 -15.843 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 37.196 -15.820 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 34.517 -14.301 0.000 0.00 0.00 O+0 HETATM 64 N UNK 0 33.204 -16.617 0.000 0.00 0.00 N+0 HETATM 65 C UNK 0 25.235 -22.699 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 23.904 -23.461 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 23.906 -25.003 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 25.240 -25.765 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 26.572 -25.000 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 26.570 -23.458 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 37.200 -14.196 0.000 0.00 0.00 C+0 HETATM 72 N UNK 0 38.460 -13.163 0.000 0.00 0.00 N+0 HETATM 73 C UNK 0 37.866 -11.646 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 36.321 -11.582 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 35.828 -13.236 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 38.668 -10.227 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 37.841 -8.828 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 36.296 -8.838 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 35.494 -10.256 0.000 0.00 0.00 C+0 HETATM 80 O UNK 0 30.535 -31.916 0.000 0.00 0.00 O+0 CONECT 1 9 2 6 CONECT 2 1 3 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 CONECT 6 5 1 7 CONECT 7 6 8 CONECT 8 7 9 CONECT 9 1 38 8 CONECT 10 28 11 CONECT 11 55 12 10 CONECT 12 11 13 25 CONECT 13 12 CONECT 14 15 16 40 CONECT 15 14 39 17 CONECT 16 14 CONECT 17 15 18 CONECT 18 17 19 20 CONECT 19 38 18 21 CONECT 20 18 CONECT 21 19 22 CONECT 22 21 23 26 CONECT 23 22 24 25 CONECT 24 23 27 CONECT 25 12 23 CONECT 26 22 CONECT 27 33 37 24 CONECT 28 10 29 30 CONECT 29 28 31 32 CONECT 30 28 CONECT 31 29 CONECT 32 29 65 CONECT 33 27 34 CONECT 34 33 35 CONECT 35 34 36 80 CONECT 36 35 37 CONECT 37 36 27 CONECT 38 19 9 CONECT 39 15 41 CONECT 40 14 45 CONECT 41 39 42 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 43 CONECT 45 40 46 47 CONECT 46 50 51 45 CONECT 47 48 49 45 CONECT 48 47 CONECT 49 47 CONECT 50 46 52 CONECT 51 46 CONECT 52 50 53 57 CONECT 53 52 54 CONECT 54 53 56 CONECT 55 11 56 CONECT 56 55 54 CONECT 57 52 58 59 CONECT 58 57 CONECT 59 57 60 CONECT 60 59 61 62 CONECT 61 60 63 64 CONECT 62 60 71 CONECT 63 61 CONECT 64 61 CONECT 65 32 66 70 CONECT 66 65 67 CONECT 67 66 68 CONECT 68 67 69 CONECT 69 68 70 CONECT 70 69 65 CONECT 71 62 72 75 CONECT 72 71 73 CONECT 73 72 74 76 CONECT 74 73 75 79 CONECT 75 74 71 CONECT 76 73 77 CONECT 77 76 78 CONECT 78 77 79 CONECT 79 78 74 CONECT 80 35 MASTER 0 0 0 0 0 0 0 0 80 0 172 0 END