HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 -5.052 -0.938 3.647 0.00 0.00 C+0 HETATM 2 C UNK 0 -4.186 -0.060 4.558 0.00 0.00 C+0 HETATM 3 C UNK 0 -3.066 -0.897 5.182 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.607 1.188 3.886 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.224 1.202 2.591 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.664 2.359 1.802 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.181 2.199 1.365 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.277 2.191 2.602 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.950 0.973 0.436 0.00 0.00 C+0 HETATM 10 C UNK 0 -1.866 1.016 -0.820 0.00 0.00 C+0 HETATM 11 C UNK 0 -1.097 0.352 -1.967 0.00 0.00 C+0 HETATM 12 C UNK 0 0.115 -0.281 -1.289 0.00 0.00 C+0 HETATM 13 C UNK 0 1.311 -0.734 -2.094 0.00 0.00 C+0 HETATM 14 C UNK 0 1.346 -0.737 -3.438 0.00 0.00 C+0 HETATM 15 C UNK 0 2.451 -1.347 -4.244 0.00 0.00 C+0 HETATM 16 C UNK 0 3.347 -2.280 -3.411 0.00 0.00 C+0 HETATM 17 C UNK 0 4.528 -2.785 -4.267 0.00 0.00 C+0 HETATM 18 C UNK 0 5.679 -3.387 -3.438 0.00 0.00 C+0 HETATM 19 N UNK 0 6.478 -4.455 -4.100 0.00 0.00 N+0 HETATM 20 C UNK 0 7.168 -3.951 -5.290 0.00 0.00 C+0 HETATM 21 C UNK 0 5.723 -5.665 -4.430 0.00 0.00 C+0 HETATM 22 C UNK 0 5.192 -3.816 -2.037 0.00 0.00 C+0 HETATM 23 O UNK 0 6.274 -4.396 -1.302 0.00 0.00 O+0 HETATM 24 C UNK 0 4.644 -2.629 -1.236 0.00 0.00 C+0 HETATM 25 C UNK 0 3.764 -1.635 -2.057 0.00 0.00 C+0 HETATM 26 C UNK 0 4.590 -0.346 -2.322 0.00 0.00 C+0 HETATM 27 C UNK 0 2.447 -1.308 -1.241 0.00 0.00 C+0 HETATM 28 C UNK 0 2.725 -0.451 0.025 0.00 0.00 C+0 HETATM 29 C UNK 0 1.461 0.005 0.771 0.00 0.00 C+0 HETATM 30 C UNK 0 0.470 0.727 -0.166 0.00 0.00 C+0 HETATM 31 C UNK 0 1.087 2.037 -0.711 0.00 0.00 C+0 HETATM 32 C UNK 0 -3.481 2.395 4.806 0.00 0.00 C+0 HETATM 33 C UNK 0 -4.787 3.209 4.873 0.00 0.00 C+0 HETATM 34 N UNK 0 -4.667 4.450 5.664 0.00 0.00 N+0 HETATM 35 C UNK 0 -4.485 4.174 7.091 0.00 0.00 C+0 HETATM 36 C UNK 0 -5.859 5.280 5.471 0.00 0.00 C+0 HETATM 37 H UNK 0 -5.563 -1.708 4.236 0.00 0.00 H+0 HETATM 38 H UNK 0 -5.821 -0.343 3.142 0.00 0.00 H+0 HETATM 39 H UNK 0 -4.459 -1.455 2.885 0.00 0.00 H+0 HETATM 40 H UNK 0 -4.848 0.271 5.369 0.00 0.00 H+0 HETATM 41 H UNK 0 -3.480 -1.756 5.721 0.00 0.00 H+0 HETATM 42 H UNK 0 -2.480 -0.310 5.897 0.00 0.00 H+0 HETATM 43 H UNK 0 -2.379 -1.279 4.418 0.00 0.00 H+0 HETATM 44 H UNK 0 -3.335 0.292 2.006 0.00 0.00 H+0 HETATM 45 H UNK 0 -3.297 2.489 0.916 0.00 0.00 H+0 HETATM 46 H UNK 0 -2.769 3.301 2.352 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.939 3.108 0.799 0.00 0.00 H+0 HETATM 48 H UNK 0 -0.323 1.233 3.131 0.00 0.00 H+0 HETATM 49 H UNK 0 -0.564 2.981 3.303 0.00 0.00 H+0 HETATM 50 H UNK 0 0.763 2.389 2.333 0.00 0.00 H+0 HETATM 51 H UNK 0 -1.219 0.069 1.002 0.00 0.00 H+0 HETATM 52 H UNK 0 -2.124 2.042 -1.105 0.00 0.00 H+0 HETATM 53 H UNK 0 -2.804 0.484 -0.624 0.00 0.00 H+0 HETATM 54 H UNK 0 -0.807 1.108 -2.705 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.713 -0.392 -2.483 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.264 -1.202 -0.813 0.00 0.00 H+0 HETATM 57 H UNK 0 0.518 -0.332 -4.014 0.00 0.00 H+0 HETATM 58 H UNK 0 3.034 -0.543 -4.708 0.00 0.00 H+0 HETATM 59 H UNK 0 2.006 -1.926 -5.063 0.00 0.00 H+0 HETATM 60 H UNK 0 2.740 -3.167 -3.168 0.00 0.00 H+0 HETATM 61 H UNK 0 4.122 -3.513 -4.978 0.00 0.00 H+0 HETATM 62 H UNK 0 4.933 -1.973 -4.885 0.00 0.00 H+0 HETATM 63 H UNK 0 6.402 -2.580 -3.248 0.00 0.00 H+0 HETATM 64 H UNK 0 7.786 -3.082 -5.042 0.00 0.00 H+0 HETATM 65 H UNK 0 6.473 -3.667 -6.088 0.00 0.00 H+0 HETATM 66 H UNK 0 7.849 -4.712 -5.687 0.00 0.00 H+0 HETATM 67 H UNK 0 6.403 -6.436 -4.812 0.00 0.00 H+0 HETATM 68 H UNK 0 5.248 -6.099 -3.546 0.00 0.00 H+0 HETATM 69 H UNK 0 4.955 -5.497 -5.191 0.00 0.00 H+0 HETATM 70 H UNK 0 4.413 -4.583 -2.119 0.00 0.00 H+0 HETATM 71 H UNK 0 6.843 -4.809 -1.984 0.00 0.00 H+0 HETATM 72 H UNK 0 4.080 -3.050 -0.394 0.00 0.00 H+0 HETATM 73 H UNK 0 5.477 -2.098 -0.756 0.00 0.00 H+0 HETATM 74 H UNK 0 5.404 -0.517 -3.032 0.00 0.00 H+0 HETATM 75 H UNK 0 5.060 0.031 -1.407 0.00 0.00 H+0 HETATM 76 H UNK 0 3.973 0.463 -2.724 0.00 0.00 H+0 HETATM 77 H UNK 0 2.049 -2.269 -0.877 0.00 0.00 H+0 HETATM 78 H UNK 0 3.351 -1.020 0.722 0.00 0.00 H+0 HETATM 79 H UNK 0 3.297 0.447 -0.230 0.00 0.00 H+0 HETATM 80 H UNK 0 0.982 -0.873 1.224 0.00 0.00 H+0 HETATM 81 H UNK 0 1.769 0.649 1.599 0.00 0.00 H+0 HETATM 82 H UNK 0 1.445 2.672 0.106 0.00 0.00 H+0 HETATM 83 H UNK 0 1.940 1.854 -1.372 0.00 0.00 H+0 HETATM 84 H UNK 0 0.367 2.627 -1.286 0.00 0.00 H+0 HETATM 85 H UNK 0 -2.659 3.045 4.487 0.00 0.00 H+0 HETATM 86 H UNK 0 -3.193 2.043 5.804 0.00 0.00 H+0 HETATM 87 H UNK 0 -5.604 2.585 5.259 0.00 0.00 H+0 HETATM 88 H UNK 0 -5.059 3.477 3.843 0.00 0.00 H+0 HETATM 89 H UNK 0 -4.436 5.110 7.659 0.00 0.00 H+0 HETATM 90 H UNK 0 -3.538 3.660 7.279 0.00 0.00 H+0 HETATM 91 H UNK 0 -5.300 3.567 7.502 0.00 0.00 H+0 HETATM 92 H UNK 0 -5.977 5.546 4.414 0.00 0.00 H+0 HETATM 93 H UNK 0 -5.764 6.225 6.019 0.00 0.00 H+0 HETATM 94 H UNK 0 -6.773 4.776 5.806 0.00 0.00 H+0 CONECT 1 2 37 38 39 CONECT 2 4 1 3 40 CONECT 3 2 41 42 43 CONECT 4 5 2 32 CONECT 5 6 4 44 CONECT 6 7 5 45 46 CONECT 7 6 9 8 47 CONECT 8 7 48 49 50 CONECT 9 10 30 51 7 CONECT 10 11 9 52 53 CONECT 11 12 10 54 55 CONECT 12 13 30 11 56 CONECT 13 14 27 12 CONECT 14 13 15 57 CONECT 15 16 14 58 59 CONECT 16 17 25 15 60 CONECT 17 16 18 61 62 CONECT 18 22 17 19 63 CONECT 19 18 20 21 CONECT 20 19 64 65 66 CONECT 21 19 67 68 69 CONECT 22 18 24 23 70 CONECT 23 22 71 CONECT 24 25 22 72 73 CONECT 25 24 16 27 26 CONECT 26 25 74 75 76 CONECT 27 13 28 25 77 CONECT 28 27 29 78 79 CONECT 29 30 28 80 81 CONECT 30 29 12 9 31 CONECT 31 30 82 83 84 CONECT 32 4 33 85 86 CONECT 33 32 34 87 88 CONECT 34 33 35 36 CONECT 35 34 89 90 91 CONECT 36 34 92 93 94 CONECT 37 1 CONECT 38 1 CONECT 39 1 CONECT 40 2 CONECT 41 3 CONECT 42 3 CONECT 43 3 CONECT 44 5 CONECT 45 6 CONECT 46 6 CONECT 47 7 CONECT 48 8 CONECT 49 8 CONECT 50 8 CONECT 51 9 CONECT 52 10 CONECT 53 10 CONECT 54 11 CONECT 55 11 CONECT 56 12 CONECT 57 14 CONECT 58 15 CONECT 59 15 CONECT 60 16 CONECT 61 17 CONECT 62 17 CONECT 63 18 CONECT 64 20 CONECT 65 20 CONECT 66 20 CONECT 67 21 CONECT 68 21 CONECT 69 21 CONECT 70 22 CONECT 71 23 CONECT 72 24 CONECT 73 24 CONECT 74 26 CONECT 75 26 CONECT 76 26 CONECT 77 27 CONECT 78 28 CONECT 79 28 CONECT 80 29 CONECT 81 29 CONECT 82 31 CONECT 83 31 CONECT 84 31 CONECT 85 32 CONECT 86 32 CONECT 87 33 CONECT 88 33 CONECT 89 35 CONECT 90 35 CONECT 91 35 CONECT 92 36 CONECT 93 36 CONECT 94 36 MASTER 0 0 0 0 0 0 0 0 94 0 194 0 END