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 4.962 1.402 -5.787 0.00 0.00 C+0 HETATM 2 C UNK 0 3.542 1.899 -5.785 0.00 0.00 C+0 HETATM 3 O UNK 0 3.090 2.612 -6.675 0.00 0.00 O+0 HETATM 4 N UNK 0 2.799 1.472 -4.714 0.00 0.00 N+0 HETATM 5 C UNK 0 1.351 1.712 -4.583 0.00 0.00 C+0 HETATM 6 C UNK 0 0.792 1.120 -3.267 0.00 0.00 C+0 HETATM 7 O UNK 0 1.251 -0.239 -3.180 0.00 0.00 O+0 HETATM 8 C UNK 0 1.283 -0.791 -1.853 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.121 -0.937 -1.259 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.126 -1.623 0.107 0.00 0.00 C+0 HETATM 11 C UNK 0 0.579 -3.010 0.138 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.315 -3.999 -0.651 0.00 0.00 C+0 HETATM 13 C UNK 0 2.009 -2.832 -0.487 0.00 0.00 C+0 HETATM 14 C UNK 0 2.823 -4.136 -0.355 0.00 0.00 C+0 HETATM 15 C UNK 0 3.048 -4.487 1.118 0.00 0.00 C+0 HETATM 16 C UNK 0 1.750 -4.649 1.956 0.00 0.00 C+0 HETATM 17 C UNK 0 1.090 -5.995 1.532 0.00 0.00 C+0 HETATM 18 C UNK 0 0.778 -3.439 1.664 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.531 -3.583 2.467 0.00 0.00 C+0 HETATM 20 C UNK 0 -0.342 -4.088 3.865 0.00 0.00 C+0 HETATM 21 C UNK 0 0.800 -4.575 4.392 0.00 0.00 C+0 HETATM 22 C UNK 0 0.769 -5.063 5.847 0.00 0.00 C+0 HETATM 23 C UNK 0 1.052 -3.945 6.872 0.00 0.00 C+0 HETATM 24 C UNK 0 0.617 -4.354 8.307 0.00 0.00 C+0 HETATM 25 C UNK 0 -0.834 -3.905 8.565 0.00 0.00 C+0 HETATM 26 C UNK 0 1.524 -3.633 9.324 0.00 0.00 C+0 HETATM 27 C UNK 0 0.707 -5.887 8.510 0.00 0.00 C+0 HETATM 28 C UNK 0 1.831 -6.515 7.685 0.00 0.00 C+0 HETATM 29 C UNK 0 1.618 -6.337 6.149 0.00 0.00 C+0 HETATM 30 C UNK 0 0.820 -7.566 5.691 0.00 0.00 C+0 HETATM 31 O UNK 0 -0.395 -7.673 5.623 0.00 0.00 O+0 HETATM 32 O UNK 0 1.575 -8.650 5.418 0.00 0.00 O+0 HETATM 33 C UNK 0 2.988 -6.294 5.426 0.00 0.00 C+0 HETATM 34 O UNK 0 3.881 -5.357 6.030 0.00 0.00 O+0 HETATM 35 C UNK 0 2.848 -5.992 3.928 0.00 0.00 C+0 HETATM 36 C UNK 0 2.089 -4.677 3.563 0.00 0.00 C+0 HETATM 37 C UNK 0 2.990 -3.468 3.955 0.00 0.00 C+0 HETATM 38 C UNK 0 2.067 -2.148 -1.903 0.00 0.00 C+0 HETATM 39 C UNK 0 1.564 -3.047 -3.052 0.00 0.00 C+0 HETATM 40 C UNK 0 3.546 -1.808 -2.249 0.00 0.00 C+0 HETATM 41 O UNK 0 -0.630 1.138 -3.297 0.00 0.00 O+0 HETATM 42 C UNK 0 -1.233 2.391 -3.662 0.00 0.00 C+0 HETATM 43 C UNK 0 -2.071 2.155 -4.933 0.00 0.00 C+0 HETATM 44 O UNK 0 -2.795 3.320 -5.335 0.00 0.00 O+0 HETATM 45 C UNK 0 -4.072 3.427 -4.691 0.00 0.00 C+0 HETATM 46 O UNK 0 -5.016 2.557 -5.321 0.00 0.00 O+0 HETATM 47 C UNK 0 -5.155 2.771 -6.732 0.00 0.00 C+0 HETATM 48 C UNK 0 -5.082 4.247 -7.136 0.00 0.00 C+0 HETATM 49 O UNK 0 -3.760 4.617 -7.569 0.00 0.00 O+0 HETATM 50 C UNK 0 -5.471 5.135 -5.956 0.00 0.00 C+0 HETATM 51 O UNK 0 -5.400 6.518 -6.351 0.00 0.00 O+0 HETATM 52 C UNK 0 -4.541 4.905 -4.751 0.00 0.00 C+0 HETATM 53 O UNK 0 -5.290 5.262 -3.569 0.00 0.00 O+0 HETATM 54 C UNK 0 -4.472 5.872 -2.564 0.00 0.00 C+0 HETATM 55 O UNK 0 -3.458 4.973 -2.123 0.00 0.00 O+0 HETATM 56 C UNK 0 -2.640 5.537 -1.096 0.00 0.00 C+0 HETATM 57 C UNK 0 -3.459 5.914 0.138 0.00 0.00 C+0 HETATM 58 O UNK 0 -2.631 6.553 1.109 0.00 0.00 O+0 HETATM 59 C UNK 0 -4.598 6.852 -0.261 0.00 0.00 C+0 HETATM 60 O UNK 0 -5.436 7.089 0.881 0.00 0.00 O+0 HETATM 61 C UNK 0 -5.411 6.251 -1.404 0.00 0.00 C+0 HETATM 62 O UNK 0 -6.402 7.206 -1.815 0.00 0.00 O+0 HETATM 63 C UNK 0 -0.247 3.569 -3.814 0.00 0.00 C+0 HETATM 64 O UNK 0 0.223 3.940 -2.503 0.00 0.00 O+0 HETATM 65 C UNK 0 0.970 3.208 -4.681 0.00 0.00 C+0 HETATM 66 O UNK 0 0.698 3.564 -6.041 0.00 0.00 O+0 HETATM 67 H UNK 0 5.016 0.478 -6.367 0.00 0.00 H+0 HETATM 68 H UNK 0 5.314 1.210 -4.769 0.00 0.00 H+0 HETATM 69 H UNK 0 5.609 2.158 -6.241 0.00 0.00 H+0 HETATM 70 H UNK 0 3.178 0.742 -4.121 0.00 0.00 H+0 HETATM 71 H UNK 0 0.905 1.173 -5.430 0.00 0.00 H+0 HETATM 72 H UNK 0 1.171 1.672 -2.399 0.00 0.00 H+0 HETATM 73 H UNK 0 1.851 -0.100 -1.215 0.00 0.00 H+0 HETATM 74 H UNK 0 -0.566 0.055 -1.119 0.00 0.00 H+0 HETATM 75 H UNK 0 -0.782 -1.445 -1.968 0.00 0.00 H+0 HETATM 76 H UNK 0 0.363 -0.946 0.821 0.00 0.00 H+0 HETATM 77 H UNK 0 -1.167 -1.718 0.437 0.00 0.00 H+0 HETATM 78 H UNK 0 0.250 -4.807 -1.119 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.087 -4.457 -0.032 0.00 0.00 H+0 HETATM 80 H UNK 0 -0.867 -3.515 -1.459 0.00 0.00 H+0 HETATM 81 H UNK 0 2.521 -2.109 0.171 0.00 0.00 H+0 HETATM 82 H UNK 0 3.814 -4.023 -0.805 0.00 0.00 H+0 HETATM 83 H UNK 0 2.352 -4.972 -0.878 0.00 0.00 H+0 HETATM 84 H UNK 0 3.671 -3.686 1.527 0.00 0.00 H+0 HETATM 85 H UNK 0 3.655 -5.398 1.174 0.00 0.00 H+0 HETATM 86 H UNK 0 0.690 -5.977 0.522 0.00 0.00 H+0 HETATM 87 H UNK 0 0.271 -6.289 2.195 0.00 0.00 H+0 HETATM 88 H UNK 0 1.816 -6.815 1.523 0.00 0.00 H+0 HETATM 89 H UNK 0 1.269 -2.560 2.099 0.00 0.00 H+0 HETATM 90 H UNK 0 -1.235 -4.262 1.980 0.00 0.00 H+0 HETATM 91 H UNK 0 -1.028 -2.608 2.533 0.00 0.00 H+0 HETATM 92 H UNK 0 -1.241 -4.050 4.480 0.00 0.00 H+0 HETATM 93 H UNK 0 -0.282 -5.332 6.028 0.00 0.00 H+0 HETATM 94 H UNK 0 0.547 -3.015 6.580 0.00 0.00 H+0 HETATM 95 H UNK 0 2.121 -3.711 6.876 0.00 0.00 H+0 HETATM 96 H UNK 0 -1.527 -4.357 7.847 0.00 0.00 H+0 HETATM 97 H UNK 0 -0.934 -2.817 8.482 0.00 0.00 H+0 HETATM 98 H UNK 0 -1.163 -4.192 9.570 0.00 0.00 H+0 HETATM 99 H UNK 0 2.570 -3.939 9.214 0.00 0.00 H+0 HETATM 100 H UNK 0 1.479 -2.546 9.190 0.00 0.00 H+0 HETATM 101 H UNK 0 1.220 -3.854 10.353 0.00 0.00 H+0 HETATM 102 H UNK 0 -0.240 -6.368 8.231 0.00 0.00 H+0 HETATM 103 H UNK 0 0.857 -6.122 9.571 0.00 0.00 H+0 HETATM 104 H UNK 0 2.777 -6.071 8.013 0.00 0.00 H+0 HETATM 105 H UNK 0 1.903 -7.580 7.941 0.00 0.00 H+0 HETATM 106 H UNK 0 0.912 -9.340 5.201 0.00 0.00 H+0 HETATM 107 H UNK 0 3.492 -7.263 5.529 0.00 0.00 H+0 HETATM 108 H UNK 0 4.742 -5.440 5.585 0.00 0.00 H+0 HETATM 109 H UNK 0 3.849 -5.963 3.480 0.00 0.00 H+0 HETATM 110 H UNK 0 2.344 -6.860 3.496 0.00 0.00 H+0 HETATM 111 H UNK 0 3.057 -3.319 5.033 0.00 0.00 H+0 HETATM 112 H UNK 0 2.628 -2.517 3.560 0.00 0.00 H+0 HETATM 113 H UNK 0 4.019 -3.603 3.607 0.00 0.00 H+0 HETATM 114 H UNK 0 0.480 -3.161 -3.056 0.00 0.00 H+0 HETATM 115 H UNK 0 1.827 -2.624 -4.029 0.00 0.00 H+0 HETATM 116 H UNK 0 2.013 -4.044 -3.011 0.00 0.00 H+0 HETATM 117 H UNK 0 4.020 -1.232 -1.446 0.00 0.00 H+0 HETATM 118 H UNK 0 3.619 -1.214 -3.166 0.00 0.00 H+0 HETATM 119 H UNK 0 4.145 -2.707 -2.421 0.00 0.00 H+0 HETATM 120 H UNK 0 -1.913 2.635 -2.838 0.00 0.00 H+0 HETATM 121 H UNK 0 -2.746 1.299 -4.799 0.00 0.00 H+0 HETATM 122 H UNK 0 -1.416 1.878 -5.765 0.00 0.00 H+0 HETATM 123 H UNK 0 -3.997 3.104 -3.649 0.00 0.00 H+0 HETATM 124 H UNK 0 -6.137 2.367 -6.999 0.00 0.00 H+0 HETATM 125 H UNK 0 -4.398 2.174 -7.252 0.00 0.00 H+0 HETATM 126 H UNK 0 -5.729 4.438 -8.000 0.00 0.00 H+0 HETATM 127 H UNK 0 -3.109 4.127 -7.020 0.00 0.00 H+0 HETATM 128 H UNK 0 -6.513 4.947 -5.673 0.00 0.00 H+0 HETATM 129 H UNK 0 -4.644 6.575 -6.971 0.00 0.00 H+0 HETATM 130 H UNK 0 -3.671 5.572 -4.835 0.00 0.00 H+0 HETATM 131 H UNK 0 -4.020 6.777 -2.992 0.00 0.00 H+0 HETATM 132 H UNK 0 -2.095 6.402 -1.493 0.00 0.00 H+0 HETATM 133 H UNK 0 -1.882 4.796 -0.821 0.00 0.00 H+0 HETATM 134 H UNK 0 -3.873 5.010 0.602 0.00 0.00 H+0 HETATM 135 H UNK 0 -3.250 6.891 1.788 0.00 0.00 H+0 HETATM 136 H UNK 0 -4.201 7.835 -0.545 0.00 0.00 H+0 HETATM 137 H UNK 0 -6.231 7.536 0.523 0.00 0.00 H+0 HETATM 138 H UNK 0 -5.959 5.369 -1.050 0.00 0.00 H+0 HETATM 139 H UNK 0 -6.770 6.855 -2.652 0.00 0.00 H+0 HETATM 140 H UNK 0 -0.770 4.445 -4.214 0.00 0.00 H+0 HETATM 141 H UNK 0 0.631 4.821 -2.588 0.00 0.00 H+0 HETATM 142 H UNK 0 1.819 3.826 -4.363 0.00 0.00 H+0 HETATM 143 H UNK 0 1.515 3.341 -6.547 0.00 0.00 H+0 CONECT 1 2 67 68 69 CONECT 2 4 1 3 CONECT 3 2 CONECT 4 2 5 70 CONECT 5 4 6 65 71 CONECT 6 41 5 7 72 CONECT 7 8 6 CONECT 8 7 9 38 73 CONECT 9 8 10 74 75 CONECT 10 9 11 76 77 CONECT 11 12 10 13 18 CONECT 12 11 78 79 80 CONECT 13 38 11 14 81 CONECT 14 13 15 82 83 CONECT 15 14 16 84 85 CONECT 16 17 15 18 36 CONECT 17 16 86 87 88 CONECT 18 11 16 19 89 CONECT 19 18 20 90 91 CONECT 20 21 19 92 CONECT 21 22 20 36 CONECT 22 21 29 23 93 CONECT 23 22 24 94 95 CONECT 24 27 23 25 26 CONECT 25 24 96 97 98 CONECT 26 24 99 100 101 CONECT 27 28 24 102 103 CONECT 28 29 27 104 105 CONECT 29 33 22 28 30 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 106 CONECT 33 35 29 34 107 CONECT 34 33 108 CONECT 35 36 33 109 110 CONECT 36 35 37 16 21 CONECT 37 36 111 112 113 CONECT 38 39 40 8 13 CONECT 39 38 114 115 116 CONECT 40 38 117 118 119 CONECT 41 6 42 CONECT 42 63 41 43 120 CONECT 43 44 42 121 122 CONECT 44 43 45 CONECT 45 52 46 44 123 CONECT 46 47 45 CONECT 47 48 46 124 125 CONECT 48 50 47 49 126 CONECT 49 48 127 CONECT 50 52 48 51 128 CONECT 51 50 129 CONECT 52 45 50 53 130 CONECT 53 52 54 CONECT 54 61 55 53 131 CONECT 55 56 54 CONECT 56 57 55 132 133 CONECT 57 59 56 58 134 CONECT 58 57 135 CONECT 59 61 57 60 136 CONECT 60 59 137 CONECT 61 54 59 62 138 CONECT 62 61 139 CONECT 63 64 65 42 140 CONECT 64 63 141 CONECT 65 66 5 63 142 CONECT 66 65 143 CONECT 67 1 CONECT 68 1 CONECT 69 1 CONECT 70 4 CONECT 71 5 CONECT 72 6 CONECT 73 8 CONECT 74 9 CONECT 75 9 CONECT 76 10 CONECT 77 10 CONECT 78 12 CONECT 79 12 CONECT 80 12 CONECT 81 13 CONECT 82 14 CONECT 83 14 CONECT 84 15 CONECT 85 15 CONECT 86 17 CONECT 87 17 CONECT 88 17 CONECT 89 18 CONECT 90 19 CONECT 91 19 CONECT 92 20 CONECT 93 22 CONECT 94 23 CONECT 95 23 CONECT 96 25 CONECT 97 25 CONECT 98 25 CONECT 99 26 CONECT 100 26 CONECT 101 26 CONECT 102 27 CONECT 103 27 CONECT 104 28 CONECT 105 28 CONECT 106 32 CONECT 107 33 CONECT 108 34 CONECT 109 35 CONECT 110 35 CONECT 111 37 CONECT 112 37 CONECT 113 37 CONECT 114 39 CONECT 115 39 CONECT 116 39 CONECT 117 40 CONECT 118 40 CONECT 119 40 CONECT 120 42 CONECT 121 43 CONECT 122 43 CONECT 123 45 CONECT 124 47 CONECT 125 47 CONECT 126 48 CONECT 127 49 CONECT 128 50 CONECT 129 51 CONECT 130 52 CONECT 131 54 CONECT 132 56 CONECT 133 56 CONECT 134 57 CONECT 135 58 CONECT 136 59 CONECT 137 60 CONECT 138 61 CONECT 139 62 CONECT 140 63 CONECT 141 64 CONECT 142 65 CONECT 143 66 MASTER 0 0 0 0 0 0 0 0 143 0 300 0 END