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 8.343 -0.975 -1.636 0.00 0.00 C+0 HETATM 2 C UNK 0 7.846 0.289 -2.230 0.00 0.00 C+0 HETATM 3 C UNK 0 8.036 1.544 -1.470 0.00 0.00 C+0 HETATM 4 C UNK 0 7.401 1.704 -0.155 0.00 0.00 C+0 HETATM 5 C UNK 0 7.777 0.754 0.937 0.00 0.00 C+0 HETATM 6 C UNK 0 7.063 1.075 2.204 0.00 0.00 C+0 HETATM 7 C UNK 0 6.250 0.242 2.806 0.00 0.00 C+0 HETATM 8 C UNK 0 5.909 -1.090 2.369 0.00 0.00 C+0 HETATM 9 C UNK 0 4.575 -1.478 1.999 0.00 0.00 C+0 HETATM 10 C UNK 0 3.468 -0.824 1.897 0.00 0.00 C+0 HETATM 11 C UNK 0 3.288 0.606 2.152 0.00 0.00 C+0 HETATM 12 C UNK 0 2.722 1.299 0.910 0.00 0.00 C+0 HETATM 13 C UNK 0 1.367 0.887 0.616 0.00 0.00 C+0 HETATM 14 C UNK 0 0.583 0.109 1.307 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.810 -0.238 0.872 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.965 -0.255 -0.615 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.892 -1.378 -0.891 0.00 0.00 C+0 HETATM 18 C UNK 0 -3.219 -0.974 -1.506 0.00 0.00 C+0 HETATM 19 O UNK 0 -3.911 -2.205 -1.680 0.00 0.00 O+0 HETATM 20 C UNK 0 -2.929 -0.456 -2.895 0.00 0.00 C+0 HETATM 21 C UNK 0 -4.172 -0.030 -3.587 0.00 0.00 C+0 HETATM 22 O UNK 0 -5.256 -0.147 -2.962 0.00 0.00 O+0 HETATM 23 O UNK 0 -4.177 0.476 -4.860 0.00 0.00 O+0 HETATM 24 C UNK 0 -4.013 -0.060 -0.680 0.00 0.00 C+0 HETATM 25 O UNK 0 -3.589 1.092 -0.429 0.00 0.00 O+0 HETATM 26 O UNK 0 -5.222 -0.429 -0.167 0.00 0.00 O+0 HETATM 27 C UNK 0 -6.056 0.416 0.651 0.00 0.00 C+0 HETATM 28 C UNK 0 -6.192 -0.091 1.992 0.00 0.00 C+0 HETATM 29 O UNK 0 -5.700 -1.241 2.260 0.00 0.00 O+0 HETATM 30 O UNK 0 -6.811 0.555 3.045 0.00 0.00 O+0 HETATM 31 C UNK 0 -7.258 0.794 -0.128 0.00 0.00 C+0 HETATM 32 C UNK 0 -8.124 -0.293 -0.643 0.00 0.00 C+0 HETATM 33 C UNK 0 -8.758 -1.208 0.260 0.00 0.00 C+0 HETATM 34 O UNK 0 -8.685 -1.169 1.491 0.00 0.00 O+0 HETATM 35 O UNK 0 -9.533 -2.242 -0.289 0.00 0.00 O+0 HETATM 36 C UNK 0 -8.073 1.867 0.532 0.00 0.00 C+0 HETATM 37 O UNK 0 -8.221 3.017 -0.010 0.00 0.00 O+0 HETATM 38 O UNK 0 -8.715 1.717 1.741 0.00 0.00 O+0 HETATM 39 C UNK 0 -2.069 -2.076 0.389 0.00 0.00 C+0 HETATM 40 O UNK 0 -2.904 -3.000 0.650 0.00 0.00 O+0 HETATM 41 O UNK 0 -1.167 -1.564 1.295 0.00 0.00 O+0 HETATM 42 H UNK 0 7.532 -1.632 -1.204 0.00 0.00 H+0 HETATM 43 H UNK 0 8.694 -1.617 -2.518 0.00 0.00 H+0 HETATM 44 H UNK 0 9.240 -0.904 -1.010 0.00 0.00 H+0 HETATM 45 H UNK 0 8.372 0.439 -3.226 0.00 0.00 H+0 HETATM 46 H UNK 0 6.780 0.120 -2.533 0.00 0.00 H+0 HETATM 47 H UNK 0 9.140 1.798 -1.370 0.00 0.00 H+0 HETATM 48 H UNK 0 7.649 2.377 -2.147 0.00 0.00 H+0 HETATM 49 H UNK 0 6.278 1.777 -0.258 0.00 0.00 H+0 HETATM 50 H UNK 0 7.673 2.736 0.235 0.00 0.00 H+0 HETATM 51 H UNK 0 8.871 0.999 1.185 0.00 0.00 H+0 HETATM 52 H UNK 0 7.761 -0.302 0.679 0.00 0.00 H+0 HETATM 53 H UNK 0 7.215 2.068 2.678 0.00 0.00 H+0 HETATM 54 H UNK 0 5.812 0.593 3.787 0.00 0.00 H+0 HETATM 55 H UNK 0 6.588 -1.464 1.527 0.00 0.00 H+0 HETATM 56 H UNK 0 6.293 -1.779 3.231 0.00 0.00 H+0 HETATM 57 H UNK 0 4.479 -2.586 1.746 0.00 0.00 H+0 HETATM 58 H UNK 0 2.574 -1.401 1.564 0.00 0.00 H+0 HETATM 59 H UNK 0 2.447 0.692 2.914 0.00 0.00 H+0 HETATM 60 H UNK 0 4.160 1.161 2.480 0.00 0.00 H+0 HETATM 61 H UNK 0 2.815 2.397 1.138 0.00 0.00 H+0 HETATM 62 H UNK 0 3.431 1.109 0.065 0.00 0.00 H+0 HETATM 63 H UNK 0 0.932 1.285 -0.324 0.00 0.00 H+0 HETATM 64 H UNK 0 0.878 -0.295 2.252 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.570 0.436 1.309 0.00 0.00 H+0 HETATM 66 H UNK 0 -1.410 0.690 -1.025 0.00 0.00 H+0 HETATM 67 H UNK 0 0.048 -0.397 -1.069 0.00 0.00 H+0 HETATM 68 H UNK 0 -1.470 -2.134 -1.601 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.250 -2.775 -2.179 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.243 0.428 -2.863 0.00 0.00 H+0 HETATM 71 H UNK 0 -2.421 -1.210 -3.505 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.378 0.612 -5.438 0.00 0.00 H+0 HETATM 73 H UNK 0 -5.427 1.376 0.709 0.00 0.00 H+0 HETATM 74 H UNK 0 -7.318 0.055 3.779 0.00 0.00 H+0 HETATM 75 H UNK 0 -6.864 1.314 -1.071 0.00 0.00 H+0 HETATM 76 H UNK 0 -7.580 -0.825 -1.495 0.00 0.00 H+0 HETATM 77 H UNK 0 -8.959 0.230 -1.222 0.00 0.00 H+0 HETATM 78 H UNK 0 -10.254 -2.028 -0.966 0.00 0.00 H+0 HETATM 79 H UNK 0 -9.721 1.636 1.800 0.00 0.00 H+0 CONECT 1 2 42 43 44 CONECT 2 1 3 45 46 CONECT 3 2 4 47 48 CONECT 4 3 5 49 50 CONECT 5 4 6 51 52 CONECT 6 5 7 53 CONECT 7 6 8 54 CONECT 8 7 9 55 56 CONECT 9 8 10 57 CONECT 10 9 11 58 CONECT 11 10 12 59 60 CONECT 12 11 13 61 62 CONECT 13 12 14 63 CONECT 14 13 15 64 CONECT 15 14 16 41 65 CONECT 16 15 17 66 67 CONECT 17 16 18 39 68 CONECT 18 17 19 20 24 CONECT 19 18 69 CONECT 20 18 21 70 71 CONECT 21 20 22 23 CONECT 22 21 CONECT 23 21 72 CONECT 24 18 25 26 CONECT 25 24 CONECT 26 24 27 CONECT 27 26 28 31 73 CONECT 28 27 29 30 CONECT 29 28 CONECT 30 28 74 CONECT 31 27 32 36 75 CONECT 32 31 33 76 77 CONECT 33 32 34 35 CONECT 34 33 CONECT 35 33 78 CONECT 36 31 37 38 CONECT 37 36 CONECT 38 36 79 CONECT 39 17 40 41 CONECT 40 39 CONECT 41 39 15 CONECT 42 1 CONECT 43 1 CONECT 44 1 CONECT 45 2 CONECT 46 2 CONECT 47 3 CONECT 48 3 CONECT 49 4 CONECT 50 4 CONECT 51 5 CONECT 52 5 CONECT 53 6 CONECT 54 7 CONECT 55 8 CONECT 56 8 CONECT 57 9 CONECT 58 10 CONECT 59 11 CONECT 60 11 CONECT 61 12 CONECT 62 12 CONECT 63 13 CONECT 64 14 CONECT 65 15 CONECT 66 16 CONECT 67 16 CONECT 68 17 CONECT 69 19 CONECT 70 20 CONECT 71 20 CONECT 72 23 CONECT 73 27 CONECT 74 30 CONECT 75 31 CONECT 76 32 CONECT 77 32 CONECT 78 35 CONECT 79 38 MASTER 0 0 0 0 0 0 0 0 79 0 158 0 END