HEADER PROTEIN 23-MAR-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-MAR-17 0 HETATM 1 H UNK 0 3.837 -7.079 0.000 0.00 0.00 H+0 HETATM 2 C UNK 0 4.782 -5.863 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 5.363 -7.289 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 3.257 -5.652 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 2.312 -6.868 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 0.786 -6.657 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 0.206 -5.231 0.000 0.00 0.00 O+0 HETATM 8 S UNK 0 -0.159 -7.873 0.000 0.00 0.00 S+0 HETATM 9 C UNK 0 -1.685 -7.663 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.630 -8.878 0.000 0.00 0.00 C+0 HETATM 11 N UNK 0 -4.155 -8.668 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 -4.736 -7.241 0.000 0.00 0.00 C+0 HETATM 13 O UNK 0 -3.791 -6.025 0.000 0.00 0.00 O-1 HETATM 14 C UNK 0 -6.261 -7.031 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -6.842 -5.604 0.000 0.00 0.00 C+0 HETATM 16 N UNK 0 -8.367 -5.393 0.000 0.00 0.00 N+0 HETATM 17 C UNK 0 -8.947 -3.967 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 -8.002 -2.751 0.000 0.00 0.00 O-1 HETATM 19 C UNK 0 -10.473 -3.756 0.000 0.00 0.00 C+0 HETATM 20 H UNK 0 -9.893 -5.183 0.000 0.00 0.00 H+0 HETATM 21 O UNK 0 -11.418 -4.972 0.000 0.00 0.00 O+0 HETATM 22 C UNK 0 -11.053 -2.330 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -12.480 -2.910 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -9.627 -1.750 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -11.634 -0.903 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 -13.159 -0.693 0.000 0.00 0.00 O+0 HETATM 27 P UNK 0 -13.740 0.734 0.000 0.00 0.00 P+0 HETATM 28 O UNK 0 -15.166 0.153 0.000 0.00 0.00 O+0 HETATM 29 O UNK 0 -12.313 1.314 0.000 0.00 0.00 O+0 HETATM 30 O UNK 0 -14.320 2.160 0.000 0.00 0.00 O+0 HETATM 31 P UNK 0 -15.845 2.371 0.000 0.00 0.00 P+0 HETATM 32 O UNK 0 -16.056 0.845 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 -15.635 3.896 0.000 0.00 0.00 O+0 HETATM 34 O UNK 0 -17.371 2.582 0.000 0.00 0.00 O+0 HETATM 35 C UNK 0 -17.951 4.008 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 -19.477 4.219 0.000 0.00 0.00 C+0 HETATM 37 H UNK 0 -18.596 5.482 0.000 0.00 0.00 H+0 HETATM 38 O UNK 0 -20.544 3.108 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -21.930 3.780 0.000 0.00 0.00 C+0 HETATM 40 H UNK 0 -23.193 4.660 0.000 0.00 0.00 H+0 HETATM 41 N UNK 0 -23.288 3.054 0.000 0.00 0.00 N+0 HETATM 42 C UNK 0 -23.498 1.528 0.000 0.00 0.00 C+0 HETATM 43 N UNK 0 -25.014 1.257 0.000 0.00 0.00 N+0 HETATM 44 C UNK 0 -25.740 2.615 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 -27.236 2.984 0.000 0.00 0.00 C+0 HETATM 46 N UNK 0 -28.303 1.874 0.000 0.00 0.00 N+0 HETATM 47 N UNK 0 -27.664 4.463 0.000 0.00 0.00 N+0 HETATM 48 C UNK 0 -26.597 5.574 0.000 0.00 0.00 C+0 HETATM 49 N UNK 0 -25.101 5.205 0.000 0.00 0.00 N+0 HETATM 50 C UNK 0 -24.673 3.726 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 -21.719 5.306 0.000 0.00 0.00 C+0 HETATM 52 H UNK 0 -21.272 6.779 0.000 0.00 0.00 H+0 HETATM 53 O UNK 0 -22.829 6.373 0.000 0.00 0.00 O+0 HETATM 54 C UNK 0 -20.203 5.577 0.000 0.00 0.00 C+0 HETATM 55 H UNK 0 -20.875 4.191 0.000 0.00 0.00 H+0 HETATM 56 O UNK 0 -19.531 6.962 0.000 0.00 0.00 O+0 HETATM 57 P UNK 0 -17.995 7.074 0.000 0.00 0.00 P+0 HETATM 58 O UNK 0 -17.884 5.538 0.000 0.00 0.00 O-1 HETATM 59 O UNK 0 -18.106 8.610 0.000 0.00 0.00 O-1 HETATM 60 O UNK 0 -16.459 7.185 0.000 0.00 0.00 O+0 HETATM 61 C UNK 0 5.727 -4.647 0.000 0.00 0.00 C+0 HETATM 62 H UNK 0 4.215 -4.357 0.000 0.00 0.00 H+0 HETATM 63 C UNK 0 5.299 -3.168 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 6.574 -2.304 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 7.790 -3.249 0.000 0.00 0.00 C+0 HETATM 66 H UNK 0 8.783 -4.426 0.000 0.00 0.00 H+0 HETATM 67 C UNK 0 9.306 -2.978 0.000 0.00 0.00 C+0 HETATM 68 H UNK 0 8.313 -1.800 0.000 0.00 0.00 H+0 HETATM 69 C UNK 0 9.829 -1.529 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 11.345 -1.258 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 12.338 -2.436 0.000 0.00 0.00 C+0 HETATM 72 H UNK 0 13.330 -3.613 0.000 0.00 0.00 H+0 HETATM 73 C UNK 0 13.854 -2.164 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 14.846 -3.342 0.000 0.00 0.00 C+0 HETATM 75 H UNK 0 15.839 -4.519 0.000 0.00 0.00 H+0 HETATM 76 O UNK 0 16.362 -3.071 0.000 0.00 0.00 O+0 HETATM 77 C UNK 0 14.323 -4.790 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 12.807 -5.061 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 11.814 -3.884 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 11.291 -5.332 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 10.299 -4.155 0.000 0.00 0.00 C+0 HETATM 82 H UNK 0 10.822 -2.707 0.000 0.00 0.00 H+0 HETATM 83 C UNK 0 9.775 -5.603 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 8.259 -5.874 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 7.267 -4.697 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 6.595 -6.083 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 4 61 CONECT 3 2 CONECT 4 2 5 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 CONECT 15 14 16 CONECT 16 15 17 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 21 22 CONECT 20 19 CONECT 21 19 CONECT 22 19 23 24 25 CONECT 23 22 CONECT 24 22 CONECT 25 22 26 CONECT 26 25 27 CONECT 27 26 28 29 30 CONECT 28 27 CONECT 29 27 CONECT 30 27 31 CONECT 31 30 32 33 34 CONECT 32 31 CONECT 33 31 CONECT 34 31 35 CONECT 35 34 36 CONECT 36 35 37 38 54 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 40 41 51 CONECT 40 39 CONECT 41 39 42 50 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 43 45 50 CONECT 45 44 46 47 CONECT 46 45 CONECT 47 45 48 CONECT 48 47 49 CONECT 49 48 50 CONECT 50 49 41 44 CONECT 51 39 52 53 54 CONECT 52 51 CONECT 53 51 CONECT 54 51 36 55 56 CONECT 55 54 CONECT 56 54 57 CONECT 57 56 58 59 60 CONECT 58 57 CONECT 59 57 CONECT 60 57 CONECT 61 2 62 63 85 CONECT 62 61 CONECT 63 61 64 CONECT 64 63 65 CONECT 65 64 66 67 85 CONECT 66 65 CONECT 67 65 68 69 81 CONECT 68 67 CONECT 69 67 70 CONECT 70 69 71 CONECT 71 70 72 73 79 CONECT 72 71 CONECT 73 71 74 CONECT 74 73 75 76 77 CONECT 75 74 CONECT 76 74 CONECT 77 74 78 CONECT 78 77 79 CONECT 79 78 71 80 81 CONECT 80 79 CONECT 81 79 67 82 83 CONECT 82 81 CONECT 83 81 84 CONECT 84 83 85 CONECT 85 84 61 65 86 CONECT 86 85 MASTER 0 0 0 0 0 0 0 0 86 0 184 0 END