HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 C UNK 0 4.098 1.430 0.141 0.00 0.00 C+0 HETATM 2 C UNK 0 4.241 -0.001 0.653 0.00 0.00 C+0 HETATM 3 O UNK 0 2.969 -0.511 1.075 0.00 0.00 O+0 HETATM 4 C UNK 0 2.638 -0.174 2.418 0.00 0.00 C+0 HETATM 5 O UNK 0 1.297 -0.578 2.715 0.00 0.00 O+0 HETATM 6 C UNK 0 0.320 0.252 2.062 0.00 0.00 C+0 HETATM 7 C UNK 0 -0.740 -0.608 1.342 0.00 0.00 C+0 HETATM 8 O UNK 0 -0.062 -1.390 0.345 0.00 0.00 O+0 HETATM 9 C UNK 0 -0.908 -2.038 -0.539 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.798 -1.875 -1.870 0.00 0.00 C+0 HETATM 11 C UNK 0 0.191 -0.956 -2.454 0.00 0.00 C+0 HETATM 12 C UNK 0 1.566 -1.235 -2.404 0.00 0.00 C+0 HETATM 13 C UNK 0 2.490 -0.342 -2.954 0.00 0.00 C+0 HETATM 14 C UNK 0 2.033 0.833 -3.531 0.00 0.00 C+0 HETATM 15 O UNK 0 2.934 1.719 -4.049 0.00 0.00 O+0 HETATM 16 C UNK 0 0.673 1.122 -3.578 0.00 0.00 C+0 HETATM 17 O UNK 0 0.285 2.313 -4.129 0.00 0.00 O+0 HETATM 18 C UNK 0 -0.253 0.227 -3.061 0.00 0.00 C+0 HETATM 19 O UNK 0 -1.612 -2.468 -2.819 0.00 0.00 O+0 HETATM 20 C UNK 0 -2.607 -3.306 -2.392 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.418 -3.876 -3.374 0.00 0.00 C+0 HETATM 22 C UNK 0 -4.445 -4.737 -3.001 0.00 0.00 C+0 HETATM 23 O UNK 0 -5.214 -5.273 -3.991 0.00 0.00 O+0 HETATM 24 C UNK 0 -4.676 -5.039 -1.662 0.00 0.00 C+0 HETATM 25 C UNK 0 -3.862 -4.467 -0.687 0.00 0.00 C+0 HETATM 26 O UNK 0 -4.136 -4.802 0.612 0.00 0.00 O+0 HETATM 27 C UNK 0 -2.827 -3.596 -1.049 0.00 0.00 C+0 HETATM 28 C UNK 0 -1.955 -2.973 -0.044 0.00 0.00 C+0 HETATM 29 O UNK 0 -2.114 -3.242 1.144 0.00 0.00 O+0 HETATM 30 O UNK 0 -1.734 0.239 0.746 0.00 0.00 O+0 HETATM 31 C UNK 0 -2.449 1.035 1.699 0.00 0.00 C+0 HETATM 32 C UNK 0 -3.506 1.876 0.952 0.00 0.00 C+0 HETATM 33 O UNK 0 -2.998 2.987 0.202 0.00 0.00 O+0 HETATM 34 C UNK 0 -2.275 2.628 -0.975 0.00 0.00 C+0 HETATM 35 O UNK 0 -0.865 2.724 -0.747 0.00 0.00 O+0 HETATM 36 C UNK 0 -0.400 4.055 -0.498 0.00 0.00 C+0 HETATM 37 C UNK 0 1.102 3.961 -0.245 0.00 0.00 C+0 HETATM 38 C UNK 0 -0.722 4.988 -1.673 0.00 0.00 C+0 HETATM 39 O UNK 0 -0.347 6.347 -1.418 0.00 0.00 O+0 HETATM 40 C UNK 0 -2.231 4.962 -1.937 0.00 0.00 C+0 HETATM 41 O UNK 0 -2.514 5.724 -3.127 0.00 0.00 O+0 HETATM 42 C UNK 0 -2.720 3.531 -2.146 0.00 0.00 C+0 HETATM 43 O UNK 0 -2.207 3.062 -3.416 0.00 0.00 O+0 HETATM 44 C UNK 0 -1.516 1.910 2.545 0.00 0.00 C+0 HETATM 45 O UNK 0 -2.240 2.533 3.612 0.00 0.00 O+0 HETATM 46 C UNK 0 -0.387 1.072 3.144 0.00 0.00 C+0 HETATM 47 O UNK 0 0.531 1.956 3.813 0.00 0.00 O+0 HETATM 48 C UNK 0 3.583 -0.886 3.407 0.00 0.00 C+0 HETATM 49 O UNK 0 3.787 -0.036 4.556 0.00 0.00 O+0 HETATM 50 C UNK 0 4.934 -1.202 2.757 0.00 0.00 C+0 HETATM 51 O UNK 0 5.941 -1.315 3.778 0.00 0.00 O+0 HETATM 52 C UNK 0 5.319 -0.113 1.752 0.00 0.00 C+0 HETATM 53 O UNK 0 6.609 -0.416 1.201 0.00 0.00 O+0 HETATM 54 H UNK 0 5.033 1.783 -0.305 0.00 0.00 H+0 HETATM 55 H UNK 0 3.819 2.119 0.945 0.00 0.00 H+0 HETATM 56 H UNK 0 3.305 1.490 -0.610 0.00 0.00 H+0 HETATM 57 H UNK 0 4.534 -0.617 -0.205 0.00 0.00 H+0 HETATM 58 H UNK 0 2.709 0.912 2.561 0.00 0.00 H+0 HETATM 59 H UNK 0 0.802 0.921 1.336 0.00 0.00 H+0 HETATM 60 H UNK 0 -1.203 -1.283 2.070 0.00 0.00 H+0 HETATM 61 H UNK 0 1.924 -2.146 -1.929 0.00 0.00 H+0 HETATM 62 H UNK 0 3.553 -0.556 -2.919 0.00 0.00 H+0 HETATM 63 H UNK 0 2.376 2.431 -4.423 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.667 2.437 -3.913 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.315 0.445 -3.108 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.250 -3.653 -4.424 0.00 0.00 H+0 HETATM 67 H UNK 0 -5.880 -5.858 -3.591 0.00 0.00 H+0 HETATM 68 H UNK 0 -5.474 -5.711 -1.361 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.474 -4.356 1.189 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.002 0.346 2.353 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.099 1.241 0.282 0.00 0.00 H+0 HETATM 72 H UNK 0 -4.200 2.301 1.686 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.483 1.592 -1.262 0.00 0.00 H+0 HETATM 74 H UNK 0 -0.863 4.440 0.419 0.00 0.00 H+0 HETATM 75 H UNK 0 1.623 3.578 -1.129 0.00 0.00 H+0 HETATM 76 H UNK 0 1.531 4.930 0.024 0.00 0.00 H+0 HETATM 77 H UNK 0 1.307 3.258 0.570 0.00 0.00 H+0 HETATM 78 H UNK 0 -0.191 4.674 -2.580 0.00 0.00 H+0 HETATM 79 H UNK 0 0.626 6.385 -1.414 0.00 0.00 H+0 HETATM 80 H UNK 0 -2.772 5.442 -1.112 0.00 0.00 H+0 HETATM 81 H UNK 0 -2.079 6.588 -2.973 0.00 0.00 H+0 HETATM 82 H UNK 0 -3.813 3.526 -2.233 0.00 0.00 H+0 HETATM 83 H UNK 0 -2.452 3.791 -4.031 0.00 0.00 H+0 HETATM 84 H UNK 0 -1.075 2.712 1.948 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.557 2.973 4.159 0.00 0.00 H+0 HETATM 86 H UNK 0 -0.784 0.414 3.928 0.00 0.00 H+0 HETATM 87 H UNK 0 1.176 1.381 4.272 0.00 0.00 H+0 HETATM 88 H UNK 0 3.138 -1.809 3.794 0.00 0.00 H+0 HETATM 89 H UNK 0 4.610 -0.381 4.966 0.00 0.00 H+0 HETATM 90 H UNK 0 4.891 -2.170 2.243 0.00 0.00 H+0 HETATM 91 H UNK 0 6.797 -1.192 3.320 0.00 0.00 H+0 HETATM 92 H UNK 0 5.439 0.839 2.283 0.00 0.00 H+0 HETATM 93 H UNK 0 6.518 -1.188 0.613 0.00 0.00 H+0 CONECT 1 2 54 55 56 CONECT 2 3 52 1 57 CONECT 3 4 2 CONECT 4 48 3 5 58 CONECT 5 4 6 CONECT 6 7 46 5 59 CONECT 7 6 30 8 60 CONECT 8 9 7 CONECT 9 28 10 8 CONECT 10 9 19 11 CONECT 11 18 10 12 CONECT 12 13 11 61 CONECT 13 12 14 62 CONECT 14 13 16 15 CONECT 15 14 63 CONECT 16 14 18 17 CONECT 17 16 64 CONECT 18 16 11 65 CONECT 19 20 10 CONECT 20 21 27 19 CONECT 21 20 22 66 CONECT 22 21 23 24 CONECT 23 22 67 CONECT 24 22 25 68 CONECT 25 27 26 24 CONECT 26 25 69 CONECT 27 25 20 28 CONECT 28 27 9 29 CONECT 29 28 CONECT 30 31 7 CONECT 31 44 30 32 70 CONECT 32 33 31 71 72 CONECT 33 32 34 CONECT 34 42 35 33 73 CONECT 35 34 36 CONECT 36 35 38 37 74 CONECT 37 36 75 76 77 CONECT 38 36 40 39 78 CONECT 39 38 79 CONECT 40 41 38 42 80 CONECT 41 40 81 CONECT 42 34 40 43 82 CONECT 43 42 83 CONECT 44 46 31 45 84 CONECT 45 44 85 CONECT 46 6 44 47 86 CONECT 47 46 87 CONECT 48 50 4 49 88 CONECT 49 48 89 CONECT 50 52 48 51 90 CONECT 51 50 91 CONECT 52 50 2 53 92 CONECT 53 52 93 CONECT 54 1 CONECT 55 1 CONECT 56 1 CONECT 57 2 CONECT 58 4 CONECT 59 6 CONECT 60 7 CONECT 61 12 CONECT 62 13 CONECT 63 15 CONECT 64 17 CONECT 65 18 CONECT 66 21 CONECT 67 23 CONECT 68 24 CONECT 69 26 CONECT 70 31 CONECT 71 32 CONECT 72 32 CONECT 73 34 CONECT 74 36 CONECT 75 37 CONECT 76 37 CONECT 77 37 CONECT 78 38 CONECT 79 39 CONECT 80 40 CONECT 81 41 CONECT 82 42 CONECT 83 43 CONECT 84 44 CONECT 85 45 CONECT 86 46 CONECT 87 47 CONECT 88 48 CONECT 89 49 CONECT 90 50 CONECT 91 51 CONECT 92 52 CONECT 93 53 MASTER 0 0 0 0 0 0 0 0 93 0 196 0 END