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 -8.489 4.527 -0.027 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.599 3.331 -0.039 0.00 0.00 C+0 HETATM 3 C UNK 0 -7.411 2.640 -1.144 0.00 0.00 C+0 HETATM 4 C UNK 0 -8.146 3.144 -2.361 0.00 0.00 C+0 HETATM 5 C UNK 0 -6.570 1.476 -1.267 0.00 0.00 C+0 HETATM 6 O UNK 0 -6.475 0.891 -2.364 0.00 0.00 O+0 HETATM 7 N UNK 0 -5.829 0.949 -0.179 0.00 0.00 N+0 HETATM 8 C UNK 0 -4.990 -0.220 -0.240 0.00 0.00 C+0 HETATM 9 C UNK 0 -5.366 -1.182 0.853 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.559 0.214 -0.170 0.00 0.00 C+0 HETATM 11 O UNK 0 -3.180 1.394 -0.167 0.00 0.00 O+0 HETATM 12 O UNK 0 -2.631 -0.805 -0.102 0.00 0.00 O+0 HETATM 13 C UNK 0 -1.215 -0.576 -0.038 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.715 -0.976 1.345 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.811 0.180 2.289 0.00 0.00 C+0 HETATM 16 C UNK 0 0.145 0.505 3.143 0.00 0.00 C+0 HETATM 17 C UNK 0 1.515 0.007 2.983 0.00 0.00 C+0 HETATM 18 C UNK 0 2.137 0.023 1.820 0.00 0.00 C+0 HETATM 19 C UNK 0 2.167 1.171 0.938 0.00 0.00 C+0 HETATM 20 C UNK 0 2.606 2.354 1.315 0.00 0.00 C+0 HETATM 21 C UNK 0 3.947 2.480 2.021 0.00 0.00 C+0 HETATM 22 O UNK 0 3.846 3.581 2.845 0.00 0.00 O+0 HETATM 23 C UNK 0 3.965 3.339 4.188 0.00 0.00 C+0 HETATM 24 C UNK 0 4.995 2.753 0.983 0.00 0.00 C+0 HETATM 25 C UNK 0 6.202 1.895 1.125 0.00 0.00 C+0 HETATM 26 O UNK 0 6.887 2.055 2.176 0.00 0.00 O+0 HETATM 27 N UNK 0 6.633 0.922 0.177 0.00 0.00 N+0 HETATM 28 C UNK 0 5.955 -0.246 -0.350 0.00 0.00 C+0 HETATM 29 C UNK 0 6.008 -0.119 -1.769 0.00 0.00 C+0 HETATM 30 C UNK 0 5.426 -0.997 -2.631 0.00 0.00 C+0 HETATM 31 O UNK 0 5.495 -0.845 -4.012 0.00 0.00 O+0 HETATM 32 C UNK 0 4.774 -2.031 -2.040 0.00 0.00 C+0 HETATM 33 C UNK 0 4.691 -2.212 -0.634 0.00 0.00 C+0 HETATM 34 C UNK 0 5.292 -1.310 0.245 0.00 0.00 C+0 HETATM 35 O UNK 0 5.198 -1.533 1.646 0.00 0.00 O+0 HETATM 36 C UNK 0 3.834 -3.430 -0.409 0.00 0.00 C+0 HETATM 37 C UNK 0 2.358 -3.012 -0.535 0.00 0.00 C+0 HETATM 38 C UNK 0 1.668 -3.638 -1.671 0.00 0.00 C+0 HETATM 39 C UNK 0 0.364 -3.478 -1.897 0.00 0.00 C+0 HETATM 40 C UNK 0 -0.180 -4.016 -3.187 0.00 0.00 C+0 HETATM 41 C UNK 0 -0.461 -2.803 -0.897 0.00 0.00 C+0 HETATM 42 O UNK 0 -1.769 -3.333 -1.015 0.00 0.00 O+0 HETATM 43 C UNK 0 -0.585 -1.330 -1.156 0.00 0.00 C+0 HETATM 44 C UNK 0 -1.523 -1.174 -2.367 0.00 0.00 C+0 HETATM 45 H UNK 0 -8.002 5.411 -0.453 0.00 0.00 H+0 HETATM 46 H UNK 0 -8.808 4.706 1.024 0.00 0.00 H+0 HETATM 47 H UNK 0 -9.391 4.312 -0.667 0.00 0.00 H+0 HETATM 48 H UNK 0 -7.106 3.026 0.858 0.00 0.00 H+0 HETATM 49 H UNK 0 -9.142 2.688 -2.453 0.00 0.00 H+0 HETATM 50 H UNK 0 -7.543 2.913 -3.281 0.00 0.00 H+0 HETATM 51 H UNK 0 -8.194 4.256 -2.313 0.00 0.00 H+0 HETATM 52 H UNK 0 -5.890 1.445 0.740 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.167 -0.702 -1.234 0.00 0.00 H+0 HETATM 54 H UNK 0 -4.683 -1.138 1.716 0.00 0.00 H+0 HETATM 55 H UNK 0 -6.430 -1.006 1.187 0.00 0.00 H+0 HETATM 56 H UNK 0 -5.304 -2.243 0.485 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.993 0.507 -0.142 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.435 -1.760 1.716 0.00 0.00 H+0 HETATM 59 H UNK 0 0.270 -1.417 1.355 0.00 0.00 H+0 HETATM 60 H UNK 0 -1.728 0.768 2.247 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.088 1.151 3.987 0.00 0.00 H+0 HETATM 62 H UNK 0 2.053 -0.391 3.841 0.00 0.00 H+0 HETATM 63 H UNK 0 2.635 -0.926 1.534 0.00 0.00 H+0 HETATM 64 H UNK 0 1.821 1.059 -0.112 0.00 0.00 H+0 HETATM 65 H UNK 0 2.002 3.219 1.103 0.00 0.00 H+0 HETATM 66 H UNK 0 4.123 1.602 2.650 0.00 0.00 H+0 HETATM 67 H UNK 0 3.859 4.343 4.695 0.00 0.00 H+0 HETATM 68 H UNK 0 4.998 3.003 4.401 0.00 0.00 H+0 HETATM 69 H UNK 0 3.196 2.628 4.559 0.00 0.00 H+0 HETATM 70 H UNK 0 5.276 3.845 1.018 0.00 0.00 H+0 HETATM 71 H UNK 0 4.518 2.639 -0.015 0.00 0.00 H+0 HETATM 72 H UNK 0 7.632 1.113 -0.220 0.00 0.00 H+0 HETATM 73 H UNK 0 6.559 0.712 -2.260 0.00 0.00 H+0 HETATM 74 H UNK 0 6.303 -1.306 -4.459 0.00 0.00 H+0 HETATM 75 H UNK 0 4.278 -2.764 -2.715 0.00 0.00 H+0 HETATM 76 H UNK 0 5.385 -1.295 2.477 0.00 0.00 H+0 HETATM 77 H UNK 0 4.049 -4.198 -1.242 0.00 0.00 H+0 HETATM 78 H UNK 0 3.911 -4.066 0.441 0.00 0.00 H+0 HETATM 79 H UNK 0 2.291 -1.898 -0.562 0.00 0.00 H+0 HETATM 80 H UNK 0 1.849 -3.320 0.395 0.00 0.00 H+0 HETATM 81 H UNK 0 2.236 -4.252 -2.356 0.00 0.00 H+0 HETATM 82 H UNK 0 0.299 -3.408 -3.999 0.00 0.00 H+0 HETATM 83 H UNK 0 0.057 -5.098 -3.324 0.00 0.00 H+0 HETATM 84 H UNK 0 -1.274 -3.850 -3.249 0.00 0.00 H+0 HETATM 85 H UNK 0 -0.143 -3.038 0.137 0.00 0.00 H+0 HETATM 86 H UNK 0 -2.109 -3.681 -0.152 0.00 0.00 H+0 HETATM 87 H UNK 0 0.383 -0.869 -1.518 0.00 0.00 H+0 HETATM 88 H UNK 0 -0.963 -1.474 -3.256 0.00 0.00 H+0 HETATM 89 H UNK 0 -2.447 -1.741 -2.189 0.00 0.00 H+0 HETATM 90 H UNK 0 -1.744 -0.071 -2.460 0.00 0.00 H+0 CONECT 1 2 45 46 47 CONECT 2 1 3 48 CONECT 3 2 4 5 CONECT 4 3 49 50 51 CONECT 5 3 6 7 CONECT 6 5 CONECT 7 5 8 52 CONECT 8 7 9 10 53 CONECT 9 8 54 55 56 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 13 CONECT 13 12 14 43 57 CONECT 14 13 15 58 59 CONECT 15 14 16 60 CONECT 16 15 17 61 CONECT 17 16 18 62 CONECT 18 17 19 63 CONECT 19 18 20 64 CONECT 20 19 21 65 CONECT 21 20 22 24 66 CONECT 22 21 23 CONECT 23 22 67 68 69 CONECT 24 21 25 70 71 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 72 CONECT 28 27 29 34 CONECT 29 28 30 73 CONECT 30 29 31 32 CONECT 31 30 74 CONECT 32 30 33 75 CONECT 33 32 34 36 CONECT 34 33 35 28 CONECT 35 34 76 CONECT 36 33 37 77 78 CONECT 37 36 38 79 80 CONECT 38 37 39 81 CONECT 39 38 40 41 CONECT 40 39 82 83 84 CONECT 41 39 42 43 85 CONECT 42 41 86 CONECT 43 41 44 13 87 CONECT 44 43 88 89 90 CONECT 45 1 CONECT 46 1 CONECT 47 1 CONECT 48 2 CONECT 49 4 CONECT 50 4 CONECT 51 4 CONECT 52 7 CONECT 53 8 CONECT 54 9 CONECT 55 9 CONECT 56 9 CONECT 57 13 CONECT 58 14 CONECT 59 14 CONECT 60 15 CONECT 61 16 CONECT 62 17 CONECT 63 18 CONECT 64 19 CONECT 65 20 CONECT 66 21 CONECT 67 23 CONECT 68 23 CONECT 69 23 CONECT 70 24 CONECT 71 24 CONECT 72 27 CONECT 73 29 CONECT 74 31 CONECT 75 32 CONECT 76 35 CONECT 77 36 CONECT 78 36 CONECT 79 37 CONECT 80 37 CONECT 81 38 CONECT 82 40 CONECT 83 40 CONECT 84 40 CONECT 85 41 CONECT 86 42 CONECT 87 43 CONECT 88 44 CONECT 89 44 CONECT 90 44 MASTER 0 0 0 0 0 0 0 0 90 0 182 0 END