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 10.410 -0.901 -3.885 0.00 0.00 C+0 HETATM 2 C UNK 0 9.749 -1.234 -2.611 0.00 0.00 C+0 HETATM 3 O UNK 0 9.927 -2.350 -2.090 0.00 0.00 O+0 HETATM 4 N UNK 0 8.912 -0.289 -1.978 0.00 0.00 N+0 HETATM 5 C UNK 0 8.224 -0.539 -0.721 0.00 0.00 C+0 HETATM 6 C UNK 0 8.544 0.604 0.251 0.00 0.00 C+0 HETATM 7 O UNK 0 9.878 0.966 0.212 0.00 0.00 O+0 HETATM 8 O UNK 0 8.218 0.204 1.521 0.00 0.00 O+0 HETATM 9 C UNK 0 6.963 -0.296 1.702 0.00 0.00 C+0 HETATM 10 C UNK 0 7.013 -1.560 2.557 0.00 0.00 C+0 HETATM 11 O UNK 0 7.566 -1.311 3.812 0.00 0.00 O+0 HETATM 12 C UNK 0 6.094 -0.471 0.515 0.00 0.00 C+0 HETATM 13 O UNK 0 5.074 0.501 0.463 0.00 0.00 O+0 HETATM 14 C UNK 0 3.815 -0.038 0.664 0.00 0.00 C+0 HETATM 15 O UNK 0 3.055 -0.073 -0.490 0.00 0.00 O+0 HETATM 16 C UNK 0 1.844 0.522 -0.498 0.00 0.00 C+0 HETATM 17 C UNK 0 1.914 1.999 -0.916 0.00 0.00 C+0 HETATM 18 O UNK 0 0.611 2.486 -0.858 0.00 0.00 O+0 HETATM 19 C UNK 0 0.953 0.343 0.694 0.00 0.00 C+0 HETATM 20 O UNK 0 -0.077 -0.532 0.343 0.00 0.00 O+0 HETATM 21 C UNK 0 -1.353 0.048 0.377 0.00 0.00 C+0 HETATM 22 O UNK 0 -2.022 -0.589 1.359 0.00 0.00 O+0 HETATM 23 C UNK 0 -2.992 -1.478 1.163 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.376 -2.889 1.154 0.00 0.00 C+0 HETATM 25 O UNK 0 -3.320 -3.873 0.964 0.00 0.00 O+0 HETATM 26 C UNK 0 -3.793 -1.369 -0.126 0.00 0.00 C+0 HETATM 27 O UNK 0 -4.822 -0.499 0.126 0.00 0.00 O+0 HETATM 28 C UNK 0 -6.075 -1.060 0.040 0.00 0.00 C+0 HETATM 29 O UNK 0 -6.633 -1.126 1.359 0.00 0.00 O+0 HETATM 30 C UNK 0 -6.547 0.060 2.031 0.00 0.00 C+0 HETATM 31 C UNK 0 -7.324 -0.113 3.333 0.00 0.00 C+0 HETATM 32 O UNK 0 -8.651 -0.425 2.994 0.00 0.00 O+0 HETATM 33 C UNK 0 -7.200 1.214 1.304 0.00 0.00 C+0 HETATM 34 O UNK 0 -6.726 2.395 1.898 0.00 0.00 O+0 HETATM 35 C UNK 0 -6.766 1.255 -0.148 0.00 0.00 C+0 HETATM 36 O UNK 0 -7.444 2.232 -0.825 0.00 0.00 O+0 HETATM 37 C UNK 0 -7.000 -0.150 -0.703 0.00 0.00 C+0 HETATM 38 N UNK 0 -6.953 -0.169 -2.118 0.00 0.00 N+1 HETATM 39 C UNK 0 -6.765 -1.502 -2.628 0.00 0.00 C+0 HETATM 40 C UNK 0 -5.995 0.742 -2.720 0.00 0.00 C+0 HETATM 41 C UNK 0 -8.300 0.247 -2.586 0.00 0.00 C+0 HETATM 42 C UNK 0 -2.914 -1.065 -1.277 0.00 0.00 C+0 HETATM 43 O UNK 0 -2.291 -2.241 -1.781 0.00 0.00 O+0 HETATM 44 C UNK 0 -1.883 -0.003 -1.014 0.00 0.00 C+0 HETATM 45 N UNK 0 -2.443 1.270 -1.479 0.00 0.00 N+0 HETATM 46 C UNK 0 -1.969 1.893 -2.661 0.00 0.00 C+0 HETATM 47 C UNK 0 -2.500 3.172 -3.173 0.00 0.00 C+0 HETATM 48 O UNK 0 -1.042 1.319 -3.305 0.00 0.00 O+0 HETATM 49 C UNK 0 1.716 -0.124 1.869 0.00 0.00 C+0 HETATM 50 O UNK 0 1.149 0.218 3.093 0.00 0.00 O+0 HETATM 51 C UNK 0 3.092 0.494 1.861 0.00 0.00 C+0 HETATM 52 N UNK 0 3.797 0.203 3.098 0.00 0.00 N+0 HETATM 53 C UNK 0 4.098 1.258 3.975 0.00 0.00 C+0 HETATM 54 C UNK 0 4.813 1.032 5.253 0.00 0.00 C+0 HETATM 55 O UNK 0 3.758 2.428 3.683 0.00 0.00 O+0 HETATM 56 C UNK 0 6.746 -0.607 -0.817 0.00 0.00 C+0 HETATM 57 O UNK 0 6.312 -1.788 -1.466 0.00 0.00 O+0 HETATM 58 H UNK 0 11.509 -0.779 -3.777 0.00 0.00 H+0 HETATM 59 H UNK 0 10.243 -1.734 -4.603 0.00 0.00 H+0 HETATM 60 H UNK 0 10.059 0.059 -4.323 0.00 0.00 H+0 HETATM 61 H UNK 0 8.764 0.646 -2.421 0.00 0.00 H+0 HETATM 62 H UNK 0 8.588 -1.515 -0.365 0.00 0.00 H+0 HETATM 63 H UNK 0 7.963 1.468 -0.111 0.00 0.00 H+0 HETATM 64 H UNK 0 10.099 1.259 -0.721 0.00 0.00 H+0 HETATM 65 H UNK 0 6.434 0.456 2.372 0.00 0.00 H+0 HETATM 66 H UNK 0 7.733 -2.260 2.053 0.00 0.00 H+0 HETATM 67 H UNK 0 6.024 -2.006 2.707 0.00 0.00 H+0 HETATM 68 H UNK 0 7.813 -0.340 3.816 0.00 0.00 H+0 HETATM 69 H UNK 0 5.542 -1.458 0.693 0.00 0.00 H+0 HETATM 70 H UNK 0 3.987 -1.144 0.887 0.00 0.00 H+0 HETATM 71 H UNK 0 1.321 0.062 -1.426 0.00 0.00 H+0 HETATM 72 H UNK 0 2.550 2.608 -0.286 0.00 0.00 H+0 HETATM 73 H UNK 0 2.239 2.010 -1.991 0.00 0.00 H+0 HETATM 74 H UNK 0 0.608 3.432 -1.153 0.00 0.00 H+0 HETATM 75 H UNK 0 0.504 1.354 0.938 0.00 0.00 H+0 HETATM 76 H UNK 0 -1.238 1.165 0.625 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.720 -1.550 2.040 0.00 0.00 H+0 HETATM 78 H UNK 0 -1.776 -3.015 2.088 0.00 0.00 H+0 HETATM 79 H UNK 0 -1.640 -2.949 0.328 0.00 0.00 H+0 HETATM 80 H UNK 0 -4.019 -3.756 1.657 0.00 0.00 H+0 HETATM 81 H UNK 0 -4.284 -2.366 -0.345 0.00 0.00 H+0 HETATM 82 H UNK 0 -6.063 -2.119 -0.288 0.00 0.00 H+0 HETATM 83 H UNK 0 -5.497 0.276 2.314 0.00 0.00 H+0 HETATM 84 H UNK 0 -7.339 0.818 3.926 0.00 0.00 H+0 HETATM 85 H UNK 0 -6.948 -0.972 3.926 0.00 0.00 H+0 HETATM 86 H UNK 0 -8.708 -1.028 2.210 0.00 0.00 H+0 HETATM 87 H UNK 0 -8.292 1.200 1.423 0.00 0.00 H+0 HETATM 88 H UNK 0 -7.020 2.499 2.837 0.00 0.00 H+0 HETATM 89 H UNK 0 -5.666 1.409 -0.149 0.00 0.00 H+0 HETATM 90 H UNK 0 -8.365 2.261 -0.463 0.00 0.00 H+0 HETATM 91 H UNK 0 -8.069 -0.377 -0.404 0.00 0.00 H+0 HETATM 92 H UNK 0 -7.666 -2.131 -2.393 0.00 0.00 H+0 HETATM 93 H UNK 0 -6.689 -1.380 -3.748 0.00 0.00 H+0 HETATM 94 H UNK 0 -5.890 -2.029 -2.231 0.00 0.00 H+0 HETATM 95 H UNK 0 -5.687 0.293 -3.695 0.00 0.00 H+0 HETATM 96 H UNK 0 -6.543 1.674 -2.979 0.00 0.00 H+0 HETATM 97 H UNK 0 -5.187 0.943 -2.032 0.00 0.00 H+0 HETATM 98 H UNK 0 -9.040 0.196 -1.763 0.00 0.00 H+0 HETATM 99 H UNK 0 -8.259 1.290 -2.960 0.00 0.00 H+0 HETATM 100 H UNK 0 -8.669 -0.418 -3.391 0.00 0.00 H+0 HETATM 101 H UNK 0 -3.540 -0.731 -2.130 0.00 0.00 H+0 HETATM 102 H UNK 0 -1.674 -2.018 -2.508 0.00 0.00 H+0 HETATM 103 H UNK 0 -1.051 -0.231 -1.751 0.00 0.00 H+0 HETATM 104 H UNK 0 -3.198 1.690 -0.904 0.00 0.00 H+0 HETATM 105 H UNK 0 -3.447 2.913 -3.712 0.00 0.00 H+0 HETATM 106 H UNK 0 -1.786 3.664 -3.873 0.00 0.00 H+0 HETATM 107 H UNK 0 -2.767 3.892 -2.387 0.00 0.00 H+0 HETATM 108 H UNK 0 1.786 -1.230 1.829 0.00 0.00 H+0 HETATM 109 H UNK 0 0.474 -0.409 3.390 0.00 0.00 H+0 HETATM 110 H UNK 0 2.943 1.585 1.739 0.00 0.00 H+0 HETATM 111 H UNK 0 4.055 -0.772 3.296 0.00 0.00 H+0 HETATM 112 H UNK 0 5.898 0.906 5.118 0.00 0.00 H+0 HETATM 113 H UNK 0 4.433 0.177 5.812 0.00 0.00 H+0 HETATM 114 H UNK 0 4.708 1.934 5.926 0.00 0.00 H+0 HETATM 115 H UNK 0 6.394 0.244 -1.461 0.00 0.00 H+0 HETATM 116 H UNK 0 6.998 -2.103 -2.126 0.00 0.00 H+0 CONECT 1 2 58 59 60 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 61 CONECT 5 4 6 56 62 CONECT 6 5 7 8 63 CONECT 7 6 64 CONECT 8 6 9 CONECT 9 8 10 12 65 CONECT 10 9 11 66 67 CONECT 11 10 68 CONECT 12 9 13 56 69 CONECT 13 12 14 CONECT 14 13 15 51 70 CONECT 15 14 16 CONECT 16 15 17 19 71 CONECT 17 16 18 72 73 CONECT 18 17 74 CONECT 19 16 20 49 75 CONECT 20 19 21 CONECT 21 20 22 44 76 CONECT 22 21 23 CONECT 23 22 24 26 77 CONECT 24 23 25 78 79 CONECT 25 24 80 CONECT 26 23 27 42 81 CONECT 27 26 28 CONECT 28 27 29 37 82 CONECT 29 28 30 CONECT 30 29 31 33 83 CONECT 31 30 32 84 85 CONECT 32 31 86 CONECT 33 30 34 35 87 CONECT 34 33 88 CONECT 35 33 36 37 89 CONECT 36 35 90 CONECT 37 35 38 28 91 CONECT 38 37 39 40 41 CONECT 39 38 92 93 94 CONECT 40 38 95 96 97 CONECT 41 38 98 99 100 CONECT 42 26 43 44 101 CONECT 43 42 102 CONECT 44 42 45 21 103 CONECT 45 44 46 104 CONECT 46 45 47 48 CONECT 47 46 105 106 107 CONECT 48 46 CONECT 49 19 50 51 108 CONECT 50 49 109 CONECT 51 49 52 14 110 CONECT 52 51 53 111 CONECT 53 52 54 55 CONECT 54 53 112 113 114 CONECT 55 53 CONECT 56 12 57 5 115 CONECT 57 56 116 CONECT 58 1 CONECT 59 1 CONECT 60 1 CONECT 61 4 CONECT 62 5 CONECT 63 6 CONECT 64 7 CONECT 65 9 CONECT 66 10 CONECT 67 10 CONECT 68 11 CONECT 69 12 CONECT 70 14 CONECT 71 16 CONECT 72 17 CONECT 73 17 CONECT 74 18 CONECT 75 19 CONECT 76 21 CONECT 77 23 CONECT 78 24 CONECT 79 24 CONECT 80 25 CONECT 81 26 CONECT 82 28 CONECT 83 30 CONECT 84 31 CONECT 85 31 CONECT 86 32 CONECT 87 33 CONECT 88 34 CONECT 89 35 CONECT 90 36 CONECT 91 37 CONECT 92 39 CONECT 93 39 CONECT 94 39 CONECT 95 40 CONECT 96 40 CONECT 97 40 CONECT 98 41 CONECT 99 41 CONECT 100 41 CONECT 101 42 CONECT 102 43 CONECT 103 44 CONECT 104 45 CONECT 105 47 CONECT 106 47 CONECT 107 47 CONECT 108 49 CONECT 109 50 CONECT 110 51 CONECT 111 52 CONECT 112 54 CONECT 113 54 CONECT 114 54 CONECT 115 56 CONECT 116 57 MASTER 0 0 0 0 0 0 0 0 116 0 238 0 END