HEADER PROTEIN 20-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 20-JUN-21 0 HETATM 1 O UNK 0 -0.257 -4.109 -0.078 0.00 0.00 O+0 HETATM 2 C UNK 0 -0.497 -3.213 0.719 0.00 0.00 C+0 HETATM 3 C UNK 0 0.230 -3.036 2.027 0.00 0.00 C+0 HETATM 4 C UNK 0 1.115 -1.777 1.974 0.00 0.00 C+0 HETATM 5 C UNK 0 2.220 -1.749 0.914 0.00 0.00 C+0 HETATM 6 C UNK 0 2.663 -0.505 0.423 0.00 0.00 C+0 HETATM 7 C UNK 0 3.652 -0.430 -0.558 0.00 0.00 C+0 HETATM 8 C UNK 0 4.213 -1.596 -1.056 0.00 0.00 C+0 HETATM 9 O UNK 0 5.170 -1.480 -2.020 0.00 0.00 O+0 HETATM 10 C UNK 0 3.810 -2.837 -0.580 0.00 0.00 C+0 HETATM 11 C UNK 0 2.821 -2.911 0.406 0.00 0.00 C+0 HETATM 12 C UNK 0 1.645 -1.377 3.354 0.00 0.00 C+0 HETATM 13 C UNK 0 2.484 -2.212 4.110 0.00 0.00 C+0 HETATM 14 O UNK 0 2.791 -3.456 3.637 0.00 0.00 O+0 HETATM 15 C UNK 0 3.016 -1.798 5.333 0.00 0.00 C+0 HETATM 16 C UNK 0 2.725 -0.527 5.815 0.00 0.00 C+0 HETATM 17 O UNK 0 3.296 -0.177 7.009 0.00 0.00 O+0 HETATM 18 C UNK 0 1.892 0.323 5.088 0.00 0.00 C+0 HETATM 19 C UNK 0 1.590 1.680 5.548 0.00 0.00 C+0 HETATM 20 O UNK 0 2.054 2.126 6.596 0.00 0.00 O+0 HETATM 21 C UNK 0 0.709 2.519 4.701 0.00 0.00 C+0 HETATM 22 O UNK 0 0.484 3.812 5.130 0.00 0.00 O+0 HETATM 23 C UNK 0 0.196 1.981 3.578 0.00 0.00 C+0 HETATM 24 O UNK 0 0.491 0.693 3.156 0.00 0.00 O+0 HETATM 25 C UNK 0 1.343 -0.103 3.881 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.734 2.673 2.642 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.670 3.619 3.087 0.00 0.00 C+0 HETATM 28 C UNK 0 -2.545 4.211 2.186 0.00 0.00 C+0 HETATM 29 O UNK 0 -3.446 5.134 2.636 0.00 0.00 O+0 HETATM 30 C UNK 0 -2.521 3.862 0.843 0.00 0.00 C+0 HETATM 31 O UNK 0 -3.422 4.472 0.006 0.00 0.00 O+0 HETATM 32 C UNK 0 -1.625 2.906 0.366 0.00 0.00 C+0 HETATM 33 C UNK 0 -0.733 2.322 1.268 0.00 0.00 C+0 HETATM 34 O UNK 0 -1.704 2.653 -0.976 0.00 0.00 O+0 HETATM 35 C UNK 0 -1.114 1.441 -1.488 0.00 0.00 C+0 HETATM 36 O UNK 0 -1.747 0.286 -0.936 0.00 0.00 O+0 HETATM 37 C UNK 0 -1.292 -0.956 -1.512 0.00 0.00 C+0 HETATM 38 C UNK 0 -1.991 -2.111 -0.774 0.00 0.00 C+0 HETATM 39 O UNK 0 -1.416 -2.224 0.547 0.00 0.00 O+0 HETATM 40 C UNK 0 -1.602 -0.983 -3.012 0.00 0.00 C+0 HETATM 41 O UNK 0 -1.133 -2.184 -3.622 0.00 0.00 O+0 HETATM 42 C UNK 0 -0.920 0.210 -3.682 0.00 0.00 C+0 HETATM 43 O UNK 0 -1.279 0.231 -5.074 0.00 0.00 O+0 HETATM 44 C UNK 0 -1.340 1.513 -3.013 0.00 0.00 C+0 HETATM 45 O UNK 0 -0.599 2.589 -3.614 0.00 0.00 O+0 HETATM 46 H UNK 0 -0.521 -2.960 2.823 0.00 0.00 H+0 HETATM 47 H UNK 0 0.794 -3.952 2.228 0.00 0.00 H+0 HETATM 48 H UNK 0 0.427 -0.989 1.641 0.00 0.00 H+0 HETATM 49 H UNK 0 2.240 0.420 0.807 0.00 0.00 H+0 HETATM 50 H UNK 0 3.985 0.535 -0.930 0.00 0.00 H+0 HETATM 51 H UNK 0 5.454 -2.373 -2.279 0.00 0.00 H+0 HETATM 52 H UNK 0 4.246 -3.756 -0.959 0.00 0.00 H+0 HETATM 53 H UNK 0 2.530 -3.896 0.766 0.00 0.00 H+0 HETATM 54 H UNK 0 3.459 -3.863 4.216 0.00 0.00 H+0 HETATM 55 H UNK 0 3.664 -2.446 5.916 0.00 0.00 H+0 HETATM 56 H UNK 0 3.026 0.744 7.227 0.00 0.00 H+0 HETATM 57 H UNK 0 0.984 3.903 5.968 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.742 3.901 4.133 0.00 0.00 H+0 HETATM 59 H UNK 0 -3.946 5.401 1.839 0.00 0.00 H+0 HETATM 60 H UNK 0 -3.294 4.041 -0.861 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.021 1.581 0.921 0.00 0.00 H+0 HETATM 62 H UNK 0 -0.037 1.439 -1.276 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.210 -1.040 -1.342 0.00 0.00 H+0 HETATM 64 H UNK 0 -3.053 -1.886 -0.631 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.921 -3.056 -1.321 0.00 0.00 H+0 HETATM 66 H UNK 0 -2.685 -0.930 -3.183 0.00 0.00 H+0 HETATM 67 H UNK 0 -1.185 -2.027 -4.587 0.00 0.00 H+0 HETATM 68 H UNK 0 0.171 0.092 -3.658 0.00 0.00 H+0 HETATM 69 H UNK 0 -0.922 1.075 -5.417 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.397 1.712 -3.231 0.00 0.00 H+0 HETATM 71 H UNK 0 -0.824 3.397 -3.115 0.00 0.00 H+0 CONECT 1 2 CONECT 2 3 39 1 CONECT 3 2 4 46 47 CONECT 4 5 12 48 3 CONECT 5 6 11 4 CONECT 6 5 7 49 CONECT 7 6 8 50 CONECT 8 7 10 9 CONECT 9 8 51 CONECT 10 8 11 52 CONECT 11 10 5 53 CONECT 12 25 13 4 CONECT 13 15 12 14 CONECT 14 13 54 CONECT 15 13 16 55 CONECT 16 17 15 18 CONECT 17 16 56 CONECT 18 16 25 19 CONECT 19 20 18 21 CONECT 20 19 CONECT 21 22 19 23 CONECT 22 21 57 CONECT 23 26 21 24 CONECT 24 25 23 CONECT 25 12 18 24 CONECT 26 23 27 33 CONECT 27 26 28 58 CONECT 28 27 30 29 CONECT 29 28 59 CONECT 30 28 32 31 CONECT 31 30 60 CONECT 32 30 33 34 CONECT 33 32 26 61 CONECT 34 32 35 CONECT 35 36 44 34 62 CONECT 36 37 35 CONECT 37 40 36 38 63 CONECT 38 39 37 64 65 CONECT 39 2 38 CONECT 40 37 42 41 66 CONECT 41 40 67 CONECT 42 44 40 43 68 CONECT 43 42 69 CONECT 44 45 35 42 70 CONECT 45 44 71 CONECT 46 3 CONECT 47 3 CONECT 48 4 CONECT 49 6 CONECT 50 7 CONECT 51 9 CONECT 52 10 CONECT 53 11 CONECT 54 14 CONECT 55 15 CONECT 56 17 CONECT 57 22 CONECT 58 27 CONECT 59 29 CONECT 60 31 CONECT 61 33 CONECT 62 35 CONECT 63 37 CONECT 64 38 CONECT 65 38 CONECT 66 40 CONECT 67 41 CONECT 68 42 CONECT 69 43 CONECT 70 44 CONECT 71 45 MASTER 0 0 0 0 0 0 0 0 71 0 152 0 END