HEADER PROTEIN 30-JUN-20 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-JUN-20 0 HETATM 1 N UNK 0 -0.896 0.680 0.000 0.00 0.00 N+0 HETATM 2 C UNK 0 -0.896 -0.860 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -2.220 -1.644 0.000 0.00 0.00 C+0 HETATM 4 N UNK 0 -2.211 -3.184 0.000 0.00 0.00 N+0 HETATM 5 N UNK 0 -8.884 -0.878 0.000 0.00 0.00 N+0 HETATM 6 N UNK 0 -7.650 2.976 0.000 0.00 0.00 N+0 HETATM 7 C UNK 0 -10.217 -1.662 0.000 0.00 0.00 C+0 HETATM 8 N UNK 0 -3.562 3.733 0.000 0.00 0.00 N+0 HETATM 9 C UNK 0 -2.238 1.436 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -4.913 2.958 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -7.641 1.436 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -4.804 5.975 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.535 -3.985 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -10.235 -3.238 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.508 -5.507 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -6.245 3.733 0.000 0.00 0.00 C+0 HETATM 17 N UNK 0 -11.424 -3.994 0.000 0.00 0.00 N+0 HETATM 18 C UNK 0 -8.884 0.680 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -12.838 -3.346 0.000 0.00 0.00 C+0 HETATM 20 N UNK 0 -2.319 6.029 0.000 0.00 0.00 N+0 HETATM 21 N UNK 0 -4.841 -6.290 0.000 0.00 0.00 N+0 HETATM 22 C UNK 0 -3.544 5.111 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.238 2.976 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -6.245 5.273 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -4.345 7.443 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -4.859 -7.830 0.000 0.00 0.00 C+0 HETATM 27 S UNK 0 -6.074 -3.985 0.000 0.00 0.00 S+0 HETATM 28 S UNK 0 -7.732 -3.210 0.000 0.00 0.00 S+0 HETATM 29 C UNK 0 -2.805 7.443 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -14.162 -4.156 0.000 0.00 0.00 C+0 HETATM 31 O UNK 0 -3.571 -0.887 0.000 0.00 0.00 O+0 HETATM 32 O UNK 0 -11.568 -0.914 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 -3.571 0.680 0.000 0.00 0.00 O+0 HETATM 34 O UNK 0 -4.913 1.436 0.000 0.00 0.00 O+0 HETATM 35 O UNK 0 -6.245 0.680 0.000 0.00 0.00 O+0 HETATM 36 O UNK 0 -2.238 -6.237 0.000 0.00 0.00 O+0 HETATM 37 C UNK 0 -10.217 1.436 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 -12.838 -1.806 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -4.814 -3.238 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -8.974 -3.913 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 0.455 -1.617 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 -14.153 -5.696 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 -3.481 -8.587 0.000 0.00 0.00 C+0 HETATM 44 N UNK 0 -15.513 -3.427 0.000 0.00 0.00 N+0 HETATM 45 C UNK 0 -10.208 2.958 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -12.829 -6.453 0.000 0.00 0.00 C+0 HETATM 47 N UNK 0 4.453 3.760 0.000 0.00 0.00 N+0 HETATM 48 O UNK 0 0.464 -3.157 0.000 0.00 0.00 O+0 HETATM 49 O UNK 0 -3.463 -10.145 0.000 0.00 0.00 O+0 HETATM 50 C UNK 0 -6.155 -8.641 0.000 0.00 0.00 C+0 HETATM 51 O UNK 0 -7.506 -7.875 0.000 0.00 0.00 O+0 HETATM 52 C UNK 0 -5.129 8.794 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 -0.896 3.760 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 -2.004 8.794 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 3.112 2.985 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 1.779 -0.824 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 -2.157 -7.804 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 -12.811 -7.993 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 -11.559 3.760 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 -8.839 3.688 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 -11.478 -5.687 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 0.437 2.985 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 1.779 3.760 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 -4.354 10.136 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 -2.805 10.145 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 -10.208 -6.453 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 -11.532 -8.713 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 -11.559 5.300 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 -8.830 5.246 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 -10.136 6.038 0.000 0.00 0.00 C+0 HETATM 71 C UNK 0 -10.208 -7.993 0.000 0.00 0.00 C+0 HETATM 72 H UNK 0 0.356 -0.122 0.000 0.00 0.00 H+0 HETATM 73 C UNK 0 12.892 -6.453 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 10.784 1.337 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 10.784 -1.319 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 11.559 -4.156 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 11.559 0.013 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 12.892 -4.931 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 11.541 -2.643 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 11.568 -7.227 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 9.244 1.355 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 14.216 -7.209 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 11.541 2.661 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 9.244 -1.319 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 10.244 -4.940 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 8.488 0.004 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 10.244 -6.471 0.000 0.00 0.00 C+0 HETATM 88 O UNK 0 14.216 -8.740 0.000 0.00 0.00 O+0 HETATM 89 O UNK 0 10.784 3.985 0.000 0.00 0.00 O+0 HETATM 90 O UNK 0 14.207 -4.156 0.000 0.00 0.00 O+0 HETATM 91 O UNK 0 13.081 0.004 0.000 0.00 0.00 O+0 HETATM 92 O UNK 0 13.081 2.661 0.000 0.00 0.00 O+0 HETATM 93 O UNK 0 15.513 -6.453 0.000 0.00 0.00 O+0 HETATM 94 C UNK 0 8.938 -4.183 0.000 0.00 0.00 C+0 HETATM 95 C UNK 0 8.488 -2.643 0.000 0.00 0.00 C+0 HETATM 96 C UNK 0 6.948 0.004 0.000 0.00 0.00 C+0 HETATM 97 C UNK 0 8.938 -7.236 0.000 0.00 0.00 C+0 HETATM 98 C UNK 0 6.966 -2.661 0.000 0.00 0.00 C+0 HETATM 99 C UNK 0 7.623 -4.958 0.000 0.00 0.00 C+0 HETATM 100 C UNK 0 7.623 -6.480 0.000 0.00 0.00 C+0 HETATM 101 C UNK 0 6.192 -1.319 0.000 0.00 0.00 C+0 CONECT 1 2 9 CONECT 2 1 3 41 72 CONECT 3 2 4 31 CONECT 4 3 13 CONECT 5 18 7 CONECT 6 16 11 CONECT 7 5 32 14 CONECT 8 23 10 CONECT 9 1 23 33 CONECT 10 8 16 34 CONECT 11 6 18 35 CONECT 12 24 22 25 CONECT 13 4 15 39 CONECT 14 40 17 7 CONECT 15 13 21 36 CONECT 16 6 10 24 CONECT 17 14 19 CONECT 18 5 11 37 CONECT 19 17 30 38 CONECT 20 22 29 CONECT 21 15 26 CONECT 22 20 12 CONECT 23 8 9 53 CONECT 24 12 16 CONECT 25 12 29 52 CONECT 26 21 43 50 CONECT 27 39 28 CONECT 28 27 40 CONECT 29 25 54 20 CONECT 30 19 42 44 CONECT 31 3 CONECT 32 7 CONECT 33 9 CONECT 34 10 CONECT 35 11 CONECT 36 15 CONECT 37 18 45 CONECT 38 19 CONECT 39 27 13 CONECT 40 14 28 CONECT 41 2 48 56 CONECT 42 30 46 CONECT 43 26 49 57 CONECT 44 30 CONECT 45 37 59 60 CONECT 46 42 58 61 CONECT 47 55 CONECT 48 41 CONECT 49 43 CONECT 50 26 51 CONECT 51 50 CONECT 52 25 64 CONECT 53 23 62 CONECT 54 29 65 CONECT 55 47 63 CONECT 56 41 CONECT 57 43 CONECT 58 46 67 CONECT 59 45 68 CONECT 60 45 69 CONECT 61 46 66 CONECT 62 53 63 CONECT 63 55 62 CONECT 64 52 65 CONECT 65 64 54 CONECT 66 61 71 CONECT 67 58 71 CONECT 68 59 70 CONECT 69 60 70 CONECT 70 69 68 CONECT 71 66 67 CONECT 72 2 CONECT 73 78 80 82 CONECT 74 77 83 81 CONECT 75 79 77 84 CONECT 76 78 79 85 CONECT 77 74 75 91 CONECT 78 76 73 90 CONECT 79 75 76 CONECT 80 73 87 CONECT 81 86 74 CONECT 82 73 88 93 CONECT 83 74 89 92 CONECT 84 75 86 95 CONECT 85 87 94 76 CONECT 86 81 84 96 CONECT 87 85 80 97 CONECT 88 82 CONECT 89 83 CONECT 90 78 CONECT 91 77 CONECT 92 83 CONECT 93 82 CONECT 94 85 99 CONECT 95 84 98 CONECT 96 86 101 CONECT 97 87 100 CONECT 98 95 101 CONECT 99 100 94 CONECT 100 99 97 CONECT 101 98 96 MASTER 0 0 0 0 0 0 0 0 101 0 216 0 END