HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 C UNK 0 -1.818 5.771 3.905 0.00 0.00 C+0 HETATM 2 O UNK 0 -2.602 4.715 3.359 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.071 4.213 2.119 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.819 3.363 2.349 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.767 2.156 1.415 0.00 0.00 C+0 HETATM 6 O UNK 0 0.591 1.714 1.342 0.00 0.00 O+0 HETATM 7 C UNK 0 0.731 0.471 0.628 0.00 0.00 C+0 HETATM 8 C UNK 0 1.046 -0.669 1.645 0.00 0.00 C+0 HETATM 9 C UNK 0 0.893 -0.268 3.117 0.00 0.00 C+0 HETATM 10 C UNK 0 0.196 -1.909 1.396 0.00 0.00 C+0 HETATM 11 O UNK 0 -0.773 -1.980 0.657 0.00 0.00 O+0 HETATM 12 O UNK 0 0.708 -2.942 2.125 0.00 0.00 O+0 HETATM 13 C UNK 0 0.114 -4.245 1.983 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.222 -4.278 2.729 0.00 0.00 C+0 HETATM 15 C UNK 0 1.103 -5.309 2.540 0.00 0.00 C+0 HETATM 16 C UNK 0 1.503 -5.040 3.997 0.00 0.00 C+0 HETATM 17 C UNK 0 2.338 -5.527 1.618 0.00 0.00 C+0 HETATM 18 O UNK 0 2.954 -6.763 2.012 0.00 0.00 O+0 HETATM 19 C UNK 0 3.397 -4.398 1.566 0.00 0.00 C+0 HETATM 20 C UNK 0 4.539 -4.517 2.577 0.00 0.00 C+0 HETATM 21 C UNK 0 3.987 -4.387 0.163 0.00 0.00 C+0 HETATM 22 O UNK 0 4.911 -5.113 -0.190 0.00 0.00 O+0 HETATM 23 C UNK 0 3.343 -3.464 -0.826 0.00 0.00 C+0 HETATM 24 C UNK 0 2.615 -4.141 -1.985 0.00 0.00 C+0 HETATM 25 O UNK 0 1.914 -3.586 -0.867 0.00 0.00 O+0 HETATM 26 C UNK 0 3.877 -2.044 -0.935 0.00 0.00 C+0 HETATM 27 C UNK 0 3.212 -1.092 -1.955 0.00 0.00 C+0 HETATM 28 C UNK 0 4.205 0.008 -2.358 0.00 0.00 C+0 HETATM 29 C UNK 0 1.833 -0.534 -1.489 0.00 0.00 C+0 HETATM 30 O UNK 0 1.158 -0.100 -2.682 0.00 0.00 O+0 HETATM 31 C UNK 0 -0.157 -0.652 -2.822 0.00 0.00 C+0 HETATM 32 O UNK 0 -0.044 -2.060 -3.058 0.00 0.00 O+0 HETATM 33 C UNK 0 -1.318 -2.696 -3.146 0.00 0.00 C+0 HETATM 34 C UNK 0 -1.080 -4.197 -3.243 0.00 0.00 C+0 HETATM 35 C UNK 0 -2.063 -2.176 -4.378 0.00 0.00 C+0 HETATM 36 C UNK 0 -2.237 -0.654 -4.267 0.00 0.00 C+0 HETATM 37 N UNK 0 -2.962 0.016 -5.383 0.00 0.00 N+0 HETATM 38 C UNK 0 -2.429 -0.287 -6.713 0.00 0.00 C+0 HETATM 39 C UNK 0 -4.398 -0.270 -5.344 0.00 0.00 C+0 HETATM 40 C UNK 0 -0.869 0.030 -4.011 0.00 0.00 C+0 HETATM 41 O UNK 0 -1.106 1.425 -3.764 0.00 0.00 O+0 HETATM 42 C UNK 0 1.875 0.627 -0.441 0.00 0.00 C+0 HETATM 43 C UNK 0 1.811 2.017 -1.102 0.00 0.00 C+0 HETATM 44 O UNK 0 -1.246 2.533 0.134 0.00 0.00 O+0 HETATM 45 C UNK 0 -2.649 2.830 0.107 0.00 0.00 C+0 HETATM 46 C UNK 0 -3.417 1.589 -0.337 0.00 0.00 C+0 HETATM 47 C UNK 0 -3.172 3.381 1.446 0.00 0.00 C+0 HETATM 48 O UNK 0 -4.342 4.177 1.244 0.00 0.00 O+0 HETATM 49 H UNK 0 -2.301 6.112 4.825 0.00 0.00 H+0 HETATM 50 H UNK 0 -1.769 6.612 3.207 0.00 0.00 H+0 HETATM 51 H UNK 0 -0.811 5.425 4.152 0.00 0.00 H+0 HETATM 52 H UNK 0 -1.842 5.070 1.471 0.00 0.00 H+0 HETATM 53 H UNK 0 -0.742 3.021 3.389 0.00 0.00 H+0 HETATM 54 H UNK 0 0.064 3.997 2.192 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.379 1.341 1.821 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.198 0.265 0.088 0.00 0.00 H+0 HETATM 57 H UNK 0 2.086 -0.985 1.498 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.146 -0.022 3.361 0.00 0.00 H+0 HETATM 59 H UNK 0 1.192 -1.085 3.783 0.00 0.00 H+0 HETATM 60 H UNK 0 1.528 0.590 3.364 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.065 -4.453 0.921 0.00 0.00 H+0 HETATM 62 H UNK 0 -1.121 -3.900 3.751 0.00 0.00 H+0 HETATM 63 H UNK 0 -1.636 -5.291 2.760 0.00 0.00 H+0 HETATM 64 H UNK 0 -1.958 -3.633 2.238 0.00 0.00 H+0 HETATM 65 H UNK 0 0.567 -6.270 2.550 0.00 0.00 H+0 HETATM 66 H UNK 0 2.218 -5.788 4.355 0.00 0.00 H+0 HETATM 67 H UNK 0 1.950 -4.049 4.122 0.00 0.00 H+0 HETATM 68 H UNK 0 0.632 -5.095 4.658 0.00 0.00 H+0 HETATM 69 H UNK 0 1.942 -5.718 0.614 0.00 0.00 H+0 HETATM 70 H UNK 0 3.672 -6.952 1.377 0.00 0.00 H+0 HETATM 71 H UNK 0 2.938 -3.419 1.711 0.00 0.00 H+0 HETATM 72 H UNK 0 5.244 -3.687 2.450 0.00 0.00 H+0 HETATM 73 H UNK 0 5.113 -5.441 2.449 0.00 0.00 H+0 HETATM 74 H UNK 0 4.176 -4.483 3.607 0.00 0.00 H+0 HETATM 75 H UNK 0 2.662 -5.221 -2.066 0.00 0.00 H+0 HETATM 76 H UNK 0 2.503 -3.650 -2.942 0.00 0.00 H+0 HETATM 77 H UNK 0 4.938 -2.148 -1.197 0.00 0.00 H+0 HETATM 78 H UNK 0 3.861 -1.585 0.060 0.00 0.00 H+0 HETATM 79 H UNK 0 3.039 -1.646 -2.885 0.00 0.00 H+0 HETATM 80 H UNK 0 5.111 -0.433 -2.789 0.00 0.00 H+0 HETATM 81 H UNK 0 4.513 0.615 -1.502 0.00 0.00 H+0 HETATM 82 H UNK 0 3.776 0.663 -3.122 0.00 0.00 H+0 HETATM 83 H UNK 0 1.280 -1.365 -1.054 0.00 0.00 H+0 HETATM 84 H UNK 0 -0.720 -0.463 -1.902 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.890 -2.492 -2.232 0.00 0.00 H+0 HETATM 86 H UNK 0 -0.452 -4.442 -4.106 0.00 0.00 H+0 HETATM 87 H UNK 0 -2.024 -4.745 -3.325 0.00 0.00 H+0 HETATM 88 H UNK 0 -0.548 -4.555 -2.355 0.00 0.00 H+0 HETATM 89 H UNK 0 -3.034 -2.675 -4.463 0.00 0.00 H+0 HETATM 90 H UNK 0 -1.479 -2.417 -5.275 0.00 0.00 H+0 HETATM 91 H UNK 0 -2.833 -0.456 -3.363 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.574 -1.335 -6.995 0.00 0.00 H+0 HETATM 93 H UNK 0 -2.929 0.333 -7.466 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.364 -0.050 -6.785 0.00 0.00 H+0 HETATM 95 H UNK 0 -4.621 -1.327 -5.524 0.00 0.00 H+0 HETATM 96 H UNK 0 -4.926 0.323 -6.101 0.00 0.00 H+0 HETATM 97 H UNK 0 -4.825 0.016 -4.377 0.00 0.00 H+0 HETATM 98 H UNK 0 -0.221 -0.039 -4.893 0.00 0.00 H+0 HETATM 99 H UNK 0 -1.774 1.681 -4.430 0.00 0.00 H+0 HETATM 100 H UNK 0 2.823 0.586 0.110 0.00 0.00 H+0 HETATM 101 H UNK 0 2.566 2.133 -1.882 0.00 0.00 H+0 HETATM 102 H UNK 0 1.998 2.810 -0.369 0.00 0.00 H+0 HETATM 103 H UNK 0 0.831 2.202 -1.554 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.785 3.590 -0.672 0.00 0.00 H+0 HETATM 105 H UNK 0 -3.037 1.232 -1.301 0.00 0.00 H+0 HETATM 106 H UNK 0 -4.486 1.797 -0.439 0.00 0.00 H+0 HETATM 107 H UNK 0 -3.285 0.767 0.374 0.00 0.00 H+0 HETATM 108 H UNK 0 -3.468 2.564 2.117 0.00 0.00 H+0 HETATM 109 H UNK 0 -4.470 4.659 2.085 0.00 0.00 H+0 CONECT 1 2 49 50 51 CONECT 2 1 3 CONECT 3 4 47 2 52 CONECT 4 5 3 53 54 CONECT 5 44 4 6 55 CONECT 6 5 7 CONECT 7 42 8 6 56 CONECT 8 10 7 9 57 CONECT 9 8 58 59 60 CONECT 10 12 8 11 CONECT 11 10 CONECT 12 13 10 CONECT 13 15 12 14 61 CONECT 14 13 62 63 64 CONECT 15 17 13 16 65 CONECT 16 15 66 67 68 CONECT 17 15 18 19 69 CONECT 18 17 70 CONECT 19 20 17 21 71 CONECT 20 19 72 73 74 CONECT 21 22 19 23 CONECT 22 21 CONECT 23 24 26 25 21 CONECT 24 23 25 75 76 CONECT 25 23 24 CONECT 26 27 23 77 78 CONECT 27 29 26 28 79 CONECT 28 27 80 81 82 CONECT 29 42 27 30 83 CONECT 30 29 31 CONECT 31 40 32 30 84 CONECT 32 33 31 CONECT 33 32 35 34 85 CONECT 34 33 86 87 88 CONECT 35 33 36 89 90 CONECT 36 35 40 37 91 CONECT 37 38 39 36 CONECT 38 37 92 93 94 CONECT 39 37 95 96 97 CONECT 40 36 31 41 98 CONECT 41 40 99 CONECT 42 29 7 43 100 CONECT 43 42 101 102 103 CONECT 44 45 5 CONECT 45 47 44 46 104 CONECT 46 45 105 106 107 CONECT 47 45 3 48 108 CONECT 48 47 109 CONECT 49 1 CONECT 50 1 CONECT 51 1 CONECT 52 3 CONECT 53 4 CONECT 54 4 CONECT 55 5 CONECT 56 7 CONECT 57 8 CONECT 58 9 CONECT 59 9 CONECT 60 9 CONECT 61 13 CONECT 62 14 CONECT 63 14 CONECT 64 14 CONECT 65 15 CONECT 66 16 CONECT 67 16 CONECT 68 16 CONECT 69 17 CONECT 70 18 CONECT 71 19 CONECT 72 20 CONECT 73 20 CONECT 74 20 CONECT 75 24 CONECT 76 24 CONECT 77 26 CONECT 78 26 CONECT 79 27 CONECT 80 28 CONECT 81 28 CONECT 82 28 CONECT 83 29 CONECT 84 31 CONECT 85 33 CONECT 86 34 CONECT 87 34 CONECT 88 34 CONECT 89 35 CONECT 90 35 CONECT 91 36 CONECT 92 38 CONECT 93 38 CONECT 94 38 CONECT 95 39 CONECT 96 39 CONECT 97 39 CONECT 98 40 CONECT 99 41 CONECT 100 42 CONECT 101 43 CONECT 102 43 CONECT 103 43 CONECT 104 45 CONECT 105 46 CONECT 106 46 CONECT 107 46 CONECT 108 47 CONECT 109 48 MASTER 0 0 0 0 0 0 0 0 109 0 224 0 END