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 -0.270 7.291 0.992 0.00 0.00 C+0 HETATM 2 C UNK 0 0.142 6.356 -0.150 0.00 0.00 C+0 HETATM 3 C UNK 0 0.398 4.969 0.348 0.00 0.00 C+0 HETATM 4 C UNK 0 1.512 4.907 1.358 0.00 0.00 C+0 HETATM 5 C UNK 0 0.447 3.892 -0.676 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.866 3.819 -1.432 0.00 0.00 C+0 HETATM 7 O UNK 0 -0.955 4.375 -2.584 0.00 0.00 O+0 HETATM 8 N UNK 0 -2.009 3.164 -0.926 0.00 0.00 N+0 HETATM 9 C UNK 0 -3.397 3.622 -0.742 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.582 3.189 0.722 0.00 0.00 C+0 HETATM 11 C UNK 0 -2.758 1.919 0.840 0.00 0.00 C+0 HETATM 12 C UNK 0 -2.077 1.792 -0.454 0.00 0.00 C+0 HETATM 13 C UNK 0 -2.809 0.941 -1.482 0.00 0.00 C+0 HETATM 14 O UNK 0 -2.247 1.218 -2.618 0.00 0.00 O+0 HETATM 15 O UNK 0 -3.780 0.143 -1.164 0.00 0.00 O+0 HETATM 16 C UNK 0 -4.397 -1.058 -1.130 0.00 0.00 C+0 HETATM 17 C UNK 0 -5.913 -0.914 -0.894 0.00 0.00 C+0 HETATM 18 C UNK 0 -6.647 -2.177 -0.846 0.00 0.00 C+0 HETATM 19 C UNK 0 -6.114 -0.098 0.336 0.00 0.00 C+0 HETATM 20 C UNK 0 -7.476 0.219 0.794 0.00 0.00 C+0 HETATM 21 C UNK 0 -8.399 -0.874 1.169 0.00 0.00 C+0 HETATM 22 C UNK 0 -7.328 1.109 2.034 0.00 0.00 C+0 HETATM 23 C UNK 0 -8.230 1.089 -0.232 0.00 0.00 C+0 HETATM 24 C UNK 0 -3.777 -2.191 -0.394 0.00 0.00 C+0 HETATM 25 C UNK 0 -2.772 -1.942 0.643 0.00 0.00 C+0 HETATM 26 C UNK 0 -3.215 -1.992 2.063 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.599 -2.921 0.473 0.00 0.00 C+0 HETATM 28 C UNK 0 -2.051 -4.327 0.272 0.00 0.00 C+0 HETATM 29 O UNK 0 -3.322 -4.605 0.738 0.00 0.00 O+0 HETATM 30 C UNK 0 -1.123 -5.339 0.909 0.00 0.00 C+0 HETATM 31 C UNK 0 -1.799 -6.011 2.112 0.00 0.00 C+0 HETATM 32 C UNK 0 0.143 -4.767 1.364 0.00 0.00 C+0 HETATM 33 N UNK 0 1.076 -4.474 0.518 0.00 0.00 N+0 HETATM 34 C UNK 0 2.294 -5.006 0.989 0.00 0.00 C+0 HETATM 35 C UNK 0 3.379 -5.129 0.052 0.00 0.00 C+0 HETATM 36 C UNK 0 3.293 -4.647 -1.202 0.00 0.00 C+0 HETATM 37 C UNK 0 4.026 -5.448 -2.240 0.00 0.00 C+0 HETATM 38 C UNK 0 2.559 -3.454 -1.553 0.00 0.00 C+0 HETATM 39 O UNK 0 1.817 -3.583 -2.614 0.00 0.00 O+0 HETATM 40 N UNK 0 2.557 -2.208 -0.901 0.00 0.00 N+0 HETATM 41 C UNK 0 3.664 -1.353 -0.582 0.00 0.00 C+0 HETATM 42 C UNK 0 4.911 -2.092 -0.188 0.00 0.00 C+0 HETATM 43 C UNK 0 6.052 -1.184 0.142 0.00 0.00 C+0 HETATM 44 C UNK 0 6.966 -0.788 -0.809 0.00 0.00 C+0 HETATM 45 C UNK 0 8.022 0.050 -0.520 0.00 0.00 C+0 HETATM 46 C UNK 0 8.211 0.537 0.758 0.00 0.00 C+0 HETATM 47 O UNK 0 9.272 1.385 1.071 0.00 0.00 O+0 HETATM 48 C UNK 0 10.165 1.742 0.033 0.00 0.00 C+0 HETATM 49 C UNK 0 7.291 0.136 1.703 0.00 0.00 C+0 HETATM 50 C UNK 0 6.233 -0.700 1.429 0.00 0.00 C+0 HETATM 51 C UNK 0 3.978 -0.404 -1.692 0.00 0.00 C+0 HETATM 52 O UNK 0 4.290 -0.972 -2.797 0.00 0.00 O+0 HETATM 53 N UNK 0 3.959 0.987 -1.619 0.00 0.00 N+0 HETATM 54 C UNK 0 5.023 1.745 -2.290 0.00 0.00 C+0 HETATM 55 C UNK 0 2.959 1.797 -0.924 0.00 0.00 C+0 HETATM 56 C UNK 0 3.723 2.474 0.196 0.00 0.00 C+0 HETATM 57 C UNK 0 2.360 2.738 -1.893 0.00 0.00 C+0 HETATM 58 O UNK 0 2.594 2.492 -3.139 0.00 0.00 O+0 HETATM 59 N UNK 0 1.556 3.877 -1.578 0.00 0.00 N+0 HETATM 60 C UNK 0 1.924 5.109 -2.290 0.00 0.00 C+0 HETATM 61 C UNK 0 2.628 -4.289 2.299 0.00 0.00 C+0 HETATM 62 S UNK 0 0.891 -4.291 2.944 0.00 0.00 S+0 HETATM 63 H UNK 0 -0.293 6.764 1.968 0.00 0.00 H+0 HETATM 64 H UNK 0 0.312 8.221 1.018 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.320 7.584 0.799 0.00 0.00 H+0 HETATM 66 H UNK 0 1.033 6.859 -0.590 0.00 0.00 H+0 HETATM 67 H UNK 0 -0.658 6.407 -0.908 0.00 0.00 H+0 HETATM 68 H UNK 0 -0.536 4.742 0.988 0.00 0.00 H+0 HETATM 69 H UNK 0 1.419 5.694 2.137 0.00 0.00 H+0 HETATM 70 H UNK 0 1.522 3.954 1.922 0.00 0.00 H+0 HETATM 71 H UNK 0 2.464 4.982 0.805 0.00 0.00 H+0 HETATM 72 H UNK 0 0.457 2.879 -0.148 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.547 4.683 -0.861 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.067 2.974 -1.351 0.00 0.00 H+0 HETATM 75 H UNK 0 -3.201 3.981 1.397 0.00 0.00 H+0 HETATM 76 H UNK 0 -4.619 2.944 0.964 0.00 0.00 H+0 HETATM 77 H UNK 0 -1.988 2.067 1.629 0.00 0.00 H+0 HETATM 78 H UNK 0 -3.380 1.063 1.159 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.061 1.369 -0.293 0.00 0.00 H+0 HETATM 80 H UNK 0 -4.456 -1.450 -2.207 0.00 0.00 H+0 HETATM 81 H UNK 0 -6.353 -0.296 -1.734 0.00 0.00 H+0 HETATM 82 H UNK 0 -7.625 -2.122 -1.385 0.00 0.00 H+0 HETATM 83 H UNK 0 -6.896 -2.545 0.163 0.00 0.00 H+0 HETATM 84 H UNK 0 -6.157 -3.033 -1.384 0.00 0.00 H+0 HETATM 85 H UNK 0 -5.585 -0.574 1.232 0.00 0.00 H+0 HETATM 86 H UNK 0 -5.570 0.893 0.258 0.00 0.00 H+0 HETATM 87 H UNK 0 -8.948 -1.367 0.360 0.00 0.00 H+0 HETATM 88 H UNK 0 -9.247 -0.357 1.759 0.00 0.00 H+0 HETATM 89 H UNK 0 -7.996 -1.567 1.950 0.00 0.00 H+0 HETATM 90 H UNK 0 -8.317 1.550 2.263 0.00 0.00 H+0 HETATM 91 H UNK 0 -6.523 1.833 1.905 0.00 0.00 H+0 HETATM 92 H UNK 0 -7.087 0.394 2.865 0.00 0.00 H+0 HETATM 93 H UNK 0 -7.500 1.518 -0.965 0.00 0.00 H+0 HETATM 94 H UNK 0 -8.797 1.885 0.278 0.00 0.00 H+0 HETATM 95 H UNK 0 -8.947 0.490 -0.823 0.00 0.00 H+0 HETATM 96 H UNK 0 -3.257 -2.833 -1.146 0.00 0.00 H+0 HETATM 97 H UNK 0 -4.622 -2.854 -0.070 0.00 0.00 H+0 HETATM 98 H UNK 0 -2.306 -0.952 0.480 0.00 0.00 H+0 HETATM 99 H UNK 0 -2.295 -2.206 2.680 0.00 0.00 H+0 HETATM 100 H UNK 0 -3.930 -2.770 2.307 0.00 0.00 H+0 HETATM 101 H UNK 0 -3.525 -0.978 2.381 0.00 0.00 H+0 HETATM 102 H UNK 0 -1.024 -2.554 -0.402 0.00 0.00 H+0 HETATM 103 H UNK 0 -0.956 -2.767 1.363 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.056 -4.532 -0.833 0.00 0.00 H+0 HETATM 105 H UNK 0 -3.658 -5.397 0.215 0.00 0.00 H+0 HETATM 106 H UNK 0 -0.891 -6.178 0.211 0.00 0.00 H+0 HETATM 107 H UNK 0 -1.049 -6.717 2.519 0.00 0.00 H+0 HETATM 108 H UNK 0 -2.694 -6.568 1.805 0.00 0.00 H+0 HETATM 109 H UNK 0 -1.986 -5.252 2.888 0.00 0.00 H+0 HETATM 110 H UNK 0 2.045 -6.060 1.335 0.00 0.00 H+0 HETATM 111 H UNK 0 4.290 -5.624 0.368 0.00 0.00 H+0 HETATM 112 H UNK 0 4.159 -4.936 -3.189 0.00 0.00 H+0 HETATM 113 H UNK 0 3.468 -6.401 -2.478 0.00 0.00 H+0 HETATM 114 H UNK 0 5.015 -5.662 -1.814 0.00 0.00 H+0 HETATM 115 H UNK 0 1.601 -1.855 -0.616 0.00 0.00 H+0 HETATM 116 H UNK 0 3.391 -0.721 0.289 0.00 0.00 H+0 HETATM 117 H UNK 0 4.773 -2.708 0.724 0.00 0.00 H+0 HETATM 118 H UNK 0 5.289 -2.776 -0.967 0.00 0.00 H+0 HETATM 119 H UNK 0 6.851 -1.157 -1.840 0.00 0.00 H+0 HETATM 120 H UNK 0 8.739 0.352 -1.292 0.00 0.00 H+0 HETATM 121 H UNK 0 10.934 2.455 0.377 0.00 0.00 H+0 HETATM 122 H UNK 0 9.644 2.217 -0.830 0.00 0.00 H+0 HETATM 123 H UNK 0 10.690 0.849 -0.378 0.00 0.00 H+0 HETATM 124 H UNK 0 7.421 0.505 2.708 0.00 0.00 H+0 HETATM 125 H UNK 0 5.511 -1.010 2.188 0.00 0.00 H+0 HETATM 126 H UNK 0 4.759 2.816 -2.418 0.00 0.00 H+0 HETATM 127 H UNK 0 5.317 1.257 -3.230 0.00 0.00 H+0 HETATM 128 H UNK 0 5.948 1.766 -1.642 0.00 0.00 H+0 HETATM 129 H UNK 0 2.198 1.155 -0.434 0.00 0.00 H+0 HETATM 130 H UNK 0 4.054 3.486 -0.149 0.00 0.00 H+0 HETATM 131 H UNK 0 4.705 1.947 0.398 0.00 0.00 H+0 HETATM 132 H UNK 0 3.187 2.461 1.143 0.00 0.00 H+0 HETATM 133 H UNK 0 0.997 5.616 -2.564 0.00 0.00 H+0 HETATM 134 H UNK 0 2.398 4.849 -3.294 0.00 0.00 H+0 HETATM 135 H UNK 0 2.687 5.686 -1.776 0.00 0.00 H+0 HETATM 136 H UNK 0 2.981 -3.272 2.170 0.00 0.00 H+0 HETATM 137 H UNK 0 3.262 -4.943 2.898 0.00 0.00 H+0 CONECT 1 2 63 64 65 CONECT 2 1 3 66 67 CONECT 3 2 4 5 68 CONECT 4 3 69 70 71 CONECT 5 3 6 59 72 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 12 CONECT 9 8 10 73 74 CONECT 10 9 11 75 76 CONECT 11 10 12 77 78 CONECT 12 11 13 8 79 CONECT 13 12 14 15 CONECT 14 13 CONECT 15 13 16 CONECT 16 15 17 24 80 CONECT 17 16 18 19 81 CONECT 18 17 82 83 84 CONECT 19 17 20 85 86 CONECT 20 19 21 22 23 CONECT 21 20 87 88 89 CONECT 22 20 90 91 92 CONECT 23 20 93 94 95 CONECT 24 16 25 96 97 CONECT 25 24 26 27 98 CONECT 26 25 99 100 101 CONECT 27 25 28 102 103 CONECT 28 27 29 30 104 CONECT 29 28 105 CONECT 30 28 31 32 106 CONECT 31 30 107 108 109 CONECT 32 30 33 62 CONECT 33 32 34 CONECT 34 33 35 61 110 CONECT 35 34 36 111 CONECT 36 35 37 38 CONECT 37 36 112 113 114 CONECT 38 36 39 40 CONECT 39 38 CONECT 40 38 41 115 CONECT 41 40 42 51 116 CONECT 42 41 43 117 118 CONECT 43 42 44 50 CONECT 44 43 45 119 CONECT 45 44 46 120 CONECT 46 45 47 49 CONECT 47 46 48 CONECT 48 47 121 122 123 CONECT 49 46 50 124 CONECT 50 49 43 125 CONECT 51 41 52 53 CONECT 52 51 CONECT 53 51 54 55 CONECT 54 53 126 127 128 CONECT 55 53 56 57 129 CONECT 56 55 130 131 132 CONECT 57 55 58 59 CONECT 58 57 CONECT 59 57 60 5 CONECT 60 59 133 134 135 CONECT 61 34 62 136 137 CONECT 62 61 32 CONECT 63 1 CONECT 64 1 CONECT 65 1 CONECT 66 2 CONECT 67 2 CONECT 68 3 CONECT 69 4 CONECT 70 4 CONECT 71 4 CONECT 72 5 CONECT 73 9 CONECT 74 9 CONECT 75 10 CONECT 76 10 CONECT 77 11 CONECT 78 11 CONECT 79 12 CONECT 80 16 CONECT 81 17 CONECT 82 18 CONECT 83 18 CONECT 84 18 CONECT 85 19 CONECT 86 19 CONECT 87 21 CONECT 88 21 CONECT 89 21 CONECT 90 22 CONECT 91 22 CONECT 92 22 CONECT 93 23 CONECT 94 23 CONECT 95 23 CONECT 96 24 CONECT 97 24 CONECT 98 25 CONECT 99 26 CONECT 100 26 CONECT 101 26 CONECT 102 27 CONECT 103 27 CONECT 104 28 CONECT 105 29 CONECT 106 30 CONECT 107 31 CONECT 108 31 CONECT 109 31 CONECT 110 34 CONECT 111 35 CONECT 112 37 CONECT 113 37 CONECT 114 37 CONECT 115 40 CONECT 116 41 CONECT 117 42 CONECT 118 42 CONECT 119 44 CONECT 120 45 CONECT 121 48 CONECT 122 48 CONECT 123 48 CONECT 124 49 CONECT 125 50 CONECT 126 54 CONECT 127 54 CONECT 128 54 CONECT 129 55 CONECT 130 56 CONECT 131 56 CONECT 132 56 CONECT 133 60 CONECT 134 60 CONECT 135 60 CONECT 136 61 CONECT 137 61 MASTER 0 0 0 0 0 0 0 0 137 0 280 0 END