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 11.142 -0.574 2.696 0.00 0.00 C+0 HETATM 2 O UNK 0 10.675 -1.748 2.076 0.00 0.00 O+0 HETATM 3 C UNK 0 9.495 -1.839 1.347 0.00 0.00 C+0 HETATM 4 C UNK 0 9.124 -3.061 0.773 0.00 0.00 C+0 HETATM 5 C UNK 0 7.951 -3.143 0.051 0.00 0.00 C+0 HETATM 6 O UNK 0 7.568 -4.346 -0.525 0.00 0.00 O+0 HETATM 7 C UNK 0 7.127 -2.044 -0.122 0.00 0.00 C+0 HETATM 8 C UNK 0 7.509 -0.852 0.449 0.00 0.00 C+0 HETATM 9 C UNK 0 8.685 -0.749 1.179 0.00 0.00 C+0 HETATM 10 C UNK 0 6.629 0.287 0.242 0.00 0.00 C+0 HETATM 11 O UNK 0 6.954 1.392 0.755 0.00 0.00 O+0 HETATM 12 C UNK 0 5.398 0.195 -0.529 0.00 0.00 C+0 HETATM 13 C UNK 0 4.580 1.293 -0.724 0.00 0.00 C+0 HETATM 14 C UNK 0 3.429 1.231 -1.448 0.00 0.00 C+0 HETATM 15 C UNK 0 3.065 0.037 -2.005 0.00 0.00 C+0 HETATM 16 C UNK 0 3.842 -1.109 -1.850 0.00 0.00 C+0 HETATM 17 O UNK 0 3.420 -2.267 -2.433 0.00 0.00 O+0 HETATM 18 C UNK 0 5.013 -1.008 -1.104 0.00 0.00 C+0 HETATM 19 C UNK 0 5.881 -2.167 -0.909 0.00 0.00 C+0 HETATM 20 O UNK 0 5.606 -3.273 -1.388 0.00 0.00 O+0 HETATM 21 C UNK 0 1.778 0.027 -2.791 0.00 0.00 C+0 HETATM 22 O UNK 0 0.779 0.433 -1.888 0.00 0.00 O+0 HETATM 23 C UNK 0 -0.194 -0.547 -1.686 0.00 0.00 C+0 HETATM 24 C UNK 0 -0.268 -0.772 -0.198 0.00 0.00 C+0 HETATM 25 C UNK 0 -1.376 0.070 0.452 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.976 1.528 0.211 0.00 0.00 C+0 HETATM 27 N UNK 0 -1.314 -0.155 1.863 0.00 0.00 N+0 HETATM 28 C UNK 0 -0.039 0.376 2.407 0.00 0.00 C+0 HETATM 29 C UNK 0 -1.244 -1.569 2.225 0.00 0.00 C+0 HETATM 30 C UNK 0 -2.730 -0.197 -0.135 0.00 0.00 C+0 HETATM 31 O UNK 0 -3.473 -0.968 0.699 0.00 0.00 O+0 HETATM 32 C UNK 0 -4.662 -0.437 1.111 0.00 0.00 C+0 HETATM 33 C UNK 0 -5.874 -1.277 0.888 0.00 0.00 C+0 HETATM 34 C UNK 0 -6.891 -0.929 1.968 0.00 0.00 C+0 HETATM 35 C UNK 0 -6.440 -1.604 3.243 0.00 0.00 C+0 HETATM 36 O UNK 0 -8.089 -1.497 1.605 0.00 0.00 O+0 HETATM 37 C UNK 0 -6.949 0.556 2.233 0.00 0.00 C+0 HETATM 38 N UNK 0 -7.387 1.329 1.097 0.00 0.00 N+0 HETATM 39 C UNK 0 -8.730 0.919 0.664 0.00 0.00 C+0 HETATM 40 C UNK 0 -7.645 2.708 1.595 0.00 0.00 C+0 HETATM 41 C UNK 0 -5.595 0.905 2.739 0.00 0.00 C+0 HETATM 42 C UNK 0 -5.026 2.228 2.371 0.00 0.00 C+0 HETATM 43 O UNK 0 -4.605 -0.046 2.458 0.00 0.00 O+0 HETATM 44 C UNK 0 -2.487 -0.795 -1.521 0.00 0.00 C+0 HETATM 45 C UNK 0 -2.401 -2.282 -1.529 0.00 0.00 C+0 HETATM 46 O UNK 0 -1.448 -0.139 -2.164 0.00 0.00 O+0 HETATM 47 C UNK 0 1.908 1.178 -3.767 0.00 0.00 C+0 HETATM 48 O UNK 0 3.119 1.125 -4.444 0.00 0.00 O+0 HETATM 49 C UNK 0 2.880 1.048 -5.803 0.00 0.00 C+0 HETATM 50 C UNK 0 1.814 2.479 -2.977 0.00 0.00 C+0 HETATM 51 C UNK 0 0.410 2.933 -2.797 0.00 0.00 C+0 HETATM 52 O UNK 0 2.512 3.434 -3.751 0.00 0.00 O+0 HETATM 53 C UNK 0 2.557 2.402 -1.696 0.00 0.00 C+0 HETATM 54 O UNK 0 2.486 3.266 -0.827 0.00 0.00 O+0 HETATM 55 H UNK 0 12.253 -0.600 2.843 0.00 0.00 H+0 HETATM 56 H UNK 0 10.934 0.349 2.119 0.00 0.00 H+0 HETATM 57 H UNK 0 10.712 -0.466 3.719 0.00 0.00 H+0 HETATM 58 H UNK 0 9.789 -3.891 0.928 0.00 0.00 H+0 HETATM 59 H UNK 0 8.161 -5.145 -0.409 0.00 0.00 H+0 HETATM 60 H UNK 0 8.955 0.194 1.613 0.00 0.00 H+0 HETATM 61 H UNK 0 4.827 2.275 -0.293 0.00 0.00 H+0 HETATM 62 H UNK 0 3.772 -3.164 -2.470 0.00 0.00 H+0 HETATM 63 H UNK 0 1.603 -0.950 -3.232 0.00 0.00 H+0 HETATM 64 H UNK 0 0.162 -1.433 -2.257 0.00 0.00 H+0 HETATM 65 H UNK 0 0.674 -0.393 0.296 0.00 0.00 H+0 HETATM 66 H UNK 0 -0.338 -1.820 0.099 0.00 0.00 H+0 HETATM 67 H UNK 0 0.098 1.562 0.072 0.00 0.00 H+0 HETATM 68 H UNK 0 -1.416 2.136 0.996 0.00 0.00 H+0 HETATM 69 H UNK 0 -1.428 1.826 -0.762 0.00 0.00 H+0 HETATM 70 H UNK 0 0.771 -0.346 2.298 0.00 0.00 H+0 HETATM 71 H UNK 0 -0.237 0.439 3.516 0.00 0.00 H+0 HETATM 72 H UNK 0 0.125 1.388 2.064 0.00 0.00 H+0 HETATM 73 H UNK 0 -0.176 -1.936 2.139 0.00 0.00 H+0 HETATM 74 H UNK 0 -1.966 -2.218 1.765 0.00 0.00 H+0 HETATM 75 H UNK 0 -1.425 -1.573 3.338 0.00 0.00 H+0 HETATM 76 H UNK 0 -3.228 0.820 -0.292 0.00 0.00 H+0 HETATM 77 H UNK 0 -4.780 0.529 0.562 0.00 0.00 H+0 HETATM 78 H UNK 0 -6.283 -1.176 -0.115 0.00 0.00 H+0 HETATM 79 H UNK 0 -5.561 -2.355 0.985 0.00 0.00 H+0 HETATM 80 H UNK 0 -6.591 -0.888 4.089 0.00 0.00 H+0 HETATM 81 H UNK 0 -7.148 -2.452 3.499 0.00 0.00 H+0 HETATM 82 H UNK 0 -5.425 -2.035 3.202 0.00 0.00 H+0 HETATM 83 H UNK 0 -8.747 -1.539 2.333 0.00 0.00 H+0 HETATM 84 H UNK 0 -7.693 0.725 3.034 0.00 0.00 H+0 HETATM 85 H UNK 0 -9.444 0.896 1.513 0.00 0.00 H+0 HETATM 86 H UNK 0 -8.737 0.050 0.010 0.00 0.00 H+0 HETATM 87 H UNK 0 -9.081 1.785 0.031 0.00 0.00 H+0 HETATM 88 H UNK 0 -6.950 3.442 1.163 0.00 0.00 H+0 HETATM 89 H UNK 0 -8.656 3.074 1.232 0.00 0.00 H+0 HETATM 90 H UNK 0 -7.751 2.700 2.683 0.00 0.00 H+0 HETATM 91 H UNK 0 -5.646 0.906 3.875 0.00 0.00 H+0 HETATM 92 H UNK 0 -4.856 2.391 1.290 0.00 0.00 H+0 HETATM 93 H UNK 0 -5.439 3.103 2.915 0.00 0.00 H+0 HETATM 94 H UNK 0 -3.954 2.189 2.776 0.00 0.00 H+0 HETATM 95 H UNK 0 -3.408 -0.516 -2.114 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.567 -2.696 -0.518 0.00 0.00 H+0 HETATM 97 H UNK 0 -1.395 -2.680 -1.858 0.00 0.00 H+0 HETATM 98 H UNK 0 -3.104 -2.745 -2.285 0.00 0.00 H+0 HETATM 99 H UNK 0 1.036 1.145 -4.447 0.00 0.00 H+0 HETATM 100 H UNK 0 2.293 0.140 -6.041 0.00 0.00 H+0 HETATM 101 H UNK 0 3.882 1.052 -6.297 0.00 0.00 H+0 HETATM 102 H UNK 0 2.305 1.971 -6.094 0.00 0.00 H+0 HETATM 103 H UNK 0 0.171 3.287 -1.777 0.00 0.00 H+0 HETATM 104 H UNK 0 0.230 3.815 -3.456 0.00 0.00 H+0 HETATM 105 H UNK 0 -0.284 2.149 -3.165 0.00 0.00 H+0 HETATM 106 H UNK 0 3.470 3.438 -3.497 0.00 0.00 H+0 CONECT 1 2 55 56 57 CONECT 2 1 3 CONECT 3 2 4 9 CONECT 4 3 5 58 CONECT 5 4 6 7 CONECT 6 5 59 CONECT 7 5 8 19 CONECT 8 7 9 10 CONECT 9 8 3 60 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 13 18 CONECT 13 12 14 61 CONECT 14 13 15 53 CONECT 15 14 16 21 CONECT 16 15 17 18 CONECT 17 16 62 CONECT 18 16 19 12 CONECT 19 18 20 7 CONECT 20 19 CONECT 21 15 22 47 63 CONECT 22 21 23 CONECT 23 22 24 46 64 CONECT 24 23 25 65 66 CONECT 25 24 26 27 30 CONECT 26 25 67 68 69 CONECT 27 25 28 29 CONECT 28 27 70 71 72 CONECT 29 27 73 74 75 CONECT 30 25 31 44 76 CONECT 31 30 32 CONECT 32 31 33 43 77 CONECT 33 32 34 78 79 CONECT 34 33 35 36 37 CONECT 35 34 80 81 82 CONECT 36 34 83 CONECT 37 34 38 41 84 CONECT 38 37 39 40 CONECT 39 38 85 86 87 CONECT 40 38 88 89 90 CONECT 41 37 42 43 91 CONECT 42 41 92 93 94 CONECT 43 41 32 CONECT 44 30 45 46 95 CONECT 45 44 96 97 98 CONECT 46 44 23 CONECT 47 21 48 50 99 CONECT 48 47 49 CONECT 49 48 100 101 102 CONECT 50 47 51 52 53 CONECT 51 50 103 104 105 CONECT 52 50 106 CONECT 53 50 54 14 CONECT 54 53 CONECT 55 1 CONECT 56 1 CONECT 57 1 CONECT 58 4 CONECT 59 6 CONECT 60 9 CONECT 61 13 CONECT 62 17 CONECT 63 21 CONECT 64 23 CONECT 65 24 CONECT 66 24 CONECT 67 26 CONECT 68 26 CONECT 69 26 CONECT 70 28 CONECT 71 28 CONECT 72 28 CONECT 73 29 CONECT 74 29 CONECT 75 29 CONECT 76 30 CONECT 77 32 CONECT 78 33 CONECT 79 33 CONECT 80 35 CONECT 81 35 CONECT 82 35 CONECT 83 36 CONECT 84 37 CONECT 85 39 CONECT 86 39 CONECT 87 39 CONECT 88 40 CONECT 89 40 CONECT 90 40 CONECT 91 41 CONECT 92 42 CONECT 93 42 CONECT 94 42 CONECT 95 44 CONECT 96 45 CONECT 97 45 CONECT 98 45 CONECT 99 47 CONECT 100 49 CONECT 101 49 CONECT 102 49 CONECT 103 51 CONECT 104 51 CONECT 105 51 CONECT 106 52 MASTER 0 0 0 0 0 0 0 0 106 0 222 0 END