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 12.933 2.182 1.227 0.00 0.00 C+0 HETATM 2 C UNK 0 12.131 1.593 0.060 0.00 0.00 C+0 HETATM 3 O UNK 0 11.474 0.473 0.567 0.00 0.00 O+0 HETATM 4 C UNK 0 11.865 -0.691 -0.125 0.00 0.00 C+0 HETATM 5 O UNK 0 11.063 -1.719 0.392 0.00 0.00 O+0 HETATM 6 C UNK 0 9.751 -1.250 0.278 0.00 0.00 C+0 HETATM 7 C UNK 0 8.745 -2.175 0.896 0.00 0.00 C+0 HETATM 8 C UNK 0 9.163 -2.714 2.229 0.00 0.00 C+0 HETATM 9 O UNK 0 7.545 -1.452 0.982 0.00 0.00 O+0 HETATM 10 C UNK 0 7.065 -1.290 -0.306 0.00 0.00 C+0 HETATM 11 C UNK 0 5.683 -0.733 -0.313 0.00 0.00 C+0 HETATM 12 C UNK 0 5.302 0.290 -1.133 0.00 0.00 C+0 HETATM 13 C UNK 0 4.017 0.782 -1.132 0.00 0.00 C+0 HETATM 14 C UNK 0 3.043 0.269 -0.301 0.00 0.00 C+0 HETATM 15 C UNK 0 3.421 -0.773 0.539 0.00 0.00 C+0 HETATM 16 C UNK 0 4.705 -1.277 0.548 0.00 0.00 C+0 HETATM 17 O UNK 0 5.106 -2.299 1.359 0.00 0.00 O+0 HETATM 18 C UNK 0 2.375 -1.291 1.408 0.00 0.00 C+0 HETATM 19 O UNK 0 2.592 -2.219 2.206 0.00 0.00 O+0 HETATM 20 C UNK 0 1.001 -0.746 1.393 0.00 0.00 C+0 HETATM 21 C UNK 0 0.696 0.226 0.570 0.00 0.00 C+0 HETATM 22 C UNK 0 1.679 0.812 -0.329 0.00 0.00 C+0 HETATM 23 O UNK 0 1.405 1.759 -1.123 0.00 0.00 O+0 HETATM 24 C UNK 0 -0.730 0.633 0.431 0.00 0.00 C+0 HETATM 25 O UNK 0 -0.849 1.927 -0.058 0.00 0.00 O+0 HETATM 26 C UNK 0 -1.386 -0.281 -0.590 0.00 0.00 C+0 HETATM 27 O UNK 0 -0.696 -1.145 -1.151 0.00 0.00 O+0 HETATM 28 C UNK 0 -2.800 -0.094 -0.858 0.00 0.00 C+0 HETATM 29 C UNK 0 -3.636 -0.101 0.440 0.00 0.00 C+0 HETATM 30 C UNK 0 -3.679 -1.533 0.890 0.00 0.00 C+0 HETATM 31 O UNK 0 -4.811 0.456 0.100 0.00 0.00 O+0 HETATM 32 C UNK 0 -5.785 0.625 1.015 0.00 0.00 C+0 HETATM 33 C UNK 0 -6.485 1.946 0.984 0.00 0.00 C+0 HETATM 34 C UNK 0 -7.907 1.874 0.554 0.00 0.00 C+0 HETATM 35 C UNK 0 -8.175 1.012 -0.630 0.00 0.00 C+0 HETATM 36 O UNK 0 -9.493 0.568 -0.620 0.00 0.00 O+0 HETATM 37 C UNK 0 -10.217 0.988 -1.704 0.00 0.00 C+0 HETATM 38 C UNK 0 -10.860 -0.082 -2.520 0.00 0.00 C+0 HETATM 39 C UNK 0 -12.142 -0.595 -1.925 0.00 0.00 C+0 HETATM 40 C UNK 0 -12.186 -0.180 -0.473 0.00 0.00 C+0 HETATM 41 O UNK 0 -13.459 -0.510 0.012 0.00 0.00 O+0 HETATM 42 C UNK 0 -12.027 1.308 -0.303 0.00 0.00 C+0 HETATM 43 C UNK 0 -13.351 2.031 -0.361 0.00 0.00 C+0 HETATM 44 O UNK 0 -11.188 1.873 -1.244 0.00 0.00 O+0 HETATM 45 C UNK 0 -7.214 -0.130 -0.637 0.00 0.00 C+0 HETATM 46 C UNK 0 -7.780 -1.389 -1.251 0.00 0.00 C+0 HETATM 47 O UNK 0 -6.777 -0.332 0.662 0.00 0.00 O+0 HETATM 48 C UNK 0 -2.974 0.701 1.501 0.00 0.00 C+0 HETATM 49 C UNK 0 -1.502 0.494 1.682 0.00 0.00 C+0 HETATM 50 O UNK 0 -1.113 1.663 2.459 0.00 0.00 O+0 HETATM 51 C UNK 0 -1.137 -0.618 2.553 0.00 0.00 C+0 HETATM 52 C UNK 0 0.039 -1.198 2.426 0.00 0.00 C+0 HETATM 53 C UNK 0 7.954 -0.481 -1.193 0.00 0.00 C+0 HETATM 54 C UNK 0 9.370 -1.007 -1.159 0.00 0.00 C+0 HETATM 55 O UNK 0 10.250 -0.122 -1.783 0.00 0.00 O+0 HETATM 56 C UNK 0 11.539 -0.566 -1.597 0.00 0.00 C+0 HETATM 57 C UNK 0 12.545 0.422 -2.175 0.00 0.00 C+0 HETATM 58 C UNK 0 13.058 1.239 -1.042 0.00 0.00 C+0 HETATM 59 O UNK 0 14.213 1.586 -1.059 0.00 0.00 O+0 HETATM 60 H UNK 0 12.208 2.481 2.025 0.00 0.00 H+0 HETATM 61 H UNK 0 13.455 3.081 0.855 0.00 0.00 H+0 HETATM 62 H UNK 0 13.666 1.440 1.612 0.00 0.00 H+0 HETATM 63 H UNK 0 11.435 2.390 -0.270 0.00 0.00 H+0 HETATM 64 H UNK 0 12.938 -0.886 0.022 0.00 0.00 H+0 HETATM 65 H UNK 0 9.704 -0.248 0.796 0.00 0.00 H+0 HETATM 66 H UNK 0 8.542 -2.996 0.160 0.00 0.00 H+0 HETATM 67 H UNK 0 8.471 -2.342 3.028 0.00 0.00 H+0 HETATM 68 H UNK 0 9.018 -3.829 2.200 0.00 0.00 H+0 HETATM 69 H UNK 0 10.210 -2.470 2.503 0.00 0.00 H+0 HETATM 70 H UNK 0 7.065 -2.335 -0.746 0.00 0.00 H+0 HETATM 71 H UNK 0 6.063 0.711 -1.799 0.00 0.00 H+0 HETATM 72 H UNK 0 3.740 1.598 -1.796 0.00 0.00 H+0 HETATM 73 H UNK 0 4.589 -2.790 2.004 0.00 0.00 H+0 HETATM 74 H UNK 0 -0.924 1.882 -1.037 0.00 0.00 H+0 HETATM 75 H UNK 0 -3.160 -0.996 -1.433 0.00 0.00 H+0 HETATM 76 H UNK 0 -3.004 0.784 -1.470 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.889 -1.571 2.000 0.00 0.00 H+0 HETATM 78 H UNK 0 -4.431 -2.148 0.410 0.00 0.00 H+0 HETATM 79 H UNK 0 -2.698 -2.037 0.773 0.00 0.00 H+0 HETATM 80 H UNK 0 -5.515 0.284 2.058 0.00 0.00 H+0 HETATM 81 H UNK 0 -5.942 2.597 0.255 0.00 0.00 H+0 HETATM 82 H UNK 0 -6.469 2.464 1.979 0.00 0.00 H+0 HETATM 83 H UNK 0 -8.241 2.934 0.349 0.00 0.00 H+0 HETATM 84 H UNK 0 -8.560 1.557 1.420 0.00 0.00 H+0 HETATM 85 H UNK 0 -7.965 1.637 -1.539 0.00 0.00 H+0 HETATM 86 H UNK 0 -9.576 1.609 -2.398 0.00 0.00 H+0 HETATM 87 H UNK 0 -10.173 -0.908 -2.801 0.00 0.00 H+0 HETATM 88 H UNK 0 -11.130 0.389 -3.512 0.00 0.00 H+0 HETATM 89 H UNK 0 -13.028 -0.233 -2.484 0.00 0.00 H+0 HETATM 90 H UNK 0 -12.105 -1.701 -1.942 0.00 0.00 H+0 HETATM 91 H UNK 0 -11.444 -0.723 0.111 0.00 0.00 H+0 HETATM 92 H UNK 0 -14.105 -0.706 -0.707 0.00 0.00 H+0 HETATM 93 H UNK 0 -11.572 1.473 0.695 0.00 0.00 H+0 HETATM 94 H UNK 0 -13.496 2.410 -1.374 0.00 0.00 H+0 HETATM 95 H UNK 0 -14.178 1.337 -0.054 0.00 0.00 H+0 HETATM 96 H UNK 0 -13.399 2.883 0.346 0.00 0.00 H+0 HETATM 97 H UNK 0 -6.330 0.143 -1.234 0.00 0.00 H+0 HETATM 98 H UNK 0 -7.258 -2.293 -0.941 0.00 0.00 H+0 HETATM 99 H UNK 0 -8.844 -1.472 -0.883 0.00 0.00 H+0 HETATM 100 H UNK 0 -7.827 -1.240 -2.341 0.00 0.00 H+0 HETATM 101 H UNK 0 -3.462 0.521 2.465 0.00 0.00 H+0 HETATM 102 H UNK 0 -3.138 1.778 1.262 0.00 0.00 H+0 HETATM 103 H UNK 0 -1.128 2.401 1.814 0.00 0.00 H+0 HETATM 104 H UNK 0 -1.833 -0.962 3.299 0.00 0.00 H+0 HETATM 105 H UNK 0 0.330 -2.006 3.062 0.00 0.00 H+0 HETATM 106 H UNK 0 7.981 0.592 -0.916 0.00 0.00 H+0 HETATM 107 H UNK 0 7.567 -0.586 -2.235 0.00 0.00 H+0 HETATM 108 H UNK 0 9.422 -1.964 -1.735 0.00 0.00 H+0 HETATM 109 H UNK 0 11.682 -1.581 -2.053 0.00 0.00 H+0 HETATM 110 H UNK 0 11.998 1.061 -2.894 0.00 0.00 H+0 HETATM 111 H UNK 0 13.373 -0.154 -2.648 0.00 0.00 H+0 CONECT 1 2 60 61 62 CONECT 2 1 3 58 63 CONECT 3 2 4 CONECT 4 3 5 56 64 CONECT 5 4 6 CONECT 6 5 7 54 65 CONECT 7 6 8 9 66 CONECT 8 7 67 68 69 CONECT 9 7 10 CONECT 10 9 11 53 70 CONECT 11 10 12 16 CONECT 12 11 13 71 CONECT 13 12 14 72 CONECT 14 13 15 22 CONECT 15 14 16 18 CONECT 16 15 17 11 CONECT 17 16 73 CONECT 18 15 19 20 CONECT 19 18 CONECT 20 18 21 52 CONECT 21 20 22 24 CONECT 22 21 23 14 CONECT 23 22 CONECT 24 21 25 26 49 CONECT 25 24 74 CONECT 26 24 27 28 CONECT 27 26 CONECT 28 26 29 75 76 CONECT 29 28 30 31 48 CONECT 30 29 77 78 79 CONECT 31 29 32 CONECT 32 31 33 47 80 CONECT 33 32 34 81 82 CONECT 34 33 35 83 84 CONECT 35 34 36 45 85 CONECT 36 35 37 CONECT 37 36 38 44 86 CONECT 38 37 39 87 88 CONECT 39 38 40 89 90 CONECT 40 39 41 42 91 CONECT 41 40 92 CONECT 42 40 43 44 93 CONECT 43 42 94 95 96 CONECT 44 42 37 CONECT 45 35 46 47 97 CONECT 46 45 98 99 100 CONECT 47 45 32 CONECT 48 29 49 101 102 CONECT 49 48 50 51 24 CONECT 50 49 103 CONECT 51 49 52 104 CONECT 52 51 20 105 CONECT 53 10 54 106 107 CONECT 54 53 55 6 108 CONECT 55 54 56 CONECT 56 55 57 4 109 CONECT 57 56 58 110 111 CONECT 58 57 59 2 CONECT 59 58 CONECT 60 1 CONECT 61 1 CONECT 62 1 CONECT 63 2 CONECT 64 4 CONECT 65 6 CONECT 66 7 CONECT 67 8 CONECT 68 8 CONECT 69 8 CONECT 70 10 CONECT 71 12 CONECT 72 13 CONECT 73 17 CONECT 74 25 CONECT 75 28 CONECT 76 28 CONECT 77 30 CONECT 78 30 CONECT 79 30 CONECT 80 32 CONECT 81 33 CONECT 82 33 CONECT 83 34 CONECT 84 34 CONECT 85 35 CONECT 86 37 CONECT 87 38 CONECT 88 38 CONECT 89 39 CONECT 90 39 CONECT 91 40 CONECT 92 41 CONECT 93 42 CONECT 94 43 CONECT 95 43 CONECT 96 43 CONECT 97 45 CONECT 98 46 CONECT 99 46 CONECT 100 46 CONECT 101 48 CONECT 102 48 CONECT 103 50 CONECT 104 51 CONECT 105 52 CONECT 106 53 CONECT 107 53 CONECT 108 54 CONECT 109 56 CONECT 110 57 CONECT 111 57 MASTER 0 0 0 0 0 0 0 0 111 0 238 0 END