HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 644 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 O UNK 0 23.996 -4.925 0.000 0.00 0.00 O+0 HETATM 2 O UNK 0 26.082 -4.709 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 18.997 -7.341 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 31.470 -6.052 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 16.389 -2.439 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 6.105 9.024 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 4.387 15.444 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 7.133 7.878 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 9.740 2.975 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 19.332 2.270 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 14.739 5.391 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 13.304 1.000 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 23.302 5.833 0.000 0.00 0.00 O+0 HETATM 14 N UNK 0 24.546 -7.535 0.000 0.00 0.00 N+0 HETATM 15 N UNK 0 20.982 -5.560 0.000 0.00 0.00 N+0 HETATM 16 N UNK 0 28.390 -6.047 0.000 0.00 0.00 N+0 HETATM 17 N UNK 0 18.925 -3.267 0.000 0.00 0.00 N+0 HETATM 18 N UNK 0 23.110 -11.926 0.000 0.00 0.00 N+0 HETATM 19 N UNK 0 31.475 -3.385 0.000 0.00 0.00 N+0 HETATM 20 N UNK 0 5.877 13.140 0.000 0.00 0.00 N+0 HETATM 21 N UNK 0 8.090 10.805 0.000 0.00 0.00 N+0 HETATM 22 N UNK 0 17.346 0.489 0.000 0.00 0.00 N+0 HETATM 23 N UNK 0 9.668 7.049 0.000 0.00 0.00 N+0 HETATM 24 N UNK 0 11.725 4.756 0.000 0.00 0.00 N+0 HETATM 25 N UNK 0 15.289 2.782 0.000 0.00 0.00 N+0 HETATM 26 N UNK 0 23.661 -14.536 0.000 0.00 0.00 N+0 HETATM 27 N UNK 0 21.125 -13.708 0.000 0.00 0.00 N+0 HETATM 28 N UNK 0 7.205 1.325 0.000 0.00 0.00 N+0 HETATM 29 N UNK 0 12.569 11.914 0.000 0.00 0.00 N+0 HETATM 30 N UNK 0 11.108 13.932 0.000 0.00 0.00 N+0 HETATM 31 C UNK 0 26.078 -7.376 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 26.702 -8.784 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 25.555 -9.813 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 24.223 -9.041 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 23.517 -6.388 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 22.010 -6.706 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 26.850 -6.044 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 21.532 -8.170 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 22.560 -9.316 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 18.446 -4.731 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 19.475 -5.877 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 16.939 -5.049 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 22.082 -10.780 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 29.162 -4.714 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 16.461 -6.513 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 14.954 -6.830 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 17.490 -7.659 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 30.702 -4.717 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 17.896 -2.121 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 5.554 11.634 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 4.022 11.476 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 18.375 -0.657 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 3.399 12.884 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 9.118 9.659 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 9.190 5.585 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 22.632 -13.390 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 6.583 10.487 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 7.683 5.268 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 4.545 13.912 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 10.625 9.976 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 8.640 8.195 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 7.205 3.804 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 16.796 3.099 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 10.219 4.439 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 17.825 1.953 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 5.747 3.334 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 12.754 3.610 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 11.104 11.440 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 17.275 4.563 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 5.747 1.794 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 8.103 2.564 0.000 0.00 0.00 C+0 HETATM 72 C UNK 0 14.261 3.928 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 12.276 2.146 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 4.414 4.104 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 18.782 4.880 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 4.414 1.024 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 10.201 12.688 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 3.080 3.334 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 3.080 1.794 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 12.572 13.454 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 19.260 6.344 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 19.810 3.734 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 20.767 6.662 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 21.317 4.052 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 21.796 5.516 0.000 0.00 0.00 C+0 CONECT 1 35 CONECT 2 37 CONECT 3 41 CONECT 4 48 CONECT 5 49 CONECT 6 57 CONECT 7 59 CONECT 8 61 CONECT 9 64 CONECT 10 65 CONECT 11 72 CONECT 12 73 CONECT 13 85 CONECT 14 31 34 35 CONECT 15 36 41 CONECT 16 37 44 CONECT 17 40 49 CONECT 18 43 56 CONECT 19 48 CONECT 20 50 59 CONECT 21 54 57 CONECT 22 52 65 CONECT 23 55 61 CONECT 24 64 67 CONECT 25 63 72 CONECT 26 56 CONECT 27 56 CONECT 28 70 71 CONECT 29 68 80 CONECT 30 77 80 CONECT 31 14 32 37 CONECT 32 31 33 CONECT 33 32 34 CONECT 34 14 33 CONECT 35 1 14 36 CONECT 36 15 35 38 CONECT 37 2 16 31 CONECT 38 36 39 CONECT 39 38 43 CONECT 40 17 41 42 CONECT 41 3 15 40 CONECT 42 40 45 CONECT 43 18 39 CONECT 44 16 48 CONECT 45 42 46 47 CONECT 46 45 CONECT 47 45 CONECT 48 4 19 44 CONECT 49 5 17 52 CONECT 50 20 51 57 CONECT 51 50 53 CONECT 52 22 49 CONECT 53 51 59 CONECT 54 21 60 61 CONECT 55 23 58 64 CONECT 56 18 26 27 CONECT 57 6 21 50 CONECT 58 55 62 CONECT 59 7 20 53 CONECT 60 54 68 CONECT 61 8 23 54 CONECT 62 58 66 71 CONECT 63 25 65 69 CONECT 64 9 24 55 CONECT 65 10 22 63 CONECT 66 62 70 74 CONECT 67 24 72 73 CONECT 68 29 60 77 CONECT 69 63 75 CONECT 70 28 66 76 CONECT 71 28 62 CONECT 72 11 25 67 CONECT 73 12 67 CONECT 74 66 78 CONECT 75 69 81 82 CONECT 76 70 79 CONECT 77 30 68 CONECT 78 74 79 CONECT 79 76 78 CONECT 80 29 30 CONECT 81 75 83 CONECT 82 75 84 CONECT 83 81 85 CONECT 84 82 85 CONECT 85 13 83 84 MASTER 0 0 0 0 0 0 0 0 85 0 180 0 END