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 -6.324 -2.047 1.168 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.025 -2.261 0.423 0.00 0.00 C+0 HETATM 3 C UNK 0 -3.930 -1.684 1.266 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.809 -2.306 2.614 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.569 -1.679 0.530 0.00 0.00 C+0 HETATM 6 N UNK 0 -2.797 -0.869 -0.632 0.00 0.00 N+0 HETATM 7 C UNK 0 -2.373 0.453 -0.745 0.00 0.00 C+0 HETATM 8 O UNK 0 -2.988 1.229 -1.526 0.00 0.00 O+0 HETATM 9 C UNK 0 -1.238 0.994 -0.003 0.00 0.00 C+0 HETATM 10 C UNK 0 -1.503 2.041 1.010 0.00 0.00 C+0 HETATM 11 C UNK 0 -2.148 3.281 0.572 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.520 4.462 0.192 0.00 0.00 C+0 HETATM 13 N UNK 0 -2.465 5.368 -0.175 0.00 0.00 N+0 HETATM 14 O UNK 0 -2.134 6.635 -0.603 0.00 0.00 O+0 HETATM 15 C UNK 0 -1.482 6.768 -1.854 0.00 0.00 C+0 HETATM 16 C UNK 0 -3.682 4.817 -0.047 0.00 0.00 C+0 HETATM 17 C UNK 0 -4.932 5.341 -0.281 0.00 0.00 C+0 HETATM 18 C UNK 0 -6.065 4.588 -0.060 0.00 0.00 C+0 HETATM 19 C UNK 0 -5.890 3.298 0.402 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.644 2.765 0.639 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.493 3.523 0.417 0.00 0.00 C+0 HETATM 22 N UNK 0 -0.276 1.414 -1.048 0.00 0.00 N+0 HETATM 23 C UNK 0 0.751 0.568 -1.509 0.00 0.00 C+0 HETATM 24 O UNK 0 0.848 0.466 -2.784 0.00 0.00 O+0 HETATM 25 C UNK 0 1.714 -0.199 -0.708 0.00 0.00 C+0 HETATM 26 C UNK 0 2.792 -0.819 -1.615 0.00 0.00 C+0 HETATM 27 C UNK 0 3.761 -1.596 -0.807 0.00 0.00 C+0 HETATM 28 C UNK 0 4.471 -0.773 0.223 0.00 0.00 C+0 HETATM 29 C UNK 0 5.254 0.350 -0.366 0.00 0.00 C+0 HETATM 30 C UNK 0 5.973 1.179 0.670 0.00 0.00 C+0 HETATM 31 C UNK 0 6.942 0.327 1.442 0.00 0.00 C+0 HETATM 32 C UNK 0 7.679 1.149 2.491 0.00 0.00 C+0 HETATM 33 C UNK 0 8.460 2.272 1.869 0.00 0.00 C+0 HETATM 34 O UNK 0 6.835 1.636 3.464 0.00 0.00 O+0 HETATM 35 N UNK 0 1.204 -1.105 0.252 0.00 0.00 N+0 HETATM 36 C UNK 0 0.563 -2.329 0.123 0.00 0.00 C+0 HETATM 37 O UNK 0 0.371 -3.049 1.176 0.00 0.00 O+0 HETATM 38 C UNK 0 0.030 -2.991 -1.094 0.00 0.00 C+0 HETATM 39 C UNK 0 1.038 -4.048 -1.442 0.00 0.00 C+0 HETATM 40 C UNK 0 0.538 -5.349 -1.921 0.00 0.00 C+0 HETATM 41 C UNK 0 -0.791 -5.761 -1.340 0.00 0.00 C+0 HETATM 42 C UNK 0 -1.718 -4.596 -1.719 0.00 0.00 C+0 HETATM 43 N UNK 0 -1.298 -3.499 -0.817 0.00 0.00 N+0 HETATM 44 C UNK 0 -2.187 -3.071 0.180 0.00 0.00 C+0 HETATM 45 O UNK 0 -2.745 -3.987 0.884 0.00 0.00 O+0 HETATM 46 H UNK 0 -6.648 -0.990 1.104 0.00 0.00 H+0 HETATM 47 H UNK 0 -7.094 -2.684 0.643 0.00 0.00 H+0 HETATM 48 H UNK 0 -6.238 -2.438 2.187 0.00 0.00 H+0 HETATM 49 H UNK 0 -5.112 -1.643 -0.505 0.00 0.00 H+0 HETATM 50 H UNK 0 -4.874 -3.294 0.120 0.00 0.00 H+0 HETATM 51 H UNK 0 -4.165 -0.600 1.406 0.00 0.00 H+0 HETATM 52 H UNK 0 -4.118 -3.369 2.665 0.00 0.00 H+0 HETATM 53 H UNK 0 -4.461 -1.726 3.332 0.00 0.00 H+0 HETATM 54 H UNK 0 -2.772 -2.153 2.985 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.893 -1.199 1.245 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.324 -1.376 -1.416 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.714 0.175 0.571 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.107 1.531 1.831 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.541 2.281 1.572 0.00 0.00 H+0 HETATM 60 H UNK 0 -0.462 4.587 0.204 0.00 0.00 H+0 HETATM 61 H UNK 0 -1.571 7.781 -2.284 0.00 0.00 H+0 HETATM 62 H UNK 0 -1.940 6.033 -2.553 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.426 6.463 -1.687 0.00 0.00 H+0 HETATM 64 H UNK 0 -5.055 6.365 -0.646 0.00 0.00 H+0 HETATM 65 H UNK 0 -7.044 5.013 -0.249 0.00 0.00 H+0 HETATM 66 H UNK 0 -6.788 2.727 0.569 0.00 0.00 H+0 HETATM 67 H UNK 0 -4.553 1.738 1.005 0.00 0.00 H+0 HETATM 68 H UNK 0 -0.449 2.380 -1.393 0.00 0.00 H+0 HETATM 69 H UNK 0 2.330 0.602 -0.169 0.00 0.00 H+0 HETATM 70 H UNK 0 2.341 -1.372 -2.442 0.00 0.00 H+0 HETATM 71 H UNK 0 3.330 0.041 -2.104 0.00 0.00 H+0 HETATM 72 H UNK 0 4.563 -1.952 -1.517 0.00 0.00 H+0 HETATM 73 H UNK 0 3.329 -2.501 -0.343 0.00 0.00 H+0 HETATM 74 H UNK 0 3.719 -0.367 0.928 0.00 0.00 H+0 HETATM 75 H UNK 0 5.181 -1.464 0.750 0.00 0.00 H+0 HETATM 76 H UNK 0 4.564 1.073 -0.893 0.00 0.00 H+0 HETATM 77 H UNK 0 5.980 0.036 -1.127 0.00 0.00 H+0 HETATM 78 H UNK 0 5.238 1.687 1.356 0.00 0.00 H+0 HETATM 79 H UNK 0 6.562 1.994 0.212 0.00 0.00 H+0 HETATM 80 H UNK 0 6.447 -0.501 1.991 0.00 0.00 H+0 HETATM 81 H UNK 0 7.715 -0.036 0.740 0.00 0.00 H+0 HETATM 82 H UNK 0 8.393 0.440 2.970 0.00 0.00 H+0 HETATM 83 H UNK 0 8.516 2.167 0.776 0.00 0.00 H+0 HETATM 84 H UNK 0 7.941 3.229 2.108 0.00 0.00 H+0 HETATM 85 H UNK 0 9.486 2.316 2.310 0.00 0.00 H+0 HETATM 86 H UNK 0 7.232 2.439 3.870 0.00 0.00 H+0 HETATM 87 H UNK 0 1.336 -0.794 1.280 0.00 0.00 H+0 HETATM 88 H UNK 0 -0.094 -2.263 -1.946 0.00 0.00 H+0 HETATM 89 H UNK 0 1.694 -3.642 -2.241 0.00 0.00 H+0 HETATM 90 H UNK 0 1.752 -4.267 -0.591 0.00 0.00 H+0 HETATM 91 H UNK 0 1.251 -6.164 -1.682 0.00 0.00 H+0 HETATM 92 H UNK 0 0.433 -5.383 -3.036 0.00 0.00 H+0 HETATM 93 H UNK 0 -0.784 -5.812 -0.245 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.096 -6.704 -1.811 0.00 0.00 H+0 HETATM 95 H UNK 0 -1.486 -4.350 -2.769 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.723 -4.956 -1.546 0.00 0.00 H+0 CONECT 1 2 46 47 48 CONECT 2 1 3 49 50 CONECT 3 2 4 5 51 CONECT 4 3 52 53 54 CONECT 5 3 6 44 55 CONECT 6 5 7 56 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 22 57 CONECT 10 9 11 58 59 CONECT 11 10 12 21 CONECT 12 11 13 60 CONECT 13 12 14 16 CONECT 14 13 15 CONECT 15 14 61 62 63 CONECT 16 13 17 21 CONECT 17 16 18 64 CONECT 18 17 19 65 CONECT 19 18 20 66 CONECT 20 19 21 67 CONECT 21 20 11 16 CONECT 22 9 23 68 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 35 69 CONECT 26 25 27 70 71 CONECT 27 26 28 72 73 CONECT 28 27 29 74 75 CONECT 29 28 30 76 77 CONECT 30 29 31 78 79 CONECT 31 30 32 80 81 CONECT 32 31 33 34 82 CONECT 33 32 83 84 85 CONECT 34 32 86 CONECT 35 25 36 87 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 43 88 CONECT 39 38 40 89 90 CONECT 40 39 41 91 92 CONECT 41 40 42 93 94 CONECT 42 41 43 95 96 CONECT 43 42 44 38 CONECT 44 43 45 5 CONECT 45 44 CONECT 46 1 CONECT 47 1 CONECT 48 1 CONECT 49 2 CONECT 50 2 CONECT 51 3 CONECT 52 4 CONECT 53 4 CONECT 54 4 CONECT 55 5 CONECT 56 6 CONECT 57 9 CONECT 58 10 CONECT 59 10 CONECT 60 12 CONECT 61 15 CONECT 62 15 CONECT 63 15 CONECT 64 17 CONECT 65 18 CONECT 66 19 CONECT 67 20 CONECT 68 22 CONECT 69 25 CONECT 70 26 CONECT 71 26 CONECT 72 27 CONECT 73 27 CONECT 74 28 CONECT 75 28 CONECT 76 29 CONECT 77 29 CONECT 78 30 CONECT 79 30 CONECT 80 31 CONECT 81 31 CONECT 82 32 CONECT 83 33 CONECT 84 33 CONECT 85 33 CONECT 86 34 CONECT 87 35 CONECT 88 38 CONECT 89 39 CONECT 90 39 CONECT 91 40 CONECT 92 40 CONECT 93 41 CONECT 94 41 CONECT 95 42 CONECT 96 42 MASTER 0 0 0 0 0 0 0 0 96 0 198 0 END