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 -6.120 3.731 -3.402 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.930 3.300 -1.962 0.00 0.00 C+0 HETATM 3 C UNK 0 -7.168 2.454 -1.625 0.00 0.00 C+0 HETATM 4 C UNK 0 -4.756 2.342 -1.891 0.00 0.00 C+0 HETATM 5 C UNK 0 -4.577 1.926 -0.468 0.00 0.00 C+0 HETATM 6 N UNK 0 -3.504 1.014 -0.234 0.00 0.00 N+0 HETATM 7 C UNK 0 -3.102 -0.088 -0.975 0.00 0.00 C+0 HETATM 8 O UNK 0 -1.875 -0.127 -1.344 0.00 0.00 O+0 HETATM 9 C UNK 0 -3.923 -1.252 -1.406 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.151 -1.487 -0.623 0.00 0.00 C+0 HETATM 11 C UNK 0 -5.044 -1.722 0.828 0.00 0.00 C+0 HETATM 12 C UNK 0 -6.475 -1.915 1.356 0.00 0.00 C+0 HETATM 13 N UNK 0 -7.065 -3.048 0.693 0.00 0.00 N+0 HETATM 14 C UNK 0 -8.010 -3.754 1.157 0.00 0.00 C+0 HETATM 15 N UNK 0 -8.499 -4.847 0.396 0.00 0.00 N+0 HETATM 16 N UNK 0 -8.596 -3.485 2.411 0.00 0.00 N+0 HETATM 17 N UNK 0 -3.151 -2.369 -1.848 0.00 0.00 N+0 HETATM 18 C UNK 0 -2.870 -3.636 -1.390 0.00 0.00 C+0 HETATM 19 O UNK 0 -3.513 -4.608 -1.990 0.00 0.00 O+0 HETATM 20 C UNK 0 -1.977 -4.176 -0.344 0.00 0.00 C+0 HETATM 21 C UNK 0 -2.650 -4.805 0.826 0.00 0.00 C+0 HETATM 22 C UNK 0 -2.153 -4.001 2.008 0.00 0.00 C+0 HETATM 23 C UNK 0 -1.488 -2.771 1.398 0.00 0.00 C+0 HETATM 24 N UNK 0 -0.958 -3.291 0.146 0.00 0.00 N+0 HETATM 25 C UNK 0 0.246 -3.084 -0.570 0.00 0.00 C+0 HETATM 26 O UNK 0 0.573 -1.883 -0.835 0.00 0.00 O+0 HETATM 27 C UNK 0 1.172 -4.141 -1.050 0.00 0.00 C+0 HETATM 28 C UNK 0 1.494 -5.139 0.019 0.00 0.00 C+0 HETATM 29 C UNK 0 2.381 -6.229 -0.527 0.00 0.00 C+0 HETATM 30 C UNK 0 2.890 -7.235 0.247 0.00 0.00 C+0 HETATM 31 N UNK 0 3.600 -8.048 -0.556 0.00 0.00 N+0 HETATM 32 C UNK 0 3.538 -7.566 -1.796 0.00 0.00 C+0 HETATM 33 N UNK 0 2.780 -6.434 -1.776 0.00 0.00 N+0 HETATM 34 N UNK 0 2.321 -3.582 -1.704 0.00 0.00 N+0 HETATM 35 C UNK 0 3.566 -3.133 -1.248 0.00 0.00 C+0 HETATM 36 O UNK 0 4.507 -3.098 -2.155 0.00 0.00 O+0 HETATM 37 C UNK 0 4.043 -2.684 0.053 0.00 0.00 C+0 HETATM 38 C UNK 0 4.860 -3.587 0.897 0.00 0.00 C+0 HETATM 39 C UNK 0 6.169 -4.072 0.429 0.00 0.00 C+0 HETATM 40 C UNK 0 6.736 -4.949 1.587 0.00 0.00 C+0 HETATM 41 C UNK 0 6.164 -4.974 -0.766 0.00 0.00 C+0 HETATM 42 N UNK 0 3.059 -2.021 0.894 0.00 0.00 N+0 HETATM 43 C UNK 0 2.925 -0.600 0.905 0.00 0.00 C+0 HETATM 44 O UNK 0 1.842 -0.118 1.374 0.00 0.00 O+0 HETATM 45 C UNK 0 3.937 0.343 0.417 0.00 0.00 C+0 HETATM 46 N UNK 0 4.998 0.419 1.399 0.00 0.00 N+0 HETATM 47 C UNK 0 5.562 1.654 1.803 0.00 0.00 C+0 HETATM 48 O UNK 0 6.019 1.793 2.963 0.00 0.00 O+0 HETATM 49 C UNK 0 5.629 2.809 0.877 0.00 0.00 C+0 HETATM 50 C UNK 0 6.689 2.425 -0.166 0.00 0.00 C+0 HETATM 51 C UNK 0 6.858 3.510 -1.167 0.00 0.00 C+0 HETATM 52 O UNK 0 6.168 4.555 -1.093 0.00 0.00 O+0 HETATM 53 O UNK 0 7.787 3.346 -2.176 0.00 0.00 O+0 HETATM 54 N UNK 0 6.165 3.970 1.559 0.00 0.00 N+0 HETATM 55 C UNK 0 5.624 5.275 1.512 0.00 0.00 C+0 HETATM 56 O UNK 0 6.449 6.254 1.498 0.00 0.00 O+0 HETATM 57 C UNK 0 4.169 5.591 1.476 0.00 0.00 C+0 HETATM 58 N UNK 0 3.961 7.024 1.456 0.00 0.00 N+0 HETATM 59 C UNK 0 3.626 7.791 0.305 0.00 0.00 C+0 HETATM 60 O UNK 0 4.192 8.914 0.096 0.00 0.00 O+0 HETATM 61 C UNK 0 2.614 7.325 -0.695 0.00 0.00 C+0 HETATM 62 C UNK 0 2.729 7.545 -2.049 0.00 0.00 C+0 HETATM 63 S UNK 0 1.295 6.794 -2.643 0.00 0.00 S+0 HETATM 64 C UNK 0 0.665 6.266 -1.155 0.00 0.00 C+0 HETATM 65 N UNK 0 1.544 6.670 -0.300 0.00 0.00 N+0 HETATM 66 C UNK 0 -0.556 5.528 -0.696 0.00 0.00 C+0 HETATM 67 C UNK 0 -0.398 5.101 0.752 0.00 0.00 C+0 HETATM 68 O UNK 0 -0.261 6.287 1.505 0.00 0.00 O+0 HETATM 69 N UNK 0 -1.719 6.370 -0.893 0.00 0.00 N+0 HETATM 70 C UNK 0 -2.833 6.474 -0.042 0.00 0.00 C+0 HETATM 71 O UNK 0 -3.260 7.642 0.259 0.00 0.00 O+0 HETATM 72 C UNK 0 -3.563 5.317 0.544 0.00 0.00 C+0 HETATM 73 C UNK 0 -4.106 5.313 1.817 0.00 0.00 C+0 HETATM 74 S UNK 0 -4.801 3.741 1.890 0.00 0.00 S+0 HETATM 75 C UNK 0 -4.363 3.199 0.321 0.00 0.00 C+0 HETATM 76 N UNK 0 -3.722 4.236 -0.154 0.00 0.00 N+0 HETATM 77 H UNK 0 -5.153 3.670 -3.939 0.00 0.00 H+0 HETATM 78 H UNK 0 -6.817 3.042 -3.945 0.00 0.00 H+0 HETATM 79 H UNK 0 -6.483 4.785 -3.398 0.00 0.00 H+0 HETATM 80 H UNK 0 -5.886 4.114 -1.250 0.00 0.00 H+0 HETATM 81 H UNK 0 -8.057 2.806 -2.184 0.00 0.00 H+0 HETATM 82 H UNK 0 -6.975 1.392 -1.890 0.00 0.00 H+0 HETATM 83 H UNK 0 -7.379 2.471 -0.538 0.00 0.00 H+0 HETATM 84 H UNK 0 -5.082 1.466 -2.530 0.00 0.00 H+0 HETATM 85 H UNK 0 -3.828 2.792 -2.280 0.00 0.00 H+0 HETATM 86 H UNK 0 -5.536 1.530 -0.080 0.00 0.00 H+0 HETATM 87 H UNK 0 -2.924 1.210 0.643 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.372 -0.816 -2.405 0.00 0.00 H+0 HETATM 89 H UNK 0 -5.652 -2.389 -1.068 0.00 0.00 H+0 HETATM 90 H UNK 0 -5.911 -0.678 -0.792 0.00 0.00 H+0 HETATM 91 H UNK 0 -4.642 -0.875 1.414 0.00 0.00 H+0 HETATM 92 H UNK 0 -4.503 -2.611 1.139 0.00 0.00 H+0 HETATM 93 H UNK 0 -6.484 -1.994 2.449 0.00 0.00 H+0 HETATM 94 H UNK 0 -7.072 -1.019 1.048 0.00 0.00 H+0 HETATM 95 H UNK 0 -9.314 -4.800 -0.234 0.00 0.00 H+0 HETATM 96 H UNK 0 -8.011 -5.765 0.468 0.00 0.00 H+0 HETATM 97 H UNK 0 -8.088 -3.716 3.281 0.00 0.00 H+0 HETATM 98 H UNK 0 -9.537 -3.058 2.476 0.00 0.00 H+0 HETATM 99 H UNK 0 -2.667 -2.149 -2.819 0.00 0.00 H+0 HETATM 100 H UNK 0 -1.370 -5.045 -0.794 0.00 0.00 H+0 HETATM 101 H UNK 0 -2.354 -5.861 1.026 0.00 0.00 H+0 HETATM 102 H UNK 0 -3.753 -4.809 0.792 0.00 0.00 H+0 HETATM 103 H UNK 0 -1.427 -4.575 2.617 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.980 -3.649 2.647 0.00 0.00 H+0 HETATM 105 H UNK 0 -0.752 -2.425 2.116 0.00 0.00 H+0 HETATM 106 H UNK 0 -2.199 -1.946 1.231 0.00 0.00 H+0 HETATM 107 H UNK 0 0.581 -4.751 -1.811 0.00 0.00 H+0 HETATM 108 H UNK 0 0.567 -5.675 0.311 0.00 0.00 H+0 HETATM 109 H UNK 0 1.934 -4.764 0.930 0.00 0.00 H+0 HETATM 110 H UNK 0 2.776 -7.394 1.298 0.00 0.00 H+0 HETATM 111 H UNK 0 3.977 -7.942 -2.699 0.00 0.00 H+0 HETATM 112 H UNK 0 2.561 -5.849 -2.590 0.00 0.00 H+0 HETATM 113 H UNK 0 2.166 -3.490 -2.773 0.00 0.00 H+0 HETATM 114 H UNK 0 4.790 -1.792 -0.138 0.00 0.00 H+0 HETATM 115 H UNK 0 5.030 -3.058 1.877 0.00 0.00 H+0 HETATM 116 H UNK 0 4.264 -4.510 1.200 0.00 0.00 H+0 HETATM 117 H UNK 0 6.943 -3.288 0.300 0.00 0.00 H+0 HETATM 118 H UNK 0 6.028 -5.772 1.816 0.00 0.00 H+0 HETATM 119 H UNK 0 6.860 -4.349 2.501 0.00 0.00 H+0 HETATM 120 H UNK 0 7.687 -5.399 1.283 0.00 0.00 H+0 HETATM 121 H UNK 0 6.793 -5.910 -0.565 0.00 0.00 H+0 HETATM 122 H UNK 0 5.169 -5.381 -0.969 0.00 0.00 H+0 HETATM 123 H UNK 0 6.678 -4.545 -1.663 0.00 0.00 H+0 HETATM 124 H UNK 0 2.410 -2.536 1.527 0.00 0.00 H+0 HETATM 125 H UNK 0 4.326 0.122 -0.599 0.00 0.00 H+0 HETATM 126 H UNK 0 3.463 1.355 0.317 0.00 0.00 H+0 HETATM 127 H UNK 0 5.333 -0.496 1.803 0.00 0.00 H+0 HETATM 128 H UNK 0 4.674 3.005 0.368 0.00 0.00 H+0 HETATM 129 H UNK 0 7.636 2.289 0.399 0.00 0.00 H+0 HETATM 130 H UNK 0 6.433 1.451 -0.629 0.00 0.00 H+0 HETATM 131 H UNK 0 8.718 3.748 -2.163 0.00 0.00 H+0 HETATM 132 H UNK 0 7.024 3.804 2.128 0.00 0.00 H+0 HETATM 133 H UNK 0 3.663 5.220 2.415 0.00 0.00 H+0 HETATM 134 H UNK 0 3.655 5.064 0.657 0.00 0.00 H+0 HETATM 135 H UNK 0 4.076 7.525 2.369 0.00 0.00 H+0 HETATM 136 H UNK 0 3.522 8.064 -2.621 0.00 0.00 H+0 HETATM 137 H UNK 0 -0.667 4.601 -1.296 0.00 0.00 H+0 HETATM 138 H UNK 0 0.557 4.559 0.907 0.00 0.00 H+0 HETATM 139 H UNK 0 -1.279 4.583 1.135 0.00 0.00 H+0 HETATM 140 H UNK 0 -0.715 7.050 1.088 0.00 0.00 H+0 HETATM 141 H UNK 0 -1.727 6.978 -1.773 0.00 0.00 H+0 HETATM 142 H UNK 0 -4.108 6.092 2.585 0.00 0.00 H+0 CONECT 1 2 77 78 79 CONECT 2 1 3 4 80 CONECT 3 2 81 82 83 CONECT 4 2 5 84 85 CONECT 5 4 6 75 86 CONECT 6 5 7 87 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 17 88 CONECT 10 9 11 89 90 CONECT 11 10 12 91 92 CONECT 12 11 13 93 94 CONECT 13 12 14 CONECT 14 13 15 16 CONECT 15 14 95 96 CONECT 16 14 97 98 CONECT 17 9 18 99 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 24 100 CONECT 21 20 22 101 102 CONECT 22 21 23 103 104 CONECT 23 22 24 105 106 CONECT 24 23 25 20 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 34 107 CONECT 28 27 29 108 109 CONECT 29 28 30 33 CONECT 30 29 31 110 CONECT 31 30 32 CONECT 32 31 33 111 CONECT 33 32 29 112 CONECT 34 27 35 113 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 42 114 CONECT 38 37 39 115 116 CONECT 39 38 40 41 117 CONECT 40 39 118 119 120 CONECT 41 39 121 122 123 CONECT 42 37 43 124 CONECT 43 42 44 45 CONECT 44 43 CONECT 45 43 46 125 126 CONECT 46 45 47 127 CONECT 47 46 48 49 CONECT 48 47 CONECT 49 47 50 54 128 CONECT 50 49 51 129 130 CONECT 51 50 52 53 CONECT 52 51 CONECT 53 51 131 CONECT 54 49 55 132 CONECT 55 54 56 57 CONECT 56 55 CONECT 57 55 58 133 134 CONECT 58 57 59 135 CONECT 59 58 60 61 CONECT 60 59 CONECT 61 59 62 65 CONECT 62 61 63 136 CONECT 63 62 64 CONECT 64 63 65 66 CONECT 65 64 61 CONECT 66 64 67 69 137 CONECT 67 66 68 138 139 CONECT 68 67 140 CONECT 69 66 70 141 CONECT 70 69 71 72 CONECT 71 70 CONECT 72 70 73 76 CONECT 73 72 74 142 CONECT 74 73 75 CONECT 75 74 76 5 CONECT 76 75 72 CONECT 77 1 CONECT 78 1 CONECT 79 1 CONECT 80 2 CONECT 81 3 CONECT 82 3 CONECT 83 3 CONECT 84 4 CONECT 85 4 CONECT 86 5 CONECT 87 6 CONECT 88 9 CONECT 89 10 CONECT 90 10 CONECT 91 11 CONECT 92 11 CONECT 93 12 CONECT 94 12 CONECT 95 15 CONECT 96 15 CONECT 97 16 CONECT 98 16 CONECT 99 17 CONECT 100 20 CONECT 101 21 CONECT 102 21 CONECT 103 22 CONECT 104 22 CONECT 105 23 CONECT 106 23 CONECT 107 27 CONECT 108 28 CONECT 109 28 CONECT 110 30 CONECT 111 32 CONECT 112 33 CONECT 113 34 CONECT 114 37 CONECT 115 38 CONECT 116 38 CONECT 117 39 CONECT 118 40 CONECT 119 40 CONECT 120 40 CONECT 121 41 CONECT 122 41 CONECT 123 41 CONECT 124 42 CONECT 125 45 CONECT 126 45 CONECT 127 46 CONECT 128 49 CONECT 129 50 CONECT 130 50 CONECT 131 53 CONECT 132 54 CONECT 133 57 CONECT 134 57 CONECT 135 58 CONECT 136 62 CONECT 137 66 CONECT 138 67 CONECT 139 67 CONECT 140 68 CONECT 141 69 CONECT 142 73 MASTER 0 0 0 0 0 0 0 0 142 0 292 0 END