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 -3.369 -5.905 -1.825 0.00 0.00 C+0 HETATM 2 O UNK 0 -2.824 -4.628 -1.732 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.845 -4.106 -0.461 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.718 -2.846 -0.389 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.411 -2.239 0.958 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.022 -1.540 0.779 0.00 0.00 C+0 HETATM 7 O UNK 0 -2.110 -0.327 0.443 0.00 0.00 O+0 HETATM 8 C UNK 0 -2.113 0.903 0.385 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.828 1.654 0.720 0.00 0.00 C+0 HETATM 10 C UNK 0 -1.103 3.104 0.581 0.00 0.00 C+0 HETATM 11 O UNK 0 -1.593 3.671 -0.530 0.00 0.00 O+0 HETATM 12 C UNK 0 -1.337 3.874 -1.817 0.00 0.00 C+0 HETATM 13 O UNK 0 -0.259 3.408 -2.266 0.00 0.00 O+0 HETATM 14 C UNK 0 -2.248 4.611 -2.733 0.00 0.00 C+0 HETATM 15 C UNK 0 -1.985 4.816 -4.058 0.00 0.00 C+0 HETATM 16 C UNK 0 -3.037 5.534 -4.628 0.00 0.00 C+0 HETATM 17 C UNK 0 -3.934 5.753 -3.611 0.00 0.00 C+0 HETATM 18 C UNK 0 -5.244 6.493 -3.736 0.00 0.00 C+0 HETATM 19 N UNK 0 -3.424 5.189 -2.510 0.00 0.00 N+0 HETATM 20 C UNK 0 0.381 0.982 0.361 0.00 0.00 C+0 HETATM 21 C UNK 0 0.659 0.506 -1.018 0.00 0.00 C+0 HETATM 22 C UNK 0 1.613 -0.666 -0.981 0.00 0.00 C+0 HETATM 23 C UNK 0 2.528 -0.783 0.165 0.00 0.00 C+0 HETATM 24 C UNK 0 2.213 -1.970 1.095 0.00 0.00 C+0 HETATM 25 C UNK 0 3.924 -1.086 -0.411 0.00 0.00 C+0 HETATM 26 C UNK 0 3.978 -2.123 -1.441 0.00 0.00 C+0 HETATM 27 C UNK 0 4.258 -1.840 -2.733 0.00 0.00 C+0 HETATM 28 O UNK 0 4.526 -0.581 -3.291 0.00 0.00 O+0 HETATM 29 C UNK 0 4.262 -3.032 -3.546 0.00 0.00 C+0 HETATM 30 O UNK 0 4.489 -3.106 -4.810 0.00 0.00 O+0 HETATM 31 O UNK 0 3.977 -4.096 -2.725 0.00 0.00 O+0 HETATM 32 C UNK 0 3.777 -3.579 -1.432 0.00 0.00 C+0 HETATM 33 O UNK 0 2.455 -3.965 -1.117 0.00 0.00 O+0 HETATM 34 C UNK 0 4.906 -1.244 0.694 0.00 0.00 C+0 HETATM 35 C UNK 0 5.788 -2.388 0.938 0.00 0.00 C+0 HETATM 36 C UNK 0 4.979 -0.194 1.516 0.00 0.00 C+0 HETATM 37 C UNK 0 4.074 0.943 1.183 0.00 0.00 C+0 HETATM 38 C UNK 0 2.667 0.397 1.069 0.00 0.00 C+0 HETATM 39 C UNK 0 1.684 1.533 0.882 0.00 0.00 C+0 HETATM 40 C UNK 0 2.356 2.459 -0.131 0.00 0.00 C+0 HETATM 41 C UNK 0 1.568 2.323 2.156 0.00 0.00 C+0 HETATM 42 C UNK 0 0.298 2.309 2.878 0.00 0.00 C+0 HETATM 43 C UNK 0 -0.822 1.511 2.292 0.00 0.00 C+0 HETATM 44 O UNK 0 -2.066 1.977 2.728 0.00 0.00 O+0 HETATM 45 C UNK 0 -2.962 1.196 3.395 0.00 0.00 C+0 HETATM 46 C UNK 0 -4.265 1.751 3.826 0.00 0.00 C+0 HETATM 47 O UNK 0 -2.732 -0.002 3.669 0.00 0.00 O+0 HETATM 48 O UNK 0 -1.233 -2.344 -0.021 0.00 0.00 O+0 HETATM 49 C UNK 0 -1.471 -3.679 0.035 0.00 0.00 C+0 HETATM 50 C UNK 0 -1.167 -4.340 1.357 0.00 0.00 C+0 HETATM 51 H UNK 0 -3.306 -6.232 -2.882 0.00 0.00 H+0 HETATM 52 H UNK 0 -2.840 -6.623 -1.151 0.00 0.00 H+0 HETATM 53 H UNK 0 -4.475 -5.876 -1.598 0.00 0.00 H+0 HETATM 54 H UNK 0 -3.299 -4.838 0.224 0.00 0.00 H+0 HETATM 55 H UNK 0 -4.781 -3.071 -0.526 0.00 0.00 H+0 HETATM 56 H UNK 0 -3.316 -2.157 -1.165 0.00 0.00 H+0 HETATM 57 H UNK 0 -3.328 -3.059 1.688 0.00 0.00 H+0 HETATM 58 H UNK 0 -4.155 -1.530 1.313 0.00 0.00 H+0 HETATM 59 H UNK 0 -1.611 -1.653 1.840 0.00 0.00 H+0 HETATM 60 H UNK 0 -2.479 1.361 -0.640 0.00 0.00 H+0 HETATM 61 H UNK 0 -2.886 1.485 1.042 0.00 0.00 H+0 HETATM 62 H UNK 0 -1.887 3.320 1.396 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.227 3.672 1.030 0.00 0.00 H+0 HETATM 64 H UNK 0 -1.113 4.494 -4.629 0.00 0.00 H+0 HETATM 65 H UNK 0 -3.124 5.852 -5.662 0.00 0.00 H+0 HETATM 66 H UNK 0 -5.420 7.109 -2.829 0.00 0.00 H+0 HETATM 67 H UNK 0 -5.258 7.132 -4.622 0.00 0.00 H+0 HETATM 68 H UNK 0 -6.082 5.750 -3.757 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.901 5.204 -1.581 0.00 0.00 H+0 HETATM 70 H UNK 0 0.306 -0.028 0.928 0.00 0.00 H+0 HETATM 71 H UNK 0 -0.233 0.183 -1.592 0.00 0.00 H+0 HETATM 72 H UNK 0 1.107 1.350 -1.604 0.00 0.00 H+0 HETATM 73 H UNK 0 2.177 -0.561 -1.962 0.00 0.00 H+0 HETATM 74 H UNK 0 1.080 -1.629 -1.118 0.00 0.00 H+0 HETATM 75 H UNK 0 3.063 -2.673 1.179 0.00 0.00 H+0 HETATM 76 H UNK 0 2.138 -1.618 2.176 0.00 0.00 H+0 HETATM 77 H UNK 0 1.303 -2.494 0.818 0.00 0.00 H+0 HETATM 78 H UNK 0 4.209 -0.090 -0.878 0.00 0.00 H+0 HETATM 79 H UNK 0 5.413 -0.325 -3.663 0.00 0.00 H+0 HETATM 80 H UNK 0 4.502 -4.125 -0.792 0.00 0.00 H+0 HETATM 81 H UNK 0 2.426 -4.777 -0.571 0.00 0.00 H+0 HETATM 82 H UNK 0 6.688 -2.091 1.567 0.00 0.00 H+0 HETATM 83 H UNK 0 5.320 -3.188 1.540 0.00 0.00 H+0 HETATM 84 H UNK 0 6.279 -2.766 0.002 0.00 0.00 H+0 HETATM 85 H UNK 0 5.665 -0.215 2.353 0.00 0.00 H+0 HETATM 86 H UNK 0 4.119 1.670 2.018 0.00 0.00 H+0 HETATM 87 H UNK 0 4.425 1.495 0.292 0.00 0.00 H+0 HETATM 88 H UNK 0 2.457 0.095 2.154 0.00 0.00 H+0 HETATM 89 H UNK 0 1.700 3.224 -0.532 0.00 0.00 H+0 HETATM 90 H UNK 0 2.880 1.951 -0.931 0.00 0.00 H+0 HETATM 91 H UNK 0 3.143 3.000 0.484 0.00 0.00 H+0 HETATM 92 H UNK 0 2.346 1.908 2.869 0.00 0.00 H+0 HETATM 93 H UNK 0 1.946 3.382 2.015 0.00 0.00 H+0 HETATM 94 H UNK 0 -0.076 3.345 3.022 0.00 0.00 H+0 HETATM 95 H UNK 0 0.389 1.924 3.940 0.00 0.00 H+0 HETATM 96 H UNK 0 -0.730 0.443 2.501 0.00 0.00 H+0 HETATM 97 H UNK 0 -4.330 1.830 4.931 0.00 0.00 H+0 HETATM 98 H UNK 0 -5.069 1.038 3.526 0.00 0.00 H+0 HETATM 99 H UNK 0 -4.399 2.757 3.411 0.00 0.00 H+0 HETATM 100 H UNK 0 -0.759 -4.140 -0.738 0.00 0.00 H+0 HETATM 101 H UNK 0 -1.984 -5.018 1.687 0.00 0.00 H+0 HETATM 102 H UNK 0 -1.045 -3.572 2.139 0.00 0.00 H+0 HETATM 103 H UNK 0 -0.207 -4.912 1.244 0.00 0.00 H+0 CONECT 1 2 51 52 53 CONECT 2 1 3 CONECT 3 2 4 49 54 CONECT 4 3 5 55 56 CONECT 5 4 6 57 58 CONECT 6 5 7 48 59 CONECT 7 6 8 CONECT 8 7 9 60 61 CONECT 9 8 10 20 43 CONECT 10 9 11 62 63 CONECT 11 10 12 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 19 CONECT 15 14 16 64 CONECT 16 15 17 65 CONECT 17 16 18 19 CONECT 18 17 66 67 68 CONECT 19 17 14 69 CONECT 20 9 21 39 70 CONECT 21 20 22 71 72 CONECT 22 21 23 73 74 CONECT 23 22 24 25 38 CONECT 24 23 75 76 77 CONECT 25 23 26 34 78 CONECT 26 25 27 32 CONECT 27 26 28 29 CONECT 28 27 79 CONECT 29 27 30 31 CONECT 30 29 CONECT 31 29 32 CONECT 32 31 33 26 80 CONECT 33 32 81 CONECT 34 25 35 36 CONECT 35 34 82 83 84 CONECT 36 34 37 85 CONECT 37 36 38 86 87 CONECT 38 37 39 23 88 CONECT 39 38 40 41 20 CONECT 40 39 89 90 91 CONECT 41 39 42 92 93 CONECT 42 41 43 94 95 CONECT 43 42 44 9 96 CONECT 44 43 45 CONECT 45 44 46 47 CONECT 46 45 97 98 99 CONECT 47 45 CONECT 48 6 49 CONECT 49 48 50 3 100 CONECT 50 49 101 102 103 CONECT 51 1 CONECT 52 1 CONECT 53 1 CONECT 54 3 CONECT 55 4 CONECT 56 4 CONECT 57 5 CONECT 58 5 CONECT 59 6 CONECT 60 8 CONECT 61 8 CONECT 62 10 CONECT 63 10 CONECT 64 15 CONECT 65 16 CONECT 66 18 CONECT 67 18 CONECT 68 18 CONECT 69 19 CONECT 70 20 CONECT 71 21 CONECT 72 21 CONECT 73 22 CONECT 74 22 CONECT 75 24 CONECT 76 24 CONECT 77 24 CONECT 78 25 CONECT 79 28 CONECT 80 32 CONECT 81 33 CONECT 82 35 CONECT 83 35 CONECT 84 35 CONECT 85 36 CONECT 86 37 CONECT 87 37 CONECT 88 38 CONECT 89 40 CONECT 90 40 CONECT 91 40 CONECT 92 41 CONECT 93 41 CONECT 94 42 CONECT 95 42 CONECT 96 43 CONECT 97 46 CONECT 98 46 CONECT 99 46 CONECT 100 49 CONECT 101 50 CONECT 102 50 CONECT 103 50 MASTER 0 0 0 0 0 0 0 0 103 0 216 0 END