HEADER PROTEIN 21-FEB-19 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-FEB-19 0 HETATM 1 C UNK 0 -6.687 10.010 0.000 0.00 0.00 C+0 HETATM 2 N UNK 0 -8.020 10.780 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 -9.354 10.010 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -9.354 8.470 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -8.020 7.700 0.000 0.00 0.00 C+0 HETATM 6 N UNK 0 -6.687 8.470 0.000 0.00 0.00 N+0 HETATM 7 O UNK 0 -5.353 10.780 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 -10.688 10.780 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 -8.020 6.160 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 -6.687 5.390 0.000 0.00 0.00 O+0 HETATM 11 N UNK 0 -9.354 5.390 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 -9.354 3.850 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -8.020 3.080 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -10.688 3.080 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -10.688 1.540 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -9.354 0.770 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -8.020 1.540 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 -12.021 3.850 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 -6.687 0.770 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -12.021 0.770 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 -13.355 3.080 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 -13.355 1.540 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 -14.689 0.770 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -16.023 1.540 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -16.023 3.080 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -14.689 3.850 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -12.021 -0.770 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 -10.688 -1.540 0.000 0.00 0.00 O+0 HETATM 29 C UNK 0 -10.688 -3.080 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -12.021 -3.850 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -13.355 -3.080 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -13.355 -1.540 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 -14.689 -0.770 0.000 0.00 0.00 O+0 HETATM 34 O UNK 0 -14.689 -3.850 0.000 0.00 0.00 O+0 HETATM 35 O UNK 0 -12.021 -5.390 0.000 0.00 0.00 O+0 HETATM 36 O UNK 0 -17.356 0.770 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 -17.356 3.850 0.000 0.00 0.00 O+0 HETATM 38 O UNK 0 -14.689 5.390 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -9.354 -3.850 0.000 0.00 0.00 C+0 HETATM 40 O UNK 0 -9.354 -5.390 0.000 0.00 0.00 O+0 HETATM 41 C UNK 0 -16.195 -1.090 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 -16.671 -2.555 0.000 0.00 0.00 C+0 HETATM 43 O UNK 0 -17.226 0.054 0.000 0.00 0.00 O+0 HETATM 44 C UNK 0 -18.177 -2.875 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 -15.641 -3.699 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -16.116 -5.164 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -17.623 -5.484 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -18.653 -4.340 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -14.689 -5.390 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 -16.023 -6.160 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 -13.355 -6.160 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 -13.355 -7.700 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 -11.823 -6.321 0.000 0.00 0.00 O+0 HETATM 54 C UNK 0 -16.023 -7.700 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 -14.689 -8.470 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 -14.689 -10.010 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 -16.023 -10.780 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 -17.356 -10.010 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 -17.356 -8.470 0.000 0.00 0.00 C+0 HETATM 60 O UNK 0 -6.687 -0.770 0.000 0.00 0.00 O+0 HETATM 61 N UNK 0 -5.353 1.540 0.000 0.00 0.00 N+0 HETATM 62 C UNK 0 -4.019 0.770 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 -2.686 1.540 0.000 0.00 0.00 C+0 HETATM 64 N UNK 0 -1.352 0.770 0.000 0.00 0.00 N+0 HETATM 65 C UNK 0 -0.018 1.540 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 1.315 0.770 0.000 0.00 0.00 C+0 HETATM 67 O UNK 0 -0.018 3.080 0.000 0.00 0.00 O+0 HETATM 68 O UNK 0 2.649 1.540 0.000 0.00 0.00 O+0 HETATM 69 C UNK 0 3.983 0.770 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 5.316 1.540 0.000 0.00 0.00 C+0 HETATM 71 O UNK 0 6.650 0.770 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 7.984 1.540 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 9.317 0.770 0.000 0.00 0.00 C+0 HETATM 74 O UNK 0 9.317 -0.770 0.000 0.00 0.00 O+0 HETATM 75 N UNK 0 10.651 1.540 0.000 0.00 0.00 N+0 HETATM 76 C UNK 0 11.985 0.770 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 13.318 1.540 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 14.652 0.770 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 14.652 -0.770 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 13.318 -1.540 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 11.985 -0.770 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 15.986 1.540 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 15.986 3.080 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 14.652 3.850 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 13.318 3.080 0.000 0.00 0.00 C+0 HETATM 86 S UNK 0 11.985 3.850 0.000 0.00 0.00 S+0 HETATM 87 O UNK 0 10.651 4.620 0.000 0.00 0.00 O+0 HETATM 88 O UNK 0 12.755 5.184 0.000 0.00 0.00 O+0 HETATM 89 O UNK 0 11.215 2.516 0.000 0.00 0.00 O+0 HETATM 90 S UNK 0 17.319 3.850 0.000 0.00 0.00 S+0 HETATM 91 O UNK 0 18.653 4.620 0.000 0.00 0.00 O+0 HETATM 92 O UNK 0 18.089 2.516 0.000 0.00 0.00 O+0 HETATM 93 O UNK 0 16.549 5.184 0.000 0.00 0.00 O+0 HETATM 94 S UNK 0 13.318 -3.080 0.000 0.00 0.00 S+0 HETATM 95 O UNK 0 13.318 -4.620 0.000 0.00 0.00 O+0 HETATM 96 O UNK 0 11.778 -3.080 0.000 0.00 0.00 O+0 HETATM 97 O UNK 0 14.858 -3.080 0.000 0.00 0.00 O+0 HETATM 98 C UNK 0 -15.594 -0.476 0.000 0.00 0.00 C+0 HETATM 99 H UNK 0 -14.689 -6.930 0.000 0.00 0.00 H+0 CONECT 1 2 6 7 CONECT 2 1 3 CONECT 3 2 4 8 CONECT 4 3 5 CONECT 5 4 6 9 CONECT 6 5 1 CONECT 7 1 CONECT 8 3 CONECT 9 5 10 11 CONECT 10 9 CONECT 11 9 12 CONECT 12 11 13 14 CONECT 13 12 17 CONECT 14 12 15 18 CONECT 15 14 16 20 CONECT 16 15 17 CONECT 17 16 13 19 CONECT 18 14 21 CONECT 19 17 60 61 CONECT 20 15 27 CONECT 21 18 26 22 CONECT 22 21 23 CONECT 23 22 24 98 CONECT 24 23 25 36 CONECT 25 24 26 37 CONECT 26 21 25 38 CONECT 27 20 32 28 CONECT 28 27 29 CONECT 29 28 30 39 CONECT 30 29 31 35 CONECT 31 30 32 34 CONECT 32 27 31 33 CONECT 33 32 41 CONECT 34 31 49 CONECT 35 30 CONECT 36 24 CONECT 37 25 CONECT 38 26 CONECT 39 40 29 CONECT 40 39 CONECT 41 33 42 43 CONECT 42 41 44 45 CONECT 43 41 CONECT 44 42 48 CONECT 45 42 46 CONECT 46 45 47 CONECT 47 46 48 CONECT 48 47 44 CONECT 49 34 50 51 99 CONECT 50 49 54 CONECT 51 49 52 53 CONECT 52 51 CONECT 53 51 CONECT 54 50 59 55 CONECT 55 54 56 CONECT 56 55 57 CONECT 57 56 58 CONECT 58 57 59 CONECT 59 54 58 CONECT 60 19 CONECT 61 19 62 CONECT 62 61 63 CONECT 63 62 64 CONECT 64 63 65 CONECT 65 64 66 67 CONECT 66 65 68 CONECT 67 65 CONECT 68 66 69 CONECT 69 68 70 CONECT 70 69 71 CONECT 71 70 72 CONECT 72 71 73 CONECT 73 72 74 75 CONECT 74 73 CONECT 75 73 76 CONECT 76 75 77 81 CONECT 77 76 85 78 CONECT 78 79 77 82 CONECT 79 78 80 CONECT 80 79 81 94 CONECT 81 76 80 CONECT 82 78 83 CONECT 83 82 84 90 CONECT 84 83 85 CONECT 85 77 84 86 CONECT 86 85 87 88 89 CONECT 87 86 CONECT 88 86 CONECT 89 86 CONECT 90 83 91 92 93 CONECT 91 90 CONECT 92 90 CONECT 93 90 CONECT 94 80 95 96 97 CONECT 95 94 CONECT 96 94 CONECT 97 94 CONECT 98 23 CONECT 99 49 MASTER 0 0 0 0 0 0 0 0 99 0 212 0 END