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 0.569 -1.299 4.025 0.00 0.00 C+0 HETATM 2 C UNK 0 -0.134 -1.439 2.722 0.00 0.00 C+0 HETATM 3 O UNK 0 -0.338 -2.565 2.192 0.00 0.00 O+0 HETATM 4 O UNK 0 -0.609 -0.369 2.007 0.00 0.00 O+0 HETATM 5 C UNK 0 -1.277 -0.413 0.770 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.745 -0.062 0.996 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.541 0.169 -0.221 0.00 0.00 C+0 HETATM 8 C UNK 0 -4.853 0.752 0.266 0.00 0.00 C+0 HETATM 9 C UNK 0 -4.733 1.892 1.207 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.497 -0.395 1.077 0.00 0.00 C+0 HETATM 11 O UNK 0 -5.779 1.008 -0.766 0.00 0.00 O+0 HETATM 12 C UNK 0 -5.798 0.535 -2.047 0.00 0.00 C+0 HETATM 13 O UNK 0 -6.836 0.791 -2.699 0.00 0.00 O+0 HETATM 14 C UNK 0 -4.734 -0.227 -2.710 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.406 0.399 -2.699 0.00 0.00 C+0 HETATM 16 C UNK 0 -2.884 0.876 -1.337 0.00 0.00 C+0 HETATM 17 C UNK 0 -3.146 2.382 -1.355 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.418 0.682 -1.413 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.734 1.684 -2.318 0.00 0.00 C+0 HETATM 20 C UNK 0 0.569 1.088 -2.812 0.00 0.00 C+0 HETATM 21 C UNK 0 1.436 0.868 -1.597 0.00 0.00 C+0 HETATM 22 C UNK 0 1.969 2.152 -1.117 0.00 0.00 C+0 HETATM 23 O UNK 0 2.529 0.043 -1.881 0.00 0.00 O+0 HETATM 24 C UNK 0 2.894 -0.608 -0.738 0.00 0.00 C+0 HETATM 25 C UNK 0 1.711 -0.500 0.242 0.00 0.00 C+0 HETATM 26 C UNK 0 0.682 0.001 -0.647 0.00 0.00 C+0 HETATM 27 C UNK 0 -0.611 0.554 -0.157 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.468 1.835 0.614 0.00 0.00 C+0 HETATM 29 C UNK 0 3.128 -2.044 -1.141 0.00 0.00 C+0 HETATM 30 C UNK 0 2.459 -2.857 -2.008 0.00 0.00 C+0 HETATM 31 C UNK 0 2.891 -4.146 -2.194 0.00 0.00 C+0 HETATM 32 C UNK 0 4.015 -4.587 -1.481 0.00 0.00 C+0 HETATM 33 C UNK 0 4.690 -3.760 -0.603 0.00 0.00 C+0 HETATM 34 C UNK 0 4.234 -2.453 -0.429 0.00 0.00 C+0 HETATM 35 N UNK 0 4.761 -1.444 0.406 0.00 0.00 N+0 HETATM 36 C UNK 0 5.568 -1.039 1.502 0.00 0.00 C+0 HETATM 37 O UNK 0 6.550 -1.693 1.922 0.00 0.00 O+0 HETATM 38 C UNK 0 5.033 0.237 2.008 0.00 0.00 C+0 HETATM 39 C UNK 0 4.540 0.290 3.406 0.00 0.00 C+0 HETATM 40 C UNK 0 5.748 1.127 2.901 0.00 0.00 C+0 HETATM 41 N UNK 0 4.096 0.690 1.001 0.00 0.00 N+0 HETATM 42 C UNK 0 4.190 -0.190 -0.120 0.00 0.00 C+0 HETATM 43 H UNK 0 -0.147 -1.423 4.839 0.00 0.00 H+0 HETATM 44 H UNK 0 1.347 -2.089 4.157 0.00 0.00 H+0 HETATM 45 H UNK 0 1.075 -0.332 4.125 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.291 -1.426 0.366 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.171 -0.972 1.519 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.874 0.755 1.713 0.00 0.00 H+0 HETATM 49 H UNK 0 -3.829 -0.849 -0.631 0.00 0.00 H+0 HETATM 50 H UNK 0 -3.821 2.474 1.192 0.00 0.00 H+0 HETATM 51 H UNK 0 -4.901 1.607 2.289 0.00 0.00 H+0 HETATM 52 H UNK 0 -5.595 2.591 0.993 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.278 -1.365 0.630 0.00 0.00 H+0 HETATM 54 H UNK 0 -5.056 -0.357 2.115 0.00 0.00 H+0 HETATM 55 H UNK 0 -6.599 -0.271 1.112 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.733 -1.313 -2.393 0.00 0.00 H+0 HETATM 57 H UNK 0 -5.025 -0.295 -3.802 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.694 -0.349 -3.163 0.00 0.00 H+0 HETATM 59 H UNK 0 -3.405 1.237 -3.452 0.00 0.00 H+0 HETATM 60 H UNK 0 -2.476 2.960 -0.726 0.00 0.00 H+0 HETATM 61 H UNK 0 -4.185 2.649 -1.167 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.946 2.750 -2.408 0.00 0.00 H+0 HETATM 63 H UNK 0 -1.268 -0.311 -1.953 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.648 2.688 -1.912 0.00 0.00 H+0 HETATM 65 H UNK 0 -1.364 1.794 -3.253 0.00 0.00 H+0 HETATM 66 H UNK 0 0.345 0.134 -3.307 0.00 0.00 H+0 HETATM 67 H UNK 0 1.023 1.821 -3.525 0.00 0.00 H+0 HETATM 68 H UNK 0 3.013 2.306 -1.543 0.00 0.00 H+0 HETATM 69 H UNK 0 2.090 2.308 -0.052 0.00 0.00 H+0 HETATM 70 H UNK 0 1.414 3.000 -1.622 0.00 0.00 H+0 HETATM 71 H UNK 0 1.586 -1.584 0.556 0.00 0.00 H+0 HETATM 72 H UNK 0 1.980 0.093 1.115 0.00 0.00 H+0 HETATM 73 H UNK 0 0.361 -0.888 -1.295 0.00 0.00 H+0 HETATM 74 H UNK 0 -1.388 2.049 1.202 0.00 0.00 H+0 HETATM 75 H UNK 0 -0.238 2.727 0.062 0.00 0.00 H+0 HETATM 76 H UNK 0 0.314 1.668 1.384 0.00 0.00 H+0 HETATM 77 H UNK 0 1.607 -2.499 -2.540 0.00 0.00 H+0 HETATM 78 H UNK 0 2.354 -4.765 -2.876 0.00 0.00 H+0 HETATM 79 H UNK 0 4.359 -5.604 -1.625 0.00 0.00 H+0 HETATM 80 H UNK 0 5.541 -4.108 -0.070 0.00 0.00 H+0 HETATM 81 H UNK 0 4.764 -0.510 4.130 0.00 0.00 H+0 HETATM 82 H UNK 0 3.607 0.842 3.615 0.00 0.00 H+0 HETATM 83 H UNK 0 6.722 0.804 3.305 0.00 0.00 H+0 HETATM 84 H UNK 0 5.538 2.213 2.836 0.00 0.00 H+0 HETATM 85 H UNK 0 4.246 1.697 0.754 0.00 0.00 H+0 HETATM 86 H UNK 0 4.929 0.173 -0.863 0.00 0.00 H+0 CONECT 1 2 43 44 45 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 CONECT 5 4 6 27 46 CONECT 6 5 7 47 48 CONECT 7 6 8 16 49 CONECT 8 7 9 10 11 CONECT 9 8 50 51 52 CONECT 10 8 53 54 55 CONECT 11 8 12 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 56 57 CONECT 15 14 16 58 59 CONECT 16 15 17 18 7 CONECT 17 16 60 61 62 CONECT 18 16 19 27 63 CONECT 19 18 20 64 65 CONECT 20 19 21 66 67 CONECT 21 20 22 23 26 CONECT 22 21 68 69 70 CONECT 23 21 24 CONECT 24 23 25 29 42 CONECT 25 24 26 71 72 CONECT 26 25 27 21 73 CONECT 27 26 28 5 18 CONECT 28 27 74 75 76 CONECT 29 24 30 34 CONECT 30 29 31 77 CONECT 31 30 32 78 CONECT 32 31 33 79 CONECT 33 32 34 80 CONECT 34 33 35 29 CONECT 35 34 36 42 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 39 41 40 CONECT 39 38 40 81 82 CONECT 40 39 38 83 84 CONECT 41 38 42 85 CONECT 42 41 35 24 86 CONECT 43 1 CONECT 44 1 CONECT 45 1 CONECT 46 5 CONECT 47 6 CONECT 48 6 CONECT 49 7 CONECT 50 9 CONECT 51 9 CONECT 52 9 CONECT 53 10 CONECT 54 10 CONECT 55 10 CONECT 56 14 CONECT 57 14 CONECT 58 15 CONECT 59 15 CONECT 60 17 CONECT 61 17 CONECT 62 17 CONECT 63 18 CONECT 64 19 CONECT 65 19 CONECT 66 20 CONECT 67 20 CONECT 68 22 CONECT 69 22 CONECT 70 22 CONECT 71 25 CONECT 72 25 CONECT 73 26 CONECT 74 28 CONECT 75 28 CONECT 76 28 CONECT 77 30 CONECT 78 31 CONECT 79 32 CONECT 80 33 CONECT 81 39 CONECT 82 39 CONECT 83 40 CONECT 84 40 CONECT 85 41 CONECT 86 42 MASTER 0 0 0 0 0 0 0 0 86 0 186 0 END