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 -8.932 -2.886 0.355 0.00 0.00 C+0 HETATM 2 O UNK 0 -7.775 -2.130 0.136 0.00 0.00 O+0 HETATM 3 C UNK 0 -7.985 -0.800 0.480 0.00 0.00 C+0 HETATM 4 C UNK 0 -7.851 0.025 -0.788 0.00 0.00 C+0 HETATM 5 O UNK 0 -8.513 1.253 -0.693 0.00 0.00 O+0 HETATM 6 C UNK 0 -9.594 1.561 -1.529 0.00 0.00 C+0 HETATM 7 N UNK 0 -10.277 2.808 -1.443 0.00 0.00 N+0 HETATM 8 O UNK 0 -9.939 0.694 -2.360 0.00 0.00 O+0 HETATM 9 C UNK 0 -6.406 0.150 -1.135 0.00 0.00 C+0 HETATM 10 O UNK 0 -6.293 0.933 -2.293 0.00 0.00 O+0 HETATM 11 C UNK 0 -5.605 0.786 0.014 0.00 0.00 C+0 HETATM 12 O UNK 0 -4.502 0.056 0.214 0.00 0.00 O+0 HETATM 13 C UNK 0 -3.179 0.057 0.191 0.00 0.00 C+0 HETATM 14 C UNK 0 -2.549 -1.161 0.552 0.00 0.00 C+0 HETATM 15 C UNK 0 -1.184 -1.226 0.548 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.374 -0.171 0.211 0.00 0.00 C+0 HETATM 17 C UNK 0 1.026 -0.251 0.211 0.00 0.00 C+0 HETATM 18 O UNK 0 1.614 -1.420 0.556 0.00 0.00 O+0 HETATM 19 C UNK 0 1.781 0.835 -0.135 0.00 0.00 C+0 HETATM 20 N UNK 0 3.191 0.924 -0.172 0.00 0.00 N+0 HETATM 21 C UNK 0 4.120 -0.008 0.198 0.00 0.00 C+0 HETATM 22 O UNK 0 3.885 -1.139 0.649 0.00 0.00 O+0 HETATM 23 C UNK 0 5.575 0.313 0.067 0.00 0.00 C+0 HETATM 24 C UNK 0 6.016 1.610 0.056 0.00 0.00 C+0 HETATM 25 C UNK 0 7.394 1.821 -0.081 0.00 0.00 C+0 HETATM 26 C UNK 0 8.305 0.796 -0.202 0.00 0.00 C+0 HETATM 27 C UNK 0 7.851 -0.504 -0.190 0.00 0.00 C+0 HETATM 28 C UNK 0 6.505 -0.725 -0.057 0.00 0.00 C+0 HETATM 29 C UNK 0 9.034 -1.385 -0.335 0.00 0.00 C+0 HETATM 30 C UNK 0 10.132 -0.455 0.195 0.00 0.00 C+0 HETATM 31 C UNK 0 11.488 -0.860 -0.279 0.00 0.00 C+0 HETATM 32 C UNK 0 12.466 0.216 0.143 0.00 0.00 C+0 HETATM 33 C UNK 0 11.484 -0.957 -1.788 0.00 0.00 C+0 HETATM 34 O UNK 0 11.805 -2.080 0.308 0.00 0.00 O+0 HETATM 35 O UNK 0 9.709 0.787 -0.348 0.00 0.00 O+0 HETATM 36 C UNK 0 1.032 1.987 -0.474 0.00 0.00 C+0 HETATM 37 O UNK 0 1.677 3.023 -0.802 0.00 0.00 O+0 HETATM 38 O UNK 0 -0.265 2.018 -0.460 0.00 0.00 O+0 HETATM 39 C UNK 0 -1.011 0.995 -0.134 0.00 0.00 C+0 HETATM 40 C UNK 0 -2.403 1.140 -0.154 0.00 0.00 C+0 HETATM 41 C UNK 0 -3.012 2.440 -0.541 0.00 0.00 C+0 HETATM 42 O UNK 0 -6.447 0.888 1.148 0.00 0.00 O+0 HETATM 43 C UNK 0 -6.953 -0.351 1.507 0.00 0.00 C+0 HETATM 44 C UNK 0 -5.894 -1.416 1.662 0.00 0.00 C+0 HETATM 45 C UNK 0 -7.667 -0.218 2.821 0.00 0.00 C+0 HETATM 46 H UNK 0 -8.714 -3.918 0.070 0.00 0.00 H+0 HETATM 47 H UNK 0 -9.732 -2.477 -0.293 0.00 0.00 H+0 HETATM 48 H UNK 0 -9.233 -2.871 1.429 0.00 0.00 H+0 HETATM 49 H UNK 0 -9.021 -0.658 0.844 0.00 0.00 H+0 HETATM 50 H UNK 0 -8.332 -0.576 -1.592 0.00 0.00 H+0 HETATM 51 H UNK 0 -11.130 2.955 -0.860 0.00 0.00 H+0 HETATM 52 H UNK 0 -9.937 3.635 -1.976 0.00 0.00 H+0 HETATM 53 H UNK 0 -6.008 -0.844 -1.405 0.00 0.00 H+0 HETATM 54 H UNK 0 -6.743 1.798 -2.208 0.00 0.00 H+0 HETATM 55 H UNK 0 -5.441 1.837 -0.287 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.179 -1.991 0.817 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.723 -2.160 0.825 0.00 0.00 H+0 HETATM 58 H UNK 0 1.239 -2.275 0.824 0.00 0.00 H+0 HETATM 59 H UNK 0 3.610 1.855 -0.558 0.00 0.00 H+0 HETATM 60 H UNK 0 5.341 2.450 0.155 0.00 0.00 H+0 HETATM 61 H UNK 0 7.746 2.856 -0.089 0.00 0.00 H+0 HETATM 62 H UNK 0 6.093 -1.739 -0.041 0.00 0.00 H+0 HETATM 63 H UNK 0 9.176 -1.567 -1.424 0.00 0.00 H+0 HETATM 64 H UNK 0 8.972 -2.306 0.267 0.00 0.00 H+0 HETATM 65 H UNK 0 10.020 -0.425 1.281 0.00 0.00 H+0 HETATM 66 H UNK 0 12.761 0.137 1.201 0.00 0.00 H+0 HETATM 67 H UNK 0 11.996 1.234 0.038 0.00 0.00 H+0 HETATM 68 H UNK 0 13.355 0.237 -0.539 0.00 0.00 H+0 HETATM 69 H UNK 0 10.670 -0.308 -2.162 0.00 0.00 H+0 HETATM 70 H UNK 0 11.209 -2.001 -2.073 0.00 0.00 H+0 HETATM 71 H UNK 0 12.486 -0.672 -2.154 0.00 0.00 H+0 HETATM 72 H UNK 0 11.844 -2.810 -0.358 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.512 2.955 0.298 0.00 0.00 H+0 HETATM 74 H UNK 0 -2.129 3.130 -0.774 0.00 0.00 H+0 HETATM 75 H UNK 0 -3.563 2.412 -1.491 0.00 0.00 H+0 HETATM 76 H UNK 0 -6.362 -2.216 2.308 0.00 0.00 H+0 HETATM 77 H UNK 0 -5.010 -1.072 2.200 0.00 0.00 H+0 HETATM 78 H UNK 0 -5.663 -1.928 0.707 0.00 0.00 H+0 HETATM 79 H UNK 0 -7.942 0.810 3.067 0.00 0.00 H+0 HETATM 80 H UNK 0 -8.585 -0.861 2.821 0.00 0.00 H+0 HETATM 81 H UNK 0 -7.042 -0.602 3.676 0.00 0.00 H+0 CONECT 1 2 46 47 48 CONECT 2 1 3 CONECT 3 2 4 43 49 CONECT 4 3 5 9 50 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 51 52 CONECT 8 6 CONECT 9 4 10 11 53 CONECT 10 9 54 CONECT 11 9 12 42 55 CONECT 12 11 13 CONECT 13 12 14 40 CONECT 14 13 15 56 CONECT 15 14 16 57 CONECT 16 15 17 39 CONECT 17 16 18 19 CONECT 18 17 58 CONECT 19 17 20 36 CONECT 20 19 21 59 CONECT 21 20 22 23 CONECT 22 21 CONECT 23 21 24 28 CONECT 24 23 25 60 CONECT 25 24 26 61 CONECT 26 25 27 35 CONECT 27 26 28 29 CONECT 28 27 23 62 CONECT 29 27 30 63 64 CONECT 30 29 31 35 65 CONECT 31 30 32 33 34 CONECT 32 31 66 67 68 CONECT 33 31 69 70 71 CONECT 34 31 72 CONECT 35 30 26 CONECT 36 19 37 38 CONECT 37 36 CONECT 38 36 39 CONECT 39 38 40 16 CONECT 40 39 41 13 CONECT 41 40 73 74 75 CONECT 42 11 43 CONECT 43 42 44 45 3 CONECT 44 43 76 77 78 CONECT 45 43 79 80 81 CONECT 46 1 CONECT 47 1 CONECT 48 1 CONECT 49 3 CONECT 50 4 CONECT 51 7 CONECT 52 7 CONECT 53 9 CONECT 54 10 CONECT 55 11 CONECT 56 14 CONECT 57 15 CONECT 58 18 CONECT 59 20 CONECT 60 24 CONECT 61 25 CONECT 62 28 CONECT 63 29 CONECT 64 29 CONECT 65 30 CONECT 66 32 CONECT 67 32 CONECT 68 32 CONECT 69 33 CONECT 70 33 CONECT 71 33 CONECT 72 34 CONECT 73 41 CONECT 74 41 CONECT 75 41 CONECT 76 44 CONECT 77 44 CONECT 78 44 CONECT 79 45 CONECT 80 45 CONECT 81 45 MASTER 0 0 0 0 0 0 0 0 81 0 170 0 END