HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 5.932 6.160 0.618 0.00 0.00 C+0 HETATM 2 C UNK 0 5.911 4.859 1.395 0.00 0.00 C+0 HETATM 3 O UNK 0 4.753 4.116 0.993 0.00 0.00 O+0 HETATM 4 C UNK 0 4.601 2.922 1.631 0.00 0.00 C+0 HETATM 5 O UNK 0 5.361 2.480 2.482 0.00 0.00 O+0 HETATM 6 C UNK 0 3.371 2.200 1.117 0.00 0.00 C+0 HETATM 7 C UNK 0 3.892 1.077 0.176 0.00 0.00 C+0 HETATM 8 C UNK 0 3.474 1.257 -1.300 0.00 0.00 C+0 HETATM 9 C UNK 0 3.778 2.607 -1.886 0.00 0.00 C+0 HETATM 10 C UNK 0 4.953 3.017 -2.407 0.00 0.00 C+0 HETATM 11 C UNK 0 6.197 2.180 -2.486 0.00 0.00 C+0 HETATM 12 C UNK 0 5.122 4.402 -2.951 0.00 0.00 C+0 HETATM 13 O UNK 0 6.173 4.806 -3.430 0.00 0.00 O+0 HETATM 14 O UNK 0 3.986 5.136 -2.828 0.00 0.00 O+0 HETATM 15 C UNK 0 4.098 6.469 -3.324 0.00 0.00 C+0 HETATM 16 O UNK 0 3.432 -0.213 0.649 0.00 0.00 O+0 HETATM 17 C UNK 0 4.173 -1.301 0.289 0.00 0.00 C+0 HETATM 18 O UNK 0 5.150 -1.271 -0.444 0.00 0.00 O+0 HETATM 19 C UNK 0 3.624 -2.541 0.950 0.00 0.00 C+0 HETATM 20 C UNK 0 3.645 -3.723 -0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 2.534 1.735 2.332 0.00 0.00 C+0 HETATM 22 O UNK 0 2.415 2.860 3.248 0.00 0.00 O+0 HETATM 23 C UNK 0 2.579 2.596 4.573 0.00 0.00 C+0 HETATM 24 C UNK 0 2.508 3.870 5.358 0.00 0.00 C+0 HETATM 25 O UNK 0 2.742 1.489 5.064 0.00 0.00 O+0 HETATM 26 C UNK 0 1.097 1.276 1.932 0.00 0.00 C+0 HETATM 27 C UNK 0 0.438 0.448 3.053 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.998 -0.087 2.764 0.00 0.00 C+0 HETATM 29 C UNK 0 -1.649 -0.404 4.119 0.00 0.00 C+0 HETATM 30 C UNK 0 -0.987 -1.314 1.800 0.00 0.00 C+0 HETATM 31 O UNK 0 -0.532 -0.851 0.504 0.00 0.00 O+0 HETATM 32 C UNK 0 0.016 -1.784 -0.322 0.00 0.00 C+0 HETATM 33 O UNK 0 0.181 -2.964 -0.042 0.00 0.00 O+0 HETATM 34 C UNK 0 0.389 -1.170 -1.648 0.00 0.00 C+0 HETATM 35 C UNK 0 -0.326 -1.862 -2.815 0.00 0.00 C+0 HETATM 36 C UNK 0 -1.823 -1.549 -2.813 0.00 0.00 C+0 HETATM 37 C UNK 0 0.298 -1.425 -4.141 0.00 0.00 C+0 HETATM 38 C UNK 0 -2.341 -2.049 1.596 0.00 0.00 C+0 HETATM 39 C UNK 0 -3.479 -1.130 1.138 0.00 0.00 C+0 HETATM 40 C UNK 0 -4.753 -1.952 0.916 0.00 0.00 C+0 HETATM 41 C UNK 0 -5.932 -1.050 0.559 0.00 0.00 C+0 HETATM 42 C UNK 0 -5.053 -2.784 2.171 0.00 0.00 C+0 HETATM 43 C UNK 0 -3.837 -3.621 2.616 0.00 0.00 C+0 HETATM 44 C UNK 0 -4.149 -4.276 3.971 0.00 0.00 C+0 HETATM 45 C UNK 0 -3.010 -5.182 4.464 0.00 0.00 C+0 HETATM 46 C UNK 0 -2.205 -4.536 5.592 0.00 0.00 C+0 HETATM 47 C UNK 0 -2.088 -5.594 3.309 0.00 0.00 C+0 HETATM 48 C UNK 0 -2.871 -5.766 1.999 0.00 0.00 C+0 HETATM 49 O UNK 0 -3.813 -6.815 2.205 0.00 0.00 O+0 HETATM 50 C UNK 0 -1.887 -6.132 0.883 0.00 0.00 C+0 HETATM 51 C UNK 0 -2.609 -6.281 -0.434 0.00 0.00 C+0 HETATM 52 C UNK 0 -2.236 -5.334 -1.541 0.00 0.00 C+0 HETATM 53 O UNK 0 -3.483 -7.138 -0.581 0.00 0.00 O+0 HETATM 54 O UNK 0 -3.577 -4.594 1.607 0.00 0.00 O+0 HETATM 55 O UNK 0 -2.706 -2.755 2.785 0.00 0.00 O+0 HETATM 56 O UNK 0 0.252 2.437 1.726 0.00 0.00 O+0 HETATM 57 C UNK 0 0.025 2.848 0.453 0.00 0.00 C+0 HETATM 58 O UNK 0 0.463 2.304 -0.549 0.00 0.00 O+0 HETATM 59 C UNK 0 -0.862 4.070 0.453 0.00 0.00 C+0 HETATM 60 C UNK 0 -0.492 5.059 -0.663 0.00 0.00 C+0 HETATM 61 C UNK 0 0.864 5.720 -0.400 0.00 0.00 C+0 HETATM 62 C UNK 0 -1.576 6.130 -0.794 0.00 0.00 C+0 HETATM 63 H UNK 0 5.984 5.965 -0.458 0.00 0.00 H+0 HETATM 64 H UNK 0 5.014 6.731 0.794 0.00 0.00 H+0 HETATM 65 H UNK 0 6.791 6.772 0.905 0.00 0.00 H+0 HETATM 66 H UNK 0 6.815 4.280 1.176 0.00 0.00 H+0 HETATM 67 H UNK 0 5.858 5.071 2.469 0.00 0.00 H+0 HETATM 68 H UNK 0 2.787 2.947 0.570 0.00 0.00 H+0 HETATM 69 H UNK 0 4.991 1.070 0.207 0.00 0.00 H+0 HETATM 70 H UNK 0 3.925 0.473 -1.919 0.00 0.00 H+0 HETATM 71 H UNK 0 2.401 1.066 -1.398 0.00 0.00 H+0 HETATM 72 H UNK 0 2.927 3.287 -1.874 0.00 0.00 H+0 HETATM 73 H UNK 0 6.068 1.179 -2.067 0.00 0.00 H+0 HETATM 74 H UNK 0 7.013 2.658 -1.933 0.00 0.00 H+0 HETATM 75 H UNK 0 6.508 2.058 -3.529 0.00 0.00 H+0 HETATM 76 H UNK 0 4.327 6.463 -4.394 0.00 0.00 H+0 HETATM 77 H UNK 0 4.859 7.024 -2.767 0.00 0.00 H+0 HETATM 78 H UNK 0 3.134 6.966 -3.180 0.00 0.00 H+0 HETATM 79 H UNK 0 4.223 -2.747 1.843 0.00 0.00 H+0 HETATM 80 H UNK 0 2.593 -2.358 1.271 0.00 0.00 H+0 HETATM 81 H UNK 0 3.204 -4.604 0.477 0.00 0.00 H+0 HETATM 82 H UNK 0 4.668 -3.973 -0.297 0.00 0.00 H+0 HETATM 83 H UNK 0 3.077 -3.505 -0.911 0.00 0.00 H+0 HETATM 84 H UNK 0 3.069 0.910 2.818 0.00 0.00 H+0 HETATM 85 H UNK 0 2.683 3.654 6.416 0.00 0.00 H+0 HETATM 86 H UNK 0 3.281 4.561 5.013 0.00 0.00 H+0 HETATM 87 H UNK 0 1.516 4.316 5.250 0.00 0.00 H+0 HETATM 88 H UNK 0 1.152 0.669 1.029 0.00 0.00 H+0 HETATM 89 H UNK 0 0.369 1.095 3.936 0.00 0.00 H+0 HETATM 90 H UNK 0 1.089 -0.393 3.323 0.00 0.00 H+0 HETATM 91 H UNK 0 -1.571 0.724 2.298 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.716 -0.621 4.019 0.00 0.00 H+0 HETATM 93 H UNK 0 -1.160 -1.255 4.602 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.578 0.453 4.798 0.00 0.00 H+0 HETATM 95 H UNK 0 -0.262 -2.034 2.204 0.00 0.00 H+0 HETATM 96 H UNK 0 0.158 -0.100 -1.643 0.00 0.00 H+0 HETATM 97 H UNK 0 1.477 -1.262 -1.742 0.00 0.00 H+0 HETATM 98 H UNK 0 -0.205 -2.949 -2.724 0.00 0.00 H+0 HETATM 99 H UNK 0 -2.324 -2.048 -3.650 0.00 0.00 H+0 HETATM 100 H UNK 0 -2.300 -1.894 -1.891 0.00 0.00 H+0 HETATM 101 H UNK 0 -2.005 -0.473 -2.905 0.00 0.00 H+0 HETATM 102 H UNK 0 -0.192 -1.925 -4.984 0.00 0.00 H+0 HETATM 103 H UNK 0 1.362 -1.682 -4.174 0.00 0.00 H+0 HETATM 104 H UNK 0 0.205 -0.344 -4.288 0.00 0.00 H+0 HETATM 105 H UNK 0 -2.185 -2.790 0.804 0.00 0.00 H+0 HETATM 106 H UNK 0 -3.204 -0.607 0.215 0.00 0.00 H+0 HETATM 107 H UNK 0 -3.682 -0.368 1.898 0.00 0.00 H+0 HETATM 108 H UNK 0 -4.586 -2.635 0.072 0.00 0.00 H+0 HETATM 109 H UNK 0 -5.719 -0.477 -0.349 0.00 0.00 H+0 HETATM 110 H UNK 0 -6.833 -1.644 0.379 0.00 0.00 H+0 HETATM 111 H UNK 0 -6.150 -0.340 1.364 0.00 0.00 H+0 HETATM 112 H UNK 0 -5.341 -2.101 2.982 0.00 0.00 H+0 HETATM 113 H UNK 0 -5.908 -3.441 1.970 0.00 0.00 H+0 HETATM 114 H UNK 0 -4.377 -3.514 4.726 0.00 0.00 H+0 HETATM 115 H UNK 0 -5.048 -4.897 3.862 0.00 0.00 H+0 HETATM 116 H UNK 0 -3.469 -6.088 4.883 0.00 0.00 H+0 HETATM 117 H UNK 0 -1.731 -3.606 5.265 0.00 0.00 H+0 HETATM 118 H UNK 0 -2.851 -4.303 6.445 0.00 0.00 H+0 HETATM 119 H UNK 0 -1.419 -5.212 5.943 0.00 0.00 H+0 HETATM 120 H UNK 0 -1.587 -6.532 3.582 0.00 0.00 H+0 HETATM 121 H UNK 0 -1.300 -4.842 3.174 0.00 0.00 H+0 HETATM 122 H UNK 0 -4.072 -7.140 1.319 0.00 0.00 H+0 HETATM 123 H UNK 0 -1.125 -5.352 0.772 0.00 0.00 H+0 HETATM 124 H UNK 0 -1.377 -7.081 1.086 0.00 0.00 H+0 HETATM 125 H UNK 0 -2.798 -5.584 -2.446 0.00 0.00 H+0 HETATM 126 H UNK 0 -1.168 -5.421 -1.756 0.00 0.00 H+0 HETATM 127 H UNK 0 -2.481 -4.312 -1.244 0.00 0.00 H+0 HETATM 128 H UNK 0 -0.793 4.571 1.426 0.00 0.00 H+0 HETATM 129 H UNK 0 -1.892 3.715 0.333 0.00 0.00 H+0 HETATM 130 H UNK 0 -0.430 4.524 -1.619 0.00 0.00 H+0 HETATM 131 H UNK 0 1.113 6.424 -1.200 0.00 0.00 H+0 HETATM 132 H UNK 0 0.860 6.272 0.546 0.00 0.00 H+0 HETATM 133 H UNK 0 1.666 4.977 -0.354 0.00 0.00 H+0 HETATM 134 H UNK 0 -1.335 6.831 -1.600 0.00 0.00 H+0 HETATM 135 H UNK 0 -2.545 5.677 -1.026 0.00 0.00 H+0 HETATM 136 H UNK 0 -1.682 6.704 0.133 0.00 0.00 H+0 CONECT 1 2 63 64 65 CONECT 2 3 1 66 67 CONECT 3 4 2 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 21 68 CONECT 7 16 8 6 69 CONECT 8 9 7 70 71 CONECT 9 10 8 72 CONECT 10 12 9 11 CONECT 11 10 73 74 75 CONECT 12 14 10 13 CONECT 13 12 CONECT 14 12 15 CONECT 15 14 76 77 78 CONECT 16 7 17 CONECT 17 18 19 16 CONECT 18 17 CONECT 19 17 20 79 80 CONECT 20 19 81 82 83 CONECT 21 26 22 6 84 CONECT 22 23 21 CONECT 23 22 24 25 CONECT 24 23 85 86 87 CONECT 25 23 CONECT 26 21 27 56 88 CONECT 27 26 28 89 90 CONECT 28 27 30 29 91 CONECT 29 28 92 93 94 CONECT 30 28 31 38 95 CONECT 31 32 30 CONECT 32 31 34 33 CONECT 33 32 CONECT 34 32 35 96 97 CONECT 35 34 36 37 98 CONECT 36 35 99 100 101 CONECT 37 35 102 103 104 CONECT 38 55 39 30 105 CONECT 39 38 40 106 107 CONECT 40 39 42 41 108 CONECT 41 40 109 110 111 CONECT 42 40 43 112 113 CONECT 43 44 55 42 54 CONECT 44 43 45 114 115 CONECT 45 47 44 46 116 CONECT 46 45 117 118 119 CONECT 47 48 45 120 121 CONECT 48 54 47 50 49 CONECT 49 48 122 CONECT 50 48 51 123 124 CONECT 51 50 52 53 CONECT 52 51 125 126 127 CONECT 53 51 CONECT 54 48 43 CONECT 55 38 43 CONECT 56 57 26 CONECT 57 56 58 59 CONECT 58 57 CONECT 59 57 60 128 129 CONECT 60 59 61 62 130 CONECT 61 60 131 132 133 CONECT 62 60 134 135 136 CONECT 63 1 CONECT 64 1 CONECT 65 1 CONECT 66 2 CONECT 67 2 CONECT 68 6 CONECT 69 7 CONECT 70 8 CONECT 71 8 CONECT 72 9 CONECT 73 11 CONECT 74 11 CONECT 75 11 CONECT 76 15 CONECT 77 15 CONECT 78 15 CONECT 79 19 CONECT 80 19 CONECT 81 20 CONECT 82 20 CONECT 83 20 CONECT 84 21 CONECT 85 24 CONECT 86 24 CONECT 87 24 CONECT 88 26 CONECT 89 27 CONECT 90 27 CONECT 91 28 CONECT 92 29 CONECT 93 29 CONECT 94 29 CONECT 95 30 CONECT 96 34 CONECT 97 34 CONECT 98 35 CONECT 99 36 CONECT 100 36 CONECT 101 36 CONECT 102 37 CONECT 103 37 CONECT 104 37 CONECT 105 38 CONECT 106 39 CONECT 107 39 CONECT 108 40 CONECT 109 41 CONECT 110 41 CONECT 111 41 CONECT 112 42 CONECT 113 42 CONECT 114 44 CONECT 115 44 CONECT 116 45 CONECT 117 46 CONECT 118 46 CONECT 119 46 CONECT 120 47 CONECT 121 47 CONECT 122 49 CONECT 123 50 CONECT 124 50 CONECT 125 52 CONECT 126 52 CONECT 127 52 CONECT 128 59 CONECT 129 59 CONECT 130 60 CONECT 131 61 CONECT 132 61 CONECT 133 61 CONECT 134 62 CONECT 135 62 CONECT 136 62 MASTER 0 0 0 0 0 0 0 0 136 0 274 0 END