HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 C UNK 0 -5.910 -1.789 4.769 0.00 0.00 C+0 HETATM 2 O UNK 0 -5.305 -2.512 3.704 0.00 0.00 O+0 HETATM 3 C UNK 0 -3.940 -2.149 3.462 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.825 -0.775 2.817 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.383 -0.462 2.414 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.227 0.031 0.962 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.039 1.304 0.647 0.00 0.00 C+0 HETATM 8 O UNK 0 -2.723 2.263 1.665 0.00 0.00 O+0 HETATM 9 C UNK 0 -3.494 3.469 1.623 0.00 0.00 C+0 HETATM 10 O UNK 0 -4.877 3.179 1.814 0.00 0.00 O+0 HETATM 11 C UNK 0 -3.010 4.342 2.814 0.00 0.00 C+0 HETATM 12 O UNK 0 -1.649 4.769 2.621 0.00 0.00 O+0 HETATM 13 C UNK 0 -3.118 3.566 4.128 0.00 0.00 C+0 HETATM 14 O UNK 0 -4.106 3.417 4.829 0.00 0.00 O+0 HETATM 15 O UNK 0 -1.934 3.023 4.513 0.00 0.00 O+0 HETATM 16 C UNK 0 -3.246 4.173 0.259 0.00 0.00 C+0 HETATM 17 C UNK 0 -4.021 5.490 0.121 0.00 0.00 C+0 HETATM 18 C UNK 0 -3.585 3.212 -0.905 0.00 0.00 C+0 HETATM 19 O UNK 0 -4.999 2.928 -0.868 0.00 0.00 O+0 HETATM 20 C UNK 0 -5.670 3.285 -2.073 0.00 0.00 C+0 HETATM 21 C UNK 0 -2.765 1.890 -0.777 0.00 0.00 C+0 HETATM 22 C UNK 0 -3.184 0.867 -1.848 0.00 0.00 C+0 HETATM 23 O UNK 0 -1.349 2.168 -0.854 0.00 0.00 O+0 HETATM 24 C UNK 0 -0.820 2.533 -2.120 0.00 0.00 C+0 HETATM 25 O UNK 0 -1.489 -1.535 2.730 0.00 0.00 O+0 HETATM 26 C UNK 0 -1.822 -2.835 2.244 0.00 0.00 C+0 HETATM 27 O UNK 0 -1.524 -2.915 0.844 0.00 0.00 O+0 HETATM 28 C UNK 0 -0.160 -3.386 0.655 0.00 0.00 C+0 HETATM 29 C UNK 0 0.611 -2.243 -0.012 0.00 0.00 C+0 HETATM 30 C UNK 0 -0.271 -4.654 -0.241 0.00 0.00 C+0 HETATM 31 C UNK 0 -0.768 -4.409 -1.665 0.00 0.00 C+0 HETATM 32 C UNK 0 0.498 -4.454 -2.488 0.00 0.00 C+0 HETATM 33 C UNK 0 1.307 -5.508 -1.753 0.00 0.00 C+0 HETATM 34 C UNK 0 2.827 -5.468 -1.966 0.00 0.00 C+0 HETATM 35 C UNK 0 3.255 -5.594 -3.427 0.00 0.00 C+0 HETATM 36 C UNK 0 3.756 -4.210 -3.777 0.00 0.00 C+0 HETATM 37 C UNK 0 4.322 -3.748 -2.445 0.00 0.00 C+0 HETATM 38 C UNK 0 4.510 -2.227 -2.326 0.00 0.00 C+0 HETATM 39 O UNK 0 5.422 -1.812 -3.348 0.00 0.00 O+0 HETATM 40 C UNK 0 5.604 -0.401 -3.446 0.00 0.00 C+0 HETATM 41 C UNK 0 4.373 0.267 -4.068 0.00 0.00 C+0 HETATM 42 O UNK 0 6.673 -0.234 -4.381 0.00 0.00 O+0 HETATM 43 C UNK 0 6.091 0.188 -2.106 0.00 0.00 C+0 HETATM 44 C UNK 0 6.249 1.714 -2.138 0.00 0.00 C+0 HETATM 45 C UNK 0 5.227 -0.266 -0.915 0.00 0.00 C+0 HETATM 46 O UNK 0 3.966 0.413 -0.969 0.00 0.00 O+0 HETATM 47 C UNK 0 3.370 0.639 0.314 0.00 0.00 C+0 HETATM 48 C UNK 0 2.053 1.374 0.067 0.00 0.00 C+0 HETATM 49 C UNK 0 1.379 1.752 1.381 0.00 0.00 C+0 HETATM 50 C UNK 0 2.344 2.530 2.278 0.00 0.00 C+0 HETATM 51 O UNK 0 2.656 3.813 1.714 0.00 0.00 O+0 HETATM 52 C UNK 0 1.613 4.769 1.833 0.00 0.00 C+0 HETATM 53 C UNK 0 3.651 1.715 2.420 0.00 0.00 C+0 HETATM 54 C UNK 0 4.707 2.461 3.228 0.00 0.00 C+0 HETATM 55 O UNK 0 4.229 1.423 1.138 0.00 0.00 O+0 HETATM 56 C UNK 0 5.009 -1.791 -0.930 0.00 0.00 C+0 HETATM 57 C UNK 0 6.293 -2.514 -0.498 0.00 0.00 C+0 HETATM 58 O UNK 0 3.380 -4.228 -1.476 0.00 0.00 O+0 HETATM 59 O UNK 0 0.996 -5.329 -0.356 0.00 0.00 O+0 HETATM 60 C UNK 0 0.399 -3.755 2.057 0.00 0.00 C+0 HETATM 61 O UNK 0 1.263 -2.757 2.616 0.00 0.00 O+0 HETATM 62 C UNK 0 2.637 -3.114 2.511 0.00 0.00 C+0 HETATM 63 C UNK 0 -0.878 -3.873 2.885 0.00 0.00 C+0 HETATM 64 C UNK 0 -0.678 -3.734 4.390 0.00 0.00 C+0 HETATM 65 C UNK 0 -3.305 -3.203 2.538 0.00 0.00 C+0 HETATM 66 C UNK 0 -4.127 -3.463 1.264 0.00 0.00 C+0 HETATM 67 H UNK 0 -6.048 -0.739 4.499 0.00 0.00 H+0 HETATM 68 H UNK 0 -5.315 -1.873 5.684 0.00 0.00 H+0 HETATM 69 H UNK 0 -6.896 -2.223 4.957 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.406 -2.157 4.422 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.177 0.003 3.506 0.00 0.00 H+0 HETATM 72 H UNK 0 -4.514 -0.712 1.967 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.039 0.351 3.066 0.00 0.00 H+0 HETATM 74 H UNK 0 -2.516 -0.762 0.268 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.161 0.215 0.790 0.00 0.00 H+0 HETATM 76 H UNK 0 -4.102 1.052 0.729 0.00 0.00 H+0 HETATM 77 H UNK 0 -5.269 3.032 0.930 0.00 0.00 H+0 HETATM 78 H UNK 0 -3.620 5.243 2.931 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.132 3.947 2.754 0.00 0.00 H+0 HETATM 80 H UNK 0 -2.157 2.565 5.350 0.00 0.00 H+0 HETATM 81 H UNK 0 -2.177 4.409 0.172 0.00 0.00 H+0 HETATM 82 H UNK 0 -5.096 5.355 0.273 0.00 0.00 H+0 HETATM 83 H UNK 0 -3.669 6.232 0.844 0.00 0.00 H+0 HETATM 84 H UNK 0 -3.873 5.919 -0.876 0.00 0.00 H+0 HETATM 85 H UNK 0 -3.333 3.718 -1.845 0.00 0.00 H+0 HETATM 86 H UNK 0 -5.588 4.361 -2.251 0.00 0.00 H+0 HETATM 87 H UNK 0 -6.727 3.028 -1.964 0.00 0.00 H+0 HETATM 88 H UNK 0 -5.261 2.730 -2.922 0.00 0.00 H+0 HETATM 89 H UNK 0 -2.488 0.023 -1.887 0.00 0.00 H+0 HETATM 90 H UNK 0 -3.178 1.318 -2.847 0.00 0.00 H+0 HETATM 91 H UNK 0 -4.192 0.478 -1.667 0.00 0.00 H+0 HETATM 92 H UNK 0 0.222 2.831 -1.977 0.00 0.00 H+0 HETATM 93 H UNK 0 -0.830 1.681 -2.805 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.353 3.379 -2.558 0.00 0.00 H+0 HETATM 95 H UNK 0 0.661 -1.370 0.646 0.00 0.00 H+0 HETATM 96 H UNK 0 0.102 -1.885 -0.913 0.00 0.00 H+0 HETATM 97 H UNK 0 1.630 -2.531 -0.277 0.00 0.00 H+0 HETATM 98 H UNK 0 -0.968 -5.352 0.241 0.00 0.00 H+0 HETATM 99 H UNK 0 -1.345 -3.490 -1.795 0.00 0.00 H+0 HETATM 100 H UNK 0 -1.418 -5.240 -1.967 0.00 0.00 H+0 HETATM 101 H UNK 0 0.996 -3.480 -2.468 0.00 0.00 H+0 HETATM 102 H UNK 0 0.313 -4.715 -3.534 0.00 0.00 H+0 HETATM 103 H UNK 0 0.939 -6.505 -2.031 0.00 0.00 H+0 HETATM 104 H UNK 0 3.281 -6.268 -1.369 0.00 0.00 H+0 HETATM 105 H UNK 0 4.083 -6.311 -3.499 0.00 0.00 H+0 HETATM 106 H UNK 0 2.466 -5.949 -4.096 0.00 0.00 H+0 HETATM 107 H UNK 0 4.498 -4.214 -4.581 0.00 0.00 H+0 HETATM 108 H UNK 0 2.916 -3.578 -4.087 0.00 0.00 H+0 HETATM 109 H UNK 0 5.277 -4.265 -2.285 0.00 0.00 H+0 HETATM 110 H UNK 0 3.530 -1.765 -2.502 0.00 0.00 H+0 HETATM 111 H UNK 0 4.582 1.300 -4.364 0.00 0.00 H+0 HETATM 112 H UNK 0 3.502 0.261 -3.409 0.00 0.00 H+0 HETATM 113 H UNK 0 4.078 -0.267 -4.980 0.00 0.00 H+0 HETATM 114 H UNK 0 6.377 -0.699 -5.180 0.00 0.00 H+0 HETATM 115 H UNK 0 7.101 -0.212 -1.933 0.00 0.00 H+0 HETATM 116 H UNK 0 6.919 2.022 -2.948 0.00 0.00 H+0 HETATM 117 H UNK 0 5.292 2.227 -2.276 0.00 0.00 H+0 HETATM 118 H UNK 0 6.683 2.072 -1.198 0.00 0.00 H+0 HETATM 119 H UNK 0 5.755 0.019 0.004 0.00 0.00 H+0 HETATM 120 H UNK 0 3.179 -0.325 0.798 0.00 0.00 H+0 HETATM 121 H UNK 0 1.386 0.757 -0.546 0.00 0.00 H+0 HETATM 122 H UNK 0 2.248 2.283 -0.516 0.00 0.00 H+0 HETATM 123 H UNK 0 0.475 2.330 1.172 0.00 0.00 H+0 HETATM 124 H UNK 0 1.062 0.839 1.900 0.00 0.00 H+0 HETATM 125 H UNK 0 1.904 2.675 3.273 0.00 0.00 H+0 HETATM 126 H UNK 0 1.282 4.858 2.872 0.00 0.00 H+0 HETATM 127 H UNK 0 2.003 5.739 1.511 0.00 0.00 H+0 HETATM 128 H UNK 0 0.774 4.512 1.183 0.00 0.00 H+0 HETATM 129 H UNK 0 3.439 0.764 2.925 0.00 0.00 H+0 HETATM 130 H UNK 0 5.598 1.835 3.353 0.00 0.00 H+0 HETATM 131 H UNK 0 5.038 3.370 2.714 0.00 0.00 H+0 HETATM 132 H UNK 0 4.331 2.731 4.219 0.00 0.00 H+0 HETATM 133 H UNK 0 4.233 -2.046 -0.200 0.00 0.00 H+0 HETATM 134 H UNK 0 7.077 -2.453 -1.258 0.00 0.00 H+0 HETATM 135 H UNK 0 6.098 -3.572 -0.299 0.00 0.00 H+0 HETATM 136 H UNK 0 6.686 -2.087 0.431 0.00 0.00 H+0 HETATM 137 H UNK 0 0.919 -4.721 2.064 0.00 0.00 H+0 HETATM 138 H UNK 0 2.853 -3.962 3.167 0.00 0.00 H+0 HETATM 139 H UNK 0 2.906 -3.362 1.481 0.00 0.00 H+0 HETATM 140 H UNK 0 3.238 -2.261 2.837 0.00 0.00 H+0 HETATM 141 H UNK 0 -1.281 -4.877 2.685 0.00 0.00 H+0 HETATM 142 H UNK 0 0.042 -4.477 4.748 0.00 0.00 H+0 HETATM 143 H UNK 0 -1.619 -3.900 4.923 0.00 0.00 H+0 HETATM 144 H UNK 0 -0.306 -2.744 4.673 0.00 0.00 H+0 HETATM 145 H UNK 0 -3.348 -4.155 3.085 0.00 0.00 H+0 HETATM 146 H UNK 0 -3.696 -4.292 0.691 0.00 0.00 H+0 HETATM 147 H UNK 0 -5.156 -3.746 1.506 0.00 0.00 H+0 HETATM 148 H UNK 0 -4.165 -2.585 0.612 0.00 0.00 H+0 CONECT 1 2 67 68 69 CONECT 2 3 1 CONECT 3 65 4 2 70 CONECT 4 5 3 71 72 CONECT 5 6 25 4 73 CONECT 6 5 7 74 75 CONECT 7 8 21 6 76 CONECT 8 9 7 CONECT 9 10 11 16 8 CONECT 10 9 77 CONECT 11 9 12 13 78 CONECT 12 11 79 CONECT 13 11 14 15 CONECT 14 13 CONECT 15 13 80 CONECT 16 17 9 18 81 CONECT 17 16 82 83 84 CONECT 18 19 16 21 85 CONECT 19 18 20 CONECT 20 19 86 87 88 CONECT 21 23 22 7 18 CONECT 22 21 89 90 91 CONECT 23 21 24 CONECT 24 23 92 93 94 CONECT 25 5 26 CONECT 26 25 65 27 63 CONECT 27 28 26 CONECT 28 30 60 27 29 CONECT 29 28 95 96 97 CONECT 30 28 59 31 98 CONECT 31 32 30 99 100 CONECT 32 31 33 101 102 CONECT 33 34 32 59 103 CONECT 34 35 33 104 58 CONECT 35 34 36 105 106 CONECT 36 35 37 107 108 CONECT 37 38 36 58 109 CONECT 38 37 56 39 110 CONECT 39 40 38 CONECT 40 39 43 42 41 CONECT 41 40 111 112 113 CONECT 42 40 114 CONECT 43 40 45 44 115 CONECT 44 43 116 117 118 CONECT 45 46 43 56 119 CONECT 46 45 47 CONECT 47 46 55 48 120 CONECT 48 49 47 121 122 CONECT 49 50 48 123 124 CONECT 50 53 49 51 125 CONECT 51 50 52 CONECT 52 51 126 127 128 CONECT 53 55 50 54 129 CONECT 54 53 130 131 132 CONECT 55 53 47 CONECT 56 38 45 57 133 CONECT 57 56 134 135 136 CONECT 58 37 34 CONECT 59 33 30 CONECT 60 63 28 61 137 CONECT 61 60 62 CONECT 62 61 138 139 140 CONECT 63 60 26 64 141 CONECT 64 63 142 143 144 CONECT 65 26 3 66 145 CONECT 66 65 146 147 148 CONECT 67 1 CONECT 68 1 CONECT 69 1 CONECT 70 3 CONECT 71 4 CONECT 72 4 CONECT 73 5 CONECT 74 6 CONECT 75 6 CONECT 76 7 CONECT 77 10 CONECT 78 11 CONECT 79 12 CONECT 80 15 CONECT 81 16 CONECT 82 17 CONECT 83 17 CONECT 84 17 CONECT 85 18 CONECT 86 20 CONECT 87 20 CONECT 88 20 CONECT 89 22 CONECT 90 22 CONECT 91 22 CONECT 92 24 CONECT 93 24 CONECT 94 24 CONECT 95 29 CONECT 96 29 CONECT 97 29 CONECT 98 30 CONECT 99 31 CONECT 100 31 CONECT 101 32 CONECT 102 32 CONECT 103 33 CONECT 104 34 CONECT 105 35 CONECT 106 35 CONECT 107 36 CONECT 108 36 CONECT 109 37 CONECT 110 38 CONECT 111 41 CONECT 112 41 CONECT 113 41 CONECT 114 42 CONECT 115 43 CONECT 116 44 CONECT 117 44 CONECT 118 44 CONECT 119 45 CONECT 120 47 CONECT 121 48 CONECT 122 48 CONECT 123 49 CONECT 124 49 CONECT 125 50 CONECT 126 52 CONECT 127 52 CONECT 128 52 CONECT 129 53 CONECT 130 54 CONECT 131 54 CONECT 132 54 CONECT 133 56 CONECT 134 57 CONECT 135 57 CONECT 136 57 CONECT 137 60 CONECT 138 62 CONECT 139 62 CONECT 140 62 CONECT 141 63 CONECT 142 64 CONECT 143 64 CONECT 144 64 CONECT 145 65 CONECT 146 66 CONECT 147 66 CONECT 148 66 MASTER 0 0 0 0 0 0 0 0 148 0 308 0 END