HEADER PROTEIN 31-OCT-19 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 31-OCT-19 0 HETATM 1 N UNK 0 -13.017 2.238 0.000 0.00 0.00 N+0 HETATM 2 C UNK 0 -13.337 0.732 0.000 0.00 0.00 C+0 HETATM 3 N UNK 0 -15.277 -1.209 0.000 0.00 0.00 N+0 HETATM 4 N UNK 0 0.393 6.714 0.000 0.00 0.00 N+0 HETATM 5 C UNK 0 0.393 5.174 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -11.610 2.864 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -14.372 -2.455 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -14.802 0.256 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 3.104 7.144 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.940 4.404 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 1.639 7.619 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -3.608 4.404 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 -2.274 5.174 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 -10.276 2.094 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -4.941 5.174 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -13.536 -10.413 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 16.149 9.916 0.000 0.00 0.00 C+0 HETATM 18 N UNK 0 4.248 8.174 0.000 0.00 0.00 N+0 HETATM 19 N UNK 0 -6.275 4.404 0.000 0.00 0.00 N+0 HETATM 20 C UNK 0 -14.047 3.382 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -11.771 4.396 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -6.275 7.484 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 9.146 10.790 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -4.941 6.714 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -6.275 2.864 0.000 0.00 0.00 C+0 HETATM 26 N UNK 0 -8.942 2.864 0.000 0.00 0.00 N+0 HETATM 27 S UNK 0 -6.436 9.016 0.000 0.00 0.00 S+0 HETATM 28 O UNK 0 -12.193 -0.299 0.000 0.00 0.00 O+0 HETATM 29 N UNK 0 17.293 10.947 0.000 0.00 0.00 N+0 HETATM 30 N UNK 0 -12.004 -10.252 0.000 0.00 0.00 N+0 HETATM 31 N UNK 0 8.322 8.253 0.000 0.00 0.00 N+0 HETATM 32 O UNK 0 1.727 4.404 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 -12.841 -2.294 0.000 0.00 0.00 O+0 HETATM 34 O UNK 0 3.424 5.637 0.000 0.00 0.00 O+0 HETATM 35 O UNK 0 -3.608 2.864 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 -13.277 4.716 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 -7.943 9.336 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 -10.276 0.554 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -7.682 6.858 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -14.999 -3.862 0.000 0.00 0.00 C+0 HETATM 41 O UNK 0 7.681 11.265 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 9.466 9.283 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -8.712 8.002 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -4.941 2.094 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 5.713 7.698 0.000 0.00 0.00 C+0 HETATM 46 N UNK 0 14.684 10.392 0.000 0.00 0.00 N+0 HETATM 47 N UNK 0 -14.441 -9.167 0.000 0.00 0.00 N+0 HETATM 48 C UNK 0 -7.609 2.094 0.000 0.00 0.00 C+0 HETATM 49 N UNK 0 16.469 8.410 0.000 0.00 0.00 N+0 HETATM 50 N UNK 0 -14.162 -11.820 0.000 0.00 0.00 N+0 HETATM 51 C UNK 0 -16.818 -1.209 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 -0.853 7.619 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 6.857 8.729 0.000 0.00 0.00 C+0 HETATM 54 O UNK 0 10.290 11.820 0.000 0.00 0.00 O+0 HETATM 55 C UNK 0 6.033 6.192 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 7.497 5.716 0.000 0.00 0.00 C+0 HETATM 57 N UNK 0 -16.530 -4.022 0.000 0.00 0.00 N+0 HETATM 58 C UNK 0 -0.940 2.864 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 10.427 4.764 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 -16.047 1.161 0.000 0.00 0.00 C+0 HETATM 61 O UNK 0 -13.904 6.123 0.000 0.00 0.00 O+0 HETATM 62 C UNK 0 7.818 4.210 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 8.642 6.746 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 10.107 6.271 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 9.282 3.734 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 1.163 9.084 0.000 0.00 0.00 C+0 HETATM 67 O UNK 0 11.891 4.288 0.000 0.00 0.00 O+0 HETATM 68 O UNK 0 -2.274 2.094 0.000 0.00 0.00 O+0 HETATM 69 C UNK 0 -17.293 0.256 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 -0.377 9.084 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 -13.815 -7.760 0.000 0.00 0.00 C+0 HETATM 72 C UNK 0 13.540 9.362 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 -14.094 -5.107 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 10.931 8.807 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 12.211 2.782 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 -14.720 -6.514 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 12.075 9.838 0.000 0.00 0.00 C+0 CONECT 1 2 6 20 CONECT 2 1 8 28 CONECT 3 8 7 51 CONECT 4 5 11 52 CONECT 5 4 10 32 CONECT 6 1 14 21 CONECT 7 3 33 40 CONECT 8 3 2 60 CONECT 9 11 18 34 CONECT 10 5 13 58 CONECT 11 9 4 66 CONECT 12 15 13 35 CONECT 13 10 12 CONECT 14 6 26 38 CONECT 15 12 19 24 CONECT 16 47 30 50 CONECT 17 46 29 49 CONECT 18 9 45 CONECT 19 15 25 CONECT 20 1 36 CONECT 21 6 36 CONECT 22 24 27 39 CONECT 23 42 41 54 CONECT 24 22 15 CONECT 25 19 48 44 CONECT 26 14 48 CONECT 27 22 37 CONECT 28 2 CONECT 29 17 CONECT 30 16 CONECT 31 53 42 CONECT 32 5 CONECT 33 7 CONECT 34 9 CONECT 35 12 CONECT 36 20 61 21 CONECT 37 27 43 CONECT 38 14 CONECT 39 22 43 CONECT 40 7 57 73 CONECT 41 23 CONECT 42 23 31 74 CONECT 43 39 37 CONECT 44 25 CONECT 45 18 53 55 CONECT 46 17 72 CONECT 47 16 71 CONECT 48 25 26 CONECT 49 17 CONECT 50 16 CONECT 51 3 69 CONECT 52 4 70 CONECT 53 31 45 CONECT 54 23 CONECT 55 45 56 CONECT 56 55 62 63 CONECT 57 40 CONECT 58 10 68 CONECT 59 64 67 65 CONECT 60 8 69 CONECT 61 36 CONECT 62 56 65 CONECT 63 56 64 CONECT 64 59 63 CONECT 65 62 59 CONECT 66 11 70 CONECT 67 59 75 CONECT 68 58 CONECT 69 60 51 CONECT 70 52 66 CONECT 71 47 76 CONECT 72 46 77 CONECT 73 40 76 CONECT 74 42 77 CONECT 75 67 CONECT 76 71 73 CONECT 77 72 74 MASTER 0 0 0 0 0 0 0 0 77 0 162 0 END