HEADER PROTEIN 17-MAY-18 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 17-MAY-18 0 HETATM 1 O UNK 0 -47.449 8.617 0.000 0.00 0.00 O+0 HETATM 2 C UNK 0 -46.679 7.283 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -47.449 5.949 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -48.989 5.949 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -49.759 4.616 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -51.299 4.616 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 -52.069 3.282 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 -52.069 5.949 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 -45.139 7.283 0.000 0.00 0.00 C+0 HETATM 10 S UNK 0 -44.369 5.949 0.000 0.00 0.00 S+0 HETATM 11 C UNK 0 -42.829 5.949 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -42.059 4.616 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 -42.829 3.282 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 -40.519 4.616 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 -39.749 5.949 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 -39.749 3.282 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 -44.369 8.617 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -42.829 8.617 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -42.059 9.951 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -40.519 9.951 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -39.749 11.284 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -38.209 11.284 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -37.439 12.618 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -38.209 13.952 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -37.439 15.285 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -38.209 16.619 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -37.439 17.953 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 -38.209 19.286 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -37.439 20.620 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -38.209 21.954 0.000 0.00 0.00 C+0 HETATM 31 O UNK 0 -39.749 21.954 0.000 0.00 0.00 O+0 HETATM 32 S UNK 0 -37.439 23.287 0.000 0.00 0.00 S+0 HETATM 33 C UNK 0 -35.899 23.287 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 -35.129 24.621 0.000 0.00 0.00 C+0 HETATM 35 N UNK 0 -33.589 24.621 0.000 0.00 0.00 N+0 HETATM 36 C UNK 0 -32.819 25.955 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 -33.589 27.288 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 -31.279 25.955 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 -30.509 27.288 0.000 0.00 0.00 C+0 HETATM 40 N UNK 0 -28.969 27.288 0.000 0.00 0.00 N+0 HETATM 41 C UNK 0 -28.199 28.622 0.000 0.00 0.00 C+0 HETATM 42 O UNK 0 -28.969 29.956 0.000 0.00 0.00 O+0 HETATM 43 C UNK 0 -26.659 28.622 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -25.889 27.288 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 -25.889 29.956 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -24.556 29.186 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -27.223 30.726 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -25.119 31.289 0.000 0.00 0.00 C+0 HETATM 49 O UNK 0 -23.579 31.289 0.000 0.00 0.00 O+0 HETATM 50 P UNK 0 -22.809 32.623 0.000 0.00 0.00 P+0 HETATM 51 O UNK 0 -21.476 31.853 0.000 0.00 0.00 O+0 HETATM 52 O UNK 0 -22.039 33.957 0.000 0.00 0.00 O+0 HETATM 53 P UNK 0 -20.499 33.957 0.000 0.00 0.00 P+0 HETATM 54 O UNK 0 -20.499 32.417 0.000 0.00 0.00 O+0 HETATM 55 O UNK 0 -18.959 33.957 0.000 0.00 0.00 O+0 HETATM 56 C UNK 0 -18.189 35.290 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 -16.649 35.290 0.000 0.00 0.00 C+0 HETATM 58 O UNK 0 -15.744 36.536 0.000 0.00 0.00 O+0 HETATM 59 C UNK 0 -14.280 36.060 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 -14.280 34.520 0.000 0.00 0.00 C+0 HETATM 61 O UNK 0 -13.034 33.615 0.000 0.00 0.00 O+0 HETATM 62 C UNK 0 -15.744 34.045 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 -16.220 32.580 0.000 0.00 0.00 O+0 HETATM 64 P UNK 0 -17.726 32.260 0.000 0.00 0.00 P+0 HETATM 65 O UNK 0 -18.047 33.766 0.000 0.00 0.00 O+0 HETATM 66 N UNK 0 -13.034 36.966 0.000 0.00 0.00 N+0 HETATM 67 C UNK 0 -11.569 36.490 0.000 0.00 0.00 C+0 HETATM 68 N UNK 0 -10.664 37.736 0.000 0.00 0.00 N+0 HETATM 69 C UNK 0 -11.569 38.982 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 -13.034 38.506 0.000 0.00 0.00 C+0 HETATM 71 N UNK 0 -14.178 39.536 0.000 0.00 0.00 N+0 HETATM 72 C UNK 0 -13.858 41.042 0.000 0.00 0.00 C+0 HETATM 73 N UNK 0 -12.393 41.518 0.000 0.00 0.00 N+0 HETATM 74 C UNK 0 -11.249 40.488 0.000 0.00 0.00 C+0 HETATM 75 N UNK 0 -9.784 40.964 0.000 0.00 0.00 N+0 HETATM 76 O UNK 0 -24.143 33.393 0.000 0.00 0.00 O+0 HETATM 77 O UNK 0 -20.499 35.497 0.000 0.00 0.00 O+0 HETATM 78 O UNK 0 -17.406 30.753 0.000 0.00 0.00 O+0 HETATM 79 O UNK 0 -19.233 31.940 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 9 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 CONECT 9 2 10 17 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 16 CONECT 15 14 CONECT 16 14 CONECT 17 9 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 CONECT 26 25 27 CONECT 27 26 28 CONECT 28 27 29 CONECT 29 28 30 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 CONECT 33 32 34 CONECT 34 33 35 CONECT 35 34 36 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 40 CONECT 40 39 41 CONECT 41 40 42 43 CONECT 42 41 CONECT 43 41 44 45 CONECT 44 43 CONECT 45 43 46 47 48 CONECT 46 45 CONECT 47 45 CONECT 48 45 49 CONECT 49 48 50 CONECT 50 49 51 52 76 CONECT 51 50 CONECT 52 50 53 CONECT 53 52 54 55 77 CONECT 54 53 CONECT 55 53 56 CONECT 56 55 57 CONECT 57 56 58 62 CONECT 58 57 59 CONECT 59 58 60 66 CONECT 60 59 61 62 CONECT 61 60 CONECT 62 60 63 57 CONECT 63 62 64 CONECT 64 63 65 78 79 CONECT 65 64 CONECT 66 59 67 70 CONECT 67 66 68 CONECT 68 67 69 CONECT 69 68 70 74 CONECT 70 69 71 66 CONECT 71 70 72 CONECT 72 71 73 CONECT 73 72 74 CONECT 74 73 75 69 CONECT 75 74 CONECT 76 50 CONECT 77 53 CONECT 78 64 CONECT 79 64 MASTER 0 0 0 0 0 0 0 0 79 0 162 0 END