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 -14.822 10.667 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -13.289 10.096 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -12.104 11.453 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -11.100 13.019 0.000 0.00 0.00 C+0 HETATM 5 O UNK 0 -12.211 14.212 0.000 0.00 0.00 O+0 HETATM 6 N UNK 0 -9.799 14.076 0.000 0.00 0.00 N+0 HETATM 7 C UNK 0 -8.322 14.790 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -8.242 16.335 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -7.037 17.280 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.546 16.927 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.897 15.533 0.000 0.00 0.00 C+0 HETATM 12 N UNK 0 -5.533 14.096 0.000 0.00 0.00 N+0 HETATM 13 O UNK 0 -5.022 12.563 0.000 0.00 0.00 O+0 HETATM 14 Fe UNK 0 -5.095 10.924 0.000 0.00 0.00 Fe+0 HETATM 15 O UNK 0 -3.620 10.478 0.000 0.00 0.00 O+0 HETATM 16 C UNK 0 -3.477 8.966 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -2.124 8.199 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.781 8.974 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 0.538 8.213 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 1.856 8.974 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 3.175 8.213 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 4.493 8.974 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 5.812 8.213 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 7.130 8.974 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 8.449 8.213 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 9.767 8.974 0.000 0.00 0.00 O+0 HETATM 27 O UNK 0 8.449 6.691 0.000 0.00 0.00 O+0 HETATM 28 N UNK 0 -4.874 8.306 0.000 0.00 0.00 N+0 HETATM 29 C UNK 0 -5.868 7.061 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -7.157 6.132 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -8.635 5.514 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -10.233 5.389 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -11.723 6.006 0.000 0.00 0.00 C+0 HETATM 34 N UNK 0 -10.661 7.135 0.000 0.00 0.00 N+0 HETATM 35 C UNK 0 -11.205 8.559 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 -9.667 9.018 0.000 0.00 0.00 O+0 HETATM 37 C UNK 0 -12.153 9.824 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -13.307 11.140 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 -12.523 12.469 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 -10.973 11.885 0.000 0.00 0.00 C+0 HETATM 41 N UNK 0 -10.784 10.387 0.000 0.00 0.00 N+0 HETATM 42 C UNK 0 -9.510 11.565 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -9.663 13.080 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 -8.428 13.970 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 -7.040 13.345 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -6.887 11.830 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -8.122 10.940 0.000 0.00 0.00 C+0 HETATM 48 O UNK 0 -6.631 11.171 0.000 0.00 0.00 O+0 HETATM 49 C UNK 0 -12.974 7.024 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 -14.222 6.074 0.000 0.00 0.00 O+0 HETATM 51 O UNK 0 -13.635 8.514 0.000 0.00 0.00 O+0 HETATM 52 O UNK 0 -5.829 9.520 0.000 0.00 0.00 O+0 HETATM 53 C UNK 0 -7.059 13.886 0.000 0.00 0.00 C+0 HETATM 54 O UNK 0 -8.198 12.657 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 51 CONECT 3 2 4 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 CONECT 7 6 8 53 CONECT 8 7 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 13 53 CONECT 13 12 14 CONECT 14 13 15 48 52 CONECT 15 14 16 CONECT 16 15 17 28 CONECT 17 16 18 CONECT 18 17 19 CONECT 19 18 20 CONECT 20 19 21 CONECT 21 20 22 CONECT 22 21 23 CONECT 23 22 24 CONECT 24 23 25 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 CONECT 28 16 29 52 CONECT 29 28 30 CONECT 30 29 31 CONECT 31 30 32 CONECT 32 31 33 CONECT 33 32 34 49 CONECT 34 33 35 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 41 CONECT 38 37 39 CONECT 39 38 40 CONECT 40 39 41 42 CONECT 41 40 37 CONECT 42 40 43 47 CONECT 43 42 44 CONECT 44 43 45 CONECT 45 44 46 CONECT 46 45 47 CONECT 47 46 42 48 CONECT 48 47 14 CONECT 49 33 50 51 CONECT 50 49 CONECT 51 49 2 CONECT 52 28 14 CONECT 53 12 7 54 CONECT 54 53 MASTER 0 0 0 0 0 0 0 0 54 0 118 0 END