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 -8.369 1.110 -0.542 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.089 1.050 -0.228 0.00 0.00 C+0 HETATM 3 C UNK 0 -6.516 0.161 0.812 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.398 -0.626 0.161 0.00 0.00 C+0 HETATM 5 O UNK 0 -5.870 -1.466 -0.801 0.00 0.00 O+0 HETATM 6 C UNK 0 -6.799 -2.396 -0.520 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.648 -1.425 1.212 0.00 0.00 C+0 HETATM 8 O UNK 0 -5.511 -2.339 1.835 0.00 0.00 O+0 HETATM 9 C UNK 0 -3.505 -2.135 0.582 0.00 0.00 C+0 HETATM 10 O UNK 0 -3.486 -3.406 0.500 0.00 0.00 O+0 HETATM 11 N UNK 0 -2.427 -1.385 0.070 0.00 0.00 N+0 HETATM 12 C UNK 0 -1.329 -2.094 -0.540 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.086 -1.999 -0.080 0.00 0.00 C+0 HETATM 14 C UNK 0 1.055 -2.713 -0.685 0.00 0.00 C+0 HETATM 15 C UNK 0 0.606 -3.628 -1.813 0.00 0.00 C+0 HETATM 16 O UNK 0 1.659 -4.300 -2.386 0.00 0.00 O+0 HETATM 17 C UNK 0 2.129 -1.804 -1.183 0.00 0.00 C+0 HETATM 18 O UNK 0 1.660 -0.923 -2.171 0.00 0.00 O+0 HETATM 19 C UNK 0 2.811 -1.006 -0.100 0.00 0.00 C+0 HETATM 20 C UNK 0 3.476 -1.880 0.925 0.00 0.00 C+0 HETATM 21 C UNK 0 3.754 -0.027 -0.694 0.00 0.00 C+0 HETATM 22 O UNK 0 3.907 -0.039 -1.937 0.00 0.00 O+0 HETATM 23 N UNK 0 4.475 0.902 0.077 0.00 0.00 N+0 HETATM 24 C UNK 0 4.401 1.052 1.509 0.00 0.00 C+0 HETATM 25 C UNK 0 4.624 2.509 1.742 0.00 0.00 C+0 HETATM 26 C UNK 0 5.455 2.981 0.578 0.00 0.00 C+0 HETATM 27 C UNK 0 5.417 1.884 -0.426 0.00 0.00 C+0 HETATM 28 C UNK 0 6.712 1.335 -0.883 0.00 0.00 C+0 HETATM 29 O UNK 0 6.469 0.424 -1.948 0.00 0.00 O+0 HETATM 30 C UNK 0 7.609 0.693 0.099 0.00 0.00 C+0 HETATM 31 C UNK 0 8.091 1.523 1.208 0.00 0.00 C+0 HETATM 32 N UNK 0 9.125 2.505 1.032 0.00 0.00 N+0 HETATM 33 O UNK 0 7.593 1.378 2.351 0.00 0.00 O+0 HETATM 34 O UNK 0 -4.470 0.195 -0.453 0.00 0.00 O+0 HETATM 35 C UNK 0 -4.716 1.525 -0.489 0.00 0.00 C+0 HETATM 36 C UNK 0 -4.323 2.255 0.782 0.00 0.00 C+0 HETATM 37 C UNK 0 -6.124 1.912 -0.936 0.00 0.00 C+0 HETATM 38 C UNK 0 -6.341 3.379 -0.640 0.00 0.00 C+0 HETATM 39 H UNK 0 -8.694 1.788 -1.313 0.00 0.00 H+0 HETATM 40 H UNK 0 -9.134 0.503 -0.059 0.00 0.00 H+0 HETATM 41 H UNK 0 -6.179 0.707 1.708 0.00 0.00 H+0 HETATM 42 H UNK 0 -7.304 -0.536 1.138 0.00 0.00 H+0 HETATM 43 H UNK 0 -7.774 -2.031 -0.114 0.00 0.00 H+0 HETATM 44 H UNK 0 -7.123 -2.823 -1.537 0.00 0.00 H+0 HETATM 45 H UNK 0 -6.516 -3.289 0.039 0.00 0.00 H+0 HETATM 46 H UNK 0 -4.233 -0.783 2.011 0.00 0.00 H+0 HETATM 47 H UNK 0 -4.958 -3.055 2.199 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.368 -0.361 0.114 0.00 0.00 H+0 HETATM 49 H UNK 0 -1.532 -2.713 -1.391 0.00 0.00 H+0 HETATM 50 H UNK 0 0.044 -1.357 0.780 0.00 0.00 H+0 HETATM 51 H UNK 0 1.480 -3.377 0.092 0.00 0.00 H+0 HETATM 52 H UNK 0 0.128 -2.969 -2.583 0.00 0.00 H+0 HETATM 53 H UNK 0 -0.207 -4.288 -1.448 0.00 0.00 H+0 HETATM 54 H UNK 0 2.375 -4.383 -1.707 0.00 0.00 H+0 HETATM 55 H UNK 0 2.910 -2.416 -1.682 0.00 0.00 H+0 HETATM 56 H UNK 0 1.509 -1.494 -2.984 0.00 0.00 H+0 HETATM 57 H UNK 0 2.003 -0.409 0.399 0.00 0.00 H+0 HETATM 58 H UNK 0 3.361 -2.981 0.712 0.00 0.00 H+0 HETATM 59 H UNK 0 3.087 -1.659 1.935 0.00 0.00 H+0 HETATM 60 H UNK 0 4.559 -1.629 0.909 0.00 0.00 H+0 HETATM 61 H UNK 0 3.389 0.784 1.902 0.00 0.00 H+0 HETATM 62 H UNK 0 5.094 0.389 2.062 0.00 0.00 H+0 HETATM 63 H UNK 0 5.200 2.669 2.677 0.00 0.00 H+0 HETATM 64 H UNK 0 3.632 3.009 1.794 0.00 0.00 H+0 HETATM 65 H UNK 0 6.457 3.323 0.886 0.00 0.00 H+0 HETATM 66 H UNK 0 4.918 3.914 0.204 0.00 0.00 H+0 HETATM 67 H UNK 0 4.964 2.372 -1.368 0.00 0.00 H+0 HETATM 68 H UNK 0 7.315 2.150 -1.397 0.00 0.00 H+0 HETATM 69 H UNK 0 6.846 -0.472 -1.722 0.00 0.00 H+0 HETATM 70 H UNK 0 7.231 -0.290 0.477 0.00 0.00 H+0 HETATM 71 H UNK 0 8.543 0.391 -0.474 0.00 0.00 H+0 HETATM 72 H UNK 0 9.681 2.526 0.158 0.00 0.00 H+0 HETATM 73 H UNK 0 9.332 3.206 1.766 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.052 1.956 -1.299 0.00 0.00 H+0 HETATM 75 H UNK 0 -5.179 2.844 1.201 0.00 0.00 H+0 HETATM 76 H UNK 0 -3.943 1.554 1.558 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.509 2.993 0.622 0.00 0.00 H+0 HETATM 78 H UNK 0 -6.204 1.754 -2.012 0.00 0.00 H+0 HETATM 79 H UNK 0 -6.909 3.852 -1.471 0.00 0.00 H+0 HETATM 80 H UNK 0 -5.366 3.909 -0.579 0.00 0.00 H+0 HETATM 81 H UNK 0 -6.897 3.540 0.308 0.00 0.00 H+0 CONECT 1 2 39 40 CONECT 2 1 3 37 CONECT 3 2 4 41 42 CONECT 4 3 5 7 34 CONECT 5 4 6 CONECT 6 5 43 44 45 CONECT 7 4 8 9 46 CONECT 8 7 47 CONECT 9 7 10 11 CONECT 10 9 CONECT 11 9 12 48 CONECT 12 11 13 49 CONECT 13 12 14 50 CONECT 14 13 15 17 51 CONECT 15 14 16 52 53 CONECT 16 15 54 CONECT 17 14 18 19 55 CONECT 18 17 56 CONECT 19 17 20 21 57 CONECT 20 19 58 59 60 CONECT 21 19 22 23 CONECT 22 21 CONECT 23 21 24 27 CONECT 24 23 25 61 62 CONECT 25 24 26 63 64 CONECT 26 25 27 65 66 CONECT 27 26 28 23 67 CONECT 28 27 29 30 68 CONECT 29 28 69 CONECT 30 28 31 70 71 CONECT 31 30 32 33 CONECT 32 31 72 73 CONECT 33 31 CONECT 34 4 35 CONECT 35 34 36 37 74 CONECT 36 35 75 76 77 CONECT 37 35 38 2 78 CONECT 38 37 79 80 81 CONECT 39 1 CONECT 40 1 CONECT 41 3 CONECT 42 3 CONECT 43 6 CONECT 44 6 CONECT 45 6 CONECT 46 7 CONECT 47 8 CONECT 48 11 CONECT 49 12 CONECT 50 13 CONECT 51 14 CONECT 52 15 CONECT 53 15 CONECT 54 16 CONECT 55 17 CONECT 56 18 CONECT 57 19 CONECT 58 20 CONECT 59 20 CONECT 60 20 CONECT 61 24 CONECT 62 24 CONECT 63 25 CONECT 64 25 CONECT 65 26 CONECT 66 26 CONECT 67 27 CONECT 68 28 CONECT 69 29 CONECT 70 30 CONECT 71 30 CONECT 72 32 CONECT 73 32 CONECT 74 35 CONECT 75 36 CONECT 76 36 CONECT 77 36 CONECT 78 37 CONECT 79 38 CONECT 80 38 CONECT 81 38 MASTER 0 0 0 0 0 0 0 0 81 0 164 0 END