HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 -0.856 -4.105 -1.340 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.716 -2.851 -1.101 0.00 0.00 C+0 HETATM 3 C UNK 0 -3.120 -3.266 -1.506 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.589 -2.549 0.362 0.00 0.00 C+0 HETATM 5 O UNK 0 -2.087 -3.647 1.062 0.00 0.00 O+0 HETATM 6 C UNK 0 -2.284 -1.298 0.816 0.00 0.00 C+0 HETATM 7 N UNK 0 -3.698 -1.325 0.558 0.00 0.00 N+0 HETATM 8 C UNK 0 -4.645 -1.621 1.558 0.00 0.00 C+0 HETATM 9 O UNK 0 -4.253 -1.878 2.713 0.00 0.00 O+0 HETATM 10 C UNK 0 -6.083 -1.626 1.247 0.00 0.00 C+0 HETATM 11 C UNK 0 -6.458 -2.607 0.152 0.00 0.00 C+0 HETATM 12 O UNK 0 -6.760 -2.058 2.415 0.00 0.00 O+0 HETATM 13 C UNK 0 -6.586 -0.239 0.890 0.00 0.00 C+0 HETATM 14 C UNK 0 -6.306 0.769 1.952 0.00 0.00 C+0 HETATM 15 C UNK 0 -6.521 2.151 1.321 0.00 0.00 C+0 HETATM 16 C UNK 0 -7.455 1.916 0.148 0.00 0.00 C+0 HETATM 17 C UNK 0 -8.534 0.960 0.639 0.00 0.00 C+0 HETATM 18 C UNK 0 -9.752 0.950 -0.228 0.00 0.00 C+0 HETATM 19 O UNK 0 -7.968 -0.318 0.673 0.00 0.00 O+0 HETATM 20 C UNK 0 -6.645 1.189 -0.911 0.00 0.00 C+0 HETATM 21 C UNK 0 -5.709 2.108 -1.631 0.00 0.00 C+0 HETATM 22 O UNK 0 -5.942 0.162 -0.274 0.00 0.00 O+0 HETATM 23 C UNK 0 -1.610 -0.068 0.333 0.00 0.00 C+0 HETATM 24 O UNK 0 -1.973 0.471 -0.751 0.00 0.00 O+0 HETATM 25 N UNK 0 -0.567 0.531 1.048 0.00 0.00 N+0 HETATM 26 N UNK 0 -0.170 -0.076 2.282 0.00 0.00 N+0 HETATM 27 C UNK 0 0.000 1.018 3.257 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.877 2.196 2.870 0.00 0.00 C+0 HETATM 29 C UNK 0 -0.445 2.836 1.559 0.00 0.00 C+0 HETATM 30 C UNK 0 0.150 1.735 0.708 0.00 0.00 C+0 HETATM 31 C UNK 0 0.165 2.049 -0.722 0.00 0.00 C+0 HETATM 32 O UNK 0 -0.531 3.016 -1.115 0.00 0.00 O+0 HETATM 33 N UNK 0 0.929 1.315 -1.676 0.00 0.00 N+0 HETATM 34 O UNK 0 0.891 1.656 -2.978 0.00 0.00 O+0 HETATM 35 C UNK 0 1.756 0.207 -1.275 0.00 0.00 C+0 HETATM 36 C UNK 0 1.327 -1.026 -1.992 0.00 0.00 C+0 HETATM 37 C UNK 0 3.183 0.550 -1.547 0.00 0.00 C+0 HETATM 38 O UNK 0 3.443 1.661 -2.051 0.00 0.00 O+0 HETATM 39 N UNK 0 4.235 -0.353 -1.245 0.00 0.00 N+0 HETATM 40 N UNK 0 3.925 -1.575 -0.703 0.00 0.00 N+0 HETATM 41 C UNK 0 5.023 -2.381 -0.294 0.00 0.00 C+0 HETATM 42 C UNK 0 6.170 -2.416 -1.259 0.00 0.00 C+0 HETATM 43 C UNK 0 6.264 -1.179 -2.113 0.00 0.00 C+0 HETATM 44 C UNK 0 5.617 0.015 -1.498 0.00 0.00 C+0 HETATM 45 C UNK 0 6.271 0.545 -0.297 0.00 0.00 C+0 HETATM 46 O UNK 0 5.631 0.644 0.810 0.00 0.00 O+0 HETATM 47 N UNK 0 7.618 0.967 -0.291 0.00 0.00 N+0 HETATM 48 N UNK 0 8.423 0.900 -1.427 0.00 0.00 N+0 HETATM 49 C UNK 0 9.594 0.128 -1.147 0.00 0.00 C+0 HETATM 50 C UNK 0 10.421 0.773 -0.083 0.00 0.00 C+0 HETATM 51 C UNK 0 9.664 1.863 0.609 0.00 0.00 C+0 HETATM 52 C UNK 0 8.244 1.510 0.907 0.00 0.00 C+0 HETATM 53 C UNK 0 7.553 2.798 1.262 0.00 0.00 C+0 HETATM 54 O UNK 0 7.872 3.494 2.252 0.00 0.00 O+0 HETATM 55 O UNK 0 6.497 3.270 0.465 0.00 0.00 O+0 HETATM 56 H UNK 0 -0.643 -4.239 -2.418 0.00 0.00 H+0 HETATM 57 H UNK 0 -1.422 -5.008 -1.005 0.00 0.00 H+0 HETATM 58 H UNK 0 0.080 -4.052 -0.722 0.00 0.00 H+0 HETATM 59 H UNK 0 -1.327 -2.071 -1.751 0.00 0.00 H+0 HETATM 60 H UNK 0 -3.538 -2.542 -2.224 0.00 0.00 H+0 HETATM 61 H UNK 0 -3.120 -4.244 -2.077 0.00 0.00 H+0 HETATM 62 H UNK 0 -3.774 -3.459 -0.633 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.506 -2.399 0.564 0.00 0.00 H+0 HETATM 64 H UNK 0 -1.339 -4.005 1.623 0.00 0.00 H+0 HETATM 65 H UNK 0 -2.177 -1.326 1.951 0.00 0.00 H+0 HETATM 66 H UNK 0 -4.018 -1.113 -0.400 0.00 0.00 H+0 HETATM 67 H UNK 0 -6.078 -3.626 0.368 0.00 0.00 H+0 HETATM 68 H UNK 0 -7.561 -2.687 0.139 0.00 0.00 H+0 HETATM 69 H UNK 0 -6.129 -2.242 -0.845 0.00 0.00 H+0 HETATM 70 H UNK 0 -7.235 -1.298 2.787 0.00 0.00 H+0 HETATM 71 H UNK 0 -5.246 0.709 2.246 0.00 0.00 H+0 HETATM 72 H UNK 0 -6.998 0.724 2.818 0.00 0.00 H+0 HETATM 73 H UNK 0 -5.580 2.628 1.050 0.00 0.00 H+0 HETATM 74 H UNK 0 -7.067 2.829 2.020 0.00 0.00 H+0 HETATM 75 H UNK 0 -7.911 2.828 -0.240 0.00 0.00 H+0 HETATM 76 H UNK 0 -8.811 1.303 1.667 0.00 0.00 H+0 HETATM 77 H UNK 0 -9.923 -0.069 -0.650 0.00 0.00 H+0 HETATM 78 H UNK 0 -9.644 1.641 -1.103 0.00 0.00 H+0 HETATM 79 H UNK 0 -10.673 1.276 0.306 0.00 0.00 H+0 HETATM 80 H UNK 0 -7.375 0.794 -1.654 0.00 0.00 H+0 HETATM 81 H UNK 0 -5.360 2.951 -1.009 0.00 0.00 H+0 HETATM 82 H UNK 0 -6.244 2.592 -2.497 0.00 0.00 H+0 HETATM 83 H UNK 0 -4.855 1.560 -2.072 0.00 0.00 H+0 HETATM 84 H UNK 0 0.770 -0.507 2.173 0.00 0.00 H+0 HETATM 85 H UNK 0 1.071 1.279 3.338 0.00 0.00 H+0 HETATM 86 H UNK 0 -0.388 0.626 4.217 0.00 0.00 H+0 HETATM 87 H UNK 0 -1.915 1.824 2.804 0.00 0.00 H+0 HETATM 88 H UNK 0 -0.769 2.957 3.661 0.00 0.00 H+0 HETATM 89 H UNK 0 -1.333 3.305 1.112 0.00 0.00 H+0 HETATM 90 H UNK 0 0.368 3.587 1.749 0.00 0.00 H+0 HETATM 91 H UNK 0 1.202 1.596 1.095 0.00 0.00 H+0 HETATM 92 H UNK 0 1.411 2.507 -3.065 0.00 0.00 H+0 HETATM 93 H UNK 0 1.660 0.034 -0.164 0.00 0.00 H+0 HETATM 94 H UNK 0 2.141 -1.388 -2.688 0.00 0.00 H+0 HETATM 95 H UNK 0 1.017 -1.849 -1.319 0.00 0.00 H+0 HETATM 96 H UNK 0 0.473 -0.789 -2.649 0.00 0.00 H+0 HETATM 97 H UNK 0 3.337 -1.385 0.165 0.00 0.00 H+0 HETATM 98 H UNK 0 5.401 -2.114 0.737 0.00 0.00 H+0 HETATM 99 H UNK 0 4.652 -3.436 -0.188 0.00 0.00 H+0 HETATM 100 H UNK 0 6.135 -3.334 -1.894 0.00 0.00 H+0 HETATM 101 H UNK 0 7.109 -2.483 -0.672 0.00 0.00 H+0 HETATM 102 H UNK 0 7.260 -0.928 -2.463 0.00 0.00 H+0 HETATM 103 H UNK 0 5.666 -1.413 -3.044 0.00 0.00 H+0 HETATM 104 H UNK 0 5.623 0.832 -2.255 0.00 0.00 H+0 HETATM 105 H UNK 0 8.637 1.883 -1.717 0.00 0.00 H+0 HETATM 106 H UNK 0 9.262 -0.893 -0.834 0.00 0.00 H+0 HETATM 107 H UNK 0 10.164 -0.034 -2.095 0.00 0.00 H+0 HETATM 108 H UNK 0 10.770 -0.021 0.613 0.00 0.00 H+0 HETATM 109 H UNK 0 11.341 1.182 -0.552 0.00 0.00 H+0 HETATM 110 H UNK 0 10.170 2.054 1.599 0.00 0.00 H+0 HETATM 111 H UNK 0 9.673 2.792 -0.010 0.00 0.00 H+0 HETATM 112 H UNK 0 8.164 0.772 1.732 0.00 0.00 H+0 HETATM 113 H UNK 0 5.676 3.579 0.964 0.00 0.00 H+0 CONECT 1 2 56 57 58 CONECT 2 1 3 4 59 CONECT 3 2 60 61 62 CONECT 4 2 5 6 63 CONECT 5 4 64 CONECT 6 4 7 23 65 CONECT 7 6 8 66 CONECT 8 7 9 10 CONECT 9 8 CONECT 10 8 11 12 13 CONECT 11 10 67 68 69 CONECT 12 10 70 CONECT 13 10 14 19 22 CONECT 14 13 15 71 72 CONECT 15 14 16 73 74 CONECT 16 15 17 20 75 CONECT 17 16 18 19 76 CONECT 18 17 77 78 79 CONECT 19 17 13 CONECT 20 16 21 22 80 CONECT 21 20 81 82 83 CONECT 22 20 13 CONECT 23 6 24 25 CONECT 24 23 CONECT 25 23 26 30 CONECT 26 25 27 84 CONECT 27 26 28 85 86 CONECT 28 27 29 87 88 CONECT 29 28 30 89 90 CONECT 30 29 31 25 91 CONECT 31 30 32 33 CONECT 32 31 CONECT 33 31 34 35 CONECT 34 33 92 CONECT 35 33 36 37 93 CONECT 36 35 94 95 96 CONECT 37 35 38 39 CONECT 38 37 CONECT 39 37 40 44 CONECT 40 39 41 97 CONECT 41 40 42 98 99 CONECT 42 41 43 100 101 CONECT 43 42 44 102 103 CONECT 44 43 45 39 104 CONECT 45 44 46 47 CONECT 46 45 CONECT 47 45 48 52 CONECT 48 47 49 105 CONECT 49 48 50 106 107 CONECT 50 49 51 108 109 CONECT 51 50 52 110 111 CONECT 52 51 53 47 112 CONECT 53 52 54 55 CONECT 54 53 CONECT 55 53 113 CONECT 56 1 CONECT 57 1 CONECT 58 1 CONECT 59 2 CONECT 60 3 CONECT 61 3 CONECT 62 3 CONECT 63 4 CONECT 64 5 CONECT 65 6 CONECT 66 7 CONECT 67 11 CONECT 68 11 CONECT 69 11 CONECT 70 12 CONECT 71 14 CONECT 72 14 CONECT 73 15 CONECT 74 15 CONECT 75 16 CONECT 76 17 CONECT 77 18 CONECT 78 18 CONECT 79 18 CONECT 80 20 CONECT 81 21 CONECT 82 21 CONECT 83 21 CONECT 84 26 CONECT 85 27 CONECT 86 27 CONECT 87 28 CONECT 88 28 CONECT 89 29 CONECT 90 29 CONECT 91 30 CONECT 92 34 CONECT 93 35 CONECT 94 36 CONECT 95 36 CONECT 96 36 CONECT 97 40 CONECT 98 41 CONECT 99 41 CONECT 100 42 CONECT 101 42 CONECT 102 43 CONECT 103 43 CONECT 104 44 CONECT 105 48 CONECT 106 49 CONECT 107 49 CONECT 108 50 CONECT 109 50 CONECT 110 51 CONECT 111 51 CONECT 112 52 CONECT 113 55 MASTER 0 0 0 0 0 0 0 0 113 0 234 0 END