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 -5.859 2.851 1.734 0.00 0.00 C+0 HETATM 2 O UNK 0 -5.581 2.162 0.586 0.00 0.00 O+0 HETATM 3 C UNK 0 -4.888 0.969 0.747 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.568 1.143 1.480 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.468 1.594 0.587 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.244 0.658 -0.578 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.915 -0.701 -0.028 0.00 0.00 C+0 HETATM 8 C UNK 0 -3.535 0.652 -1.405 0.00 0.00 C+0 HETATM 9 O UNK 0 -3.710 1.984 -1.844 0.00 0.00 O+0 HETATM 10 C UNK 0 -3.475 -0.192 -2.621 0.00 0.00 C+0 HETATM 11 C UNK 0 -2.271 0.114 -3.497 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.081 0.111 -2.640 0.00 0.00 C+0 HETATM 13 C UNK 0 0.211 0.617 -3.251 0.00 0.00 C+0 HETATM 14 C UNK 0 1.039 0.597 -1.980 0.00 0.00 C+0 HETATM 15 C UNK 0 0.228 0.850 -0.899 0.00 0.00 C+0 HETATM 16 N UNK 0 0.989 0.804 0.187 0.00 0.00 N+0 HETATM 17 C UNK 0 2.256 0.532 -0.151 0.00 0.00 C+0 HETATM 18 C UNK 0 3.446 0.372 0.572 0.00 0.00 C+0 HETATM 19 C UNK 0 4.636 0.087 -0.062 0.00 0.00 C+0 HETATM 20 C UNK 0 4.701 -0.050 -1.435 0.00 0.00 C+0 HETATM 21 C UNK 0 3.526 0.108 -2.156 0.00 0.00 C+0 HETATM 22 C UNK 0 2.323 0.395 -1.520 0.00 0.00 C+0 HETATM 23 C UNK 0 6.104 -0.353 -1.822 0.00 0.00 C+0 HETATM 24 C UNK 0 6.828 -0.371 -0.523 0.00 0.00 C+0 HETATM 25 C UNK 0 5.979 -0.120 0.462 0.00 0.00 C+0 HETATM 26 C UNK 0 6.553 -0.107 1.835 0.00 0.00 C+0 HETATM 27 C UNK 0 7.407 -1.358 1.923 0.00 0.00 C+0 HETATM 28 C UNK 0 7.960 -1.432 3.329 0.00 0.00 C+0 HETATM 29 C UNK 0 6.452 -2.546 1.754 0.00 0.00 C+0 HETATM 30 O UNK 0 8.396 -1.403 0.980 0.00 0.00 O+0 HETATM 31 C UNK 0 8.244 -0.601 -0.119 0.00 0.00 C+0 HETATM 32 C UNK 0 9.001 -1.188 -1.312 0.00 0.00 C+0 HETATM 33 C UNK 0 8.859 0.774 0.142 0.00 0.00 C+0 HETATM 34 C UNK 0 -1.152 1.077 -1.468 0.00 0.00 C+0 HETATM 35 C UNK 0 -1.234 2.478 -2.011 0.00 0.00 C+0 HETATM 36 C UNK 0 -4.703 0.360 -0.581 0.00 0.00 C+0 HETATM 37 C UNK 0 -5.618 -0.451 -1.044 0.00 0.00 C+0 HETATM 38 C UNK 0 -6.825 -0.759 -0.262 0.00 0.00 C+0 HETATM 39 O UNK 0 -7.723 -1.521 -0.672 0.00 0.00 O+0 HETATM 40 C UNK 0 -6.939 -0.099 1.098 0.00 0.00 C+0 HETATM 41 C UNK 0 -7.562 -1.139 2.006 0.00 0.00 C+0 HETATM 42 C UNK 0 -8.967 -1.448 1.490 0.00 0.00 C+0 HETATM 43 C UNK 0 -6.737 -2.393 1.904 0.00 0.00 C+0 HETATM 44 O UNK 0 -7.613 -0.696 3.326 0.00 0.00 O+0 HETATM 45 O UNK 0 -5.665 0.152 1.538 0.00 0.00 O+0 HETATM 46 H UNK 0 -6.470 2.273 2.487 0.00 0.00 H+0 HETATM 47 H UNK 0 -6.585 3.689 1.457 0.00 0.00 H+0 HETATM 48 H UNK 0 -5.016 3.399 2.187 0.00 0.00 H+0 HETATM 49 H UNK 0 -3.712 1.905 2.269 0.00 0.00 H+0 HETATM 50 H UNK 0 -3.371 0.203 2.035 0.00 0.00 H+0 HETATM 51 H UNK 0 -1.558 1.714 1.167 0.00 0.00 H+0 HETATM 52 H UNK 0 -2.759 2.633 0.252 0.00 0.00 H+0 HETATM 53 H UNK 0 -1.909 -0.775 1.068 0.00 0.00 H+0 HETATM 54 H UNK 0 -2.625 -1.496 -0.385 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.875 -1.039 -0.322 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.410 2.043 -2.529 0.00 0.00 H+0 HETATM 57 H UNK 0 -4.354 0.114 -3.263 0.00 0.00 H+0 HETATM 58 H UNK 0 -3.560 -1.278 -2.429 0.00 0.00 H+0 HETATM 59 H UNK 0 -2.422 0.988 -4.142 0.00 0.00 H+0 HETATM 60 H UNK 0 -2.190 -0.766 -4.197 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.870 -0.932 -2.336 0.00 0.00 H+0 HETATM 62 H UNK 0 0.589 -0.148 -3.958 0.00 0.00 H+0 HETATM 63 H UNK 0 0.169 1.628 -3.644 0.00 0.00 H+0 HETATM 64 H UNK 0 0.664 0.954 1.168 0.00 0.00 H+0 HETATM 65 H UNK 0 3.420 0.474 1.647 0.00 0.00 H+0 HETATM 66 H UNK 0 3.509 0.014 -3.232 0.00 0.00 H+0 HETATM 67 H UNK 0 6.139 -1.410 -2.201 0.00 0.00 H+0 HETATM 68 H UNK 0 6.515 0.357 -2.539 0.00 0.00 H+0 HETATM 69 H UNK 0 5.749 -0.203 2.603 0.00 0.00 H+0 HETATM 70 H UNK 0 7.122 0.791 2.068 0.00 0.00 H+0 HETATM 71 H UNK 0 8.722 -0.620 3.457 0.00 0.00 H+0 HETATM 72 H UNK 0 8.471 -2.411 3.507 0.00 0.00 H+0 HETATM 73 H UNK 0 7.177 -1.244 4.085 0.00 0.00 H+0 HETATM 74 H UNK 0 6.613 -3.292 2.554 0.00 0.00 H+0 HETATM 75 H UNK 0 6.607 -3.009 0.736 0.00 0.00 H+0 HETATM 76 H UNK 0 5.394 -2.230 1.804 0.00 0.00 H+0 HETATM 77 H UNK 0 8.863 -0.528 -2.198 0.00 0.00 H+0 HETATM 78 H UNK 0 10.069 -1.166 -1.044 0.00 0.00 H+0 HETATM 79 H UNK 0 8.611 -2.203 -1.522 0.00 0.00 H+0 HETATM 80 H UNK 0 9.338 0.819 1.150 0.00 0.00 H+0 HETATM 81 H UNK 0 8.113 1.587 0.035 0.00 0.00 H+0 HETATM 82 H UNK 0 9.671 1.012 -0.577 0.00 0.00 H+0 HETATM 83 H UNK 0 -0.194 2.862 -2.083 0.00 0.00 H+0 HETATM 84 H UNK 0 -1.773 3.197 -1.402 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.640 2.516 -3.042 0.00 0.00 H+0 HETATM 86 H UNK 0 -5.550 -0.932 -2.001 0.00 0.00 H+0 HETATM 87 H UNK 0 -7.586 0.784 1.011 0.00 0.00 H+0 HETATM 88 H UNK 0 -9.282 -0.625 0.818 0.00 0.00 H+0 HETATM 89 H UNK 0 -9.646 -1.508 2.392 0.00 0.00 H+0 HETATM 90 H UNK 0 -9.029 -2.447 1.026 0.00 0.00 H+0 HETATM 91 H UNK 0 -7.393 -3.257 1.796 0.00 0.00 H+0 HETATM 92 H UNK 0 -6.081 -2.360 1.010 0.00 0.00 H+0 HETATM 93 H UNK 0 -6.106 -2.559 2.803 0.00 0.00 H+0 HETATM 94 H UNK 0 -8.361 -0.037 3.435 0.00 0.00 H+0 CONECT 1 2 46 47 48 CONECT 2 1 3 CONECT 3 2 4 36 45 CONECT 4 3 5 49 50 CONECT 5 4 6 51 52 CONECT 6 5 7 8 34 CONECT 7 6 53 54 55 CONECT 8 6 9 10 36 CONECT 9 8 56 CONECT 10 8 11 57 58 CONECT 11 10 12 59 60 CONECT 12 11 13 34 61 CONECT 13 12 14 62 63 CONECT 14 13 15 22 CONECT 15 14 16 34 CONECT 16 15 17 64 CONECT 17 16 18 22 CONECT 18 17 19 65 CONECT 19 18 20 25 CONECT 20 19 21 23 CONECT 21 20 22 66 CONECT 22 21 14 17 CONECT 23 20 24 67 68 CONECT 24 23 25 31 CONECT 25 24 26 19 CONECT 26 25 27 69 70 CONECT 27 26 28 29 30 CONECT 28 27 71 72 73 CONECT 29 27 74 75 76 CONECT 30 27 31 CONECT 31 30 32 33 24 CONECT 32 31 77 78 79 CONECT 33 31 80 81 82 CONECT 34 15 35 6 12 CONECT 35 34 83 84 85 CONECT 36 8 37 3 CONECT 37 36 38 86 CONECT 38 37 39 40 CONECT 39 38 CONECT 40 38 41 45 87 CONECT 41 40 42 43 44 CONECT 42 41 88 89 90 CONECT 43 41 91 92 93 CONECT 44 41 94 CONECT 45 40 3 CONECT 46 1 CONECT 47 1 CONECT 48 1 CONECT 49 4 CONECT 50 4 CONECT 51 5 CONECT 52 5 CONECT 53 7 CONECT 54 7 CONECT 55 7 CONECT 56 9 CONECT 57 10 CONECT 58 10 CONECT 59 11 CONECT 60 11 CONECT 61 12 CONECT 62 13 CONECT 63 13 CONECT 64 16 CONECT 65 18 CONECT 66 21 CONECT 67 23 CONECT 68 23 CONECT 69 26 CONECT 70 26 CONECT 71 28 CONECT 72 28 CONECT 73 28 CONECT 74 29 CONECT 75 29 CONECT 76 29 CONECT 77 32 CONECT 78 32 CONECT 79 32 CONECT 80 33 CONECT 81 33 CONECT 82 33 CONECT 83 35 CONECT 84 35 CONECT 85 35 CONECT 86 37 CONECT 87 40 CONECT 88 42 CONECT 89 42 CONECT 90 42 CONECT 91 43 CONECT 92 43 CONECT 93 43 CONECT 94 44 MASTER 0 0 0 0 0 0 0 0 94 0 202 0 END