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 -7.490 1.063 1.541 0.00 0.00 C+0 HETATM 2 O UNK 0 -6.396 0.463 0.893 0.00 0.00 O+0 HETATM 3 C UNK 0 -6.508 -0.585 0.026 0.00 0.00 C+0 HETATM 4 O UNK 0 -7.672 -1.018 -0.187 0.00 0.00 O+0 HETATM 5 C UNK 0 -5.381 -1.191 -0.632 0.00 0.00 C+0 HETATM 6 C UNK 0 -4.123 -0.870 -0.522 0.00 0.00 C+0 HETATM 7 O UNK 0 -3.195 -1.619 -1.276 0.00 0.00 O+0 HETATM 8 C UNK 0 -3.090 -2.993 -0.922 0.00 0.00 C+0 HETATM 9 C UNK 0 -3.579 0.190 0.309 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.506 -0.437 1.240 0.00 0.00 C+0 HETATM 11 C UNK 0 -2.845 1.250 -0.503 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.713 0.688 -1.253 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.490 0.819 -0.819 0.00 0.00 C+0 HETATM 14 C UNK 0 0.655 0.256 -1.568 0.00 0.00 C+0 HETATM 15 C UNK 0 0.466 -0.425 -2.747 0.00 0.00 C+0 HETATM 16 S UNK 0 2.077 -0.840 -3.167 0.00 0.00 S+0 HETATM 17 C UNK 0 2.872 -0.134 -1.841 0.00 0.00 C+0 HETATM 18 C UNK 0 4.338 -0.117 -1.560 0.00 0.00 C+0 HETATM 19 C UNK 0 5.234 -0.717 -2.414 0.00 0.00 C+0 HETATM 20 S UNK 0 6.717 -0.403 -1.629 0.00 0.00 S+0 HETATM 21 C UNK 0 6.119 0.458 -0.285 0.00 0.00 C+0 HETATM 22 C UNK 0 6.886 1.062 0.865 0.00 0.00 C+0 HETATM 23 C UNK 0 7.003 0.017 1.965 0.00 0.00 C+0 HETATM 24 C UNK 0 7.732 -1.211 1.465 0.00 0.00 C+0 HETATM 25 C UNK 0 5.626 -0.383 2.457 0.00 0.00 C+0 HETATM 26 N UNK 0 4.818 0.461 -0.504 0.00 0.00 N+0 HETATM 27 N UNK 0 1.878 0.382 -1.146 0.00 0.00 N+0 HETATM 28 O UNK 0 -3.756 1.901 -1.343 0.00 0.00 O+0 HETATM 29 C UNK 0 -3.866 3.254 -1.029 0.00 0.00 C+0 HETATM 30 H UNK 0 -7.693 2.080 1.138 0.00 0.00 H+0 HETATM 31 H UNK 0 -8.358 0.384 1.468 0.00 0.00 H+0 HETATM 32 H UNK 0 -7.230 1.109 2.626 0.00 0.00 H+0 HETATM 33 H UNK 0 -5.629 -2.042 -1.320 0.00 0.00 H+0 HETATM 34 H UNK 0 -2.778 -3.130 0.129 0.00 0.00 H+0 HETATM 35 H UNK 0 -2.427 -3.510 -1.627 0.00 0.00 H+0 HETATM 36 H UNK 0 -4.132 -3.415 -0.983 0.00 0.00 H+0 HETATM 37 H UNK 0 -4.310 0.655 0.964 0.00 0.00 H+0 HETATM 38 H UNK 0 -1.666 -0.832 0.633 0.00 0.00 H+0 HETATM 39 H UNK 0 -2.109 0.356 1.902 0.00 0.00 H+0 HETATM 40 H UNK 0 -2.991 -1.208 1.864 0.00 0.00 H+0 HETATM 41 H UNK 0 -2.454 2.014 0.198 0.00 0.00 H+0 HETATM 42 H UNK 0 -1.933 0.167 -2.168 0.00 0.00 H+0 HETATM 43 H UNK 0 -0.331 1.350 0.102 0.00 0.00 H+0 HETATM 44 H UNK 0 -0.479 -0.644 -3.278 0.00 0.00 H+0 HETATM 45 H UNK 0 5.005 -1.252 -3.354 0.00 0.00 H+0 HETATM 46 H UNK 0 7.885 1.331 0.523 0.00 0.00 H+0 HETATM 47 H UNK 0 6.283 1.885 1.262 0.00 0.00 H+0 HETATM 48 H UNK 0 7.614 0.467 2.763 0.00 0.00 H+0 HETATM 49 H UNK 0 8.452 -0.938 0.668 0.00 0.00 H+0 HETATM 50 H UNK 0 7.011 -1.983 1.127 0.00 0.00 H+0 HETATM 51 H UNK 0 8.267 -1.648 2.332 0.00 0.00 H+0 HETATM 52 H UNK 0 5.681 -0.815 3.476 0.00 0.00 H+0 HETATM 53 H UNK 0 4.985 0.508 2.487 0.00 0.00 H+0 HETATM 54 H UNK 0 5.218 -1.129 1.722 0.00 0.00 H+0 HETATM 55 H UNK 0 -2.881 3.783 -1.132 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.279 3.430 -0.018 0.00 0.00 H+0 HETATM 57 H UNK 0 -4.532 3.705 -1.793 0.00 0.00 H+0 CONECT 1 2 30 31 32 CONECT 2 1 3 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 33 CONECT 6 5 7 9 CONECT 7 6 8 CONECT 8 7 34 35 36 CONECT 9 6 10 11 37 CONECT 10 9 38 39 40 CONECT 11 9 12 28 41 CONECT 12 11 13 42 CONECT 13 12 14 43 CONECT 14 13 15 27 CONECT 15 14 16 44 CONECT 16 15 17 CONECT 17 16 18 27 CONECT 18 17 19 26 CONECT 19 18 20 45 CONECT 20 19 21 CONECT 21 20 22 26 CONECT 22 21 23 46 47 CONECT 23 22 24 25 48 CONECT 24 23 49 50 51 CONECT 25 23 52 53 54 CONECT 26 21 18 CONECT 27 17 14 CONECT 28 11 29 CONECT 29 28 55 56 57 CONECT 30 1 CONECT 31 1 CONECT 32 1 CONECT 33 5 CONECT 34 8 CONECT 35 8 CONECT 36 8 CONECT 37 9 CONECT 38 10 CONECT 39 10 CONECT 40 10 CONECT 41 11 CONECT 42 12 CONECT 43 13 CONECT 44 15 CONECT 45 19 CONECT 46 22 CONECT 47 22 CONECT 48 23 CONECT 49 24 CONECT 50 24 CONECT 51 24 CONECT 52 25 CONECT 53 25 CONECT 54 25 CONECT 55 29 CONECT 56 29 CONECT 57 29 MASTER 0 0 0 0 0 0 0 0 57 0 116 0 END