HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 8.546 -0.984 -2.321 0.00 0.00 C+0 HETATM 2 C UNK 0 7.125 -0.677 -2.703 0.00 0.00 C+0 HETATM 3 C UNK 0 6.214 -1.648 -1.974 0.00 0.00 C+0 HETATM 4 C UNK 0 6.581 -3.014 -2.397 0.00 0.00 C+0 HETATM 5 O UNK 0 5.770 -3.749 -2.987 0.00 0.00 O+0 HETATM 6 O UNK 0 7.850 -3.487 -2.132 0.00 0.00 O+0 HETATM 7 C UNK 0 6.358 -1.507 -0.499 0.00 0.00 C+0 HETATM 8 O UNK 0 6.711 -2.505 0.177 0.00 0.00 O+0 HETATM 9 O UNK 0 6.122 -0.321 0.177 0.00 0.00 O+0 HETATM 10 C UNK 0 6.264 -0.195 1.581 0.00 0.00 C+0 HETATM 11 C UNK 0 4.957 0.364 2.126 0.00 0.00 C+0 HETATM 12 C UNK 0 5.234 1.161 3.416 0.00 0.00 C+0 HETATM 13 O UNK 0 4.001 -0.570 2.442 0.00 0.00 O+0 HETATM 14 C UNK 0 2.733 -0.550 1.888 0.00 0.00 C+0 HETATM 15 C UNK 0 1.800 -1.505 2.269 0.00 0.00 C+0 HETATM 16 C UNK 0 0.537 -1.500 1.730 0.00 0.00 C+0 HETATM 17 C UNK 0 0.130 -0.580 0.808 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.197 -0.577 0.241 0.00 0.00 C+0 HETATM 19 C UNK 0 -1.648 -1.562 -0.576 0.00 0.00 C+0 HETATM 20 C UNK 0 -2.903 -1.580 -1.125 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.768 -0.534 -0.833 0.00 0.00 C+0 HETATM 22 C UNK 0 -3.316 0.474 -0.002 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.048 0.503 0.560 0.00 0.00 C+0 HETATM 24 O UNK 0 -1.573 1.480 1.383 0.00 0.00 O+0 HETATM 25 C UNK 0 -4.236 1.558 0.248 0.00 0.00 C+0 HETATM 26 O UNK 0 -3.875 2.610 1.068 0.00 0.00 O+0 HETATM 27 C UNK 0 -5.436 1.585 -0.288 0.00 0.00 C+0 HETATM 28 C UNK 0 -6.376 2.683 -0.035 0.00 0.00 C+0 HETATM 29 O UNK 0 -5.974 3.717 0.533 0.00 0.00 O+0 HETATM 30 C UNK 0 -7.761 2.519 -0.464 0.00 0.00 C+0 HETATM 31 O UNK 0 -8.641 1.852 0.358 0.00 0.00 O+0 HETATM 32 C UNK 0 -8.237 1.272 -0.887 0.00 0.00 C+0 HETATM 33 C UNK 0 -9.400 1.216 -1.858 0.00 0.00 C+0 HETATM 34 C UNK 0 -7.324 0.080 -0.846 0.00 0.00 C+0 HETATM 35 O UNK 0 -7.405 -0.655 0.333 0.00 0.00 O+0 HETATM 36 C UNK 0 -7.790 -1.976 0.416 0.00 0.00 C+0 HETATM 37 O UNK 0 -8.085 -2.543 -0.650 0.00 0.00 O+0 HETATM 38 C UNK 0 -7.869 -2.739 1.677 0.00 0.00 C+0 HETATM 39 C UNK 0 -9.288 -2.811 2.174 0.00 0.00 C+0 HETATM 40 O UNK 0 -10.237 -2.268 1.550 0.00 0.00 O+0 HETATM 41 O UNK 0 -9.609 -3.477 3.340 0.00 0.00 O+0 HETATM 42 C UNK 0 -5.910 0.526 -1.190 0.00 0.00 C+0 HETATM 43 C UNK 0 -6.038 1.204 -2.571 0.00 0.00 C+0 HETATM 44 O UNK 0 -5.041 -0.522 -1.367 0.00 0.00 O+0 HETATM 45 C UNK 0 1.052 0.403 0.398 0.00 0.00 C+0 HETATM 46 O UNK 0 0.666 1.330 -0.522 0.00 0.00 O+0 HETATM 47 C UNK 0 2.337 0.396 0.950 0.00 0.00 C+0 HETATM 48 C UNK 0 3.326 1.388 0.568 0.00 0.00 C+0 HETATM 49 O UNK 0 2.989 2.354 -0.369 0.00 0.00 O+0 HETATM 50 C UNK 0 4.522 1.356 1.116 0.00 0.00 C+0 HETATM 51 C UNK 0 5.547 2.327 0.737 0.00 0.00 C+0 HETATM 52 O UNK 0 5.253 3.234 -0.082 0.00 0.00 O+0 HETATM 53 C UNK 0 6.896 2.209 1.331 0.00 0.00 C+0 HETATM 54 O UNK 0 7.884 1.496 0.680 0.00 0.00 O+0 HETATM 55 C UNK 0 7.309 0.887 1.793 0.00 0.00 C+0 HETATM 56 C UNK 0 8.277 0.703 2.935 0.00 0.00 C+0 HETATM 57 H UNK 0 9.020 -1.688 -3.020 0.00 0.00 H+0 HETATM 58 H UNK 0 9.122 -0.033 -2.230 0.00 0.00 H+0 HETATM 59 H UNK 0 8.547 -1.432 -1.311 0.00 0.00 H+0 HETATM 60 H UNK 0 6.985 -0.740 -3.800 0.00 0.00 H+0 HETATM 61 H UNK 0 6.916 0.375 -2.417 0.00 0.00 H+0 HETATM 62 H UNK 0 5.172 -1.396 -2.294 0.00 0.00 H+0 HETATM 63 H UNK 0 8.396 -4.035 -2.788 0.00 0.00 H+0 HETATM 64 H UNK 0 6.569 -1.140 2.057 0.00 0.00 H+0 HETATM 65 H UNK 0 4.316 1.071 4.030 0.00 0.00 H+0 HETATM 66 H UNK 0 6.050 0.727 3.998 0.00 0.00 H+0 HETATM 67 H UNK 0 5.338 2.244 3.206 0.00 0.00 H+0 HETATM 68 H UNK 0 2.101 -2.245 2.997 0.00 0.00 H+0 HETATM 69 H UNK 0 -0.131 -2.299 2.098 0.00 0.00 H+0 HETATM 70 H UNK 0 -1.017 -2.426 -0.852 0.00 0.00 H+0 HETATM 71 H UNK 0 -3.269 -2.357 -1.774 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.939 2.285 1.738 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.653 3.491 0.579 0.00 0.00 H+0 HETATM 74 H UNK 0 -8.178 3.458 -0.937 0.00 0.00 H+0 HETATM 75 H UNK 0 -9.265 0.397 -2.606 0.00 0.00 H+0 HETATM 76 H UNK 0 -10.300 0.943 -1.278 0.00 0.00 H+0 HETATM 77 H UNK 0 -9.588 2.207 -2.328 0.00 0.00 H+0 HETATM 78 H UNK 0 -7.619 -0.595 -1.672 0.00 0.00 H+0 HETATM 79 H UNK 0 -7.566 -3.813 1.527 0.00 0.00 H+0 HETATM 80 H UNK 0 -7.272 -2.313 2.499 0.00 0.00 H+0 HETATM 81 H UNK 0 -9.953 -3.025 4.184 0.00 0.00 H+0 HETATM 82 H UNK 0 -5.042 1.212 -3.064 0.00 0.00 H+0 HETATM 83 H UNK 0 -6.343 2.245 -2.443 0.00 0.00 H+0 HETATM 84 H UNK 0 -6.791 0.632 -3.127 0.00 0.00 H+0 HETATM 85 H UNK 0 0.972 2.078 -1.001 0.00 0.00 H+0 HETATM 86 H UNK 0 3.419 2.354 -1.288 0.00 0.00 H+0 HETATM 87 H UNK 0 7.259 3.100 1.926 0.00 0.00 H+0 HETATM 88 H UNK 0 8.127 -0.310 3.404 0.00 0.00 H+0 HETATM 89 H UNK 0 8.288 1.524 3.661 0.00 0.00 H+0 HETATM 90 H UNK 0 9.322 0.652 2.528 0.00 0.00 H+0 CONECT 1 2 57 58 59 CONECT 2 1 3 60 61 CONECT 3 2 4 7 62 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 63 CONECT 7 3 8 9 CONECT 8 7 CONECT 9 7 10 CONECT 10 9 11 55 64 CONECT 11 10 12 13 50 CONECT 12 11 65 66 67 CONECT 13 11 14 CONECT 14 13 15 47 CONECT 15 14 16 68 CONECT 16 15 17 69 CONECT 17 16 18 45 CONECT 18 17 19 23 CONECT 19 18 20 70 CONECT 20 19 21 71 CONECT 21 20 22 44 CONECT 22 21 23 25 CONECT 23 22 24 18 CONECT 24 23 72 CONECT 25 22 26 27 CONECT 26 25 73 CONECT 27 25 28 42 CONECT 28 27 29 30 CONECT 29 28 CONECT 30 28 31 32 74 CONECT 31 30 32 CONECT 32 31 33 34 30 CONECT 33 32 75 76 77 CONECT 34 32 35 42 78 CONECT 35 34 36 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 79 80 CONECT 39 38 40 41 CONECT 40 39 CONECT 41 39 81 CONECT 42 34 43 44 27 CONECT 43 42 82 83 84 CONECT 44 42 21 CONECT 45 17 46 47 CONECT 46 45 85 CONECT 47 45 48 14 CONECT 48 47 49 50 CONECT 49 48 86 CONECT 50 48 51 11 CONECT 51 50 52 53 CONECT 52 51 CONECT 53 51 54 55 87 CONECT 54 53 55 CONECT 55 54 56 10 53 CONECT 56 55 88 89 90 CONECT 57 1 CONECT 58 1 CONECT 59 1 CONECT 60 2 CONECT 61 2 CONECT 62 3 CONECT 63 6 CONECT 64 10 CONECT 65 12 CONECT 66 12 CONECT 67 12 CONECT 68 15 CONECT 69 16 CONECT 70 19 CONECT 71 20 CONECT 72 24 CONECT 73 26 CONECT 74 30 CONECT 75 33 CONECT 76 33 CONECT 77 33 CONECT 78 34 CONECT 79 38 CONECT 80 38 CONECT 81 41 CONECT 82 43 CONECT 83 43 CONECT 84 43 CONECT 85 46 CONECT 86 49 CONECT 87 53 CONECT 88 56 CONECT 89 56 CONECT 90 56 MASTER 0 0 0 0 0 0 0 0 90 0 194 0 END