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 N UNK 0 12.639 0.938 5.508 0.00 0.00 N+0 HETATM 2 C UNK 0 12.516 0.228 4.237 0.00 0.00 C+0 HETATM 3 C UNK 0 12.103 1.196 3.148 0.00 0.00 C+0 HETATM 4 C UNK 0 11.992 0.392 1.845 0.00 0.00 C+0 HETATM 5 C UNK 0 11.582 1.323 0.731 0.00 0.00 C+0 HETATM 6 N UNK 0 12.603 2.375 0.589 0.00 0.00 N+0 HETATM 7 C UNK 0 11.409 0.677 -0.591 0.00 0.00 C+0 HETATM 8 C UNK 0 10.331 -0.359 -0.524 0.00 0.00 C+0 HETATM 9 O UNK 0 9.616 -0.420 0.529 0.00 0.00 O+0 HETATM 10 N UNK 0 10.156 -1.220 -1.627 0.00 0.00 N+0 HETATM 11 C UNK 0 9.222 -2.235 -1.839 0.00 0.00 C+0 HETATM 12 C UNK 0 7.838 -1.979 -2.153 0.00 0.00 C+0 HETATM 13 C UNK 0 6.872 -1.202 -1.409 0.00 0.00 C+0 HETATM 14 C UNK 0 6.972 0.257 -1.246 0.00 0.00 C+0 HETATM 15 N UNK 0 7.001 0.867 -2.614 0.00 0.00 N+0 HETATM 16 C UNK 0 5.663 0.814 -0.607 0.00 0.00 C+0 HETATM 17 C UNK 0 4.506 0.604 -1.493 0.00 0.00 C+0 HETATM 18 O UNK 0 4.716 0.214 -2.681 0.00 0.00 O+0 HETATM 19 N UNK 0 3.147 0.808 -1.127 0.00 0.00 N+0 HETATM 20 C UNK 0 2.120 0.581 -2.094 0.00 0.00 C+0 HETATM 21 C UNK 0 0.730 0.817 -1.593 0.00 0.00 C+0 HETATM 22 C UNK 0 -0.261 0.617 -2.708 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.663 0.829 -2.301 0.00 0.00 C+0 HETATM 24 N UNK 0 -2.473 0.632 -3.546 0.00 0.00 N+0 HETATM 25 C UNK 0 -2.203 -0.209 -1.315 0.00 0.00 C+0 HETATM 26 C UNK 0 -3.629 0.145 -0.990 0.00 0.00 C+0 HETATM 27 O UNK 0 -4.021 1.299 -1.238 0.00 0.00 O+0 HETATM 28 N UNK 0 -4.474 -0.839 -0.419 0.00 0.00 N+0 HETATM 29 C UNK 0 -5.865 -0.533 -0.080 0.00 0.00 C+0 HETATM 30 C UNK 0 -6.779 -0.939 -1.162 0.00 0.00 C+0 HETATM 31 N UNK 0 -7.626 0.168 -1.615 0.00 0.00 N+0 HETATM 32 C UNK 0 -8.645 0.752 -0.801 0.00 0.00 C+0 HETATM 33 N UNK 0 -9.931 0.543 -0.976 0.00 0.00 N+0 HETATM 34 C UNK 0 -10.656 1.257 -0.014 0.00 0.00 C+0 HETATM 35 C UNK 0 -11.872 1.983 -0.477 0.00 0.00 C+0 HETATM 36 O UNK 0 -12.553 1.730 -1.467 0.00 0.00 O+0 HETATM 37 N UNK 0 -12.203 3.070 0.382 0.00 0.00 N+0 HETATM 38 C UNK 0 -11.618 3.019 1.719 0.00 0.00 C+0 HETATM 39 C UNK 0 -10.098 2.878 1.679 0.00 0.00 C+0 HETATM 40 O UNK 0 -9.622 2.036 2.686 0.00 0.00 O+0 HETATM 41 C UNK 0 -9.694 2.407 0.322 0.00 0.00 C+0 HETATM 42 N UNK 0 -8.454 1.650 0.282 0.00 0.00 N+0 HETATM 43 O UNK 0 -7.553 -2.017 -1.072 0.00 0.00 O+0 HETATM 44 C UNK 0 -7.638 -2.763 0.071 0.00 0.00 C+0 HETATM 45 C UNK 0 -9.086 -2.851 0.419 0.00 0.00 C+0 HETATM 46 O UNK 0 -9.534 -3.477 1.523 0.00 0.00 O+0 HETATM 47 C UNK 0 -9.538 -3.171 2.850 0.00 0.00 C+0 HETATM 48 N UNK 0 -10.061 -4.064 3.847 0.00 0.00 N+0 HETATM 49 O UNK 0 -9.076 -2.078 3.258 0.00 0.00 O+0 HETATM 50 C UNK 0 -6.717 -2.463 1.145 0.00 0.00 C+0 HETATM 51 O UNK 0 -5.477 -3.173 0.898 0.00 0.00 O+0 HETATM 52 C UNK 0 -6.287 -1.029 1.247 0.00 0.00 C+0 HETATM 53 O UNK 0 -5.176 -1.013 2.109 0.00 0.00 O+0 HETATM 54 H UNK 0 13.659 1.110 5.715 0.00 0.00 H+0 HETATM 55 H UNK 0 12.295 0.298 6.255 0.00 0.00 H+0 HETATM 56 H UNK 0 11.716 -0.535 4.287 0.00 0.00 H+0 HETATM 57 H UNK 0 13.508 -0.186 3.933 0.00 0.00 H+0 HETATM 58 H UNK 0 12.814 2.011 2.984 0.00 0.00 H+0 HETATM 59 H UNK 0 11.142 1.634 3.458 0.00 0.00 H+0 HETATM 60 H UNK 0 13.040 0.052 1.627 0.00 0.00 H+0 HETATM 61 H UNK 0 11.351 -0.486 1.980 0.00 0.00 H+0 HETATM 62 H UNK 0 10.643 1.838 1.047 0.00 0.00 H+0 HETATM 63 H UNK 0 13.238 2.085 -0.211 0.00 0.00 H+0 HETATM 64 H UNK 0 12.120 3.236 0.291 0.00 0.00 H+0 HETATM 65 H UNK 0 12.350 0.160 -0.942 0.00 0.00 H+0 HETATM 66 H UNK 0 11.126 1.473 -1.338 0.00 0.00 H+0 HETATM 67 H UNK 0 10.871 -1.042 -2.428 0.00 0.00 H+0 HETATM 68 H UNK 0 9.657 -2.994 -2.602 0.00 0.00 H+0 HETATM 69 H UNK 0 9.237 -2.896 -0.862 0.00 0.00 H+0 HETATM 70 H UNK 0 7.305 -3.028 -2.309 0.00 0.00 H+0 HETATM 71 H UNK 0 7.835 -1.606 -3.279 0.00 0.00 H+0 HETATM 72 H UNK 0 5.819 -1.439 -1.763 0.00 0.00 H+0 HETATM 73 H UNK 0 6.858 -1.660 -0.332 0.00 0.00 H+0 HETATM 74 H UNK 0 7.763 0.654 -0.684 0.00 0.00 H+0 HETATM 75 H UNK 0 7.926 1.339 -2.735 0.00 0.00 H+0 HETATM 76 H UNK 0 6.919 0.142 -3.344 0.00 0.00 H+0 HETATM 77 H UNK 0 5.533 0.321 0.381 0.00 0.00 H+0 HETATM 78 H UNK 0 5.803 1.905 -0.414 0.00 0.00 H+0 HETATM 79 H UNK 0 2.903 1.125 -0.160 0.00 0.00 H+0 HETATM 80 H UNK 0 2.251 1.216 -3.012 0.00 0.00 H+0 HETATM 81 H UNK 0 2.172 -0.505 -2.408 0.00 0.00 H+0 HETATM 82 H UNK 0 0.644 1.864 -1.243 0.00 0.00 H+0 HETATM 83 H UNK 0 0.555 0.101 -0.760 0.00 0.00 H+0 HETATM 84 H UNK 0 -0.114 -0.369 -3.219 0.00 0.00 H+0 HETATM 85 H UNK 0 -0.021 1.369 -3.499 0.00 0.00 H+0 HETATM 86 H UNK 0 -1.827 1.827 -1.891 0.00 0.00 H+0 HETATM 87 H UNK 0 -3.449 0.351 -3.290 0.00 0.00 H+0 HETATM 88 H UNK 0 -2.016 -0.208 -4.020 0.00 0.00 H+0 HETATM 89 H UNK 0 -1.612 -0.231 -0.394 0.00 0.00 H+0 HETATM 90 H UNK 0 -2.228 -1.201 -1.794 0.00 0.00 H+0 HETATM 91 H UNK 0 -4.111 -1.777 -0.242 0.00 0.00 H+0 HETATM 92 H UNK 0 -5.920 0.625 -0.056 0.00 0.00 H+0 HETATM 93 H UNK 0 -6.101 -1.119 -2.079 0.00 0.00 H+0 HETATM 94 H UNK 0 -7.486 0.565 -2.584 0.00 0.00 H+0 HETATM 95 H UNK 0 -10.887 0.688 0.918 0.00 0.00 H+0 HETATM 96 H UNK 0 -12.814 3.866 0.116 0.00 0.00 H+0 HETATM 97 H UNK 0 -11.965 3.822 2.374 0.00 0.00 H+0 HETATM 98 H UNK 0 -11.982 2.050 2.181 0.00 0.00 H+0 HETATM 99 H UNK 0 -9.687 3.893 1.851 0.00 0.00 H+0 HETATM 100 H UNK 0 -10.356 1.605 3.210 0.00 0.00 H+0 HETATM 101 H UNK 0 -9.708 3.170 -0.458 0.00 0.00 H+0 HETATM 102 H UNK 0 -7.661 1.772 0.908 0.00 0.00 H+0 HETATM 103 H UNK 0 -7.388 -3.833 -0.303 0.00 0.00 H+0 HETATM 104 H UNK 0 -9.680 -3.240 -0.487 0.00 0.00 H+0 HETATM 105 H UNK 0 -9.520 -1.776 0.458 0.00 0.00 H+0 HETATM 106 H UNK 0 -9.484 -4.630 4.472 0.00 0.00 H+0 HETATM 107 H UNK 0 -11.098 -4.124 3.922 0.00 0.00 H+0 HETATM 108 H UNK 0 -6.953 -2.822 2.160 0.00 0.00 H+0 HETATM 109 H UNK 0 -5.679 -4.143 0.910 0.00 0.00 H+0 HETATM 110 H UNK 0 -7.101 -0.391 1.660 0.00 0.00 H+0 HETATM 111 H UNK 0 -5.460 -0.997 3.064 0.00 0.00 H+0 CONECT 1 2 54 55 CONECT 2 1 3 56 57 CONECT 3 2 4 58 59 CONECT 4 3 5 60 61 CONECT 5 4 6 7 62 CONECT 6 5 63 64 CONECT 7 5 8 65 66 CONECT 8 7 9 10 CONECT 9 8 CONECT 10 8 11 67 CONECT 11 10 12 68 69 CONECT 12 11 13 70 71 CONECT 13 12 14 72 73 CONECT 14 13 15 16 74 CONECT 15 14 75 76 CONECT 16 14 17 77 78 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 79 CONECT 20 19 21 80 81 CONECT 21 20 22 82 83 CONECT 22 21 23 84 85 CONECT 23 22 24 25 86 CONECT 24 23 87 88 CONECT 25 23 26 89 90 CONECT 26 25 27 28 CONECT 27 26 CONECT 28 26 29 91 CONECT 29 28 30 52 92 CONECT 30 29 31 43 93 CONECT 31 30 32 94 CONECT 32 31 33 42 CONECT 33 32 34 CONECT 34 33 35 41 95 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 96 CONECT 38 37 39 97 98 CONECT 39 38 40 41 99 CONECT 40 39 100 CONECT 41 39 42 34 101 CONECT 42 41 32 102 CONECT 43 30 44 CONECT 44 43 45 50 103 CONECT 45 44 46 104 105 CONECT 46 45 47 CONECT 47 46 48 49 CONECT 48 47 106 107 CONECT 49 47 CONECT 50 44 51 52 108 CONECT 51 50 109 CONECT 52 50 53 29 110 CONECT 53 52 111 CONECT 54 1 CONECT 55 1 CONECT 56 2 CONECT 57 2 CONECT 58 3 CONECT 59 3 CONECT 60 4 CONECT 61 4 CONECT 62 5 CONECT 63 6 CONECT 64 6 CONECT 65 7 CONECT 66 7 CONECT 67 10 CONECT 68 11 CONECT 69 11 CONECT 70 12 CONECT 71 12 CONECT 72 13 CONECT 73 13 CONECT 74 14 CONECT 75 15 CONECT 76 15 CONECT 77 16 CONECT 78 16 CONECT 79 19 CONECT 80 20 CONECT 81 20 CONECT 82 21 CONECT 83 21 CONECT 84 22 CONECT 85 22 CONECT 86 23 CONECT 87 24 CONECT 88 24 CONECT 89 25 CONECT 90 25 CONECT 91 28 CONECT 92 29 CONECT 93 30 CONECT 94 31 CONECT 95 34 CONECT 96 37 CONECT 97 38 CONECT 98 38 CONECT 99 39 CONECT 100 40 CONECT 101 41 CONECT 102 42 CONECT 103 44 CONECT 104 45 CONECT 105 45 CONECT 106 48 CONECT 107 48 CONECT 108 50 CONECT 109 51 CONECT 110 52 CONECT 111 53 MASTER 0 0 0 0 0 0 0 0 111 0 226 0 END