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 C UNK 0 -6.451 -2.118 -1.789 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.996 -2.736 -0.515 0.00 0.00 C+0 HETATM 3 C UNK 0 -5.723 -4.201 -0.818 0.00 0.00 C+0 HETATM 4 C UNK 0 -4.968 -2.061 0.290 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.617 -1.814 -0.323 0.00 0.00 C+0 HETATM 6 C UNK 0 -3.538 -0.948 -1.458 0.00 0.00 C+0 HETATM 7 O UNK 0 -3.022 -1.464 -2.551 0.00 0.00 O+0 HETATM 8 N UNK 0 -3.912 0.404 -1.661 0.00 0.00 N+0 HETATM 9 C UNK 0 -4.696 0.772 -2.858 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.548 1.546 -0.857 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.729 2.407 -0.510 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.780 1.808 0.266 0.00 0.00 C+0 HETATM 13 C UNK 0 -6.941 1.320 -0.249 0.00 0.00 C+0 HETATM 14 C UNK 0 -7.921 0.729 0.560 0.00 0.00 C+0 HETATM 15 C UNK 0 -7.733 0.626 1.914 0.00 0.00 C+0 HETATM 16 C UNK 0 -6.564 1.113 2.463 0.00 0.00 C+0 HETATM 17 C UNK 0 -5.612 1.691 1.649 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.549 2.367 -1.640 0.00 0.00 C+0 HETATM 19 O UNK 0 -2.399 2.064 -2.886 0.00 0.00 O+0 HETATM 20 N UNK 0 -1.767 3.413 -1.189 0.00 0.00 N+0 HETATM 21 C UNK 0 -0.711 3.424 -0.198 0.00 0.00 C+0 HETATM 22 C UNK 0 -0.867 4.730 0.599 0.00 0.00 C+0 HETATM 23 C UNK 0 0.210 4.824 1.663 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.228 4.842 1.231 0.00 0.00 C+0 HETATM 25 C UNK 0 0.587 3.503 -0.974 0.00 0.00 C+0 HETATM 26 O UNK 0 0.541 4.365 -1.924 0.00 0.00 O+0 HETATM 27 O UNK 0 1.694 2.769 -0.730 0.00 0.00 O+0 HETATM 28 C UNK 0 1.834 1.365 -0.684 0.00 0.00 C+0 HETATM 29 C UNK 0 1.568 0.727 -2.030 0.00 0.00 C+0 HETATM 30 C UNK 0 3.289 1.065 -0.336 0.00 0.00 C+0 HETATM 31 N UNK 0 4.108 2.259 -0.592 0.00 0.00 N+0 HETATM 32 C UNK 0 4.819 2.964 0.376 0.00 0.00 C+0 HETATM 33 O UNK 0 4.799 2.602 1.570 0.00 0.00 O+0 HETATM 34 C UNK 0 5.610 4.154 -0.001 0.00 0.00 C+0 HETATM 35 O UNK 0 5.527 4.417 -1.369 0.00 0.00 O+0 HETATM 36 C UNK 0 7.069 3.953 0.398 0.00 0.00 C+0 HETATM 37 O UNK 0 7.809 5.113 0.103 0.00 0.00 O+0 HETATM 38 S UNK 0 9.411 4.926 0.525 0.00 0.00 S+0 HETATM 39 O UNK 0 10.206 5.892 -0.341 0.00 0.00 O+0 HETATM 40 O UNK 0 9.938 3.556 0.198 0.00 0.00 O+0 HETATM 41 O UNK 0 9.659 5.309 2.153 0.00 0.00 O+0 HETATM 42 C UNK 0 3.773 -0.053 -1.168 0.00 0.00 C+0 HETATM 43 O UNK 0 4.905 0.165 -1.760 0.00 0.00 O+0 HETATM 44 N UNK 0 3.179 -1.292 -1.395 0.00 0.00 N+0 HETATM 45 C UNK 0 2.717 -2.283 -0.469 0.00 0.00 C+0 HETATM 46 C UNK 0 3.729 -3.413 -0.334 0.00 0.00 C+0 HETATM 47 C UNK 0 3.237 -4.456 0.645 0.00 0.00 C+0 HETATM 48 C UNK 0 4.266 -5.573 0.756 0.00 0.00 C+0 HETATM 49 N UNK 0 5.516 -5.026 1.222 0.00 0.00 N+0 HETATM 50 C UNK 0 6.519 -4.963 0.422 0.00 0.00 C+0 HETATM 51 N UNK 0 6.369 -5.435 -0.904 0.00 0.00 N+0 HETATM 52 N UNK 0 7.749 -4.418 0.903 0.00 0.00 N+0 HETATM 53 C UNK 0 2.323 -1.807 0.859 0.00 0.00 C+0 HETATM 54 O UNK 0 3.220 -1.617 1.722 0.00 0.00 O+0 HETATM 55 N UNK 0 0.987 -1.545 1.239 0.00 0.00 N+0 HETATM 56 C UNK 0 -0.163 -1.993 0.514 0.00 0.00 C+0 HETATM 57 C UNK 0 -0.470 -3.410 1.045 0.00 0.00 C+0 HETATM 58 C UNK 0 -1.407 -3.222 2.217 0.00 0.00 C+0 HETATM 59 C UNK 0 -2.834 -2.928 1.696 0.00 0.00 C+0 HETATM 60 O UNK 0 -3.290 -4.086 1.191 0.00 0.00 O+0 HETATM 61 N UNK 0 -2.590 -1.851 0.675 0.00 0.00 N+0 HETATM 62 C UNK 0 -1.390 -1.135 0.846 0.00 0.00 C+0 HETATM 63 O UNK 0 -1.097 0.014 1.202 0.00 0.00 O+0 HETATM 64 H UNK 0 -5.629 -1.979 -2.507 0.00 0.00 H+0 HETATM 65 H UNK 0 -7.005 -1.191 -1.533 0.00 0.00 H+0 HETATM 66 H UNK 0 -7.178 -2.831 -2.314 0.00 0.00 H+0 HETATM 67 H UNK 0 -6.936 -2.787 0.143 0.00 0.00 H+0 HETATM 68 H UNK 0 -6.580 -4.544 -1.456 0.00 0.00 H+0 HETATM 69 H UNK 0 -4.834 -4.255 -1.461 0.00 0.00 H+0 HETATM 70 H UNK 0 -5.704 -4.835 0.064 0.00 0.00 H+0 HETATM 71 H UNK 0 -4.917 -2.468 1.325 0.00 0.00 H+0 HETATM 72 H UNK 0 -5.378 -1.007 0.478 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.443 -2.921 -0.789 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.256 0.287 -3.758 0.00 0.00 H+0 HETATM 75 H UNK 0 -5.707 0.381 -2.764 0.00 0.00 H+0 HETATM 76 H UNK 0 -4.675 1.850 -3.071 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.113 1.249 0.120 0.00 0.00 H+0 HETATM 78 H UNK 0 -5.122 2.943 -1.421 0.00 0.00 H+0 HETATM 79 H UNK 0 -4.303 3.267 0.103 0.00 0.00 H+0 HETATM 80 H UNK 0 -7.175 1.373 -1.293 0.00 0.00 H+0 HETATM 81 H UNK 0 -8.834 0.352 0.111 0.00 0.00 H+0 HETATM 82 H UNK 0 -8.513 0.162 2.510 0.00 0.00 H+0 HETATM 83 H UNK 0 -6.451 1.014 3.534 0.00 0.00 H+0 HETATM 84 H UNK 0 -4.696 2.071 2.094 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.927 4.383 -1.632 0.00 0.00 H+0 HETATM 86 H UNK 0 -0.729 2.604 0.511 0.00 0.00 H+0 HETATM 87 H UNK 0 -0.724 5.614 -0.061 0.00 0.00 H+0 HETATM 88 H UNK 0 0.439 3.843 2.122 0.00 0.00 H+0 HETATM 89 H UNK 0 1.113 5.364 1.311 0.00 0.00 H+0 HETATM 90 H UNK 0 -0.217 5.449 2.480 0.00 0.00 H+0 HETATM 91 H UNK 0 -3.000 5.243 0.521 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.586 3.893 1.656 0.00 0.00 H+0 HETATM 93 H UNK 0 -2.118 5.549 2.105 0.00 0.00 H+0 HETATM 94 H UNK 0 1.224 0.972 0.127 0.00 0.00 H+0 HETATM 95 H UNK 0 0.868 1.446 -2.552 0.00 0.00 H+0 HETATM 96 H UNK 0 1.103 -0.263 -1.920 0.00 0.00 H+0 HETATM 97 H UNK 0 2.496 0.755 -2.610 0.00 0.00 H+0 HETATM 98 H UNK 0 3.386 0.908 0.753 0.00 0.00 H+0 HETATM 99 H UNK 0 4.117 2.557 -1.611 0.00 0.00 H+0 HETATM 100 H UNK 0 5.201 5.022 0.555 0.00 0.00 H+0 HETATM 101 H UNK 0 6.017 3.716 -1.869 0.00 0.00 H+0 HETATM 102 H UNK 0 7.133 3.767 1.477 0.00 0.00 H+0 HETATM 103 H UNK 0 7.530 3.127 -0.148 0.00 0.00 H+0 HETATM 104 H UNK 0 10.648 5.213 2.301 0.00 0.00 H+0 HETATM 105 H UNK 0 3.052 -1.565 -2.429 0.00 0.00 H+0 HETATM 106 H UNK 0 1.810 -2.780 -0.897 0.00 0.00 H+0 HETATM 107 H UNK 0 3.945 -3.894 -1.297 0.00 0.00 H+0 HETATM 108 H UNK 0 4.685 -3.013 0.064 0.00 0.00 H+0 HETATM 109 H UNK 0 2.293 -4.896 0.294 0.00 0.00 H+0 HETATM 110 H UNK 0 3.064 -4.024 1.650 0.00 0.00 H+0 HETATM 111 H UNK 0 4.410 -6.018 -0.247 0.00 0.00 H+0 HETATM 112 H UNK 0 3.900 -6.382 1.423 0.00 0.00 H+0 HETATM 113 H UNK 0 6.404 -6.451 -1.086 0.00 0.00 H+0 HETATM 114 H UNK 0 6.224 -4.719 -1.669 0.00 0.00 H+0 HETATM 115 H UNK 0 8.450 -5.074 1.326 0.00 0.00 H+0 HETATM 116 H UNK 0 7.992 -3.410 0.860 0.00 0.00 H+0 HETATM 117 H UNK 0 0.822 -0.988 2.106 0.00 0.00 H+0 HETATM 118 H UNK 0 -0.044 -1.998 -0.580 0.00 0.00 H+0 HETATM 119 H UNK 0 -0.854 -4.051 0.258 0.00 0.00 H+0 HETATM 120 H UNK 0 0.461 -3.873 1.453 0.00 0.00 H+0 HETATM 121 H UNK 0 -1.080 -2.342 2.786 0.00 0.00 H+0 HETATM 122 H UNK 0 -1.465 -4.138 2.803 0.00 0.00 H+0 HETATM 123 H UNK 0 -3.404 -2.573 2.539 0.00 0.00 H+0 HETATM 124 H UNK 0 -2.845 -4.455 0.415 0.00 0.00 H+0 CONECT 1 2 64 65 66 CONECT 2 1 3 4 67 CONECT 3 2 68 69 70 CONECT 4 2 5 71 72 CONECT 5 4 6 61 73 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 10 CONECT 9 8 74 75 76 CONECT 10 8 11 18 77 CONECT 11 10 12 78 79 CONECT 12 11 13 17 CONECT 13 12 14 80 CONECT 14 13 15 81 CONECT 15 14 16 82 CONECT 16 15 17 83 CONECT 17 16 12 84 CONECT 18 10 19 20 CONECT 19 18 CONECT 20 18 21 85 CONECT 21 20 22 25 86 CONECT 22 21 23 24 87 CONECT 23 22 88 89 90 CONECT 24 22 91 92 93 CONECT 25 21 26 27 CONECT 26 25 CONECT 27 25 28 CONECT 28 27 29 30 94 CONECT 29 28 95 96 97 CONECT 30 28 31 42 98 CONECT 31 30 32 99 CONECT 32 31 33 34 CONECT 33 32 CONECT 34 32 35 36 100 CONECT 35 34 101 CONECT 36 34 37 102 103 CONECT 37 36 38 CONECT 38 37 39 40 41 CONECT 39 38 CONECT 40 38 CONECT 41 38 104 CONECT 42 30 43 44 CONECT 43 42 CONECT 44 42 45 105 CONECT 45 44 46 53 106 CONECT 46 45 47 107 108 CONECT 47 46 48 109 110 CONECT 48 47 49 111 112 CONECT 49 48 50 CONECT 50 49 51 52 CONECT 51 50 113 114 CONECT 52 50 115 116 CONECT 53 45 54 55 CONECT 54 53 CONECT 55 53 56 117 CONECT 56 55 57 62 118 CONECT 57 56 58 119 120 CONECT 58 57 59 121 122 CONECT 59 58 60 61 123 CONECT 60 59 124 CONECT 61 59 62 5 CONECT 62 61 63 56 CONECT 63 62 CONECT 64 1 CONECT 65 1 CONECT 66 1 CONECT 67 2 CONECT 68 3 CONECT 69 3 CONECT 70 3 CONECT 71 4 CONECT 72 4 CONECT 73 5 CONECT 74 9 CONECT 75 9 CONECT 76 9 CONECT 77 10 CONECT 78 11 CONECT 79 11 CONECT 80 13 CONECT 81 14 CONECT 82 15 CONECT 83 16 CONECT 84 17 CONECT 85 20 CONECT 86 21 CONECT 87 22 CONECT 88 23 CONECT 89 23 CONECT 90 23 CONECT 91 24 CONECT 92 24 CONECT 93 24 CONECT 94 28 CONECT 95 29 CONECT 96 29 CONECT 97 29 CONECT 98 30 CONECT 99 31 CONECT 100 34 CONECT 101 35 CONECT 102 36 CONECT 103 36 CONECT 104 41 CONECT 105 44 CONECT 106 45 CONECT 107 46 CONECT 108 46 CONECT 109 47 CONECT 110 47 CONECT 111 48 CONECT 112 48 CONECT 113 51 CONECT 114 51 CONECT 115 52 CONECT 116 52 CONECT 117 55 CONECT 118 56 CONECT 119 57 CONECT 120 57 CONECT 121 58 CONECT 122 58 CONECT 123 59 CONECT 124 60 MASTER 0 0 0 0 0 0 0 0 124 0 252 0 END