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 12.375 0.119 -2.381 0.00 0.00 C+0 HETATM 2 O UNK 0 11.038 -0.031 -2.646 0.00 0.00 O+0 HETATM 3 C UNK 0 10.235 1.016 -2.207 0.00 0.00 C+0 HETATM 4 C UNK 0 9.262 0.447 -1.202 0.00 0.00 C+0 HETATM 5 C UNK 0 8.050 -0.177 -1.849 0.00 0.00 C+0 HETATM 6 O UNK 0 7.787 -1.358 -1.184 0.00 0.00 O+0 HETATM 7 C UNK 0 6.532 -1.429 -0.620 0.00 0.00 C+0 HETATM 8 C UNK 0 5.678 -2.565 -1.069 0.00 0.00 C+0 HETATM 9 C UNK 0 4.609 -2.794 -0.030 0.00 0.00 C+0 HETATM 10 C UNK 0 4.233 -1.491 0.663 0.00 0.00 C+0 HETATM 11 O UNK 0 3.345 -1.817 1.687 0.00 0.00 O+0 HETATM 12 C UNK 0 2.036 -1.481 1.378 0.00 0.00 C+0 HETATM 13 C UNK 0 1.212 -2.718 1.558 0.00 0.00 C+0 HETATM 14 C UNK 0 0.162 -2.515 2.676 0.00 0.00 C+0 HETATM 15 O UNK 0 -0.594 -3.679 2.783 0.00 0.00 O+0 HETATM 16 C UNK 0 -0.635 -1.371 2.184 0.00 0.00 C+0 HETATM 17 C UNK 0 0.049 -0.209 1.888 0.00 0.00 C+0 HETATM 18 O UNK 0 -0.562 0.848 1.414 0.00 0.00 O+0 HETATM 19 C UNK 0 -1.860 0.879 1.189 0.00 0.00 C+0 HETATM 20 C UNK 0 -2.425 2.023 0.689 0.00 0.00 C+0 HETATM 21 C UNK 0 -3.785 2.074 0.445 0.00 0.00 C+0 HETATM 22 C UNK 0 -4.571 0.944 0.718 0.00 0.00 C+0 HETATM 23 C UNK 0 -4.006 -0.200 1.218 0.00 0.00 C+0 HETATM 24 O UNK 0 -4.684 -1.319 1.507 0.00 0.00 O+0 HETATM 25 C UNK 0 -2.611 -0.223 1.456 0.00 0.00 C+0 HETATM 26 C UNK 0 -1.993 -1.370 1.962 0.00 0.00 C+0 HETATM 27 O UNK 0 -2.615 -2.417 2.230 0.00 0.00 O+0 HETATM 28 C UNK 0 -6.022 1.044 0.524 0.00 0.00 C+0 HETATM 29 C UNK 0 -6.516 2.266 0.091 0.00 0.00 C+0 HETATM 30 C UNK 0 -7.862 2.406 -0.141 0.00 0.00 C+0 HETATM 31 C UNK 0 -8.736 1.330 0.056 0.00 0.00 C+0 HETATM 32 C UNK 0 -8.223 0.135 0.482 0.00 0.00 C+0 HETATM 33 C UNK 0 -6.842 -0.026 0.725 0.00 0.00 C+0 HETATM 34 O UNK 0 -6.486 -1.236 1.131 0.00 0.00 O+0 HETATM 35 C UNK 0 -9.184 -0.951 0.650 0.00 0.00 C+0 HETATM 36 O UNK 0 -8.809 -2.067 1.035 0.00 0.00 O+0 HETATM 37 N UNK 0 -10.583 -0.770 0.378 0.00 0.00 N+0 HETATM 38 C UNK 0 -11.725 -1.613 0.610 0.00 0.00 C+0 HETATM 39 C UNK 0 -12.806 -0.554 0.814 0.00 0.00 C+0 HETATM 40 O UNK 0 -12.265 0.652 0.457 0.00 0.00 O+0 HETATM 41 C UNK 0 -11.075 0.427 -0.245 0.00 0.00 C+0 HETATM 42 C UNK 0 -11.491 0.127 -1.679 0.00 0.00 C+0 HETATM 43 C UNK 0 -10.158 1.575 -0.177 0.00 0.00 C+0 HETATM 44 C UNK 0 -5.733 3.498 -0.141 0.00 0.00 C+0 HETATM 45 C UNK 0 -4.297 3.342 -0.150 0.00 0.00 C+0 HETATM 46 O UNK 0 -3.622 4.374 0.524 0.00 0.00 O+0 HETATM 47 C UNK 0 -2.293 4.382 0.189 0.00 0.00 C+0 HETATM 48 O UNK 0 -1.642 3.158 0.415 0.00 0.00 O+0 HETATM 49 C UNK 0 1.520 -0.283 2.160 0.00 0.00 C+0 HETATM 50 O UNK 0 2.055 0.911 1.648 0.00 0.00 O+0 HETATM 51 O UNK 0 5.278 -0.843 1.241 0.00 0.00 O+0 HETATM 52 C UNK 0 6.530 -1.308 0.879 0.00 0.00 C+0 HETATM 53 C UNK 0 6.877 -2.508 1.653 0.00 0.00 C+0 HETATM 54 O UNK 0 8.398 -0.410 -3.191 0.00 0.00 O+0 HETATM 55 C UNK 0 8.363 0.815 -3.859 0.00 0.00 C+0 HETATM 56 C UNK 0 7.050 1.546 -3.696 0.00 0.00 C+0 HETATM 57 C UNK 0 9.534 1.618 -3.404 0.00 0.00 C+0 HETATM 58 O UNK 0 10.418 1.798 -4.440 0.00 0.00 O+0 HETATM 59 H UNK 0 12.879 -0.804 -2.796 0.00 0.00 H+0 HETATM 60 H UNK 0 12.653 0.131 -1.313 0.00 0.00 H+0 HETATM 61 H UNK 0 12.826 0.971 -2.957 0.00 0.00 H+0 HETATM 62 H UNK 0 10.879 1.761 -1.721 0.00 0.00 H+0 HETATM 63 H UNK 0 9.736 -0.280 -0.545 0.00 0.00 H+0 HETATM 64 H UNK 0 8.935 1.298 -0.541 0.00 0.00 H+0 HETATM 65 H UNK 0 7.219 0.553 -1.778 0.00 0.00 H+0 HETATM 66 H UNK 0 6.013 -0.475 -0.952 0.00 0.00 H+0 HETATM 67 H UNK 0 5.244 -2.267 -2.068 0.00 0.00 H+0 HETATM 68 H UNK 0 6.251 -3.491 -1.291 0.00 0.00 H+0 HETATM 69 H UNK 0 3.689 -3.083 -0.630 0.00 0.00 H+0 HETATM 70 H UNK 0 4.771 -3.634 0.635 0.00 0.00 H+0 HETATM 71 H UNK 0 3.659 -0.937 -0.111 0.00 0.00 H+0 HETATM 72 H UNK 0 2.015 -1.126 0.314 0.00 0.00 H+0 HETATM 73 H UNK 0 1.837 -3.607 1.805 0.00 0.00 H+0 HETATM 74 H UNK 0 0.663 -2.932 0.594 0.00 0.00 H+0 HETATM 75 H UNK 0 0.696 -2.266 3.596 0.00 0.00 H+0 HETATM 76 H UNK 0 -0.708 -4.049 1.859 0.00 0.00 H+0 HETATM 77 H UNK 0 -4.472 -2.204 1.859 0.00 0.00 H+0 HETATM 78 H UNK 0 -8.290 3.343 -0.482 0.00 0.00 H+0 HETATM 79 H UNK 0 -6.905 -2.095 1.320 0.00 0.00 H+0 HETATM 80 H UNK 0 -11.637 -2.272 1.488 0.00 0.00 H+0 HETATM 81 H UNK 0 -11.945 -2.258 -0.266 0.00 0.00 H+0 HETATM 82 H UNK 0 -13.087 -0.573 1.906 0.00 0.00 H+0 HETATM 83 H UNK 0 -13.687 -0.794 0.204 0.00 0.00 H+0 HETATM 84 H UNK 0 -12.233 -0.705 -1.612 0.00 0.00 H+0 HETATM 85 H UNK 0 -10.602 -0.139 -2.265 0.00 0.00 H+0 HETATM 86 H UNK 0 -11.984 1.009 -2.109 0.00 0.00 H+0 HETATM 87 H UNK 0 -10.220 2.153 -1.145 0.00 0.00 H+0 HETATM 88 H UNK 0 -10.534 2.256 0.644 0.00 0.00 H+0 HETATM 89 H UNK 0 -6.091 3.965 -1.099 0.00 0.00 H+0 HETATM 90 H UNK 0 -6.058 4.222 0.643 0.00 0.00 H+0 HETATM 91 H UNK 0 -3.913 3.381 -1.210 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.219 4.717 -0.890 0.00 0.00 H+0 HETATM 93 H UNK 0 -1.786 5.198 0.757 0.00 0.00 H+0 HETATM 94 H UNK 0 1.710 -0.406 3.241 0.00 0.00 H+0 HETATM 95 H UNK 0 1.520 1.651 1.994 0.00 0.00 H+0 HETATM 96 H UNK 0 7.243 -0.480 1.177 0.00 0.00 H+0 HETATM 97 H UNK 0 7.780 -2.339 2.319 0.00 0.00 H+0 HETATM 98 H UNK 0 6.089 -2.798 2.410 0.00 0.00 H+0 HETATM 99 H UNK 0 7.103 -3.424 1.091 0.00 0.00 H+0 HETATM 100 H UNK 0 8.503 0.560 -4.935 0.00 0.00 H+0 HETATM 101 H UNK 0 6.913 2.180 -4.623 0.00 0.00 H+0 HETATM 102 H UNK 0 7.084 2.281 -2.841 0.00 0.00 H+0 HETATM 103 H UNK 0 6.191 0.874 -3.645 0.00 0.00 H+0 HETATM 104 H UNK 0 9.146 2.624 -3.062 0.00 0.00 H+0 HETATM 105 H UNK 0 11.215 2.289 -4.119 0.00 0.00 H+0 CONECT 1 2 59 60 61 CONECT 2 1 3 CONECT 3 2 4 57 62 CONECT 4 3 5 63 64 CONECT 5 4 6 54 65 CONECT 6 5 7 CONECT 7 6 8 52 66 CONECT 8 7 9 67 68 CONECT 9 8 10 69 70 CONECT 10 9 11 51 71 CONECT 11 10 12 CONECT 12 11 13 49 72 CONECT 13 12 14 73 74 CONECT 14 13 15 16 75 CONECT 15 14 76 CONECT 16 14 17 26 CONECT 17 16 18 49 CONECT 18 17 19 CONECT 19 18 20 25 CONECT 20 19 21 48 CONECT 21 20 22 45 CONECT 22 21 23 28 CONECT 23 22 24 25 CONECT 24 23 77 CONECT 25 23 26 19 CONECT 26 25 27 16 CONECT 27 26 CONECT 28 22 29 33 CONECT 29 28 30 44 CONECT 30 29 31 78 CONECT 31 30 32 43 CONECT 32 31 33 35 CONECT 33 32 34 28 CONECT 34 33 79 CONECT 35 32 36 37 CONECT 36 35 CONECT 37 35 38 41 CONECT 38 37 39 80 81 CONECT 39 38 40 82 83 CONECT 40 39 41 CONECT 41 40 42 43 37 CONECT 42 41 84 85 86 CONECT 43 41 31 87 88 CONECT 44 29 45 89 90 CONECT 45 44 46 21 91 CONECT 46 45 47 CONECT 47 46 48 92 93 CONECT 48 47 20 CONECT 49 17 50 12 94 CONECT 50 49 95 CONECT 51 10 52 CONECT 52 51 53 7 96 CONECT 53 52 97 98 99 CONECT 54 5 55 CONECT 55 54 56 57 100 CONECT 56 55 101 102 103 CONECT 57 55 58 3 104 CONECT 58 57 105 CONECT 59 1 CONECT 60 1 CONECT 61 1 CONECT 62 3 CONECT 63 4 CONECT 64 4 CONECT 65 5 CONECT 66 7 CONECT 67 8 CONECT 68 8 CONECT 69 9 CONECT 70 9 CONECT 71 10 CONECT 72 12 CONECT 73 13 CONECT 74 13 CONECT 75 14 CONECT 76 15 CONECT 77 24 CONECT 78 30 CONECT 79 34 CONECT 80 38 CONECT 81 38 CONECT 82 39 CONECT 83 39 CONECT 84 42 CONECT 85 42 CONECT 86 42 CONECT 87 43 CONECT 88 43 CONECT 89 44 CONECT 90 44 CONECT 91 45 CONECT 92 47 CONECT 93 47 CONECT 94 49 CONECT 95 50 CONECT 96 52 CONECT 97 53 CONECT 98 53 CONECT 99 53 CONECT 100 55 CONECT 101 56 CONECT 102 56 CONECT 103 56 CONECT 104 57 CONECT 105 58 MASTER 0 0 0 0 0 0 0 0 105 0 228 0 END