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 -4.246 -4.956 -0.148 0.00 0.00 C+0 HETATM 2 C UNK 0 -4.516 -3.577 -0.699 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.567 -2.626 0.451 0.00 0.00 C+0 HETATM 4 O UNK 0 -4.397 -3.030 1.635 0.00 0.00 O+0 HETATM 5 O UNK 0 -4.800 -1.278 0.270 0.00 0.00 O+0 HETATM 6 C UNK 0 -4.860 -0.319 1.316 0.00 0.00 C+0 HETATM 7 C UNK 0 -6.285 0.215 1.278 0.00 0.00 C+0 HETATM 8 C UNK 0 -6.549 1.074 0.091 0.00 0.00 C+0 HETATM 9 C UNK 0 -7.771 1.915 0.351 0.00 0.00 C+0 HETATM 10 C UNK 0 -8.193 2.674 -0.911 0.00 0.00 C+0 HETATM 11 C UNK 0 -7.558 2.957 1.418 0.00 0.00 C+0 HETATM 12 O UNK 0 -8.872 1.119 0.704 0.00 0.00 O+0 HETATM 13 O UNK 0 -5.504 1.909 -0.249 0.00 0.00 O+0 HETATM 14 C UNK 0 -4.324 1.162 -0.490 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.326 1.995 -1.202 0.00 0.00 C+0 HETATM 16 C UNK 0 -1.976 1.350 -1.242 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.462 0.865 0.055 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.929 2.062 0.820 0.00 0.00 C+0 HETATM 19 C UNK 0 -2.527 0.133 0.857 0.00 0.00 C+0 HETATM 20 C UNK 0 -2.034 -0.295 2.207 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.657 -0.854 2.247 0.00 0.00 C+0 HETATM 22 C UNK 0 0.260 -0.218 1.288 0.00 0.00 C+0 HETATM 23 C UNK 0 1.531 -0.957 0.977 0.00 0.00 C+0 HETATM 24 C UNK 0 1.921 -0.297 -0.325 0.00 0.00 C+0 HETATM 25 C UNK 0 0.758 0.179 -0.934 0.00 0.00 C+0 HETATM 26 N UNK 0 1.067 0.763 -2.095 0.00 0.00 N+0 HETATM 27 C UNK 0 2.384 0.694 -2.279 0.00 0.00 C+0 HETATM 28 C UNK 0 3.202 1.124 -3.285 0.00 0.00 C+0 HETATM 29 C UNK 0 4.574 0.930 -3.264 0.00 0.00 C+0 HETATM 30 C UNK 0 5.128 0.277 -2.182 0.00 0.00 C+0 HETATM 31 C UNK 0 4.293 -0.170 -1.139 0.00 0.00 C+0 HETATM 32 C UNK 0 2.938 0.040 -1.194 0.00 0.00 C+0 HETATM 33 C UNK 0 4.888 -0.883 0.023 0.00 0.00 C+0 HETATM 34 C UNK 0 6.257 -0.293 0.200 0.00 0.00 C+0 HETATM 35 C UNK 0 7.064 -0.787 -1.020 0.00 0.00 C+0 HETATM 36 C UNK 0 6.580 0.043 -2.118 0.00 0.00 C+0 HETATM 37 O UNK 0 7.285 0.572 -3.006 0.00 0.00 O+0 HETATM 38 C UNK 0 8.440 -0.467 -0.502 0.00 0.00 C+0 HETATM 39 C UNK 0 9.512 -1.321 -1.147 0.00 0.00 C+0 HETATM 40 C UNK 0 8.735 0.983 -0.820 0.00 0.00 C+0 HETATM 41 O UNK 0 8.438 -0.726 0.851 0.00 0.00 O+0 HETATM 42 C UNK 0 7.094 -0.780 1.289 0.00 0.00 C+0 HETATM 43 C UNK 0 7.019 0.213 2.456 0.00 0.00 C+0 HETATM 44 C UNK 0 6.845 -2.167 1.771 0.00 0.00 C+0 HETATM 45 C UNK 0 -0.367 -0.155 -0.077 0.00 0.00 C+0 HETATM 46 C UNK 0 -0.868 -1.513 -0.487 0.00 0.00 C+0 HETATM 47 C UNK 0 -3.848 0.771 0.920 0.00 0.00 C+0 HETATM 48 C UNK 0 -4.024 1.950 1.778 0.00 0.00 C+0 HETATM 49 H UNK 0 -4.689 -5.762 -0.795 0.00 0.00 H+0 HETATM 50 H UNK 0 -4.724 -5.073 0.857 0.00 0.00 H+0 HETATM 51 H UNK 0 -3.151 -5.122 0.014 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.672 -3.306 -1.395 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.432 -3.571 -1.296 0.00 0.00 H+0 HETATM 54 H UNK 0 -4.689 -0.723 2.311 0.00 0.00 H+0 HETATM 55 H UNK 0 -6.613 0.630 2.251 0.00 0.00 H+0 HETATM 56 H UNK 0 -6.928 -0.708 1.148 0.00 0.00 H+0 HETATM 57 H UNK 0 -6.774 0.464 -0.818 0.00 0.00 H+0 HETATM 58 H UNK 0 -8.369 2.004 -1.759 0.00 0.00 H+0 HETATM 59 H UNK 0 -9.161 3.163 -0.651 0.00 0.00 H+0 HETATM 60 H UNK 0 -7.485 3.494 -1.121 0.00 0.00 H+0 HETATM 61 H UNK 0 -7.683 2.506 2.421 0.00 0.00 H+0 HETATM 62 H UNK 0 -6.549 3.410 1.270 0.00 0.00 H+0 HETATM 63 H UNK 0 -8.277 3.794 1.309 0.00 0.00 H+0 HETATM 64 H UNK 0 -8.748 0.195 0.356 0.00 0.00 H+0 HETATM 65 H UNK 0 -4.622 0.292 -1.080 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.293 3.053 -0.863 0.00 0.00 H+0 HETATM 67 H UNK 0 -3.675 2.063 -2.274 0.00 0.00 H+0 HETATM 68 H UNK 0 -1.955 0.625 -2.060 0.00 0.00 H+0 HETATM 69 H UNK 0 -1.265 2.192 -1.558 0.00 0.00 H+0 HETATM 70 H UNK 0 -1.013 1.987 1.901 0.00 0.00 H+0 HETATM 71 H UNK 0 0.087 2.272 0.432 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.513 2.993 0.543 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.697 -0.820 0.277 0.00 0.00 H+0 HETATM 74 H UNK 0 -2.716 -1.092 2.569 0.00 0.00 H+0 HETATM 75 H UNK 0 -2.136 0.529 2.971 0.00 0.00 H+0 HETATM 76 H UNK 0 -0.645 -1.984 2.241 0.00 0.00 H+0 HETATM 77 H UNK 0 -0.247 -0.633 3.282 0.00 0.00 H+0 HETATM 78 H UNK 0 0.564 0.763 1.686 0.00 0.00 H+0 HETATM 79 H UNK 0 2.245 -0.740 1.769 0.00 0.00 H+0 HETATM 80 H UNK 0 1.382 -2.029 0.775 0.00 0.00 H+0 HETATM 81 H UNK 0 0.381 1.212 -2.792 0.00 0.00 H+0 HETATM 82 H UNK 0 2.821 1.646 -4.164 0.00 0.00 H+0 HETATM 83 H UNK 0 5.228 1.267 -4.055 0.00 0.00 H+0 HETATM 84 H UNK 0 4.968 -1.959 -0.324 0.00 0.00 H+0 HETATM 85 H UNK 0 4.308 -0.878 0.930 0.00 0.00 H+0 HETATM 86 H UNK 0 6.176 0.803 0.177 0.00 0.00 H+0 HETATM 87 H UNK 0 6.893 -1.874 -1.160 0.00 0.00 H+0 HETATM 88 H UNK 0 9.068 -1.890 -1.972 0.00 0.00 H+0 HETATM 89 H UNK 0 10.357 -0.677 -1.507 0.00 0.00 H+0 HETATM 90 H UNK 0 9.972 -2.025 -0.425 0.00 0.00 H+0 HETATM 91 H UNK 0 9.268 1.086 -1.772 0.00 0.00 H+0 HETATM 92 H UNK 0 9.299 1.499 -0.040 0.00 0.00 H+0 HETATM 93 H UNK 0 7.763 1.538 -0.928 0.00 0.00 H+0 HETATM 94 H UNK 0 6.186 -0.009 3.130 0.00 0.00 H+0 HETATM 95 H UNK 0 6.857 1.258 2.066 0.00 0.00 H+0 HETATM 96 H UNK 0 7.955 0.248 3.028 0.00 0.00 H+0 HETATM 97 H UNK 0 6.028 -2.697 1.283 0.00 0.00 H+0 HETATM 98 H UNK 0 7.754 -2.829 1.685 0.00 0.00 H+0 HETATM 99 H UNK 0 6.632 -2.151 2.879 0.00 0.00 H+0 HETATM 100 H UNK 0 -1.592 -1.448 -1.303 0.00 0.00 H+0 HETATM 101 H UNK 0 -1.212 -2.164 0.309 0.00 0.00 H+0 HETATM 102 H UNK 0 0.017 -2.055 -0.940 0.00 0.00 H+0 HETATM 103 H UNK 0 -5.016 1.877 2.299 0.00 0.00 H+0 HETATM 104 H UNK 0 -3.302 2.141 2.565 0.00 0.00 H+0 HETATM 105 H UNK 0 -4.116 2.918 1.198 0.00 0.00 H+0 CONECT 1 2 49 50 51 CONECT 2 1 3 52 53 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 CONECT 6 5 7 47 54 CONECT 7 6 8 55 56 CONECT 8 7 9 13 57 CONECT 9 8 10 11 12 CONECT 10 9 58 59 60 CONECT 11 9 61 62 63 CONECT 12 9 64 CONECT 13 8 14 CONECT 14 13 15 47 65 CONECT 15 14 16 66 67 CONECT 16 15 17 68 69 CONECT 17 16 18 19 45 CONECT 18 17 70 71 72 CONECT 19 17 20 47 73 CONECT 20 19 21 74 75 CONECT 21 20 22 76 77 CONECT 22 21 23 45 78 CONECT 23 22 24 79 80 CONECT 24 23 25 32 CONECT 25 24 26 45 CONECT 26 25 27 81 CONECT 27 26 28 32 CONECT 28 27 29 82 CONECT 29 28 30 83 CONECT 30 29 31 36 CONECT 31 30 32 33 CONECT 32 31 24 27 CONECT 33 31 34 84 85 CONECT 34 33 35 42 86 CONECT 35 34 36 38 87 CONECT 36 35 37 30 CONECT 37 36 CONECT 38 35 39 40 41 CONECT 39 38 88 89 90 CONECT 40 38 91 92 93 CONECT 41 38 42 CONECT 42 41 43 44 34 CONECT 43 42 94 95 96 CONECT 44 42 97 98 99 CONECT 45 25 46 17 22 CONECT 46 45 100 101 102 CONECT 47 19 48 6 14 CONECT 48 47 103 104 105 CONECT 49 1 CONECT 50 1 CONECT 51 1 CONECT 52 2 CONECT 53 2 CONECT 54 6 CONECT 55 7 CONECT 56 7 CONECT 57 8 CONECT 58 10 CONECT 59 10 CONECT 60 10 CONECT 61 11 CONECT 62 11 CONECT 63 11 CONECT 64 12 CONECT 65 14 CONECT 66 15 CONECT 67 15 CONECT 68 16 CONECT 69 16 CONECT 70 18 CONECT 71 18 CONECT 72 18 CONECT 73 19 CONECT 74 20 CONECT 75 20 CONECT 76 21 CONECT 77 21 CONECT 78 22 CONECT 79 23 CONECT 80 23 CONECT 81 26 CONECT 82 28 CONECT 83 29 CONECT 84 33 CONECT 85 33 CONECT 86 34 CONECT 87 35 CONECT 88 39 CONECT 89 39 CONECT 90 39 CONECT 91 40 CONECT 92 40 CONECT 93 40 CONECT 94 43 CONECT 95 43 CONECT 96 43 CONECT 97 44 CONECT 98 44 CONECT 99 44 CONECT 100 46 CONECT 101 46 CONECT 102 46 CONECT 103 48 CONECT 104 48 CONECT 105 48 MASTER 0 0 0 0 0 0 0 0 105 0 224 0 END