HEADER PROTEIN 29-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 29-APR-22 0 HETATM 1 C UNK 0 8.315 2.424 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 7.483 1.128 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 6.792 -0.248 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 7.887 -1.331 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 9.255 -0.624 0.000 0.00 0.00 C+0 HETATM 6 H UNK 0 9.505 -2.143 0.000 0.00 0.00 H+0 HETATM 7 C UNK 0 9.006 0.896 0.000 0.00 0.00 C+0 HETATM 8 H UNK 0 10.382 0.205 0.000 0.00 0.00 H+0 HETATM 9 C UNK 0 10.374 1.603 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 10.606 3.125 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 11.469 0.520 0.000 0.00 0.00 C+0 HETATM 12 O UNK 0 12.013 1.961 0.000 0.00 0.00 O+0 HETATM 13 C UNK 0 13.532 2.211 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 14.508 1.020 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 16.028 1.269 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 13.965 -0.421 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 12.445 -0.671 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 10.778 -0.856 0.000 0.00 0.00 O+0 HETATM 19 H UNK 0 5.946 1.038 0.000 0.00 0.00 H+0 HETATM 20 C UNK 0 5.255 -0.338 0.000 0.00 0.00 C+0 HETATM 21 H UNK 0 3.717 -0.427 0.000 0.00 0.00 H+0 HETATM 22 C UNK 0 4.563 -1.714 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 3.026 -1.803 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 2.180 -0.517 0.000 0.00 0.00 C+0 HETATM 25 H UNK 0 1.334 0.770 0.000 0.00 0.00 H+0 HETATM 26 C UNK 0 0.642 -0.606 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -0.204 0.681 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 -1.741 0.591 0.000 0.00 0.00 O+0 HETATM 29 C UNK 0 -2.587 1.878 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -4.125 1.788 0.000 0.00 0.00 C+0 HETATM 31 O UNK 0 -4.816 0.412 0.000 0.00 0.00 O+0 HETATM 32 C UNK 0 -4.971 3.075 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 -6.508 2.985 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 -4.280 4.451 0.000 0.00 0.00 C+0 HETATM 35 O UNK 0 -5.126 5.738 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 -6.663 5.648 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 -7.510 6.935 0.000 0.00 0.00 C+0 HETATM 38 O UNK 0 -6.818 8.311 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 -9.047 6.845 0.000 0.00 0.00 C+0 HETATM 40 O UNK 0 -9.893 8.132 0.000 0.00 0.00 O+0 HETATM 41 C UNK 0 -9.738 5.469 0.000 0.00 0.00 C+0 HETATM 42 O UNK 0 -11.276 5.380 0.000 0.00 0.00 O+0 HETATM 43 C UNK 0 -12.122 6.666 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -11.431 8.043 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 -12.277 9.329 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -11.586 10.705 0.000 0.00 0.00 C+0 HETATM 47 O UNK 0 -12.432 11.992 0.000 0.00 0.00 O+0 HETATM 48 C UNK 0 -13.814 9.240 0.000 0.00 0.00 C+0 HETATM 49 O UNK 0 -14.660 10.526 0.000 0.00 0.00 O+0 HETATM 50 C UNK 0 -14.505 7.864 0.000 0.00 0.00 C+0 HETATM 51 O UNK 0 -16.043 7.774 0.000 0.00 0.00 O+0 HETATM 52 C UNK 0 -16.889 9.061 0.000 0.00 0.00 C+0 HETATM 53 O UNK 0 -16.198 10.437 0.000 0.00 0.00 O+0 HETATM 54 C UNK 0 -17.044 11.724 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 -16.353 13.100 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 -18.581 11.634 0.000 0.00 0.00 C+0 HETATM 57 O UNK 0 -19.428 12.921 0.000 0.00 0.00 O+0 HETATM 58 C UNK 0 -18.736 14.297 0.000 0.00 0.00 C+0 HETATM 59 O UNK 0 -17.199 14.387 0.000 0.00 0.00 O+0 HETATM 60 C UNK 0 -16.508 15.763 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 -14.970 15.852 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 -17.354 17.049 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 -16.663 18.426 0.000 0.00 0.00 O+0 HETATM 64 C UNK 0 -18.891 16.960 0.000 0.00 0.00 C+0 HETATM 65 O UNK 0 -19.738 18.247 0.000 0.00 0.00 O+0 HETATM 66 C UNK 0 -19.583 15.584 0.000 0.00 0.00 C+0 HETATM 67 O UNK 0 -21.120 15.494 0.000 0.00 0.00 O+0 HETATM 68 C UNK 0 -19.273 10.258 0.000 0.00 0.00 C+0 HETATM 69 O UNK 0 -20.810 10.169 0.000 0.00 0.00 O+0 HETATM 70 C UNK 0 -18.426 8.971 0.000 0.00 0.00 C+0 HETATM 71 O UNK 0 -19.117 7.595 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 -20.655 7.506 0.000 0.00 0.00 C+0 HETATM 73 O UNK 0 -21.346 6.130 0.000 0.00 0.00 O+0 HETATM 74 C UNK 0 -22.883 6.040 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 -23.575 4.664 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 -23.730 7.327 0.000 0.00 0.00 C+0 HETATM 77 O UNK 0 -25.267 7.237 0.000 0.00 0.00 O+0 HETATM 78 C UNK 0 -23.038 8.703 0.000 0.00 0.00 C+0 HETATM 79 O UNK 0 -23.885 9.990 0.000 0.00 0.00 O+0 HETATM 80 C UNK 0 -21.501 8.792 0.000 0.00 0.00 C+0 HETATM 81 O UNK 0 -21.751 10.312 0.000 0.00 0.00 O+0 HETATM 82 C UNK 0 -13.659 6.577 0.000 0.00 0.00 C+0 HETATM 83 O UNK 0 -14.350 5.201 0.000 0.00 0.00 O+0 HETATM 84 C UNK 0 -15.888 5.111 0.000 0.00 0.00 C+0 HETATM 85 O UNK 0 -16.734 6.398 0.000 0.00 0.00 O+0 HETATM 86 C UNK 0 -18.271 6.308 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 -18.962 4.932 0.000 0.00 0.00 C+0 HETATM 88 O UNK 0 -20.500 4.843 0.000 0.00 0.00 O+0 HETATM 89 C UNK 0 -18.116 3.646 0.000 0.00 0.00 C+0 HETATM 90 O UNK 0 -18.807 2.269 0.000 0.00 0.00 O+0 HETATM 91 C UNK 0 -16.579 3.735 0.000 0.00 0.00 C+0 HETATM 92 O UNK 0 -15.733 2.448 0.000 0.00 0.00 O+0 HETATM 93 C UNK 0 -8.892 4.183 0.000 0.00 0.00 C+0 HETATM 94 C UNK 0 -9.583 2.806 0.000 0.00 0.00 C+0 HETATM 95 O UNK 0 -11.121 2.717 0.000 0.00 0.00 O+0 HETATM 96 O UNK 0 -7.355 4.272 0.000 0.00 0.00 O+0 HETATM 97 C UNK 0 -2.742 4.541 0.000 0.00 0.00 C+0 HETATM 98 C UNK 0 -2.051 5.917 0.000 0.00 0.00 C+0 HETATM 99 O UNK 0 -0.514 6.006 0.000 0.00 0.00 O+0 HETATM 100 O UNK 0 -1.896 3.254 0.000 0.00 0.00 O+0 HETATM 101 C UNK 0 0.487 2.057 0.000 0.00 0.00 C+0 HETATM 102 C UNK 0 2.025 2.146 0.000 0.00 0.00 C+0 HETATM 103 C UNK 0 2.871 0.859 0.000 0.00 0.00 C+0 HETATM 104 C UNK 0 3.562 2.236 0.000 0.00 0.00 C+0 HETATM 105 C UNK 0 4.408 0.949 0.000 0.00 0.00 C+0 HETATM 106 H UNK 0 4.319 2.486 0.000 0.00 0.00 H+0 HETATM 107 C UNK 0 5.100 2.325 0.000 0.00 0.00 C+0 HETATM 108 C UNK 0 6.637 2.415 0.000 0.00 0.00 C+0 HETATM 109 O UNK 0 7.328 3.791 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 7 108 CONECT 3 2 4 19 20 CONECT 4 3 5 CONECT 5 4 6 7 18 CONECT 6 5 CONECT 7 5 2 8 9 CONECT 8 7 CONECT 9 7 10 11 CONECT 10 9 CONECT 11 9 12 17 18 CONECT 12 11 13 CONECT 13 12 14 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 17 CONECT 17 16 11 CONECT 18 11 5 CONECT 19 3 CONECT 20 3 21 22 105 CONECT 21 20 CONECT 22 20 23 CONECT 23 22 24 CONECT 24 23 25 26 103 CONECT 25 24 CONECT 26 24 27 CONECT 27 26 28 101 CONECT 28 27 29 CONECT 29 28 30 100 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 34 CONECT 33 32 CONECT 34 32 35 97 CONECT 35 34 36 CONECT 36 35 37 96 CONECT 37 36 38 39 CONECT 38 37 CONECT 39 37 40 41 CONECT 40 39 CONECT 41 39 42 93 CONECT 42 41 43 CONECT 43 42 44 82 CONECT 44 43 45 CONECT 45 44 46 48 CONECT 46 45 47 CONECT 47 46 CONECT 48 45 49 50 CONECT 49 48 CONECT 50 48 51 82 CONECT 51 50 52 CONECT 52 51 53 70 CONECT 53 52 54 CONECT 54 53 55 56 CONECT 55 54 CONECT 56 54 57 68 CONECT 57 56 58 CONECT 58 57 59 66 CONECT 59 58 60 CONECT 60 59 61 62 CONECT 61 60 CONECT 62 60 63 64 CONECT 63 62 CONECT 64 62 65 66 CONECT 65 64 CONECT 66 64 58 67 CONECT 67 66 CONECT 68 56 69 70 CONECT 69 68 CONECT 70 68 52 71 CONECT 71 70 72 CONECT 72 71 73 80 CONECT 73 72 74 CONECT 74 73 75 76 CONECT 75 74 CONECT 76 74 77 78 CONECT 77 76 CONECT 78 76 79 80 CONECT 79 78 CONECT 80 78 72 81 CONECT 81 80 CONECT 82 50 43 83 CONECT 83 82 84 CONECT 84 83 85 91 CONECT 85 84 86 CONECT 86 85 87 CONECT 87 86 88 89 CONECT 88 87 CONECT 89 87 90 91 CONECT 90 89 CONECT 91 89 84 92 CONECT 92 91 CONECT 93 41 94 96 CONECT 94 93 95 CONECT 95 94 CONECT 96 93 36 CONECT 97 34 98 100 CONECT 98 97 99 CONECT 99 98 CONECT 100 97 29 CONECT 101 27 102 CONECT 102 101 103 CONECT 103 102 24 104 105 CONECT 104 103 CONECT 105 103 20 106 107 CONECT 106 105 CONECT 107 105 108 CONECT 108 107 2 109 CONECT 109 108 MASTER 0 0 0 0 0 0 0 0 109 0 242 0 END