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 14.955 1.362 -0.396 0.00 0.00 C+0 HETATM 2 C UNK 0 13.708 1.225 -1.242 0.00 0.00 C+0 HETATM 3 C UNK 0 13.721 -0.047 -2.054 0.00 0.00 C+0 HETATM 4 C UNK 0 12.446 1.139 -0.366 0.00 0.00 C+0 HETATM 5 C UNK 0 11.298 1.001 -1.320 0.00 0.00 C+0 HETATM 6 C UNK 0 9.992 0.916 -0.591 0.00 0.00 C+0 HETATM 7 C UNK 0 10.002 -0.272 0.324 0.00 0.00 C+0 HETATM 8 C UNK 0 8.666 -0.373 1.044 0.00 0.00 C+0 HETATM 9 C UNK 0 7.559 -0.524 0.054 0.00 0.00 C+0 HETATM 10 C UNK 0 6.235 -0.675 0.802 0.00 0.00 C+0 HETATM 11 C UNK 0 6.215 -1.890 1.685 0.00 0.00 C+0 HETATM 12 C UNK 0 4.946 -2.115 2.391 0.00 0.00 C+0 HETATM 13 O UNK 0 4.843 -1.496 3.560 0.00 0.00 O+0 HETATM 14 N UNK 0 3.843 -2.887 2.034 0.00 0.00 N+0 HETATM 15 C UNK 0 2.850 -3.079 3.170 0.00 0.00 C+0 HETATM 16 C UNK 0 3.450 -3.390 0.789 0.00 0.00 C+0 HETATM 17 C UNK 0 4.326 -4.192 -0.052 0.00 0.00 C+0 HETATM 18 O UNK 0 5.458 -3.619 -0.576 0.00 0.00 O+0 HETATM 19 C UNK 0 2.880 -2.207 -0.041 0.00 0.00 C+0 HETATM 20 O UNK 0 2.756 -2.431 -1.256 0.00 0.00 O+0 HETATM 21 N UNK 0 2.569 -1.036 0.662 0.00 0.00 N+0 HETATM 22 C UNK 0 2.012 0.192 0.096 0.00 0.00 C+0 HETATM 23 C UNK 0 2.823 1.348 0.584 0.00 0.00 C+0 HETATM 24 C UNK 0 0.572 0.291 0.465 0.00 0.00 C+0 HETATM 25 O UNK 0 -0.068 -0.785 0.591 0.00 0.00 O+0 HETATM 26 N UNK 0 -0.084 1.519 0.675 0.00 0.00 N+0 HETATM 27 C UNK 0 -1.497 1.558 1.032 0.00 0.00 C+0 HETATM 28 C UNK 0 -2.344 0.971 -0.029 0.00 0.00 C+0 HETATM 29 O UNK 0 -1.791 0.567 -1.075 0.00 0.00 O+0 HETATM 30 N UNK 0 -3.721 0.875 0.138 0.00 0.00 N+0 HETATM 31 C UNK 0 -4.336 1.308 1.405 0.00 0.00 C+0 HETATM 32 C UNK 0 -4.654 0.414 -0.860 0.00 0.00 C+0 HETATM 33 C UNK 0 -5.143 -0.916 -0.420 0.00 0.00 C+0 HETATM 34 O UNK 0 -4.194 -1.784 -0.307 0.00 0.00 O+0 HETATM 35 N UNK 0 -6.442 -1.347 -0.114 0.00 0.00 N+0 HETATM 36 C UNK 0 -7.638 -1.550 -0.869 0.00 0.00 C+0 HETATM 37 C UNK 0 -7.340 -2.699 -1.931 0.00 0.00 C+0 HETATM 38 C UNK 0 -8.824 -2.037 -0.105 0.00 0.00 C+0 HETATM 39 O UNK 0 -8.431 -3.052 0.662 0.00 0.00 O+0 HETATM 40 N UNK 0 -10.168 -1.717 -0.008 0.00 0.00 N+0 HETATM 41 C UNK 0 -11.061 -0.988 0.853 0.00 0.00 C+0 HETATM 42 C UNK 0 -11.847 -1.907 1.716 0.00 0.00 C+0 HETATM 43 O UNK 0 -11.761 -3.154 1.714 0.00 0.00 O+0 HETATM 44 O UNK 0 -12.771 -1.345 2.620 0.00 0.00 O+0 HETATM 45 C UNK 0 -12.036 -0.036 0.140 0.00 0.00 C+0 HETATM 46 C UNK 0 -11.288 1.233 -0.270 0.00 0.00 C+0 HETATM 47 C UNK 0 -11.806 2.397 0.279 0.00 0.00 C+0 HETATM 48 C UNK 0 -11.079 3.613 0.271 0.00 0.00 C+0 HETATM 49 C UNK 0 -9.818 3.638 -0.288 0.00 0.00 C+0 HETATM 50 O UNK 0 -9.125 4.816 -0.279 0.00 0.00 O+0 HETATM 51 C UNK 0 -9.347 2.450 -0.820 0.00 0.00 C+0 HETATM 52 C UNK 0 -10.057 1.239 -0.846 0.00 0.00 C+0 HETATM 53 C UNK 0 -7.808 2.511 -1.032 0.00 0.00 C+0 HETATM 54 C UNK 0 -6.935 1.547 -0.507 0.00 0.00 C+0 HETATM 55 C UNK 0 -5.683 1.499 -1.034 0.00 0.00 C+0 HETATM 56 C UNK 0 -5.308 2.406 -2.035 0.00 0.00 C+0 HETATM 57 C UNK 0 -6.208 3.380 -2.526 0.00 0.00 C+0 HETATM 58 C UNK 0 -7.486 3.429 -2.013 0.00 0.00 C+0 HETATM 59 O UNK 0 -8.345 4.374 -2.505 0.00 0.00 O+0 HETATM 60 H UNK 0 15.460 0.362 -0.344 0.00 0.00 H+0 HETATM 61 H UNK 0 14.726 1.650 0.642 0.00 0.00 H+0 HETATM 62 H UNK 0 15.620 2.103 -0.847 0.00 0.00 H+0 HETATM 63 H UNK 0 13.559 2.077 -1.922 0.00 0.00 H+0 HETATM 64 H UNK 0 13.186 0.142 -3.010 0.00 0.00 H+0 HETATM 65 H UNK 0 14.760 -0.327 -2.350 0.00 0.00 H+0 HETATM 66 H UNK 0 13.208 -0.875 -1.515 0.00 0.00 H+0 HETATM 67 H UNK 0 12.516 0.219 0.269 0.00 0.00 H+0 HETATM 68 H UNK 0 12.397 2.011 0.293 0.00 0.00 H+0 HETATM 69 H UNK 0 11.432 0.065 -1.914 0.00 0.00 H+0 HETATM 70 H UNK 0 11.284 1.863 -2.049 0.00 0.00 H+0 HETATM 71 H UNK 0 9.861 1.879 -0.025 0.00 0.00 H+0 HETATM 72 H UNK 0 9.204 0.824 -1.377 0.00 0.00 H+0 HETATM 73 H UNK 0 10.197 -1.214 -0.219 0.00 0.00 H+0 HETATM 74 H UNK 0 10.772 -0.157 1.131 0.00 0.00 H+0 HETATM 75 H UNK 0 8.729 -1.261 1.729 0.00 0.00 H+0 HETATM 76 H UNK 0 8.550 0.541 1.659 0.00 0.00 H+0 HETATM 77 H UNK 0 7.465 0.401 -0.576 0.00 0.00 H+0 HETATM 78 H UNK 0 7.748 -1.422 -0.578 0.00 0.00 H+0 HETATM 79 H UNK 0 5.433 -0.788 0.030 0.00 0.00 H+0 HETATM 80 H UNK 0 6.056 0.238 1.374 0.00 0.00 H+0 HETATM 81 H UNK 0 6.983 -1.588 2.531 0.00 0.00 H+0 HETATM 82 H UNK 0 6.673 -2.770 1.289 0.00 0.00 H+0 HETATM 83 H UNK 0 3.201 -3.942 3.742 0.00 0.00 H+0 HETATM 84 H UNK 0 1.853 -3.163 2.721 0.00 0.00 H+0 HETATM 85 H UNK 0 2.944 -2.170 3.775 0.00 0.00 H+0 HETATM 86 H UNK 0 2.497 -4.039 0.955 0.00 0.00 H+0 HETATM 87 H UNK 0 3.705 -4.576 -0.925 0.00 0.00 H+0 HETATM 88 H UNK 0 4.595 -5.144 0.495 0.00 0.00 H+0 HETATM 89 H UNK 0 6.142 -4.326 -0.797 0.00 0.00 H+0 HETATM 90 H UNK 0 2.755 -1.033 1.708 0.00 0.00 H+0 HETATM 91 H UNK 0 2.043 0.087 -1.012 0.00 0.00 H+0 HETATM 92 H UNK 0 2.442 1.711 1.565 0.00 0.00 H+0 HETATM 93 H UNK 0 2.816 2.150 -0.176 0.00 0.00 H+0 HETATM 94 H UNK 0 3.872 0.981 0.750 0.00 0.00 H+0 HETATM 95 H UNK 0 0.451 2.399 0.574 0.00 0.00 H+0 HETATM 96 H UNK 0 -1.815 2.559 1.374 0.00 0.00 H+0 HETATM 97 H UNK 0 -1.612 0.891 1.932 0.00 0.00 H+0 HETATM 98 H UNK 0 -4.793 0.428 1.928 0.00 0.00 H+0 HETATM 99 H UNK 0 -3.625 1.767 2.087 0.00 0.00 H+0 HETATM 100 H UNK 0 -5.148 2.063 1.211 0.00 0.00 H+0 HETATM 101 H UNK 0 -4.130 0.175 -1.827 0.00 0.00 H+0 HETATM 102 H UNK 0 -6.573 -1.597 0.947 0.00 0.00 H+0 HETATM 103 H UNK 0 -7.799 -0.712 -1.541 0.00 0.00 H+0 HETATM 104 H UNK 0 -8.269 -2.705 -2.535 0.00 0.00 H+0 HETATM 105 H UNK 0 -7.256 -3.653 -1.419 0.00 0.00 H+0 HETATM 106 H UNK 0 -6.509 -2.390 -2.558 0.00 0.00 H+0 HETATM 107 H UNK 0 -10.786 -2.202 -0.806 0.00 0.00 H+0 HETATM 108 H UNK 0 -10.487 -0.336 1.577 0.00 0.00 H+0 HETATM 109 H UNK 0 -13.633 -1.850 2.741 0.00 0.00 H+0 HETATM 110 H UNK 0 -12.558 -0.522 -0.607 0.00 0.00 H+0 HETATM 111 H UNK 0 -12.766 0.219 0.966 0.00 0.00 H+0 HETATM 112 H UNK 0 -12.810 2.401 0.738 0.00 0.00 H+0 HETATM 113 H UNK 0 -11.537 4.493 0.705 0.00 0.00 H+0 HETATM 114 H UNK 0 -9.500 5.639 0.104 0.00 0.00 H+0 HETATM 115 H UNK 0 -9.711 0.344 -1.497 0.00 0.00 H+0 HETATM 116 H UNK 0 -7.197 0.924 0.425 0.00 0.00 H+0 HETATM 117 H UNK 0 -4.294 2.380 -2.461 0.00 0.00 H+0 HETATM 118 H UNK 0 -5.865 4.066 -3.295 0.00 0.00 H+0 HETATM 119 H UNK 0 -8.144 5.043 -3.204 0.00 0.00 H+0 CONECT 1 2 60 61 62 CONECT 2 1 3 4 63 CONECT 3 2 64 65 66 CONECT 4 2 5 67 68 CONECT 5 4 6 69 70 CONECT 6 5 7 71 72 CONECT 7 6 8 73 74 CONECT 8 7 9 75 76 CONECT 9 8 10 77 78 CONECT 10 9 11 79 80 CONECT 11 10 12 81 82 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 16 CONECT 15 14 83 84 85 CONECT 16 14 17 19 86 CONECT 17 16 18 87 88 CONECT 18 17 89 CONECT 19 16 20 21 CONECT 20 19 CONECT 21 19 22 90 CONECT 22 21 23 24 91 CONECT 23 22 92 93 94 CONECT 24 22 25 26 CONECT 25 24 CONECT 26 24 27 95 CONECT 27 26 28 96 97 CONECT 28 27 29 30 CONECT 29 28 CONECT 30 28 31 32 CONECT 31 30 98 99 100 CONECT 32 30 33 55 101 CONECT 33 32 34 35 CONECT 34 33 CONECT 35 33 36 102 CONECT 36 35 37 38 103 CONECT 37 36 104 105 106 CONECT 38 36 39 40 CONECT 39 38 CONECT 40 38 41 107 CONECT 41 40 42 45 108 CONECT 42 41 43 44 CONECT 43 42 CONECT 44 42 109 CONECT 45 41 46 110 111 CONECT 46 45 47 52 CONECT 47 46 48 112 CONECT 48 47 49 113 CONECT 49 48 50 51 CONECT 50 49 114 CONECT 51 49 52 53 CONECT 52 51 46 115 CONECT 53 51 54 58 CONECT 54 53 55 116 CONECT 55 54 56 32 CONECT 56 55 57 117 CONECT 57 56 58 118 CONECT 58 57 59 53 CONECT 59 58 119 CONECT 60 1 CONECT 61 1 CONECT 62 1 CONECT 63 2 CONECT 64 3 CONECT 65 3 CONECT 66 3 CONECT 67 4 CONECT 68 4 CONECT 69 5 CONECT 70 5 CONECT 71 6 CONECT 72 6 CONECT 73 7 CONECT 74 7 CONECT 75 8 CONECT 76 8 CONECT 77 9 CONECT 78 9 CONECT 79 10 CONECT 80 10 CONECT 81 11 CONECT 82 11 CONECT 83 15 CONECT 84 15 CONECT 85 15 CONECT 86 16 CONECT 87 17 CONECT 88 17 CONECT 89 18 CONECT 90 21 CONECT 91 22 CONECT 92 23 CONECT 93 23 CONECT 94 23 CONECT 95 26 CONECT 96 27 CONECT 97 27 CONECT 98 31 CONECT 99 31 CONECT 100 31 CONECT 101 32 CONECT 102 35 CONECT 103 36 CONECT 104 37 CONECT 105 37 CONECT 106 37 CONECT 107 40 CONECT 108 41 CONECT 109 44 CONECT 110 45 CONECT 111 45 CONECT 112 47 CONECT 113 48 CONECT 114 50 CONECT 115 52 CONECT 116 54 CONECT 117 56 CONECT 118 57 CONECT 119 59 MASTER 0 0 0 0 0 0 0 0 119 0 242 0 END