HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 -5.209 4.459 0.773 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.285 3.079 0.213 0.00 0.00 C+0 HETATM 3 C UNK 0 -6.405 2.678 -0.482 0.00 0.00 C+0 HETATM 4 Cl UNK 0 -7.696 3.856 -0.650 0.00 0.00 Cl+0 HETATM 5 C UNK 0 -6.544 1.446 -1.046 0.00 0.00 C+0 HETATM 6 C UNK 0 -5.530 0.522 -0.936 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.370 0.898 -0.230 0.00 0.00 C+0 HETATM 8 C UNK 0 -3.499 -0.170 -0.263 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.166 -0.235 0.311 0.00 0.00 C+0 HETATM 10 N UNK 0 -1.461 -1.328 0.200 0.00 0.00 N+0 HETATM 11 C UNK 0 -0.216 -1.167 0.825 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.243 -1.990 2.112 0.00 0.00 C+0 HETATM 13 C UNK 0 0.874 -1.706 -0.059 0.00 0.00 C+0 HETATM 14 O UNK 0 0.551 -2.355 -1.108 0.00 0.00 O+0 HETATM 15 N UNK 0 2.217 -1.529 0.229 0.00 0.00 N+0 HETATM 16 C UNK 0 3.290 -2.050 -0.551 0.00 0.00 C+0 HETATM 17 C UNK 0 3.805 -3.325 0.113 0.00 0.00 C+0 HETATM 18 C UNK 0 4.385 -1.155 -0.867 0.00 0.00 C+0 HETATM 19 O UNK 0 4.535 -0.897 -2.194 0.00 0.00 O+0 HETATM 20 N UNK 0 5.275 -0.536 -0.056 0.00 0.00 N+0 HETATM 21 C UNK 0 6.410 0.328 -0.237 0.00 0.00 C+0 HETATM 22 C UNK 0 6.330 1.547 0.628 0.00 0.00 C+0 HETATM 23 O UNK 0 5.220 2.355 0.324 0.00 0.00 O+0 HETATM 24 C UNK 0 7.658 -0.442 -0.095 0.00 0.00 C+0 HETATM 25 O UNK 0 7.505 -1.653 -0.673 0.00 0.00 O+0 HETATM 26 O UNK 0 8.809 -0.171 0.467 0.00 0.00 O+0 HETATM 27 C UNK 0 -0.091 0.272 1.154 0.00 0.00 C+0 HETATM 28 O UNK 0 -1.444 0.713 1.007 0.00 0.00 O+0 HETATM 29 C UNK 0 -4.145 -1.180 -0.983 0.00 0.00 C+0 HETATM 30 N UNK 0 -5.356 -0.736 -1.371 0.00 0.00 N+0 HETATM 31 C UNK 0 -6.317 -1.480 -2.180 0.00 0.00 C+0 HETATM 32 C UNK 0 -4.255 2.148 0.333 0.00 0.00 C+0 HETATM 33 O UNK 0 -3.142 2.503 1.014 0.00 0.00 O+0 HETATM 34 H UNK 0 -5.857 4.427 1.695 0.00 0.00 H+0 HETATM 35 H UNK 0 -5.757 5.128 0.065 0.00 0.00 H+0 HETATM 36 H UNK 0 -4.186 4.814 0.967 0.00 0.00 H+0 HETATM 37 H UNK 0 -7.426 1.122 -1.589 0.00 0.00 H+0 HETATM 38 H UNK 0 0.440 -1.621 2.881 0.00 0.00 H+0 HETATM 39 H UNK 0 -1.286 -1.952 2.488 0.00 0.00 H+0 HETATM 40 H UNK 0 -0.034 -3.046 1.813 0.00 0.00 H+0 HETATM 41 H UNK 0 2.445 -0.951 1.088 0.00 0.00 H+0 HETATM 42 H UNK 0 2.837 -2.436 -1.539 0.00 0.00 H+0 HETATM 43 H UNK 0 2.901 -4.009 0.189 0.00 0.00 H+0 HETATM 44 H UNK 0 4.181 -3.074 1.103 0.00 0.00 H+0 HETATM 45 H UNK 0 4.575 -3.790 -0.510 0.00 0.00 H+0 HETATM 46 H UNK 0 5.112 -0.674 1.060 0.00 0.00 H+0 HETATM 47 H UNK 0 6.439 0.713 -1.306 0.00 0.00 H+0 HETATM 48 H UNK 0 6.279 1.191 1.691 0.00 0.00 H+0 HETATM 49 H UNK 0 7.229 2.163 0.564 0.00 0.00 H+0 HETATM 50 H UNK 0 4.844 2.588 1.216 0.00 0.00 H+0 HETATM 51 H UNK 0 9.291 -0.769 1.186 0.00 0.00 H+0 HETATM 52 H UNK 0 0.242 0.443 2.222 0.00 0.00 H+0 HETATM 53 H UNK 0 0.546 0.815 0.449 0.00 0.00 H+0 HETATM 54 H UNK 0 -3.712 -2.132 -1.180 0.00 0.00 H+0 HETATM 55 H UNK 0 -5.891 -2.501 -2.388 0.00 0.00 H+0 HETATM 56 H UNK 0 -7.232 -1.562 -1.596 0.00 0.00 H+0 HETATM 57 H UNK 0 -6.549 -0.939 -3.124 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.926 3.353 1.469 0.00 0.00 H+0 CONECT 1 2 34 35 36 CONECT 2 1 3 32 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 37 CONECT 6 5 7 30 CONECT 7 6 8 32 CONECT 8 7 9 29 CONECT 9 8 10 28 CONECT 10 9 11 CONECT 11 10 12 13 27 CONECT 12 11 38 39 40 CONECT 13 11 14 15 CONECT 14 13 CONECT 15 13 16 41 CONECT 16 15 17 18 42 CONECT 17 16 43 44 45 CONECT 18 16 19 20 CONECT 19 18 CONECT 20 18 21 46 CONECT 21 20 22 24 47 CONECT 22 21 23 48 49 CONECT 23 22 50 CONECT 24 21 25 26 CONECT 25 24 CONECT 26 24 51 CONECT 27 11 28 52 53 CONECT 28 27 9 CONECT 29 8 30 54 CONECT 30 29 31 6 CONECT 31 30 55 56 57 CONECT 32 7 33 2 CONECT 33 32 58 CONECT 34 1 CONECT 35 1 CONECT 36 1 CONECT 37 5 CONECT 38 12 CONECT 39 12 CONECT 40 12 CONECT 41 15 CONECT 42 16 CONECT 43 17 CONECT 44 17 CONECT 45 17 CONECT 46 20 CONECT 47 21 CONECT 48 22 CONECT 49 22 CONECT 50 23 CONECT 51 26 CONECT 52 27 CONECT 53 27 CONECT 54 29 CONECT 55 31 CONECT 56 31 CONECT 57 31 CONECT 58 33 MASTER 0 0 0 0 0 0 0 0 58 0 120 0 END