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 -3.135 -3.856 -2.459 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.519 -4.178 -1.337 0.00 0.00 C+0 HETATM 3 C UNK 0 -1.093 -4.002 -1.190 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.559 -2.959 -0.258 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.822 -1.555 -0.544 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.239 -1.140 -0.537 0.00 0.00 C+0 HETATM 7 O UNK 0 -3.203 -1.740 -0.063 0.00 0.00 O+0 HETATM 8 O UNK 0 -2.566 0.106 -1.143 0.00 0.00 O+0 HETATM 9 C UNK 0 -3.902 0.540 -1.157 0.00 0.00 C+0 HETATM 10 O UNK 0 -4.044 1.816 -0.605 0.00 0.00 O+0 HETATM 11 C UNK 0 -5.384 2.164 -0.500 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.814 1.771 0.917 0.00 0.00 C+0 HETATM 13 O UNK 0 -7.172 2.070 1.161 0.00 0.00 O+0 HETATM 14 C UNK 0 -7.720 3.330 1.105 0.00 0.00 C+0 HETATM 15 C UNK 0 -9.153 3.604 1.367 0.00 0.00 C+0 HETATM 16 O UNK 0 -6.982 4.318 0.816 0.00 0.00 O+0 HETATM 17 C UNK 0 -6.259 1.436 -1.495 0.00 0.00 C+0 HETATM 18 O UNK 0 -7.417 2.190 -1.680 0.00 0.00 O+0 HETATM 19 C UNK 0 -5.518 1.453 -2.833 0.00 0.00 C+0 HETATM 20 O UNK 0 -6.307 0.911 -3.829 0.00 0.00 O+0 HETATM 21 C UNK 0 -4.299 0.588 -2.640 0.00 0.00 C+0 HETATM 22 O UNK 0 -3.226 1.094 -3.403 0.00 0.00 O+0 HETATM 23 C UNK 0 0.010 -0.531 0.170 0.00 0.00 C+0 HETATM 24 C UNK 0 -0.050 -0.590 1.664 0.00 0.00 C+0 HETATM 25 O UNK 0 -0.559 0.573 2.280 0.00 0.00 O+0 HETATM 26 C UNK 0 -1.587 0.537 3.229 0.00 0.00 C+0 HETATM 27 C UNK 0 -2.031 1.810 3.800 0.00 0.00 C+0 HETATM 28 O UNK 0 -2.041 -0.594 3.510 0.00 0.00 O+0 HETATM 29 C UNK 0 1.443 -0.663 2.042 0.00 0.00 C+0 HETATM 30 C UNK 0 2.015 0.242 1.027 0.00 0.00 C+0 HETATM 31 C UNK 0 1.622 1.661 1.300 0.00 0.00 C+0 HETATM 32 C UNK 0 3.463 0.203 0.805 0.00 0.00 C+0 HETATM 33 C UNK 0 3.875 0.909 -0.256 0.00 0.00 C+0 HETATM 34 C UNK 0 2.959 1.319 -1.349 0.00 0.00 C+0 HETATM 35 C UNK 0 1.562 0.851 -1.245 0.00 0.00 C+0 HETATM 36 C UNK 0 1.387 -0.300 -0.272 0.00 0.00 C+0 HETATM 37 C UNK 0 2.139 -1.442 -0.847 0.00 0.00 C+0 HETATM 38 C UNK 0 5.301 1.333 -0.405 0.00 0.00 C+0 HETATM 39 C UNK 0 5.787 0.814 -1.724 0.00 0.00 C+0 HETATM 40 C UNK 0 5.409 2.851 -0.458 0.00 0.00 C+0 HETATM 41 C UNK 0 6.785 3.339 -0.069 0.00 0.00 C+0 HETATM 42 C UNK 0 7.804 2.270 -0.072 0.00 0.00 C+0 HETATM 43 O UNK 0 8.836 2.385 -0.685 0.00 0.00 O+0 HETATM 44 C UNK 0 7.544 1.034 0.698 0.00 0.00 C+0 HETATM 45 C UNK 0 8.051 1.225 2.136 0.00 0.00 C+0 HETATM 46 C UNK 0 8.279 -0.162 0.135 0.00 0.00 C+0 HETATM 47 C UNK 0 6.064 0.853 0.776 0.00 0.00 C+0 HETATM 48 C UNK 0 5.750 -0.587 1.141 0.00 0.00 C+0 HETATM 49 C UNK 0 4.330 -0.560 1.705 0.00 0.00 C+0 HETATM 50 C UNK 0 -3.334 -4.795 -0.252 0.00 0.00 C+0 HETATM 51 C UNK 0 -2.808 -6.236 -0.135 0.00 0.00 C+0 HETATM 52 C UNK 0 -4.784 -4.931 -0.672 0.00 0.00 C+0 HETATM 53 H UNK 0 -2.550 -3.454 -3.274 0.00 0.00 H+0 HETATM 54 H UNK 0 -4.202 -3.970 -2.617 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.576 -3.886 -2.202 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.684 -5.029 -0.875 0.00 0.00 H+0 HETATM 57 H UNK 0 -1.030 -3.168 0.782 0.00 0.00 H+0 HETATM 58 H UNK 0 0.494 -3.245 -0.068 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.553 -1.431 -1.674 0.00 0.00 H+0 HETATM 60 H UNK 0 -4.530 -0.202 -0.672 0.00 0.00 H+0 HETATM 61 H UNK 0 -5.550 3.246 -0.669 0.00 0.00 H+0 HETATM 62 H UNK 0 -5.630 0.692 1.074 0.00 0.00 H+0 HETATM 63 H UNK 0 -5.188 2.388 1.611 0.00 0.00 H+0 HETATM 64 H UNK 0 -9.331 3.697 2.459 0.00 0.00 H+0 HETATM 65 H UNK 0 -9.816 2.792 0.987 0.00 0.00 H+0 HETATM 66 H UNK 0 -9.451 4.580 0.918 0.00 0.00 H+0 HETATM 67 H UNK 0 -6.467 0.399 -1.211 0.00 0.00 H+0 HETATM 68 H UNK 0 -7.243 2.974 -2.250 0.00 0.00 H+0 HETATM 69 H UNK 0 -5.213 2.489 -3.087 0.00 0.00 H+0 HETATM 70 H UNK 0 -6.113 1.390 -4.694 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.476 -0.440 -2.983 0.00 0.00 H+0 HETATM 72 H UNK 0 -2.781 1.770 -2.798 0.00 0.00 H+0 HETATM 73 H UNK 0 -0.538 0.464 -0.068 0.00 0.00 H+0 HETATM 74 H UNK 0 -0.604 -1.445 2.071 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.334 2.186 4.596 0.00 0.00 H+0 HETATM 76 H UNK 0 -3.013 1.699 4.287 0.00 0.00 H+0 HETATM 77 H UNK 0 -2.035 2.603 2.998 0.00 0.00 H+0 HETATM 78 H UNK 0 1.812 -1.694 2.031 0.00 0.00 H+0 HETATM 79 H UNK 0 1.561 -0.225 3.040 0.00 0.00 H+0 HETATM 80 H UNK 0 2.406 2.387 0.955 0.00 0.00 H+0 HETATM 81 H UNK 0 0.671 1.993 0.907 0.00 0.00 H+0 HETATM 82 H UNK 0 1.595 1.796 2.417 0.00 0.00 H+0 HETATM 83 H UNK 0 2.977 2.443 -1.375 0.00 0.00 H+0 HETATM 84 H UNK 0 3.432 0.946 -2.300 0.00 0.00 H+0 HETATM 85 H UNK 0 1.249 0.418 -2.245 0.00 0.00 H+0 HETATM 86 H UNK 0 0.839 1.677 -1.087 0.00 0.00 H+0 HETATM 87 H UNK 0 2.563 -2.159 -0.147 0.00 0.00 H+0 HETATM 88 H UNK 0 1.508 -1.880 -1.658 0.00 0.00 H+0 HETATM 89 H UNK 0 3.032 -1.065 -1.426 0.00 0.00 H+0 HETATM 90 H UNK 0 5.378 1.520 -2.506 0.00 0.00 H+0 HETATM 91 H UNK 0 6.880 0.849 -1.854 0.00 0.00 H+0 HETATM 92 H UNK 0 5.402 -0.205 -1.955 0.00 0.00 H+0 HETATM 93 H UNK 0 5.251 3.188 -1.524 0.00 0.00 H+0 HETATM 94 H UNK 0 4.612 3.283 0.147 0.00 0.00 H+0 HETATM 95 H UNK 0 6.693 3.714 0.984 0.00 0.00 H+0 HETATM 96 H UNK 0 7.083 4.220 -0.672 0.00 0.00 H+0 HETATM 97 H UNK 0 7.228 1.605 2.785 0.00 0.00 H+0 HETATM 98 H UNK 0 8.313 0.219 2.523 0.00 0.00 H+0 HETATM 99 H UNK 0 8.939 1.883 2.142 0.00 0.00 H+0 HETATM 100 H UNK 0 8.791 -0.734 0.937 0.00 0.00 H+0 HETATM 101 H UNK 0 7.612 -0.888 -0.374 0.00 0.00 H+0 HETATM 102 H UNK 0 9.107 0.171 -0.558 0.00 0.00 H+0 HETATM 103 H UNK 0 5.703 1.462 1.656 0.00 0.00 H+0 HETATM 104 H UNK 0 5.693 -1.198 0.227 0.00 0.00 H+0 HETATM 105 H UNK 0 6.477 -0.918 1.883 0.00 0.00 H+0 HETATM 106 H UNK 0 4.007 -1.573 1.933 0.00 0.00 H+0 HETATM 107 H UNK 0 4.419 0.030 2.664 0.00 0.00 H+0 HETATM 108 H UNK 0 -3.192 -4.361 0.734 0.00 0.00 H+0 HETATM 109 H UNK 0 -1.861 -6.258 0.409 0.00 0.00 H+0 HETATM 110 H UNK 0 -2.704 -6.601 -1.174 0.00 0.00 H+0 HETATM 111 H UNK 0 -3.595 -6.888 0.328 0.00 0.00 H+0 HETATM 112 H UNK 0 -5.215 -3.941 -0.848 0.00 0.00 H+0 HETATM 113 H UNK 0 -4.834 -5.600 -1.555 0.00 0.00 H+0 HETATM 114 H UNK 0 -5.309 -5.488 0.148 0.00 0.00 H+0 CONECT 1 2 53 54 CONECT 2 1 3 50 CONECT 3 2 4 55 56 CONECT 4 3 5 57 58 CONECT 5 4 6 23 59 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 CONECT 9 8 10 21 60 CONECT 10 9 11 CONECT 11 10 12 17 61 CONECT 12 11 13 62 63 CONECT 13 12 14 CONECT 14 13 15 16 CONECT 15 14 64 65 66 CONECT 16 14 CONECT 17 11 18 19 67 CONECT 18 17 68 CONECT 19 17 20 21 69 CONECT 20 19 70 CONECT 21 19 22 9 71 CONECT 22 21 72 CONECT 23 5 24 36 73 CONECT 24 23 25 29 74 CONECT 25 24 26 CONECT 26 25 27 28 CONECT 27 26 75 76 77 CONECT 28 26 CONECT 29 24 30 78 79 CONECT 30 29 31 32 36 CONECT 31 30 80 81 82 CONECT 32 30 33 49 CONECT 33 32 34 38 CONECT 34 33 35 83 84 CONECT 35 34 36 85 86 CONECT 36 35 37 23 30 CONECT 37 36 87 88 89 CONECT 38 33 39 40 47 CONECT 39 38 90 91 92 CONECT 40 38 41 93 94 CONECT 41 40 42 95 96 CONECT 42 41 43 44 CONECT 43 42 CONECT 44 42 45 46 47 CONECT 45 44 97 98 99 CONECT 46 44 100 101 102 CONECT 47 44 48 38 103 CONECT 48 47 49 104 105 CONECT 49 48 32 106 107 CONECT 50 2 51 52 108 CONECT 51 50 109 110 111 CONECT 52 50 112 113 114 CONECT 53 1 CONECT 54 1 CONECT 55 3 CONECT 56 3 CONECT 57 4 CONECT 58 4 CONECT 59 5 CONECT 60 9 CONECT 61 11 CONECT 62 12 CONECT 63 12 CONECT 64 15 CONECT 65 15 CONECT 66 15 CONECT 67 17 CONECT 68 18 CONECT 69 19 CONECT 70 20 CONECT 71 21 CONECT 72 22 CONECT 73 23 CONECT 74 24 CONECT 75 27 CONECT 76 27 CONECT 77 27 CONECT 78 29 CONECT 79 29 CONECT 80 31 CONECT 81 31 CONECT 82 31 CONECT 83 34 CONECT 84 34 CONECT 85 35 CONECT 86 35 CONECT 87 37 CONECT 88 37 CONECT 89 37 CONECT 90 39 CONECT 91 39 CONECT 92 39 CONECT 93 40 CONECT 94 40 CONECT 95 41 CONECT 96 41 CONECT 97 45 CONECT 98 45 CONECT 99 45 CONECT 100 46 CONECT 101 46 CONECT 102 46 CONECT 103 47 CONECT 104 48 CONECT 105 48 CONECT 106 49 CONECT 107 49 CONECT 108 50 CONECT 109 51 CONECT 110 51 CONECT 111 51 CONECT 112 52 CONECT 113 52 CONECT 114 52 MASTER 0 0 0 0 0 0 0 0 114 0 236 0 END