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 -7.692 2.862 -0.657 0.00 0.00 C+0 HETATM 2 C UNK 0 -8.587 1.846 -0.022 0.00 0.00 C+0 HETATM 3 C UNK 0 -8.347 0.497 -0.745 0.00 0.00 C+0 HETATM 4 C UNK 0 -9.200 -0.524 -0.157 0.00 0.00 C+0 HETATM 5 O UNK 0 -9.876 -0.266 0.865 0.00 0.00 O+0 HETATM 6 O UNK 0 -9.290 -1.786 -0.695 0.00 0.00 O+0 HETATM 7 C UNK 0 -6.843 0.198 -0.639 0.00 0.00 C+0 HETATM 8 C UNK 0 -6.549 -1.072 -1.320 0.00 0.00 C+0 HETATM 9 C UNK 0 -6.119 -2.221 -0.468 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.083 -1.599 0.514 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.663 -2.778 1.362 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.722 -0.535 1.304 0.00 0.00 C+0 HETATM 13 C UNK 0 -4.885 0.025 2.393 0.00 0.00 C+0 HETATM 14 C UNK 0 -5.779 1.106 3.075 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.622 0.722 2.075 0.00 0.00 C+0 HETATM 16 O UNK 0 -3.898 1.763 1.212 0.00 0.00 O+0 HETATM 17 C UNK 0 -2.366 -0.010 1.922 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.030 -0.762 3.263 0.00 0.00 C+0 HETATM 19 C UNK 0 -1.144 0.698 1.545 0.00 0.00 C+0 HETATM 20 O UNK 0 -0.282 0.697 2.505 0.00 0.00 O+0 HETATM 21 C UNK 0 -0.668 1.391 0.378 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.395 2.607 -0.126 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.449 3.724 0.890 0.00 0.00 C+0 HETATM 24 C UNK 0 -0.218 0.504 -0.798 0.00 0.00 C+0 HETATM 25 O UNK 0 0.778 -0.282 -0.326 0.00 0.00 O+0 HETATM 26 C UNK 0 1.361 -1.205 -1.188 0.00 0.00 C+0 HETATM 27 C UNK 0 1.113 -2.511 -0.550 0.00 0.00 C+0 HETATM 28 C UNK 0 1.966 -3.490 -0.679 0.00 0.00 C+0 HETATM 29 C UNK 0 3.192 -3.268 -1.479 0.00 0.00 C+0 HETATM 30 O UNK 0 4.178 -4.086 -0.905 0.00 0.00 O+0 HETATM 31 C UNK 0 3.629 -1.829 -1.444 0.00 0.00 C+0 HETATM 32 C UNK 0 4.400 -1.560 -2.717 0.00 0.00 C+0 HETATM 33 C UNK 0 5.354 -0.470 -2.215 0.00 0.00 C+0 HETATM 34 C UNK 0 5.618 -0.960 -0.827 0.00 0.00 C+0 HETATM 35 C UNK 0 6.927 -1.726 -0.886 0.00 0.00 C+0 HETATM 36 C UNK 0 5.883 0.210 0.133 0.00 0.00 C+0 HETATM 37 C UNK 0 6.046 -0.326 1.507 0.00 0.00 C+0 HETATM 38 C UNK 0 7.411 -0.193 2.103 0.00 0.00 C+0 HETATM 39 C UNK 0 8.072 1.112 1.802 0.00 0.00 C+0 HETATM 40 O UNK 0 7.964 1.995 2.902 0.00 0.00 O+0 HETATM 41 C UNK 0 9.559 0.865 1.630 0.00 0.00 C+0 HETATM 42 C UNK 0 10.341 2.098 1.326 0.00 0.00 C+0 HETATM 43 C UNK 0 7.471 1.814 0.627 0.00 0.00 C+0 HETATM 44 C UNK 0 6.431 2.814 1.097 0.00 0.00 C+0 HETATM 45 O UNK 0 6.957 0.947 -0.325 0.00 0.00 O+0 HETATM 46 O UNK 0 4.563 -1.701 -0.415 0.00 0.00 O+0 HETATM 47 O UNK 0 2.670 -0.917 -1.282 0.00 0.00 O+0 HETATM 48 C UNK 0 0.653 -1.268 -2.531 0.00 0.00 C+0 HETATM 49 C UNK 0 1.105 -0.236 -3.487 0.00 0.00 C+0 HETATM 50 C UNK 0 -0.810 -1.371 -2.283 0.00 0.00 C+0 HETATM 51 C UNK 0 -1.301 -0.102 -1.588 0.00 0.00 C+0 HETATM 52 C UNK 0 -1.852 0.765 -2.708 0.00 0.00 C+0 HETATM 53 O UNK 0 -6.342 0.452 0.583 0.00 0.00 O+0 HETATM 54 H UNK 0 -7.586 2.663 -1.757 0.00 0.00 H+0 HETATM 55 H UNK 0 -6.681 2.790 -0.214 0.00 0.00 H+0 HETATM 56 H UNK 0 -8.101 3.891 -0.567 0.00 0.00 H+0 HETATM 57 H UNK 0 -8.415 1.723 1.057 0.00 0.00 H+0 HETATM 58 H UNK 0 -9.659 2.076 -0.203 0.00 0.00 H+0 HETATM 59 H UNK 0 -8.538 0.709 -1.814 0.00 0.00 H+0 HETATM 60 H UNK 0 -10.033 -2.001 -1.372 0.00 0.00 H+0 HETATM 61 H UNK 0 -6.405 1.019 -1.306 0.00 0.00 H+0 HETATM 62 H UNK 0 -7.420 -1.387 -1.953 0.00 0.00 H+0 HETATM 63 H UNK 0 -5.715 -0.942 -2.083 0.00 0.00 H+0 HETATM 64 H UNK 0 -6.869 -2.664 0.178 0.00 0.00 H+0 HETATM 65 H UNK 0 -5.604 -2.979 -1.054 0.00 0.00 H+0 HETATM 66 H UNK 0 -4.267 -1.301 -0.149 0.00 0.00 H+0 HETATM 67 H UNK 0 -3.837 -3.298 0.793 0.00 0.00 H+0 HETATM 68 H UNK 0 -5.464 -3.552 1.441 0.00 0.00 H+0 HETATM 69 H UNK 0 -4.225 -2.498 2.331 0.00 0.00 H+0 HETATM 70 H UNK 0 -6.590 -1.056 1.852 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.800 -0.746 3.191 0.00 0.00 H+0 HETATM 72 H UNK 0 -5.178 1.546 3.884 0.00 0.00 H+0 HETATM 73 H UNK 0 -6.004 1.862 2.305 0.00 0.00 H+0 HETATM 74 H UNK 0 -6.696 0.603 3.461 0.00 0.00 H+0 HETATM 75 H UNK 0 -3.383 1.372 3.066 0.00 0.00 H+0 HETATM 76 H UNK 0 -4.242 1.453 0.331 0.00 0.00 H+0 HETATM 77 H UNK 0 -2.547 -0.907 1.254 0.00 0.00 H+0 HETATM 78 H UNK 0 -1.329 -1.569 3.081 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.485 0.027 3.848 0.00 0.00 H+0 HETATM 80 H UNK 0 -2.930 -0.982 3.825 0.00 0.00 H+0 HETATM 81 H UNK 0 0.337 1.896 0.722 0.00 0.00 H+0 HETATM 82 H UNK 0 -2.290 2.441 -0.705 0.00 0.00 H+0 HETATM 83 H UNK 0 -0.663 3.030 -0.918 0.00 0.00 H+0 HETATM 84 H UNK 0 -2.431 4.220 0.928 0.00 0.00 H+0 HETATM 85 H UNK 0 -0.678 4.489 0.777 0.00 0.00 H+0 HETATM 86 H UNK 0 -1.304 3.233 1.888 0.00 0.00 H+0 HETATM 87 H UNK 0 0.310 1.271 -1.474 0.00 0.00 H+0 HETATM 88 H UNK 0 0.201 -2.700 0.055 0.00 0.00 H+0 HETATM 89 H UNK 0 1.765 -4.455 -0.198 0.00 0.00 H+0 HETATM 90 H UNK 0 3.085 -3.644 -2.526 0.00 0.00 H+0 HETATM 91 H UNK 0 3.814 -4.976 -0.722 0.00 0.00 H+0 HETATM 92 H UNK 0 3.835 -1.130 -3.531 0.00 0.00 H+0 HETATM 93 H UNK 0 4.966 -2.450 -3.057 0.00 0.00 H+0 HETATM 94 H UNK 0 6.260 -0.455 -2.853 0.00 0.00 H+0 HETATM 95 H UNK 0 4.812 0.492 -2.187 0.00 0.00 H+0 HETATM 96 H UNK 0 7.039 -2.310 -1.807 0.00 0.00 H+0 HETATM 97 H UNK 0 7.734 -0.936 -0.935 0.00 0.00 H+0 HETATM 98 H UNK 0 7.142 -2.297 0.042 0.00 0.00 H+0 HETATM 99 H UNK 0 4.969 0.842 0.087 0.00 0.00 H+0 HETATM 100 H UNK 0 5.286 0.092 2.228 0.00 0.00 H+0 HETATM 101 H UNK 0 5.813 -1.422 1.498 0.00 0.00 H+0 HETATM 102 H UNK 0 7.279 -0.255 3.224 0.00 0.00 H+0 HETATM 103 H UNK 0 8.085 -1.064 1.871 0.00 0.00 H+0 HETATM 104 H UNK 0 8.691 1.787 3.552 0.00 0.00 H+0 HETATM 105 H UNK 0 9.703 0.126 0.800 0.00 0.00 H+0 HETATM 106 H UNK 0 9.895 0.347 2.556 0.00 0.00 H+0 HETATM 107 H UNK 0 9.894 3.038 1.666 0.00 0.00 H+0 HETATM 108 H UNK 0 10.486 2.181 0.212 0.00 0.00 H+0 HETATM 109 H UNK 0 11.373 1.962 1.767 0.00 0.00 H+0 HETATM 110 H UNK 0 8.270 2.403 0.131 0.00 0.00 H+0 HETATM 111 H UNK 0 5.574 2.897 0.381 0.00 0.00 H+0 HETATM 112 H UNK 0 6.854 3.834 1.185 0.00 0.00 H+0 HETATM 113 H UNK 0 6.077 2.552 2.131 0.00 0.00 H+0 HETATM 114 H UNK 0 0.955 -2.274 -2.953 0.00 0.00 H+0 HETATM 115 H UNK 0 1.935 0.342 -2.975 0.00 0.00 H+0 HETATM 116 H UNK 0 1.641 -0.681 -4.381 0.00 0.00 H+0 HETATM 117 H UNK 0 0.366 0.437 -3.909 0.00 0.00 H+0 HETATM 118 H UNK 0 -0.950 -2.265 -1.605 0.00 0.00 H+0 HETATM 119 H UNK 0 -1.413 -1.599 -3.187 0.00 0.00 H+0 HETATM 120 H UNK 0 -2.108 -0.454 -0.923 0.00 0.00 H+0 HETATM 121 H UNK 0 -1.968 0.197 -3.674 0.00 0.00 H+0 HETATM 122 H UNK 0 -1.336 1.729 -2.819 0.00 0.00 H+0 HETATM 123 H UNK 0 -2.930 1.017 -2.468 0.00 0.00 H+0 CONECT 1 2 54 55 56 CONECT 2 1 3 57 58 CONECT 3 2 4 7 59 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 60 CONECT 7 3 8 53 61 CONECT 8 7 9 62 63 CONECT 9 8 10 64 65 CONECT 10 9 11 12 66 CONECT 11 10 67 68 69 CONECT 12 10 13 53 70 CONECT 13 12 14 15 71 CONECT 14 13 72 73 74 CONECT 15 13 16 17 75 CONECT 16 15 76 CONECT 17 15 18 19 77 CONECT 18 17 78 79 80 CONECT 19 17 20 21 CONECT 20 19 CONECT 21 19 22 24 81 CONECT 22 21 23 82 83 CONECT 23 22 84 85 86 CONECT 24 21 25 51 87 CONECT 25 24 26 CONECT 26 25 27 48 47 CONECT 27 26 28 88 CONECT 28 27 29 89 CONECT 29 28 30 31 90 CONECT 30 29 91 CONECT 31 29 32 47 46 CONECT 32 31 33 92 93 CONECT 33 32 34 94 95 CONECT 34 33 35 36 46 CONECT 35 34 96 97 98 CONECT 36 34 37 45 99 CONECT 37 36 38 100 101 CONECT 38 37 39 102 103 CONECT 39 38 40 41 43 CONECT 40 39 104 CONECT 41 39 42 105 106 CONECT 42 41 107 108 109 CONECT 43 39 44 45 110 CONECT 44 43 111 112 113 CONECT 45 43 36 CONECT 46 34 31 CONECT 47 31 26 CONECT 48 26 49 50 114 CONECT 49 48 115 116 117 CONECT 50 48 51 118 119 CONECT 51 50 52 24 120 CONECT 52 51 121 122 123 CONECT 53 12 7 CONECT 54 1 CONECT 55 1 CONECT 56 1 CONECT 57 2 CONECT 58 2 CONECT 59 3 CONECT 60 6 CONECT 61 7 CONECT 62 8 CONECT 63 8 CONECT 64 9 CONECT 65 9 CONECT 66 10 CONECT 67 11 CONECT 68 11 CONECT 69 11 CONECT 70 12 CONECT 71 13 CONECT 72 14 CONECT 73 14 CONECT 74 14 CONECT 75 15 CONECT 76 16 CONECT 77 17 CONECT 78 18 CONECT 79 18 CONECT 80 18 CONECT 81 21 CONECT 82 22 CONECT 83 22 CONECT 84 23 CONECT 85 23 CONECT 86 23 CONECT 87 24 CONECT 88 27 CONECT 89 28 CONECT 90 29 CONECT 91 30 CONECT 92 32 CONECT 93 32 CONECT 94 33 CONECT 95 33 CONECT 96 35 CONECT 97 35 CONECT 98 35 CONECT 99 36 CONECT 100 37 CONECT 101 37 CONECT 102 38 CONECT 103 38 CONECT 104 40 CONECT 105 41 CONECT 106 41 CONECT 107 42 CONECT 108 42 CONECT 109 42 CONECT 110 43 CONECT 111 44 CONECT 112 44 CONECT 113 44 CONECT 114 48 CONECT 115 49 CONECT 116 49 CONECT 117 49 CONECT 118 50 CONECT 119 50 CONECT 120 51 CONECT 121 52 CONECT 122 52 CONECT 123 52 MASTER 0 0 0 0 0 0 0 0 123 0 254 0 END