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 -3.268 5.718 1.264 0.00 0.00 C+0 HETATM 2 O UNK 0 -3.700 4.600 0.547 0.00 0.00 O+0 HETATM 3 C UNK 0 -3.932 3.530 1.407 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.092 2.380 0.944 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.760 1.393 1.743 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.097 1.620 3.014 0.00 0.00 C+0 HETATM 7 C UNK 0 -0.979 2.312 3.147 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.064 2.569 2.046 0.00 0.00 C+0 HETATM 9 C UNK 0 0.327 1.673 1.172 0.00 0.00 C+0 HETATM 10 C UNK 0 0.537 0.291 1.593 0.00 0.00 C+0 HETATM 11 C UNK 0 0.852 -0.643 0.439 0.00 0.00 C+0 HETATM 12 O UNK 0 2.129 -1.205 0.558 0.00 0.00 O+0 HETATM 13 C UNK 0 3.138 -0.894 -0.344 0.00 0.00 C+0 HETATM 14 O UNK 0 2.891 -0.070 -1.280 0.00 0.00 O+0 HETATM 15 C UNK 0 4.488 -1.466 -0.274 0.00 0.00 C+0 HETATM 16 C UNK 0 4.601 -2.686 -1.210 0.00 0.00 C+0 HETATM 17 N UNK 0 5.414 -0.471 -0.843 0.00 0.00 N+0 HETATM 18 C UNK 0 6.591 -0.107 -0.155 0.00 0.00 C+0 HETATM 19 O UNK 0 6.902 -0.622 0.963 0.00 0.00 O+0 HETATM 20 C UNK 0 7.488 0.883 -0.716 0.00 0.00 C+0 HETATM 21 C UNK 0 7.291 1.505 -1.854 0.00 0.00 C+0 HETATM 22 C UNK 0 8.319 2.504 -2.291 0.00 0.00 C+0 HETATM 23 C UNK 0 8.518 3.475 -1.135 0.00 0.00 C+0 HETATM 24 C UNK 0 8.753 2.758 0.171 0.00 0.00 C+0 HETATM 25 C UNK 0 8.759 1.264 0.006 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.202 -1.707 0.402 0.00 0.00 C+0 HETATM 27 C UNK 0 0.184 -2.894 1.264 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.652 -2.114 -0.970 0.00 0.00 C+0 HETATM 29 O UNK 0 0.380 -1.714 -1.860 0.00 0.00 O+0 HETATM 30 C UNK 0 -0.729 -3.591 -1.169 0.00 0.00 C+0 HETATM 31 C UNK 0 0.544 -4.415 -1.236 0.00 0.00 C+0 HETATM 32 C UNK 0 -1.901 -4.136 -1.283 0.00 0.00 C+0 HETATM 33 C UNK 0 -3.168 -3.407 -1.535 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.737 -2.946 -0.215 0.00 0.00 C+0 HETATM 35 C UNK 0 -4.796 -1.897 -0.252 0.00 0.00 C+0 HETATM 36 C UNK 0 -4.766 -0.540 -0.633 0.00 0.00 C+0 HETATM 37 O UNK 0 -3.629 0.054 -1.181 0.00 0.00 O+0 HETATM 38 C UNK 0 -5.967 0.140 -0.424 0.00 0.00 C+0 HETATM 39 C UNK 0 -7.119 -0.483 0.115 0.00 0.00 C+0 HETATM 40 C UNK 0 -7.142 -1.804 0.479 0.00 0.00 C+0 HETATM 41 N UNK 0 -8.144 -2.482 0.978 0.00 0.00 N+0 HETATM 42 C UNK 0 -8.034 -3.730 1.274 0.00 0.00 C+0 HETATM 43 S UNK 0 -6.417 -4.062 0.846 0.00 0.00 S+0 HETATM 44 C UNK 0 -5.987 -2.465 0.286 0.00 0.00 C+0 HETATM 45 N UNK 0 -6.316 1.541 -0.616 0.00 0.00 N+0 HETATM 46 C UNK 0 -5.703 2.747 -0.191 0.00 0.00 C+0 HETATM 47 O UNK 0 -5.395 3.619 -1.073 0.00 0.00 O+0 HETATM 48 C UNK 0 -5.375 3.115 1.210 0.00 0.00 C+0 HETATM 49 H UNK 0 -3.080 6.567 0.596 0.00 0.00 H+0 HETATM 50 H UNK 0 -4.006 5.933 2.048 0.00 0.00 H+0 HETATM 51 H UNK 0 -2.270 5.415 1.691 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.731 3.783 2.458 0.00 0.00 H+0 HETATM 53 H UNK 0 -2.740 2.343 -0.102 0.00 0.00 H+0 HETATM 54 H UNK 0 -2.997 0.349 1.444 0.00 0.00 H+0 HETATM 55 H UNK 0 -2.514 1.188 3.938 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.786 2.696 4.159 0.00 0.00 H+0 HETATM 57 H UNK 0 0.324 3.575 1.940 0.00 0.00 H+0 HETATM 58 H UNK 0 0.509 1.915 0.110 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.370 -0.092 2.074 0.00 0.00 H+0 HETATM 60 H UNK 0 1.426 0.266 2.261 0.00 0.00 H+0 HETATM 61 H UNK 0 0.780 -0.040 -0.508 0.00 0.00 H+0 HETATM 62 H UNK 0 4.780 -1.812 0.711 0.00 0.00 H+0 HETATM 63 H UNK 0 4.324 -2.388 -2.245 0.00 0.00 H+0 HETATM 64 H UNK 0 3.943 -3.499 -0.835 0.00 0.00 H+0 HETATM 65 H UNK 0 5.653 -3.032 -1.139 0.00 0.00 H+0 HETATM 66 H UNK 0 5.147 -0.067 -1.754 0.00 0.00 H+0 HETATM 67 H UNK 0 6.422 1.301 -2.449 0.00 0.00 H+0 HETATM 68 H UNK 0 9.257 2.028 -2.593 0.00 0.00 H+0 HETATM 69 H UNK 0 7.922 3.107 -3.131 0.00 0.00 H+0 HETATM 70 H UNK 0 9.409 4.081 -1.369 0.00 0.00 H+0 HETATM 71 H UNK 0 7.608 4.133 -1.079 0.00 0.00 H+0 HETATM 72 H UNK 0 9.689 3.096 0.676 0.00 0.00 H+0 HETATM 73 H UNK 0 7.881 2.996 0.850 0.00 0.00 H+0 HETATM 74 H UNK 0 9.615 0.911 -0.589 0.00 0.00 H+0 HETATM 75 H UNK 0 8.761 0.818 1.038 0.00 0.00 H+0 HETATM 76 H UNK 0 -1.120 -1.273 0.902 0.00 0.00 H+0 HETATM 77 H UNK 0 -0.627 -3.643 1.312 0.00 0.00 H+0 HETATM 78 H UNK 0 1.179 -3.291 1.068 0.00 0.00 H+0 HETATM 79 H UNK 0 0.238 -2.472 2.315 0.00 0.00 H+0 HETATM 80 H UNK 0 -1.538 -1.591 -1.325 0.00 0.00 H+0 HETATM 81 H UNK 0 0.138 -1.917 -2.787 0.00 0.00 H+0 HETATM 82 H UNK 0 0.527 -5.133 -0.376 0.00 0.00 H+0 HETATM 83 H UNK 0 1.426 -3.779 -1.255 0.00 0.00 H+0 HETATM 84 H UNK 0 0.549 -5.027 -2.157 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.977 -5.233 -1.185 0.00 0.00 H+0 HETATM 86 H UNK 0 -3.932 -4.090 -2.020 0.00 0.00 H+0 HETATM 87 H UNK 0 -3.096 -2.555 -2.197 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.131 -3.937 0.247 0.00 0.00 H+0 HETATM 89 H UNK 0 -2.935 -2.786 0.581 0.00 0.00 H+0 HETATM 90 H UNK 0 -2.930 0.417 -1.518 0.00 0.00 H+0 HETATM 91 H UNK 0 -8.069 0.086 0.242 0.00 0.00 H+0 HETATM 92 H UNK 0 -8.842 -4.342 1.695 0.00 0.00 H+0 HETATM 93 H UNK 0 -7.245 1.735 -1.169 0.00 0.00 H+0 HETATM 94 H UNK 0 -5.525 2.224 1.877 0.00 0.00 H+0 HETATM 95 H UNK 0 -6.081 3.894 1.601 0.00 0.00 H+0 CONECT 1 2 49 50 51 CONECT 2 1 3 CONECT 3 2 4 48 52 CONECT 4 3 5 53 CONECT 5 4 6 54 CONECT 6 5 7 55 CONECT 7 6 8 56 CONECT 8 7 9 57 CONECT 9 8 10 58 CONECT 10 9 11 59 60 CONECT 11 10 12 26 61 CONECT 12 11 13 CONECT 13 12 14 15 CONECT 14 13 CONECT 15 13 16 17 62 CONECT 16 15 63 64 65 CONECT 17 15 18 66 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 25 CONECT 21 20 22 67 CONECT 22 21 23 68 69 CONECT 23 22 24 70 71 CONECT 24 23 25 72 73 CONECT 25 24 20 74 75 CONECT 26 11 27 28 76 CONECT 27 26 77 78 79 CONECT 28 26 29 30 80 CONECT 29 28 81 CONECT 30 28 31 32 CONECT 31 30 82 83 84 CONECT 32 30 33 85 CONECT 33 32 34 86 87 CONECT 34 33 35 88 89 CONECT 35 34 36 44 CONECT 36 35 37 38 CONECT 37 36 90 CONECT 38 36 39 45 CONECT 39 38 40 91 CONECT 40 39 41 44 CONECT 41 40 42 CONECT 42 41 43 92 CONECT 43 42 44 CONECT 44 43 35 40 CONECT 45 38 46 93 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 3 94 95 CONECT 49 1 CONECT 50 1 CONECT 51 1 CONECT 52 3 CONECT 53 4 CONECT 54 5 CONECT 55 6 CONECT 56 7 CONECT 57 8 CONECT 58 9 CONECT 59 10 CONECT 60 10 CONECT 61 11 CONECT 62 15 CONECT 63 16 CONECT 64 16 CONECT 65 16 CONECT 66 17 CONECT 67 21 CONECT 68 22 CONECT 69 22 CONECT 70 23 CONECT 71 23 CONECT 72 24 CONECT 73 24 CONECT 74 25 CONECT 75 25 CONECT 76 26 CONECT 77 27 CONECT 78 27 CONECT 79 27 CONECT 80 28 CONECT 81 29 CONECT 82 31 CONECT 83 31 CONECT 84 31 CONECT 85 32 CONECT 86 33 CONECT 87 33 CONECT 88 34 CONECT 89 34 CONECT 90 37 CONECT 91 39 CONECT 92 42 CONECT 93 45 CONECT 94 48 CONECT 95 48 MASTER 0 0 0 0 0 0 0 0 95 0 196 0 END