HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 2.509 -2.422 3.519 0.00 0.00 C+0 HETATM 2 O UNK 0 1.792 -1.226 3.351 0.00 0.00 O+0 HETATM 3 C UNK 0 1.772 -0.845 2.034 0.00 0.00 C+0 HETATM 4 C UNK 0 0.361 -0.678 1.469 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.426 -1.838 1.972 0.00 0.00 C+0 HETATM 6 O UNK 0 -1.733 -1.804 1.640 0.00 0.00 O+0 HETATM 7 C UNK 0 -2.058 -1.875 0.330 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.991 -0.818 -0.128 0.00 0.00 C+0 HETATM 9 C UNK 0 -3.530 -0.972 -1.379 0.00 0.00 C+0 HETATM 10 C UNK 0 -4.398 -0.020 -1.858 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.737 1.088 -1.098 0.00 0.00 C+0 HETATM 12 C UNK 0 -4.205 1.258 0.163 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.322 0.287 0.644 0.00 0.00 C+0 HETATM 14 O UNK 0 -2.778 0.405 1.867 0.00 0.00 O+0 HETATM 15 C UNK 0 -4.584 2.438 0.938 0.00 0.00 C+0 HETATM 16 O UNK 0 -4.084 2.561 2.075 0.00 0.00 O+0 HETATM 17 C UNK 0 -5.504 3.467 0.461 0.00 0.00 C+0 HETATM 18 C UNK 0 -5.826 4.569 1.248 0.00 0.00 C+0 HETATM 19 O UNK 0 -5.331 4.785 2.494 0.00 0.00 O+0 HETATM 20 C UNK 0 -6.715 5.495 0.698 0.00 0.00 C+0 HETATM 21 C UNK 0 -7.231 5.307 -0.554 0.00 0.00 C+0 HETATM 22 C UNK 0 -6.901 4.215 -1.313 0.00 0.00 C+0 HETATM 23 C UNK 0 -6.030 3.285 -0.805 0.00 0.00 C+0 HETATM 24 C UNK 0 -5.656 2.099 -1.598 0.00 0.00 C+0 HETATM 25 O UNK 0 -6.159 1.986 -2.728 0.00 0.00 O+0 HETATM 26 C UNK 0 -3.159 -2.176 -2.151 0.00 0.00 C+0 HETATM 27 O UNK 0 -3.279 -2.157 -3.387 0.00 0.00 O+0 HETATM 28 C UNK 0 -2.652 -3.394 -1.475 0.00 0.00 C+0 HETATM 29 C UNK 0 -3.361 -4.640 -1.956 0.00 0.00 C+0 HETATM 30 O UNK 0 -1.271 -3.498 -1.702 0.00 0.00 O+0 HETATM 31 C UNK 0 -2.826 -3.193 0.015 0.00 0.00 C+0 HETATM 32 O UNK 0 -2.311 -4.234 0.758 0.00 0.00 O+0 HETATM 33 C UNK 0 -3.361 -4.736 1.546 0.00 0.00 C+0 HETATM 34 O UNK 0 0.419 -0.474 0.139 0.00 0.00 O+0 HETATM 35 C UNK 0 1.206 0.516 -0.341 0.00 0.00 C+0 HETATM 36 C UNK 0 1.503 0.326 -1.825 0.00 0.00 C+0 HETATM 37 C UNK 0 2.493 0.765 0.360 0.00 0.00 C+0 HETATM 38 O UNK 0 3.446 -0.182 -0.150 0.00 0.00 O+0 HETATM 39 C UNK 0 4.609 0.248 -0.779 0.00 0.00 C+0 HETATM 40 O UNK 0 4.749 1.495 -0.861 0.00 0.00 O+0 HETATM 41 C UNK 0 5.615 -0.700 -1.316 0.00 0.00 C+0 HETATM 42 C UNK 0 6.780 -0.017 -1.952 0.00 0.00 C+0 HETATM 43 C UNK 0 7.465 0.843 -0.965 0.00 0.00 C+0 HETATM 44 C UNK 0 7.653 2.139 -1.096 0.00 0.00 C+0 HETATM 45 C UNK 0 7.236 3.034 -2.233 0.00 0.00 C+0 HETATM 46 C UNK 0 8.374 2.586 0.114 0.00 0.00 C+0 HETATM 47 O UNK 0 8.705 3.779 0.297 0.00 0.00 O+0 HETATM 48 O UNK 0 8.602 1.509 0.958 0.00 0.00 O+0 HETATM 49 C UNK 0 8.038 0.416 0.293 0.00 0.00 C+0 HETATM 50 O UNK 0 8.063 -0.763 0.786 0.00 0.00 O+0 HETATM 51 C UNK 0 2.436 0.503 1.846 0.00 0.00 C+0 HETATM 52 O UNK 0 3.700 0.553 2.426 0.00 0.00 O+0 HETATM 53 H UNK 0 3.574 -2.291 3.174 0.00 0.00 H+0 HETATM 54 H UNK 0 2.572 -2.714 4.577 0.00 0.00 H+0 HETATM 55 H UNK 0 2.102 -3.252 2.923 0.00 0.00 H+0 HETATM 56 H UNK 0 2.317 -1.565 1.427 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.086 0.255 1.929 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.379 -1.804 3.109 0.00 0.00 H+0 HETATM 59 H UNK 0 0.067 -2.819 1.736 0.00 0.00 H+0 HETATM 60 H UNK 0 -1.136 -1.946 -0.321 0.00 0.00 H+0 HETATM 61 H UNK 0 -4.805 -0.168 -2.847 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.747 0.954 2.636 0.00 0.00 H+0 HETATM 63 H UNK 0 -4.725 4.271 3.022 0.00 0.00 H+0 HETATM 64 H UNK 0 -6.968 6.361 1.319 0.00 0.00 H+0 HETATM 65 H UNK 0 -7.923 6.073 -0.923 0.00 0.00 H+0 HETATM 66 H UNK 0 -7.310 4.081 -2.288 0.00 0.00 H+0 HETATM 67 H UNK 0 -4.350 -4.692 -1.460 0.00 0.00 H+0 HETATM 68 H UNK 0 -2.762 -5.510 -1.648 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.415 -4.606 -3.045 0.00 0.00 H+0 HETATM 70 H UNK 0 -1.051 -4.454 -1.887 0.00 0.00 H+0 HETATM 71 H UNK 0 -3.899 -2.997 0.198 0.00 0.00 H+0 HETATM 72 H UNK 0 -4.195 -5.100 0.899 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.035 -5.531 2.223 0.00 0.00 H+0 HETATM 74 H UNK 0 -3.795 -3.882 2.129 0.00 0.00 H+0 HETATM 75 H UNK 0 0.611 1.477 -0.289 0.00 0.00 H+0 HETATM 76 H UNK 0 0.538 0.211 -2.390 0.00 0.00 H+0 HETATM 77 H UNK 0 2.169 -0.544 -2.004 0.00 0.00 H+0 HETATM 78 H UNK 0 2.003 1.210 -2.256 0.00 0.00 H+0 HETATM 79 H UNK 0 2.850 1.792 0.165 0.00 0.00 H+0 HETATM 80 H UNK 0 5.925 -1.374 -0.489 0.00 0.00 H+0 HETATM 81 H UNK 0 5.152 -1.389 -2.079 0.00 0.00 H+0 HETATM 82 H UNK 0 6.517 0.521 -2.873 0.00 0.00 H+0 HETATM 83 H UNK 0 7.548 -0.780 -2.267 0.00 0.00 H+0 HETATM 84 H UNK 0 6.271 3.497 -1.966 0.00 0.00 H+0 HETATM 85 H UNK 0 8.042 3.794 -2.347 0.00 0.00 H+0 HETATM 86 H UNK 0 7.113 2.447 -3.165 0.00 0.00 H+0 HETATM 87 H UNK 0 1.807 1.256 2.351 0.00 0.00 H+0 HETATM 88 H UNK 0 4.296 -0.075 1.927 0.00 0.00 H+0 CONECT 1 2 53 54 55 CONECT 2 1 3 CONECT 3 2 4 51 56 CONECT 4 3 5 34 57 CONECT 5 4 6 58 59 CONECT 6 5 7 CONECT 7 6 8 31 60 CONECT 8 7 9 13 CONECT 9 8 10 26 CONECT 10 9 11 61 CONECT 11 10 12 24 CONECT 12 11 13 15 CONECT 13 12 14 8 CONECT 14 13 62 CONECT 15 12 16 17 CONECT 16 15 CONECT 17 15 18 23 CONECT 18 17 19 20 CONECT 19 18 63 CONECT 20 18 21 64 CONECT 21 20 22 65 CONECT 22 21 23 66 CONECT 23 22 24 17 CONECT 24 23 25 11 CONECT 25 24 CONECT 26 9 27 28 CONECT 27 26 CONECT 28 26 29 30 31 CONECT 29 28 67 68 69 CONECT 30 28 70 CONECT 31 28 32 7 71 CONECT 32 31 33 CONECT 33 32 72 73 74 CONECT 34 4 35 CONECT 35 34 36 37 75 CONECT 36 35 76 77 78 CONECT 37 35 38 51 79 CONECT 38 37 39 CONECT 39 38 40 41 CONECT 40 39 CONECT 41 39 42 80 81 CONECT 42 41 43 82 83 CONECT 43 42 44 49 CONECT 44 43 45 46 CONECT 45 44 84 85 86 CONECT 46 44 47 48 CONECT 47 46 CONECT 48 46 49 CONECT 49 48 50 43 CONECT 50 49 CONECT 51 37 52 3 87 CONECT 52 51 88 CONECT 53 1 CONECT 54 1 CONECT 55 1 CONECT 56 3 CONECT 57 4 CONECT 58 5 CONECT 59 5 CONECT 60 7 CONECT 61 10 CONECT 62 14 CONECT 63 19 CONECT 64 20 CONECT 65 21 CONECT 66 22 CONECT 67 29 CONECT 68 29 CONECT 69 29 CONECT 70 30 CONECT 71 31 CONECT 72 33 CONECT 73 33 CONECT 74 33 CONECT 75 35 CONECT 76 36 CONECT 77 36 CONECT 78 36 CONECT 79 37 CONECT 80 41 CONECT 81 41 CONECT 82 42 CONECT 83 42 CONECT 84 45 CONECT 85 45 CONECT 86 45 CONECT 87 51 CONECT 88 52 MASTER 0 0 0 0 0 0 0 0 88 0 186 0 END