HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 9.126 -1.024 -0.191 0.00 0.00 C+0 HETATM 2 N UNK 0 8.054 -1.813 -0.739 0.00 0.00 N+0 HETATM 3 C UNK 0 6.793 -1.809 -0.113 0.00 0.00 C+0 HETATM 4 C UNK 0 6.594 -1.076 1.030 0.00 0.00 C+0 HETATM 5 C UNK 0 5.345 -1.055 1.665 0.00 0.00 C+0 HETATM 6 C UNK 0 4.286 -1.763 1.167 0.00 0.00 C+0 HETATM 7 C UNK 0 2.957 -1.761 1.797 0.00 0.00 C+0 HETATM 8 C UNK 0 1.998 -0.722 1.328 0.00 0.00 C+0 HETATM 9 N UNK 0 2.495 0.611 1.573 0.00 0.00 N+0 HETATM 10 C UNK 0 1.836 1.825 1.230 0.00 0.00 C+0 HETATM 11 O UNK 0 2.595 2.851 1.131 0.00 0.00 O+0 HETATM 12 C UNK 0 0.357 1.935 0.994 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.023 2.842 -0.081 0.00 0.00 C+0 HETATM 14 C UNK 0 0.380 2.728 -1.468 0.00 0.00 C+0 HETATM 15 C UNK 0 1.863 2.795 -1.752 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.183 3.998 -2.166 0.00 0.00 C+0 HETATM 17 N UNK 0 -0.311 2.247 2.247 0.00 0.00 N+0 HETATM 18 C UNK 0 -1.493 2.884 2.550 0.00 0.00 C+0 HETATM 19 O UNK 0 -1.365 4.036 3.160 0.00 0.00 O+0 HETATM 20 C UNK 0 -2.913 2.528 2.330 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.687 3.528 1.497 0.00 0.00 C+0 HETATM 22 C UNK 0 -5.133 3.042 1.400 0.00 0.00 C+0 HETATM 23 C UNK 0 -3.767 4.817 2.291 0.00 0.00 C+0 HETATM 24 N UNK 0 -3.204 1.155 2.096 0.00 0.00 N+0 HETATM 25 C UNK 0 -2.675 0.169 1.265 0.00 0.00 C+0 HETATM 26 O UNK 0 -2.043 -0.805 1.867 0.00 0.00 O+0 HETATM 27 C UNK 0 -2.672 -0.026 -0.181 0.00 0.00 C+0 HETATM 28 C UNK 0 -3.856 0.537 -0.927 0.00 0.00 C+0 HETATM 29 C UNK 0 -5.177 0.005 -0.507 0.00 0.00 C+0 HETATM 30 C UNK 0 -5.362 -1.477 -0.648 0.00 0.00 C+0 HETATM 31 C UNK 0 -6.231 0.634 -1.434 0.00 0.00 C+0 HETATM 32 N UNK 0 -2.478 -1.388 -0.636 0.00 0.00 N+0 HETATM 33 C UNK 0 -1.710 -2.410 -0.080 0.00 0.00 C+0 HETATM 34 O UNK 0 -2.297 -3.479 0.321 0.00 0.00 O+0 HETATM 35 C UNK 0 -0.228 -2.443 0.126 0.00 0.00 C+0 HETATM 36 C UNK 0 0.241 -3.800 -0.357 0.00 0.00 C+0 HETATM 37 C UNK 0 -0.045 -4.110 -1.776 0.00 0.00 C+0 HETATM 38 C UNK 0 0.567 -3.204 -2.792 0.00 0.00 C+0 HETATM 39 C UNK 0 0.491 -5.526 -2.030 0.00 0.00 C+0 HETATM 40 N UNK 0 0.487 -1.431 -0.565 0.00 0.00 N+0 HETATM 41 C UNK 0 1.716 -0.954 -0.111 0.00 0.00 C+0 HETATM 42 O UNK 0 2.668 -0.691 -0.923 0.00 0.00 O+0 HETATM 43 C UNK 0 4.531 -2.487 0.018 0.00 0.00 C+0 HETATM 44 C UNK 0 5.744 -2.530 -0.631 0.00 0.00 C+0 HETATM 45 H UNK 0 9.279 -1.181 0.905 0.00 0.00 H+0 HETATM 46 H UNK 0 8.845 0.056 -0.290 0.00 0.00 H+0 HETATM 47 H UNK 0 10.053 -1.252 -0.757 0.00 0.00 H+0 HETATM 48 H UNK 0 8.202 -2.380 -1.583 0.00 0.00 H+0 HETATM 49 H UNK 0 7.426 -0.516 1.429 0.00 0.00 H+0 HETATM 50 H UNK 0 5.303 -0.469 2.554 0.00 0.00 H+0 HETATM 51 H UNK 0 3.055 -1.730 2.930 0.00 0.00 H+0 HETATM 52 H UNK 0 2.559 -2.808 1.634 0.00 0.00 H+0 HETATM 53 H UNK 0 1.050 -0.871 1.921 0.00 0.00 H+0 HETATM 54 H UNK 0 3.417 0.717 2.052 0.00 0.00 H+0 HETATM 55 H UNK 0 0.059 0.886 0.784 0.00 0.00 H+0 HETATM 56 H UNK 0 -1.156 2.914 -0.065 0.00 0.00 H+0 HETATM 57 H UNK 0 0.266 3.893 0.259 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.117 1.919 -2.061 0.00 0.00 H+0 HETATM 59 H UNK 0 2.050 2.851 -2.871 0.00 0.00 H+0 HETATM 60 H UNK 0 2.444 1.932 -1.431 0.00 0.00 H+0 HETATM 61 H UNK 0 2.293 3.783 -1.409 0.00 0.00 H+0 HETATM 62 H UNK 0 0.174 4.003 -3.215 0.00 0.00 H+0 HETATM 63 H UNK 0 0.262 4.874 -1.652 0.00 0.00 H+0 HETATM 64 H UNK 0 -1.282 3.992 -2.074 0.00 0.00 H+0 HETATM 65 H UNK 0 0.275 1.895 3.099 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.434 2.747 3.352 0.00 0.00 H+0 HETATM 67 H UNK 0 -3.265 3.697 0.487 0.00 0.00 H+0 HETATM 68 H UNK 0 -5.359 2.819 0.340 0.00 0.00 H+0 HETATM 69 H UNK 0 -5.315 2.147 1.994 0.00 0.00 H+0 HETATM 70 H UNK 0 -5.857 3.842 1.676 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.722 5.369 2.040 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.840 4.570 3.358 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.888 5.473 2.139 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.024 0.757 2.704 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.783 0.539 -0.602 0.00 0.00 H+0 HETATM 76 H UNK 0 -3.713 0.166 -1.995 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.883 1.617 -1.027 0.00 0.00 H+0 HETATM 78 H UNK 0 -5.481 0.282 0.524 0.00 0.00 H+0 HETATM 79 H UNK 0 -6.412 -1.680 -0.267 0.00 0.00 H+0 HETATM 80 H UNK 0 -5.374 -1.838 -1.684 0.00 0.00 H+0 HETATM 81 H UNK 0 -4.727 -2.082 0.022 0.00 0.00 H+0 HETATM 82 H UNK 0 -7.248 0.435 -1.030 0.00 0.00 H+0 HETATM 83 H UNK 0 -6.179 0.028 -2.381 0.00 0.00 H+0 HETATM 84 H UNK 0 -6.028 1.678 -1.656 0.00 0.00 H+0 HETATM 85 H UNK 0 -3.000 -1.674 -1.541 0.00 0.00 H+0 HETATM 86 H UNK 0 0.007 -2.465 1.228 0.00 0.00 H+0 HETATM 87 H UNK 0 -0.130 -4.593 0.332 0.00 0.00 H+0 HETATM 88 H UNK 0 1.362 -3.819 -0.202 0.00 0.00 H+0 HETATM 89 H UNK 0 -1.160 -4.125 -1.907 0.00 0.00 H+0 HETATM 90 H UNK 0 0.931 -3.808 -3.690 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.188 -2.517 -3.252 0.00 0.00 H+0 HETATM 92 H UNK 0 1.461 -2.678 -2.408 0.00 0.00 H+0 HETATM 93 H UNK 0 0.457 -6.097 -1.091 0.00 0.00 H+0 HETATM 94 H UNK 0 1.526 -5.436 -2.348 0.00 0.00 H+0 HETATM 95 H UNK 0 -0.106 -6.000 -2.841 0.00 0.00 H+0 HETATM 96 H UNK 0 0.055 -1.025 -1.450 0.00 0.00 H+0 HETATM 97 H UNK 0 3.732 -3.090 -0.425 0.00 0.00 H+0 HETATM 98 H UNK 0 5.857 -3.129 -1.538 0.00 0.00 H+0 CONECT 1 2 45 46 47 CONECT 2 1 3 48 CONECT 3 2 4 44 CONECT 4 3 5 49 CONECT 5 4 6 50 CONECT 6 5 7 43 CONECT 7 6 8 51 52 CONECT 8 7 9 41 53 CONECT 9 8 10 54 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 17 55 CONECT 13 12 14 56 57 CONECT 14 13 15 16 58 CONECT 15 14 59 60 61 CONECT 16 14 62 63 64 CONECT 17 12 18 65 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 24 66 CONECT 21 20 22 23 67 CONECT 22 21 68 69 70 CONECT 23 21 71 72 73 CONECT 24 20 25 74 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 32 75 CONECT 28 27 29 76 77 CONECT 29 28 30 31 78 CONECT 30 29 79 80 81 CONECT 31 29 82 83 84 CONECT 32 27 33 85 CONECT 33 32 34 35 CONECT 34 33 CONECT 35 33 36 40 86 CONECT 36 35 37 87 88 CONECT 37 36 38 39 89 CONECT 38 37 90 91 92 CONECT 39 37 93 94 95 CONECT 40 35 41 96 CONECT 41 40 42 8 CONECT 42 41 CONECT 43 6 44 97 CONECT 44 43 3 98 CONECT 45 1 CONECT 46 1 CONECT 47 1 CONECT 48 2 CONECT 49 4 CONECT 50 5 CONECT 51 7 CONECT 52 7 CONECT 53 8 CONECT 54 9 CONECT 55 12 CONECT 56 13 CONECT 57 13 CONECT 58 14 CONECT 59 15 CONECT 60 15 CONECT 61 15 CONECT 62 16 CONECT 63 16 CONECT 64 16 CONECT 65 17 CONECT 66 20 CONECT 67 21 CONECT 68 22 CONECT 69 22 CONECT 70 22 CONECT 71 23 CONECT 72 23 CONECT 73 23 CONECT 74 24 CONECT 75 27 CONECT 76 28 CONECT 77 28 CONECT 78 29 CONECT 79 30 CONECT 80 30 CONECT 81 30 CONECT 82 31 CONECT 83 31 CONECT 84 31 CONECT 85 32 CONECT 86 35 CONECT 87 36 CONECT 88 36 CONECT 89 37 CONECT 90 38 CONECT 91 38 CONECT 92 38 CONECT 93 39 CONECT 94 39 CONECT 95 39 CONECT 96 40 CONECT 97 43 CONECT 98 44 MASTER 0 0 0 0 0 0 0 0 98 0 198 0 END