HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 C UNK 0 13.882 -6.146 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 12.567 -5.381 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 15.197 -5.391 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 13.861 -7.654 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 12.577 -3.863 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 9.917 -5.371 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 16.511 -6.177 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 15.207 -3.873 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 15.166 -8.429 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 12.781 -8.714 0.000 0.00 0.00 O+0 HETATM 11 C UNK 0 11.262 -3.098 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 13.892 -3.119 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 12.567 -2.334 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 9.927 -3.853 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 16.491 -7.675 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 17.826 -5.422 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 16.501 -4.648 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 11.283 -1.580 0.000 0.00 0.00 C+0 HETATM 19 O UNK 0 14.962 -2.028 0.000 0.00 0.00 O+0 HETATM 20 C UNK 0 17.795 -8.449 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 19.121 -6.207 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 9.937 -0.795 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 12.608 -0.795 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 19.100 -7.715 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 8.602 -1.580 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 20.160 -8.765 0.000 0.00 0.00 O+0 HETATM 27 C UNK 0 7.267 -0.795 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 5.932 -1.580 0.000 0.00 0.00 C+0 HETATM 29 O UNK 0 7.267 0.744 0.000 0.00 0.00 O+0 HETATM 30 C UNK 0 4.597 -0.785 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 5.932 -3.119 0.000 0.00 0.00 C+0 HETATM 32 S UNK 0 3.251 -1.559 0.000 0.00 0.00 S+0 HETATM 33 O UNK 0 4.576 0.683 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 1.906 -0.775 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 0.550 -1.559 0.000 0.00 0.00 C+0 HETATM 36 N UNK 0 -0.805 -0.775 0.000 0.00 0.00 N+0 HETATM 37 C UNK 0 -2.151 -1.559 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -3.486 -0.775 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 -2.151 -3.119 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 -4.841 -1.559 0.000 0.00 0.00 C+0 HETATM 41 N UNK 0 -6.187 -0.785 0.000 0.00 0.00 N+0 HETATM 42 C UNK 0 -7.542 -1.559 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -8.877 -0.785 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -7.542 -3.119 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 -10.243 -1.559 0.000 0.00 0.00 C+0 HETATM 46 O UNK 0 -8.877 0.775 0.000 0.00 0.00 O+0 HETATM 47 C UNK 0 -11.578 -0.785 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -10.253 -2.956 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -10.263 0.051 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 -12.924 -1.559 0.000 0.00 0.00 O+0 HETATM 51 P UNK 0 -14.544 -1.590 0.000 0.00 0.00 P+0 HETATM 52 O UNK 0 -14.544 1.580 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 -14.565 -3.435 0.000 0.00 0.00 O+0 HETATM 54 O UNK 0 -16.104 -1.580 0.000 0.00 0.00 O+0 HETATM 55 P UNK 0 -14.544 4.872 0.000 0.00 0.00 P+0 HETATM 56 O UNK 0 -12.068 4.902 0.000 0.00 0.00 O+0 HETATM 57 O UNK 0 -14.544 6.441 0.000 0.00 0.00 O+0 HETATM 58 O UNK 0 -16.124 4.892 0.000 0.00 0.00 O+0 HETATM 59 C UNK 0 -9.937 5.912 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 -8.480 5.443 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 -7.990 3.965 0.000 0.00 0.00 C+0 HETATM 62 O UNK 0 -7.226 6.360 0.000 0.00 0.00 O+0 HETATM 63 C UNK 0 -6.401 3.965 0.000 0.00 0.00 C+0 HETATM 64 O UNK 0 -8.786 2.854 0.000 0.00 0.00 O+0 HETATM 65 C UNK 0 -5.922 5.432 0.000 0.00 0.00 C+0 HETATM 66 O UNK 0 -5.494 2.711 0.000 0.00 0.00 O+0 HETATM 67 P UNK 0 -10.447 2.864 0.000 0.00 0.00 P+0 HETATM 68 N UNK 0 -5.279 8.123 0.000 0.00 0.00 N+0 HETATM 69 O UNK 0 -10.315 4.352 0.000 0.00 0.00 O+0 HETATM 70 O UNK 0 -11.976 2.823 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 -10.457 1.284 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 -8.001 8.123 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 -5.279 9.703 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 -8.001 9.703 0.000 0.00 0.00 C+0 HETATM 75 N UNK 0 -9.367 7.349 0.000 0.00 0.00 N+0 HETATM 76 N UNK 0 -6.635 10.508 0.000 0.00 0.00 N+0 HETATM 77 C UNK 0 -9.367 10.488 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 -10.722 8.123 0.000 0.00 0.00 C+0 HETATM 79 N UNK 0 -10.722 9.703 0.000 0.00 0.00 N+0 HETATM 80 N UNK 0 -9.377 12.037 0.000 0.00 0.00 N+0 HETATM 81 H UNK 0 12.557 -7.023 0.000 0.00 0.00 H+0 HETATM 82 H UNK 0 15.186 -6.910 0.000 0.00 0.00 H+0 HETATM 83 H UNK 0 16.481 -9.183 0.000 0.00 0.00 H+0 CONECT 1 2 3 4 CONECT 2 1 5 6 81 CONECT 3 1 7 8 82 CONECT 4 1 9 10 CONECT 5 2 11 12 13 CONECT 6 2 14 CONECT 7 3 15 16 17 CONECT 8 3 12 CONECT 9 4 15 CONECT 10 4 CONECT 11 5 18 14 CONECT 12 5 19 8 CONECT 13 5 CONECT 14 6 11 CONECT 15 7 20 9 83 CONECT 16 7 21 CONECT 17 7 CONECT 18 11 22 23 CONECT 19 12 CONECT 20 15 24 CONECT 21 16 24 CONECT 22 18 25 CONECT 23 18 CONECT 24 20 26 21 CONECT 25 22 27 CONECT 26 24 CONECT 27 25 28 29 CONECT 28 27 30 31 CONECT 29 27 CONECT 30 28 32 33 CONECT 31 28 CONECT 32 30 34 CONECT 33 30 CONECT 34 32 35 CONECT 35 34 36 CONECT 36 35 37 CONECT 37 36 38 39 CONECT 38 37 40 CONECT 39 37 CONECT 40 38 41 CONECT 41 40 42 CONECT 42 41 43 44 CONECT 43 42 45 46 CONECT 44 42 CONECT 45 43 47 48 49 CONECT 46 43 CONECT 47 45 50 CONECT 48 45 CONECT 49 45 CONECT 50 47 51 CONECT 51 50 52 53 54 CONECT 52 51 55 CONECT 53 51 CONECT 54 51 CONECT 55 52 56 57 58 CONECT 56 55 59 CONECT 57 55 CONECT 58 55 CONECT 59 56 60 CONECT 60 59 61 62 CONECT 61 60 63 64 CONECT 62 60 65 CONECT 63 61 66 65 CONECT 64 61 67 CONECT 65 62 68 63 CONECT 66 63 CONECT 67 64 69 70 71 CONECT 68 65 72 73 CONECT 69 67 CONECT 70 67 CONECT 71 67 CONECT 72 68 74 75 CONECT 73 68 76 CONECT 74 72 77 76 CONECT 75 72 78 CONECT 76 73 74 CONECT 77 74 79 80 CONECT 78 75 79 CONECT 79 77 78 CONECT 80 77 CONECT 81 2 CONECT 82 3 CONECT 83 15 MASTER 0 0 0 0 0 0 0 0 83 0 178 0 END