HEADER PROTEIN 24-FEB-12 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-FEB-12 0 HETATM 1 C UNK 0 22.577 -26.857 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 22.577 -28.397 0.000 0.00 0.00 C+0 HETATM 3 O UNK 0 21.244 -26.087 0.000 0.00 0.00 O+0 HETATM 4 C UNK 0 21.244 -29.167 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 19.910 -26.857 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 19.910 -28.397 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 18.576 -29.167 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 21.244 -30.707 0.000 0.00 0.00 O+0 HETATM 9 N UNK 0 23.911 -29.167 0.000 0.00 0.00 N+0 HETATM 10 O UNK 0 23.911 -26.087 0.000 0.00 0.00 O+0 HETATM 11 P UNK 0 25.245 -26.857 0.000 0.00 0.00 P+0 HETATM 12 O UNK 0 26.015 -25.523 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 26.578 -27.627 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 24.475 -28.191 0.000 0.00 0.00 O+0 HETATM 15 P UNK 0 27.912 -26.857 0.000 0.00 0.00 P+0 HETATM 16 O UNK 0 28.682 -28.191 0.000 0.00 0.00 O+0 HETATM 17 O UNK 0 27.142 -25.523 0.000 0.00 0.00 O+0 HETATM 18 O UNK 0 29.246 -26.087 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 18.576 -26.087 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 18.576 -24.547 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 23.911 -30.707 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 25.245 -31.477 0.000 0.00 0.00 C+0 HETATM 23 O UNK 0 22.577 -31.477 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 17.243 -29.937 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 17.243 -31.477 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 15.909 -29.167 0.000 0.00 0.00 O+0 HETATM 27 C UNK 0 15.909 -32.247 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 14.575 -29.937 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 14.575 -31.477 0.000 0.00 0.00 C+0 HETATM 30 O UNK 0 13.241 -32.247 0.000 0.00 0.00 O+0 HETATM 31 O UNK 0 15.909 -33.787 0.000 0.00 0.00 O+0 HETATM 32 N UNK 0 18.576 -32.247 0.000 0.00 0.00 N+0 HETATM 33 C UNK 0 13.241 -29.167 0.000 0.00 0.00 C+0 HETATM 34 O UNK 0 13.241 -27.627 0.000 0.00 0.00 O+0 HETATM 35 C UNK 0 18.576 -33.787 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 17.243 -34.557 0.000 0.00 0.00 O+0 HETATM 37 C UNK 0 19.910 -34.557 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 33.279 -28.340 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 33.257 -26.800 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 31.913 -26.049 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 34.580 -26.012 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 30.590 -26.838 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 38.613 -28.265 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 38.591 -26.725 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 37.247 -25.974 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 39.914 -25.936 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 35.924 -26.763 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 43.947 -28.189 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 43.926 -26.650 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 42.581 -25.899 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 45.248 -25.861 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 41.259 -26.687 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 49.281 -28.114 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 49.260 -26.574 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 47.915 -25.823 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 50.583 -25.786 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 46.593 -26.612 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 54.616 -28.039 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 54.594 -26.499 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 53.250 -25.748 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 55.917 -25.710 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 51.927 -26.537 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 59.950 -27.964 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 59.928 -26.424 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 58.584 -25.673 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 61.251 -25.635 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 57.261 -26.461 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 65.284 -27.889 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 65.263 -26.349 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 63.918 -25.597 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 66.585 -25.560 0.000 0.00 0.00 C+0 HETATM 72 C UNK 0 62.595 -26.386 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 70.618 -27.813 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 70.597 -26.273 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 69.252 -25.522 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 71.919 -25.485 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 67.930 -26.311 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 75.953 -27.738 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 75.931 -26.198 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 74.587 -25.447 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 77.254 -25.409 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 73.264 -26.236 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 81.287 -27.663 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 81.265 -26.123 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 79.921 -25.372 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 82.588 -25.334 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 78.598 -26.160 0.000 0.00 0.00 C+0 HETATM 88 C UNK 0 86.621 -27.587 0.000 0.00 0.00 C+0 HETATM 89 C UNK 0 86.599 -26.047 0.000 0.00 0.00 C+0 HETATM 90 C UNK 0 85.255 -25.296 0.000 0.00 0.00 C+0 HETATM 91 C UNK 0 87.922 -25.259 0.000 0.00 0.00 C+0 HETATM 92 C UNK 0 83.932 -26.085 0.000 0.00 0.00 C+0 HETATM 93 O UNK 0 11.908 -29.937 0.000 0.00 0.00 O+0 HETATM 94 C UNK 0 11.853 -33.114 0.000 0.00 0.00 C+0 HETATM 95 C UNK 0 11.886 -34.653 0.000 0.00 0.00 C+0 HETATM 96 O UNK 0 10.503 -32.372 0.000 0.00 0.00 O+0 HETATM 97 C UNK 0 10.569 -35.451 0.000 0.00 0.00 C+0 HETATM 98 C UNK 0 9.186 -33.170 0.000 0.00 0.00 C+0 HETATM 99 C UNK 0 9.219 -34.710 0.000 0.00 0.00 C+0 HETATM 100 C UNK 0 7.837 -32.428 0.000 0.00 0.00 C+0 HETATM 101 N UNK 0 7.902 -35.508 0.000 0.00 0.00 N+0 HETATM 102 O UNK 0 10.601 -36.991 0.000 0.00 0.00 O+0 HETATM 103 O UNK 0 13.235 -35.395 0.000 0.00 0.00 O+0 HETATM 104 C UNK 0 7.934 -37.047 0.000 0.00 0.00 C+0 HETATM 105 C UNK 0 6.617 -37.845 0.000 0.00 0.00 C+0 HETATM 106 O UNK 0 9.284 -37.789 0.000 0.00 0.00 O+0 CONECT 1 2 3 10 CONECT 2 1 4 9 CONECT 3 1 5 CONECT 4 2 6 8 CONECT 5 3 6 19 CONECT 6 4 5 7 CONECT 7 6 24 CONECT 8 4 CONECT 9 2 21 CONECT 10 1 11 CONECT 11 12 13 14 10 CONECT 12 11 CONECT 13 11 15 CONECT 14 11 CONECT 15 16 17 18 13 CONECT 16 15 CONECT 17 15 CONECT 18 15 42 CONECT 19 5 20 CONECT 20 19 CONECT 21 9 22 23 CONECT 22 21 CONECT 23 21 CONECT 24 25 26 7 CONECT 25 24 27 32 CONECT 26 24 28 CONECT 27 25 29 31 CONECT 28 26 29 33 CONECT 29 27 28 30 CONECT 30 29 94 CONECT 31 27 CONECT 32 25 35 CONECT 33 28 34 93 CONECT 34 33 CONECT 35 32 36 37 CONECT 36 35 CONECT 37 35 CONECT 38 39 CONECT 39 38 40 41 CONECT 40 39 42 CONECT 41 39 47 CONECT 42 40 18 CONECT 43 44 CONECT 44 43 45 46 CONECT 45 44 47 CONECT 46 44 52 CONECT 47 45 41 CONECT 48 49 CONECT 49 48 50 51 CONECT 50 49 52 CONECT 51 49 57 CONECT 52 50 46 CONECT 53 54 CONECT 54 53 55 56 CONECT 55 54 57 CONECT 56 54 62 CONECT 57 55 51 CONECT 58 59 CONECT 59 58 60 61 CONECT 60 59 62 CONECT 61 59 67 CONECT 62 60 56 CONECT 63 64 CONECT 64 63 65 66 CONECT 65 64 67 CONECT 66 64 72 CONECT 67 65 61 CONECT 68 69 CONECT 69 68 70 71 CONECT 70 69 72 CONECT 71 69 77 CONECT 72 70 66 CONECT 73 74 CONECT 74 73 75 76 CONECT 75 74 77 CONECT 76 74 82 CONECT 77 75 71 CONECT 78 79 CONECT 79 78 80 81 CONECT 80 79 82 CONECT 81 79 87 CONECT 82 80 76 CONECT 83 84 CONECT 84 83 85 86 CONECT 85 84 87 CONECT 86 84 92 CONECT 87 85 81 CONECT 88 89 CONECT 89 88 90 91 CONECT 90 89 92 CONECT 91 89 CONECT 92 90 86 CONECT 93 33 CONECT 94 95 96 30 CONECT 95 94 97 103 CONECT 96 94 98 CONECT 97 95 99 102 CONECT 98 96 99 100 CONECT 99 97 98 101 CONECT 100 98 CONECT 101 99 104 CONECT 102 97 CONECT 103 95 CONECT 104 101 105 106 CONECT 105 104 CONECT 106 104 MASTER 0 0 0 0 0 0 0 0 106 0 216 0 END