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 -5.910 1.045 3.909 0.00 0.00 C+0 HETATM 2 O UNK 0 -5.508 1.681 2.722 0.00 0.00 O+0 HETATM 3 C UNK 0 -4.399 1.325 1.969 0.00 0.00 C+0 HETATM 4 O UNK 0 -3.669 0.399 2.303 0.00 0.00 O+0 HETATM 5 C UNK 0 -4.115 2.139 0.708 0.00 0.00 C+0 HETATM 6 C UNK 0 -5.110 1.685 -0.311 0.00 0.00 C+0 HETATM 7 C UNK 0 -6.543 1.917 -0.038 0.00 0.00 C+0 HETATM 8 C UNK 0 -7.353 1.280 -1.178 0.00 0.00 C+0 HETATM 9 C UNK 0 -7.170 -0.239 -1.146 0.00 0.00 C+0 HETATM 10 N UNK 0 -7.629 -0.706 0.167 0.00 0.00 N+0 HETATM 11 O UNK 0 -6.735 -0.747 1.173 0.00 0.00 O+0 HETATM 12 C UNK 0 -8.958 -1.111 0.404 0.00 0.00 C+0 HETATM 13 O UNK 0 -9.276 -1.376 1.608 0.00 0.00 O+0 HETATM 14 C UNK 0 -9.978 -1.240 -0.660 0.00 0.00 C+0 HETATM 15 C UNK 0 -11.213 -1.595 -0.358 0.00 0.00 C+0 HETATM 16 C UNK 0 -12.302 -1.764 -1.292 0.00 0.00 C+0 HETATM 17 C UNK 0 -12.168 -1.636 -2.647 0.00 0.00 C+0 HETATM 18 C UNK 0 -13.238 -1.799 -3.511 0.00 0.00 C+0 HETATM 19 C UNK 0 -14.460 -2.094 -2.997 0.00 0.00 C+0 HETATM 20 C UNK 0 -14.653 -2.236 -1.619 0.00 0.00 C+0 HETATM 21 C UNK 0 -13.562 -2.065 -0.818 0.00 0.00 C+0 HETATM 22 N UNK 0 -2.802 1.788 0.235 0.00 0.00 N+0 HETATM 23 C UNK 0 -1.609 1.729 0.966 0.00 0.00 C+0 HETATM 24 O UNK 0 -1.549 1.926 2.202 0.00 0.00 O+0 HETATM 25 C UNK 0 -0.358 1.435 0.263 0.00 0.00 C+0 HETATM 26 C UNK 0 0.728 1.015 1.211 0.00 0.00 C+0 HETATM 27 O UNK 0 0.822 2.058 2.167 0.00 0.00 O+0 HETATM 28 C UNK 0 2.080 1.214 0.449 0.00 0.00 C+0 HETATM 29 C UNK 0 3.178 0.774 1.310 0.00 0.00 C+0 HETATM 30 O UNK 0 3.004 -0.118 2.182 0.00 0.00 O+0 HETATM 31 N UNK 0 4.447 1.399 1.117 0.00 0.00 N+0 HETATM 32 C UNK 0 5.603 1.019 1.891 0.00 0.00 C+0 HETATM 33 C UNK 0 6.820 1.535 1.185 0.00 0.00 C+0 HETATM 34 C UNK 0 6.916 1.001 -0.202 0.00 0.00 C+0 HETATM 35 C UNK 0 7.021 -0.502 -0.206 0.00 0.00 C+0 HETATM 36 C UNK 0 7.068 -1.013 -1.641 0.00 0.00 C+0 HETATM 37 N UNK 0 7.169 -2.418 -1.707 0.00 0.00 N+0 HETATM 38 O UNK 0 5.935 -3.109 -1.754 0.00 0.00 O+0 HETATM 39 C UNK 0 8.282 -3.233 -1.736 0.00 0.00 C+0 HETATM 40 O UNK 0 8.049 -4.529 -1.862 0.00 0.00 O+0 HETATM 41 C UNK 0 9.664 -2.926 -1.655 0.00 0.00 C+0 HETATM 42 C UNK 0 10.235 -1.766 -1.488 0.00 0.00 C+0 HETATM 43 C UNK 0 11.706 -1.583 -1.426 0.00 0.00 C+0 HETATM 44 C UNK 0 12.207 -0.307 -1.218 0.00 0.00 C+0 HETATM 45 C UNK 0 13.561 -0.064 -1.174 0.00 0.00 C+0 HETATM 46 C UNK 0 14.476 -1.085 -1.337 0.00 0.00 C+0 HETATM 47 C UNK 0 13.981 -2.350 -1.543 0.00 0.00 C+0 HETATM 48 C UNK 0 12.598 -2.606 -1.589 0.00 0.00 C+0 HETATM 49 C UNK 0 5.532 1.766 3.240 0.00 0.00 C+0 HETATM 50 O UNK 0 4.559 2.511 3.400 0.00 0.00 O+0 HETATM 51 O UNK 0 6.496 1.595 4.189 0.00 0.00 O+0 HETATM 52 C UNK 0 0.563 -0.307 1.732 0.00 0.00 C+0 HETATM 53 O UNK 0 0.547 -1.317 0.966 0.00 0.00 O+0 HETATM 54 O UNK 0 0.409 -0.562 3.091 0.00 0.00 O+0 HETATM 55 H UNK 0 -5.612 -0.010 3.999 0.00 0.00 H+0 HETATM 56 H UNK 0 -7.011 1.187 4.051 0.00 0.00 H+0 HETATM 57 H UNK 0 -5.404 1.601 4.742 0.00 0.00 H+0 HETATM 58 H UNK 0 -4.172 3.197 1.045 0.00 0.00 H+0 HETATM 59 H UNK 0 -4.872 0.596 -0.500 0.00 0.00 H+0 HETATM 60 H UNK 0 -4.885 2.153 -1.319 0.00 0.00 H+0 HETATM 61 H UNK 0 -6.934 1.596 0.926 0.00 0.00 H+0 HETATM 62 H UNK 0 -6.758 3.019 -0.107 0.00 0.00 H+0 HETATM 63 H UNK 0 -6.852 1.626 -2.124 0.00 0.00 H+0 HETATM 64 H UNK 0 -8.386 1.608 -1.205 0.00 0.00 H+0 HETATM 65 H UNK 0 -6.154 -0.530 -1.341 0.00 0.00 H+0 HETATM 66 H UNK 0 -7.792 -0.637 -1.977 0.00 0.00 H+0 HETATM 67 H UNK 0 -6.841 -1.656 1.582 0.00 0.00 H+0 HETATM 68 H UNK 0 -9.748 -1.063 -1.698 0.00 0.00 H+0 HETATM 69 H UNK 0 -11.412 -1.768 0.719 0.00 0.00 H+0 HETATM 70 H UNK 0 -11.213 -1.400 -3.090 0.00 0.00 H+0 HETATM 71 H UNK 0 -13.112 -1.690 -4.592 0.00 0.00 H+0 HETATM 72 H UNK 0 -15.275 -2.221 -3.715 0.00 0.00 H+0 HETATM 73 H UNK 0 -15.663 -2.469 -1.266 0.00 0.00 H+0 HETATM 74 H UNK 0 -13.710 -2.178 0.259 0.00 0.00 H+0 HETATM 75 H UNK 0 -2.722 1.546 -0.809 0.00 0.00 H+0 HETATM 76 H UNK 0 0.057 2.357 -0.252 0.00 0.00 H+0 HETATM 77 H UNK 0 -0.511 0.678 -0.536 0.00 0.00 H+0 HETATM 78 H UNK 0 1.123 2.868 1.659 0.00 0.00 H+0 HETATM 79 H UNK 0 2.153 2.290 0.165 0.00 0.00 H+0 HETATM 80 H UNK 0 1.984 0.547 -0.424 0.00 0.00 H+0 HETATM 81 H UNK 0 4.561 2.166 0.399 0.00 0.00 H+0 HETATM 82 H UNK 0 5.598 -0.023 2.178 0.00 0.00 H+0 HETATM 83 H UNK 0 7.759 1.274 1.764 0.00 0.00 H+0 HETATM 84 H UNK 0 6.802 2.662 1.115 0.00 0.00 H+0 HETATM 85 H UNK 0 5.982 1.337 -0.738 0.00 0.00 H+0 HETATM 86 H UNK 0 7.811 1.431 -0.727 0.00 0.00 H+0 HETATM 87 H UNK 0 7.945 -0.768 0.340 0.00 0.00 H+0 HETATM 88 H UNK 0 6.168 -0.969 0.295 0.00 0.00 H+0 HETATM 89 H UNK 0 5.986 -0.733 -2.004 0.00 0.00 H+0 HETATM 90 H UNK 0 7.743 -0.424 -2.264 0.00 0.00 H+0 HETATM 91 H UNK 0 6.024 -3.747 -2.531 0.00 0.00 H+0 HETATM 92 H UNK 0 10.370 -3.785 -1.746 0.00 0.00 H+0 HETATM 93 H UNK 0 9.609 -0.891 -1.369 0.00 0.00 H+0 HETATM 94 H UNK 0 11.479 0.504 -1.085 0.00 0.00 H+0 HETATM 95 H UNK 0 13.922 0.942 -1.011 0.00 0.00 H+0 HETATM 96 H UNK 0 15.556 -0.920 -1.309 0.00 0.00 H+0 HETATM 97 H UNK 0 14.658 -3.178 -1.680 0.00 0.00 H+0 HETATM 98 H UNK 0 12.262 -3.626 -1.749 0.00 0.00 H+0 HETATM 99 H UNK 0 6.570 0.791 4.801 0.00 0.00 H+0 HETATM 100 H UNK 0 -0.472 -0.929 3.487 0.00 0.00 H+0 CONECT 1 2 55 56 57 CONECT 2 1 3 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 22 58 CONECT 6 5 7 59 60 CONECT 7 6 8 61 62 CONECT 8 7 9 63 64 CONECT 9 8 10 65 66 CONECT 10 9 11 12 CONECT 11 10 67 CONECT 12 10 13 14 CONECT 13 12 CONECT 14 12 15 68 CONECT 15 14 16 69 CONECT 16 15 17 21 CONECT 17 16 18 70 CONECT 18 17 19 71 CONECT 19 18 20 72 CONECT 20 19 21 73 CONECT 21 20 16 74 CONECT 22 5 23 75 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 76 77 CONECT 26 25 27 28 52 CONECT 27 26 78 CONECT 28 26 29 79 80 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 81 CONECT 32 31 33 49 82 CONECT 33 32 34 83 84 CONECT 34 33 35 85 86 CONECT 35 34 36 87 88 CONECT 36 35 37 89 90 CONECT 37 36 38 39 CONECT 38 37 91 CONECT 39 37 40 41 CONECT 40 39 CONECT 41 39 42 92 CONECT 42 41 43 93 CONECT 43 42 44 48 CONECT 44 43 45 94 CONECT 45 44 46 95 CONECT 46 45 47 96 CONECT 47 46 48 97 CONECT 48 47 43 98 CONECT 49 32 50 51 CONECT 50 49 CONECT 51 49 99 CONECT 52 26 53 54 CONECT 53 52 CONECT 54 52 100 CONECT 55 1 CONECT 56 1 CONECT 57 1 CONECT 58 5 CONECT 59 6 CONECT 60 6 CONECT 61 7 CONECT 62 7 CONECT 63 8 CONECT 64 8 CONECT 65 9 CONECT 66 9 CONECT 67 11 CONECT 68 14 CONECT 69 15 CONECT 70 17 CONECT 71 18 CONECT 72 19 CONECT 73 20 CONECT 74 21 CONECT 75 22 CONECT 76 25 CONECT 77 25 CONECT 78 27 CONECT 79 28 CONECT 80 28 CONECT 81 31 CONECT 82 32 CONECT 83 33 CONECT 84 33 CONECT 85 34 CONECT 86 34 CONECT 87 35 CONECT 88 35 CONECT 89 36 CONECT 90 36 CONECT 91 38 CONECT 92 41 CONECT 93 42 CONECT 94 44 CONECT 95 45 CONECT 96 46 CONECT 97 47 CONECT 98 48 CONECT 99 51 CONECT 100 54 MASTER 0 0 0 0 0 0 0 0 100 0 202 0 END