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 -9.480 -1.373 0.340 0.00 0.00 C+0 HETATM 2 O UNK 0 -8.351 -0.527 0.366 0.00 0.00 O+0 HETATM 3 C UNK 0 -7.199 -1.239 0.105 0.00 0.00 C+0 HETATM 4 C UNK 0 -6.235 -1.242 1.298 0.00 0.00 C+0 HETATM 5 O UNK 0 -7.022 -1.586 2.416 0.00 0.00 O+0 HETATM 6 C UNK 0 -7.244 -0.727 3.481 0.00 0.00 C+0 HETATM 7 N UNK 0 -8.052 -1.125 4.594 0.00 0.00 N+0 HETATM 8 O UNK 0 -6.714 0.397 3.428 0.00 0.00 O+0 HETATM 9 C UNK 0 -5.192 -2.250 0.950 0.00 0.00 C+0 HETATM 10 O UNK 0 -5.816 -3.423 0.557 0.00 0.00 O+0 HETATM 11 C UNK 0 -4.449 -1.724 -0.285 0.00 0.00 C+0 HETATM 12 O UNK 0 -3.563 -0.711 0.024 0.00 0.00 O+0 HETATM 13 C UNK 0 -2.230 -0.591 -0.129 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.462 -1.567 -0.691 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.093 -1.401 -0.829 0.00 0.00 C+0 HETATM 16 C UNK 0 0.507 -0.245 -0.398 0.00 0.00 C+0 HETATM 17 C UNK 0 1.885 -0.020 -0.511 0.00 0.00 C+0 HETATM 18 O UNK 0 2.694 -0.964 -1.065 0.00 0.00 O+0 HETATM 19 C UNK 0 2.421 1.166 -0.056 0.00 0.00 C+0 HETATM 20 N UNK 0 3.815 1.418 -0.162 0.00 0.00 N+0 HETATM 21 C UNK 0 4.292 2.056 -1.334 0.00 0.00 C+0 HETATM 22 O UNK 0 3.466 2.380 -2.236 0.00 0.00 O+0 HETATM 23 C UNK 0 5.713 2.326 -1.472 0.00 0.00 C+0 HETATM 24 C UNK 0 6.156 3.223 -2.452 0.00 0.00 C+0 HETATM 25 C UNK 0 7.497 3.471 -2.589 0.00 0.00 C+0 HETATM 26 C UNK 0 8.456 2.887 -1.813 0.00 0.00 C+0 HETATM 27 O UNK 0 9.795 3.188 -2.010 0.00 0.00 O+0 HETATM 28 C UNK 0 8.026 2.005 -0.848 0.00 0.00 C+0 HETATM 29 C UNK 0 9.066 1.358 0.007 0.00 0.00 C+0 HETATM 30 C UNK 0 8.387 0.452 0.958 0.00 0.00 C+0 HETATM 31 C UNK 0 8.626 -0.843 0.991 0.00 0.00 C+0 HETATM 32 C UNK 0 7.925 -1.728 1.961 0.00 0.00 C+0 HETATM 33 C UNK 0 9.604 -1.457 0.056 0.00 0.00 C+0 HETATM 34 C UNK 0 6.669 1.734 -0.688 0.00 0.00 C+0 HETATM 35 C UNK 0 1.604 2.112 0.501 0.00 0.00 C+0 HETATM 36 O UNK 0 2.112 3.185 0.909 0.00 0.00 O+0 HETATM 37 O UNK 0 0.319 1.877 0.594 0.00 0.00 O+0 HETATM 38 C UNK 0 -0.240 0.764 0.177 0.00 0.00 C+0 HETATM 39 C UNK 0 -1.603 0.564 0.298 0.00 0.00 C+0 HETATM 40 C UNK 0 -2.378 1.687 0.931 0.00 0.00 C+0 HETATM 41 O UNK 0 -5.270 -1.356 -1.317 0.00 0.00 O+0 HETATM 42 C UNK 0 -6.425 -0.694 -1.063 0.00 0.00 C+0 HETATM 43 C UNK 0 -6.132 0.766 -0.757 0.00 0.00 C+0 HETATM 44 C UNK 0 -7.336 -0.704 -2.303 0.00 0.00 C+0 HETATM 45 H UNK 0 -9.610 -1.863 -0.636 0.00 0.00 H+0 HETATM 46 H UNK 0 -10.395 -0.781 0.527 0.00 0.00 H+0 HETATM 47 H UNK 0 -9.404 -2.182 1.099 0.00 0.00 H+0 HETATM 48 H UNK 0 -7.419 -2.333 -0.070 0.00 0.00 H+0 HETATM 49 H UNK 0 -5.817 -0.231 1.357 0.00 0.00 H+0 HETATM 50 H UNK 0 -7.664 -1.710 5.353 0.00 0.00 H+0 HETATM 51 H UNK 0 -9.052 -0.841 4.681 0.00 0.00 H+0 HETATM 52 H UNK 0 -4.422 -2.397 1.719 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.372 -4.233 0.876 0.00 0.00 H+0 HETATM 54 H UNK 0 -3.813 -2.576 -0.698 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.861 -2.523 -1.063 0.00 0.00 H+0 HETATM 56 H UNK 0 0.501 -2.182 -1.275 0.00 0.00 H+0 HETATM 57 H UNK 0 2.442 -1.853 -1.429 0.00 0.00 H+0 HETATM 58 H UNK 0 4.473 1.142 0.606 0.00 0.00 H+0 HETATM 59 H UNK 0 5.394 3.689 -3.071 0.00 0.00 H+0 HETATM 60 H UNK 0 7.822 4.173 -3.358 0.00 0.00 H+0 HETATM 61 H UNK 0 10.064 3.834 -2.723 0.00 0.00 H+0 HETATM 62 H UNK 0 9.804 0.823 -0.613 0.00 0.00 H+0 HETATM 63 H UNK 0 9.571 2.179 0.572 0.00 0.00 H+0 HETATM 64 H UNK 0 7.668 0.881 1.650 0.00 0.00 H+0 HETATM 65 H UNK 0 8.570 -2.535 2.321 0.00 0.00 H+0 HETATM 66 H UNK 0 7.549 -1.097 2.816 0.00 0.00 H+0 HETATM 67 H UNK 0 7.067 -2.188 1.416 0.00 0.00 H+0 HETATM 68 H UNK 0 9.478 -2.569 0.033 0.00 0.00 H+0 HETATM 69 H UNK 0 10.637 -1.263 0.349 0.00 0.00 H+0 HETATM 70 H UNK 0 9.375 -1.134 -1.001 0.00 0.00 H+0 HETATM 71 H UNK 0 6.374 1.038 0.073 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.323 1.274 1.332 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.582 2.498 0.229 0.00 0.00 H+0 HETATM 74 H UNK 0 -1.753 2.066 1.756 0.00 0.00 H+0 HETATM 75 H UNK 0 -6.930 1.153 -0.070 0.00 0.00 H+0 HETATM 76 H UNK 0 -6.157 1.335 -1.723 0.00 0.00 H+0 HETATM 77 H UNK 0 -5.188 0.884 -0.221 0.00 0.00 H+0 HETATM 78 H UNK 0 -6.920 0.067 -2.986 0.00 0.00 H+0 HETATM 79 H UNK 0 -7.300 -1.668 -2.828 0.00 0.00 H+0 HETATM 80 H UNK 0 -8.358 -0.393 -2.061 0.00 0.00 H+0 CONECT 1 2 45 46 47 CONECT 2 1 3 CONECT 3 2 4 42 48 CONECT 4 3 5 9 49 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 50 51 CONECT 8 6 CONECT 9 4 10 11 52 CONECT 10 9 53 CONECT 11 9 12 41 54 CONECT 12 11 13 CONECT 13 12 14 39 CONECT 14 13 15 55 CONECT 15 14 16 56 CONECT 16 15 17 38 CONECT 17 16 18 19 CONECT 18 17 57 CONECT 19 17 20 35 CONECT 20 19 21 58 CONECT 21 20 22 23 CONECT 22 21 CONECT 23 21 24 34 CONECT 24 23 25 59 CONECT 25 24 26 60 CONECT 26 25 27 28 CONECT 27 26 61 CONECT 28 26 29 34 CONECT 29 28 30 62 63 CONECT 30 29 31 64 CONECT 31 30 32 33 CONECT 32 31 65 66 67 CONECT 33 31 68 69 70 CONECT 34 28 23 71 CONECT 35 19 36 37 CONECT 36 35 CONECT 37 35 38 CONECT 38 37 39 16 CONECT 39 38 40 13 CONECT 40 39 72 73 74 CONECT 41 11 42 CONECT 42 41 43 44 3 CONECT 43 42 75 76 77 CONECT 44 42 78 79 80 CONECT 45 1 CONECT 46 1 CONECT 47 1 CONECT 48 3 CONECT 49 4 CONECT 50 7 CONECT 51 7 CONECT 52 9 CONECT 53 10 CONECT 54 11 CONECT 55 14 CONECT 56 15 CONECT 57 18 CONECT 58 20 CONECT 59 24 CONECT 60 25 CONECT 61 27 CONECT 62 29 CONECT 63 29 CONECT 64 30 CONECT 65 32 CONECT 66 32 CONECT 67 32 CONECT 68 33 CONECT 69 33 CONECT 70 33 CONECT 71 34 CONECT 72 40 CONECT 73 40 CONECT 74 40 CONECT 75 43 CONECT 76 43 CONECT 77 43 CONECT 78 44 CONECT 79 44 CONECT 80 44 MASTER 0 0 0 0 0 0 0 0 80 0 166 0 END