HEADER PROTEIN 07-JUL-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-JUL-17 0 HETATM 1 C UNK 0 0.194 -2.551 0.000 0.00 0.00 C+0 HETATM 2 N UNK 0 -1.630 -2.533 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 0.947 -1.224 0.000 0.00 0.00 C+0 HETATM 4 O UNK 0 0.423 0.278 0.000 0.00 0.00 O+0 HETATM 5 N UNK 0 2.476 -1.189 0.000 0.00 0.00 N+0 HETATM 6 C UNK 0 1.901 -2.533 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 1.144 -3.877 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -10.673 0.114 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -11.417 -1.215 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -9.110 0.122 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -8.350 1.459 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -6.835 1.563 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 -5.711 2.575 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 -4.458 0.113 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -6.047 0.136 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -5.361 -0.843 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -4.629 1.501 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -6.766 -1.232 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -6.104 -2.579 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.452 -2.553 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.698 -1.211 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -2.207 -1.215 0.000 0.00 0.00 C+0 HETATM 23 O UNK 0 -1.410 0.155 0.000 0.00 0.00 O+0 HETATM 24 O UNK 0 -3.499 -3.877 0.000 0.00 0.00 O+0 HETATM 25 H UNK 0 -5.711 -4.024 0.000 0.00 0.00 H+0 HETATM 26 C UNK 0 -8.340 -1.221 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 -7.617 -3.242 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 -9.105 -2.551 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -10.654 -2.563 0.000 0.00 0.00 C+0 HETATM 30 O UNK 0 -11.698 -3.877 0.000 0.00 0.00 O+0 HETATM 31 N UNK 0 1.693 1.181 0.000 0.00 0.00 N+0 HETATM 32 C UNK 0 2.971 0.244 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 4.467 0.756 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 7.375 1.642 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 6.218 2.614 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 5.603 -0.295 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 7.060 0.197 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -5.710 4.093 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 -7.080 4.879 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -8.530 4.876 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 -7.803 6.177 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 4.713 2.095 0.000 0.00 0.00 C+0 HETATM 43 H UNK 0 -7.397 2.917 0.000 0.00 0.00 H+0 HETATM 44 O UNK 0 -7.587 0.136 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 7.698 -3.097 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 6.364 -3.867 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 6.364 -5.407 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 7.698 -6.177 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 9.031 -5.407 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 9.031 -3.867 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 5.030 -6.177 0.000 0.00 0.00 C+0 HETATM 52 S UNK 0 10.365 -3.097 0.000 0.00 0.00 S+0 HETATM 53 O UNK 0 9.595 -1.763 0.000 0.00 0.00 O+0 HETATM 54 O UNK 0 11.698 -2.327 0.000 0.00 0.00 O+0 HETATM 55 O UNK 0 11.135 -4.430 0.000 0.00 0.00 O+0 CONECT 1 2 3 6 7 CONECT 2 1 22 CONECT 3 1 5 4 CONECT 4 3 31 CONECT 5 3 32 CONECT 6 1 CONECT 7 1 CONECT 8 9 10 CONECT 9 8 29 CONECT 10 8 11 26 CONECT 11 10 12 CONECT 12 11 13 43 15 CONECT 13 12 38 17 CONECT 14 15 21 CONECT 15 14 12 18 44 CONECT 16 17 18 CONECT 17 16 13 CONECT 18 16 19 15 26 CONECT 19 18 20 25 27 CONECT 20 19 21 24 CONECT 21 20 14 22 CONECT 22 2 21 23 CONECT 23 22 CONECT 24 20 CONECT 25 19 CONECT 26 10 18 28 CONECT 27 19 28 CONECT 28 27 26 29 CONECT 29 9 28 30 CONECT 30 29 CONECT 31 4 32 CONECT 32 31 33 5 CONECT 33 32 36 42 CONECT 34 35 37 CONECT 35 34 42 CONECT 36 33 37 CONECT 37 36 34 CONECT 38 13 39 CONECT 39 38 40 41 CONECT 40 41 39 CONECT 41 40 39 CONECT 42 33 35 CONECT 43 12 CONECT 44 15 CONECT 45 46 50 CONECT 46 45 47 CONECT 47 46 48 51 CONECT 48 47 49 CONECT 49 48 50 CONECT 50 49 45 52 CONECT 51 47 CONECT 52 50 53 54 55 CONECT 53 52 CONECT 54 52 CONECT 55 52 MASTER 0 0 0 0 0 0 0 0 55 0 124 0 END