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 3.532 5.956 3.606 0.00 0.00 C+0 HETATM 2 C UNK 0 3.759 5.074 2.640 0.00 0.00 C+0 HETATM 3 O UNK 0 4.541 5.396 1.565 0.00 0.00 O+0 HETATM 4 C UNK 0 4.785 4.476 0.545 0.00 0.00 C+0 HETATM 5 C UNK 0 5.577 4.860 -0.503 0.00 0.00 C+0 HETATM 6 C UNK 0 5.837 3.973 -1.525 0.00 0.00 C+0 HETATM 7 O UNK 0 6.640 4.319 -2.616 0.00 0.00 O+0 HETATM 8 C UNK 0 7.202 5.600 -2.685 0.00 0.00 C+0 HETATM 9 C UNK 0 5.286 2.730 -1.453 0.00 0.00 C+0 HETATM 10 C UNK 0 4.467 2.275 -0.409 0.00 0.00 C+0 HETATM 11 C UNK 0 3.940 0.928 -0.464 0.00 0.00 C+0 HETATM 12 O UNK 0 4.288 0.227 -1.493 0.00 0.00 O+0 HETATM 13 O UNK 0 3.127 0.273 0.403 0.00 0.00 O+0 HETATM 14 C UNK 0 2.638 -1.012 0.334 0.00 0.00 C+0 HETATM 15 C UNK 0 3.417 -2.002 1.229 0.00 0.00 C+0 HETATM 16 O UNK 0 2.786 -3.210 1.195 0.00 0.00 O+0 HETATM 17 C UNK 0 2.834 -4.409 0.638 0.00 0.00 C+0 HETATM 18 O UNK 0 2.538 -4.769 -0.560 0.00 0.00 O+0 HETATM 19 C UNK 0 3.290 -5.598 1.451 0.00 0.00 C+0 HETATM 20 C UNK 0 2.155 -6.419 1.985 0.00 0.00 C+0 HETATM 21 N UNK 0 2.305 -7.745 1.364 0.00 0.00 N+0 HETATM 22 C UNK 0 0.812 -5.775 1.861 0.00 0.00 C+0 HETATM 23 C UNK 0 0.049 -5.902 0.738 0.00 0.00 C+0 HETATM 24 C UNK 0 -1.194 -5.193 0.677 0.00 0.00 C+0 HETATM 25 O UNK 0 -1.808 -5.517 -0.585 0.00 0.00 O+0 HETATM 26 C UNK 0 -1.666 -4.387 1.672 0.00 0.00 C+0 HETATM 27 C UNK 0 -0.920 -4.267 2.792 0.00 0.00 C+0 HETATM 28 Cl UNK 0 -1.301 -3.455 4.379 0.00 0.00 Cl+0 HETATM 29 C UNK 0 0.328 -4.974 2.862 0.00 0.00 C+0 HETATM 30 O UNK 0 -2.902 -3.658 1.560 0.00 0.00 O+0 HETATM 31 C UNK 0 -2.948 -2.443 0.730 0.00 0.00 C+0 HETATM 32 C UNK 0 -1.549 -2.164 0.291 0.00 0.00 C+0 HETATM 33 C UNK 0 -0.713 -2.551 -0.627 0.00 0.00 C+0 HETATM 34 C UNK 0 0.661 -2.147 -0.649 0.00 0.00 C+0 HETATM 35 C UNK 0 1.159 -1.308 0.332 0.00 0.00 C+0 HETATM 36 C UNK 0 0.307 -0.873 1.310 0.00 0.00 C+0 HETATM 37 Cl UNK 0 0.489 0.210 2.768 0.00 0.00 Cl+0 HETATM 38 C UNK 0 -1.041 -1.305 1.281 0.00 0.00 C+0 HETATM 39 C UNK 0 -2.124 -0.969 2.202 0.00 0.00 C+0 HETATM 40 C UNK 0 -2.583 -0.556 3.351 0.00 0.00 C+0 HETATM 41 C UNK 0 -4.033 -0.539 3.407 0.00 0.00 C+0 HETATM 42 C UNK 0 -4.444 -0.949 2.214 0.00 0.00 C+0 HETATM 43 C UNK 0 -3.356 -1.216 1.348 0.00 0.00 C+0 HETATM 44 O UNK 0 -3.307 -0.090 0.497 0.00 0.00 O+0 HETATM 45 C UNK 0 -4.010 -0.109 -0.651 0.00 0.00 C+0 HETATM 46 O UNK 0 -3.163 0.090 -1.700 0.00 0.00 O+0 HETATM 47 C UNK 0 -2.818 1.389 -1.995 0.00 0.00 C+0 HETATM 48 C UNK 0 -2.128 1.358 -3.340 0.00 0.00 C+0 HETATM 49 C UNK 0 -1.834 1.872 -0.964 0.00 0.00 C+0 HETATM 50 C UNK 0 -4.027 2.293 -2.143 0.00 0.00 C+0 HETATM 51 N UNK 0 -4.023 3.173 -3.232 0.00 0.00 N+0 HETATM 52 C UNK 0 -3.026 4.185 -3.281 0.00 0.00 C+0 HETATM 53 C UNK 0 -5.220 3.422 -3.941 0.00 0.00 C+0 HETATM 54 C UNK 0 -5.304 1.495 -1.930 0.00 0.00 C+0 HETATM 55 O UNK 0 -5.392 0.400 -2.759 0.00 0.00 O+0 HETATM 56 C UNK 0 -5.113 0.930 -0.511 0.00 0.00 C+0 HETATM 57 O UNK 0 -6.329 0.356 -0.180 0.00 0.00 O+0 HETATM 58 C UNK 0 4.234 3.187 0.585 0.00 0.00 C+0 HETATM 59 N UNK 0 3.425 2.834 1.684 0.00 0.00 N+0 HETATM 60 C UNK 0 3.166 3.756 2.730 0.00 0.00 C+0 HETATM 61 O UNK 0 2.453 3.467 3.709 0.00 0.00 O+0 HETATM 62 H UNK 0 2.920 5.719 4.456 0.00 0.00 H+0 HETATM 63 H UNK 0 3.980 6.954 3.533 0.00 0.00 H+0 HETATM 64 H UNK 0 6.016 5.843 -0.570 0.00 0.00 H+0 HETATM 65 H UNK 0 7.918 5.679 -3.549 0.00 0.00 H+0 HETATM 66 H UNK 0 7.695 5.813 -1.728 0.00 0.00 H+0 HETATM 67 H UNK 0 6.395 6.351 -2.912 0.00 0.00 H+0 HETATM 68 H UNK 0 5.517 2.057 -2.285 0.00 0.00 H+0 HETATM 69 H UNK 0 3.147 -1.293 -0.657 0.00 0.00 H+0 HETATM 70 H UNK 0 4.436 -2.039 0.825 0.00 0.00 H+0 HETATM 71 H UNK 0 3.540 -1.560 2.247 0.00 0.00 H+0 HETATM 72 H UNK 0 3.916 -6.213 0.797 0.00 0.00 H+0 HETATM 73 H UNK 0 3.990 -5.216 2.242 0.00 0.00 H+0 HETATM 74 H UNK 0 2.493 -6.660 3.041 0.00 0.00 H+0 HETATM 75 H UNK 0 3.299 -8.002 1.545 0.00 0.00 H+0 HETATM 76 H UNK 0 1.733 -8.391 1.952 0.00 0.00 H+0 HETATM 77 H UNK 0 0.205 -6.464 -0.234 0.00 0.00 H+0 HETATM 78 H UNK 0 -1.383 -6.089 -1.262 0.00 0.00 H+0 HETATM 79 H UNK 0 0.745 -4.678 3.867 0.00 0.00 H+0 HETATM 80 H UNK 0 -3.700 -2.691 -0.017 0.00 0.00 H+0 HETATM 81 H UNK 0 -0.846 -3.215 -1.534 0.00 0.00 H+0 HETATM 82 H UNK 0 1.148 -2.625 -1.554 0.00 0.00 H+0 HETATM 83 H UNK 0 -1.901 -0.259 4.167 0.00 0.00 H+0 HETATM 84 H UNK 0 -4.588 -0.241 4.270 0.00 0.00 H+0 HETATM 85 H UNK 0 -5.502 -1.047 2.004 0.00 0.00 H+0 HETATM 86 H UNK 0 -4.560 -1.049 -0.880 0.00 0.00 H+0 HETATM 87 H UNK 0 -1.358 2.173 -3.354 0.00 0.00 H+0 HETATM 88 H UNK 0 -2.902 1.491 -4.120 0.00 0.00 H+0 HETATM 89 H UNK 0 -1.601 0.382 -3.435 0.00 0.00 H+0 HETATM 90 H UNK 0 -0.976 2.426 -1.392 0.00 0.00 H+0 HETATM 91 H UNK 0 -1.352 1.022 -0.397 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.319 2.583 -0.234 0.00 0.00 H+0 HETATM 93 H UNK 0 -3.993 2.945 -1.209 0.00 0.00 H+0 HETATM 94 H UNK 0 -3.468 5.225 -3.333 0.00 0.00 H+0 HETATM 95 H UNK 0 -2.415 4.115 -4.203 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.346 4.112 -2.393 0.00 0.00 H+0 HETATM 97 H UNK 0 -6.109 3.663 -3.325 0.00 0.00 H+0 HETATM 98 H UNK 0 -5.045 4.363 -4.550 0.00 0.00 H+0 HETATM 99 H UNK 0 -5.424 2.640 -4.715 0.00 0.00 H+0 HETATM 100 H UNK 0 -6.188 2.134 -1.884 0.00 0.00 H+0 HETATM 101 H UNK 0 -6.141 0.603 -3.395 0.00 0.00 H+0 HETATM 102 H UNK 0 -4.892 1.710 0.211 0.00 0.00 H+0 HETATM 103 H UNK 0 -6.841 0.842 0.486 0.00 0.00 H+0 HETATM 104 H UNK 0 3.006 1.891 1.740 0.00 0.00 H+0 CONECT 1 2 62 63 CONECT 2 1 3 60 CONECT 3 2 4 CONECT 4 3 5 58 CONECT 5 4 6 64 CONECT 6 5 7 9 CONECT 7 6 8 CONECT 8 7 65 66 67 CONECT 9 6 10 68 CONECT 10 9 11 58 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 CONECT 14 13 15 35 69 CONECT 15 14 16 70 71 CONECT 16 15 17 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 72 73 CONECT 20 19 21 22 74 CONECT 21 20 75 76 CONECT 22 20 23 29 CONECT 23 22 24 77 CONECT 24 23 25 26 CONECT 25 24 78 CONECT 26 24 27 30 CONECT 27 26 28 29 CONECT 28 27 CONECT 29 27 22 79 CONECT 30 26 31 CONECT 31 30 32 43 80 CONECT 32 31 33 38 CONECT 33 32 34 81 CONECT 34 33 35 82 CONECT 35 34 36 14 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 32 CONECT 39 38 40 43 CONECT 40 39 41 83 CONECT 41 40 42 84 CONECT 42 41 43 85 CONECT 43 42 44 39 31 CONECT 44 43 45 CONECT 45 44 46 56 86 CONECT 46 45 47 CONECT 47 46 48 49 50 CONECT 48 47 87 88 89 CONECT 49 47 90 91 92 CONECT 50 47 51 54 93 CONECT 51 50 52 53 CONECT 52 51 94 95 96 CONECT 53 51 97 98 99 CONECT 54 50 55 56 100 CONECT 55 54 101 CONECT 56 54 57 45 102 CONECT 57 56 103 CONECT 58 10 59 4 CONECT 59 58 60 104 CONECT 60 59 61 2 CONECT 61 60 CONECT 62 1 CONECT 63 1 CONECT 64 5 CONECT 65 8 CONECT 66 8 CONECT 67 8 CONECT 68 9 CONECT 69 14 CONECT 70 15 CONECT 71 15 CONECT 72 19 CONECT 73 19 CONECT 74 20 CONECT 75 21 CONECT 76 21 CONECT 77 23 CONECT 78 25 CONECT 79 29 CONECT 80 31 CONECT 81 33 CONECT 82 34 CONECT 83 40 CONECT 84 41 CONECT 85 42 CONECT 86 45 CONECT 87 48 CONECT 88 48 CONECT 89 48 CONECT 90 49 CONECT 91 49 CONECT 92 49 CONECT 93 50 CONECT 94 52 CONECT 95 52 CONECT 96 52 CONECT 97 53 CONECT 98 53 CONECT 99 53 CONECT 100 54 CONECT 101 55 CONECT 102 56 CONECT 103 57 CONECT 104 59 MASTER 0 0 0 0 0 0 0 0 104 0 222 0 END