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 -0.331 -3.913 -2.357 0.00 0.00 C+0 HETATM 2 C UNK 0 -0.543 -3.749 -0.891 0.00 0.00 C+0 HETATM 3 C UNK 0 0.630 -4.409 -0.167 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.592 -2.245 -0.484 0.00 0.00 C+0 HETATM 5 O UNK 0 0.631 -1.743 -0.858 0.00 0.00 O+0 HETATM 6 C UNK 0 1.215 -0.549 -1.020 0.00 0.00 C+0 HETATM 7 O UNK 0 1.272 0.160 -2.090 0.00 0.00 O+0 HETATM 8 C UNK 0 1.910 0.121 0.115 0.00 0.00 C+0 HETATM 9 N UNK 0 3.358 -0.140 -0.054 0.00 0.00 N+0 HETATM 10 C UNK 0 4.106 -0.728 0.972 0.00 0.00 C+0 HETATM 11 O UNK 0 3.465 -1.025 2.061 0.00 0.00 O+0 HETATM 12 C UNK 0 5.501 -1.032 0.936 0.00 0.00 C+0 HETATM 13 C UNK 0 6.072 -1.621 2.060 0.00 0.00 C+0 HETATM 14 C UNK 0 7.400 -1.931 2.075 0.00 0.00 C+0 HETATM 15 C UNK 0 8.173 -1.656 0.969 0.00 0.00 C+0 HETATM 16 C UNK 0 7.629 -1.079 -0.143 0.00 0.00 C+0 HETATM 17 N UNK 0 8.440 -0.794 -1.297 0.00 0.00 N+0 HETATM 18 C UNK 0 6.273 -0.760 -0.165 0.00 0.00 C+0 HETATM 19 O UNK 0 5.788 -0.180 -1.314 0.00 0.00 O+0 HETATM 20 C UNK 0 1.655 1.615 0.058 0.00 0.00 C+0 HETATM 21 C UNK 0 2.898 2.352 -0.432 0.00 0.00 C+0 HETATM 22 O UNK 0 1.354 2.089 1.355 0.00 0.00 O+0 HETATM 23 C UNK 0 0.665 3.213 1.675 0.00 0.00 C+0 HETATM 24 O UNK 0 1.141 4.034 2.498 0.00 0.00 O+0 HETATM 25 C UNK 0 -0.651 3.498 1.071 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.660 5.018 0.830 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.943 5.467 0.213 0.00 0.00 C+0 HETATM 28 C UNK 0 0.481 5.411 -0.081 0.00 0.00 C+0 HETATM 29 O UNK 0 -1.723 3.220 1.905 0.00 0.00 O+0 HETATM 30 C UNK 0 -2.479 2.121 2.097 0.00 0.00 C+0 HETATM 31 O UNK 0 -2.442 1.520 3.214 0.00 0.00 O+0 HETATM 32 C UNK 0 -3.400 1.499 1.106 0.00 0.00 C+0 HETATM 33 C UNK 0 -4.809 1.423 1.720 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.612 2.418 -0.110 0.00 0.00 C+0 HETATM 35 C UNK 0 -2.913 0.196 0.570 0.00 0.00 C+0 HETATM 36 O UNK 0 -1.505 0.369 0.474 0.00 0.00 O+0 HETATM 37 C UNK 0 -3.115 -1.000 1.429 0.00 0.00 C+0 HETATM 38 C UNK 0 -4.454 -1.703 1.227 0.00 0.00 C+0 HETATM 39 C UNK 0 -4.643 -2.189 -0.168 0.00 0.00 C+0 HETATM 40 C UNK 0 -4.216 -3.450 -0.542 0.00 0.00 C+0 HETATM 41 C UNK 0 -4.371 -3.944 -1.805 0.00 0.00 C+0 HETATM 42 C UNK 0 -4.988 -3.117 -2.733 0.00 0.00 C+0 HETATM 43 C UNK 0 -5.428 -1.857 -2.409 0.00 0.00 C+0 HETATM 44 C UNK 0 -5.249 -1.407 -1.123 0.00 0.00 C+0 HETATM 45 O UNK 0 -2.156 -1.980 1.400 0.00 0.00 O+0 HETATM 46 C UNK 0 -0.924 -2.175 0.960 0.00 0.00 C+0 HETATM 47 O UNK 0 0.040 -2.315 1.744 0.00 0.00 O+0 HETATM 48 H UNK 0 0.730 -4.093 -2.560 0.00 0.00 H+0 HETATM 49 H UNK 0 -0.614 -2.950 -2.863 0.00 0.00 H+0 HETATM 50 H UNK 0 -0.917 -4.763 -2.773 0.00 0.00 H+0 HETATM 51 H UNK 0 -1.448 -4.224 -0.494 0.00 0.00 H+0 HETATM 52 H UNK 0 1.472 -3.664 -0.249 0.00 0.00 H+0 HETATM 53 H UNK 0 0.972 -5.308 -0.676 0.00 0.00 H+0 HETATM 54 H UNK 0 0.436 -4.518 0.910 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.477 -1.882 -1.098 0.00 0.00 H+0 HETATM 56 H UNK 0 1.642 -0.234 1.100 0.00 0.00 H+0 HETATM 57 H UNK 0 3.743 0.138 -0.953 0.00 0.00 H+0 HETATM 58 H UNK 0 5.447 -1.829 2.922 0.00 0.00 H+0 HETATM 59 H UNK 0 7.860 -2.394 2.953 0.00 0.00 H+0 HETATM 60 H UNK 0 9.232 -1.889 0.946 0.00 0.00 H+0 HETATM 61 H UNK 0 9.331 -0.279 -1.169 0.00 0.00 H+0 HETATM 62 H UNK 0 8.130 -1.101 -2.230 0.00 0.00 H+0 HETATM 63 H UNK 0 6.391 -0.000 -2.090 0.00 0.00 H+0 HETATM 64 H UNK 0 0.826 1.878 -0.606 0.00 0.00 H+0 HETATM 65 H UNK 0 3.092 2.019 -1.455 0.00 0.00 H+0 HETATM 66 H UNK 0 2.657 3.421 -0.437 0.00 0.00 H+0 HETATM 67 H UNK 0 3.734 2.144 0.267 0.00 0.00 H+0 HETATM 68 H UNK 0 -0.679 3.050 0.080 0.00 0.00 H+0 HETATM 69 H UNK 0 -0.519 5.574 1.774 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.191 4.910 -0.722 0.00 0.00 H+0 HETATM 71 H UNK 0 -1.864 6.547 -0.005 0.00 0.00 H+0 HETATM 72 H UNK 0 -2.770 5.353 0.950 0.00 0.00 H+0 HETATM 73 H UNK 0 0.544 4.788 -0.981 0.00 0.00 H+0 HETATM 74 H UNK 0 1.456 5.311 0.458 0.00 0.00 H+0 HETATM 75 H UNK 0 0.363 6.487 -0.296 0.00 0.00 H+0 HETATM 76 H UNK 0 -5.094 2.486 1.994 0.00 0.00 H+0 HETATM 77 H UNK 0 -5.556 1.119 0.992 0.00 0.00 H+0 HETATM 78 H UNK 0 -4.809 0.898 2.686 0.00 0.00 H+0 HETATM 79 H UNK 0 -4.488 1.939 -0.644 0.00 0.00 H+0 HETATM 80 H UNK 0 -3.969 3.406 0.189 0.00 0.00 H+0 HETATM 81 H UNK 0 -2.791 2.381 -0.819 0.00 0.00 H+0 HETATM 82 H UNK 0 -3.301 0.057 -0.447 0.00 0.00 H+0 HETATM 83 H UNK 0 -1.280 0.778 -0.401 0.00 0.00 H+0 HETATM 84 H UNK 0 -3.168 -0.661 2.517 0.00 0.00 H+0 HETATM 85 H UNK 0 -5.312 -1.172 1.617 0.00 0.00 H+0 HETATM 86 H UNK 0 -4.380 -2.637 1.863 0.00 0.00 H+0 HETATM 87 H UNK 0 -3.731 -4.081 0.223 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.021 -4.934 -2.045 0.00 0.00 H+0 HETATM 89 H UNK 0 -5.115 -3.502 -3.740 0.00 0.00 H+0 HETATM 90 H UNK 0 -5.918 -1.217 -3.163 0.00 0.00 H+0 HETATM 91 H UNK 0 -5.598 -0.405 -0.842 0.00 0.00 H+0 CONECT 1 2 48 49 50 CONECT 2 1 3 4 51 CONECT 3 2 52 53 54 CONECT 4 2 5 46 55 CONECT 5 4 6 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 20 56 CONECT 9 8 10 57 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 18 CONECT 13 12 14 58 CONECT 14 13 15 59 CONECT 15 14 16 60 CONECT 16 15 17 18 CONECT 17 16 61 62 CONECT 18 16 19 12 CONECT 19 18 63 CONECT 20 8 21 22 64 CONECT 21 20 65 66 67 CONECT 22 20 23 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 29 68 CONECT 26 25 27 28 69 CONECT 27 26 70 71 72 CONECT 28 26 73 74 75 CONECT 29 25 30 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 34 35 CONECT 33 32 76 77 78 CONECT 34 32 79 80 81 CONECT 35 32 36 37 82 CONECT 36 35 83 CONECT 37 35 38 45 84 CONECT 38 37 39 85 86 CONECT 39 38 40 44 CONECT 40 39 41 87 CONECT 41 40 42 88 CONECT 42 41 43 89 CONECT 43 42 44 90 CONECT 44 43 39 91 CONECT 45 37 46 CONECT 46 45 47 4 CONECT 47 46 CONECT 48 1 CONECT 49 1 CONECT 50 1 CONECT 51 2 CONECT 52 3 CONECT 53 3 CONECT 54 3 CONECT 55 4 CONECT 56 8 CONECT 57 9 CONECT 58 13 CONECT 59 14 CONECT 60 15 CONECT 61 17 CONECT 62 17 CONECT 63 19 CONECT 64 20 CONECT 65 21 CONECT 66 21 CONECT 67 21 CONECT 68 25 CONECT 69 26 CONECT 70 27 CONECT 71 27 CONECT 72 27 CONECT 73 28 CONECT 74 28 CONECT 75 28 CONECT 76 33 CONECT 77 33 CONECT 78 33 CONECT 79 34 CONECT 80 34 CONECT 81 34 CONECT 82 35 CONECT 83 36 CONECT 84 37 CONECT 85 38 CONECT 86 38 CONECT 87 40 CONECT 88 41 CONECT 89 42 CONECT 90 43 CONECT 91 44 MASTER 0 0 0 0 0 0 0 0 91 0 186 0 END