HEADER PROTEIN 30-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-APR-22 0 HETATM 1 H UNK 0 -10.535 -16.348 0.000 0.00 0.00 H+0 HETATM 2 O UNK 0 -8.995 -16.348 0.000 0.00 0.00 O+0 HETATM 3 C UNK 0 -8.225 -15.015 0.000 0.00 0.00 C+0 HETATM 4 H UNK 0 -8.315 -13.477 0.000 0.00 0.00 H+0 HETATM 5 H UNK 0 -9.512 -14.168 0.000 0.00 0.00 H+0 HETATM 6 C UNK 0 -6.685 -15.015 0.000 0.00 0.00 C+0 HETATM 7 H UNK 0 -7.384 -16.387 0.000 0.00 0.00 H+0 HETATM 8 O UNK 0 -5.780 -13.769 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 -4.316 -14.245 0.000 0.00 0.00 C+0 HETATM 10 H UNK 0 -2.943 -14.944 0.000 0.00 0.00 H+0 HETATM 11 O UNK 0 -3.070 -13.339 0.000 0.00 0.00 O+0 HETATM 12 P UNK 0 -3.231 -11.808 0.000 0.00 0.00 P+0 HETATM 13 O UNK 0 -1.699 -11.647 0.000 0.00 0.00 O-1 HETATM 14 O UNK 0 -4.762 -11.969 0.000 0.00 0.00 O+0 HETATM 15 O UNK 0 -3.392 -10.276 0.000 0.00 0.00 O+0 HETATM 16 P UNK 0 -2.146 -9.371 0.000 0.00 0.00 P+0 HETATM 17 O UNK 0 -1.241 -10.617 0.000 0.00 0.00 O-1 HETATM 18 O UNK 0 -3.051 -8.125 0.000 0.00 0.00 O+0 HETATM 19 O UNK 0 -0.900 -8.466 0.000 0.00 0.00 O+0 HETATM 20 C UNK 0 -1.061 -6.934 0.000 0.00 0.00 C+0 HETATM 21 H UNK 0 -2.037 -5.743 0.000 0.00 0.00 H+0 HETATM 22 H UNK 0 -2.599 -7.006 0.000 0.00 0.00 H+0 HETATM 23 C UNK 0 0.185 -6.029 0.000 0.00 0.00 C+0 HETATM 24 H UNK 0 0.426 -7.550 0.000 0.00 0.00 H+0 HETATM 25 O UNK 0 0.185 -4.489 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 1.650 -4.013 0.000 0.00 0.00 C+0 HETATM 27 H UNK 0 3.171 -3.772 0.000 0.00 0.00 H+0 HETATM 28 N UNK 0 2.126 -2.549 0.000 0.00 0.00 N+0 HETATM 29 C UNK 0 1.220 -1.303 0.000 0.00 0.00 C+0 HETATM 30 H UNK 0 -0.320 -1.303 0.000 0.00 0.00 H+0 HETATM 31 N UNK 0 2.126 -0.057 0.000 0.00 0.00 N+0 HETATM 32 C UNK 0 3.590 -0.533 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 4.924 0.237 0.000 0.00 0.00 C+0 HETATM 34 N UNK 0 6.258 -0.533 0.000 0.00 0.00 N+0 HETATM 35 C UNK 0 6.258 -2.073 0.000 0.00 0.00 C+0 HETATM 36 H UNK 0 7.591 -2.843 0.000 0.00 0.00 H+0 HETATM 37 N UNK 0 4.924 -2.843 0.000 0.00 0.00 N+0 HETATM 38 C UNK 0 3.590 -2.073 0.000 0.00 0.00 C+0 HETATM 39 N UNK 0 4.924 1.777 0.000 0.00 0.00 N+0 HETATM 40 H UNK 0 6.258 2.547 0.000 0.00 0.00 H+0 HETATM 41 H UNK 0 3.590 2.547 0.000 0.00 0.00 H+0 HETATM 42 C UNK 0 2.555 -5.259 0.000 0.00 0.00 C+0 HETATM 43 H UNK 0 3.254 -6.631 0.000 0.00 0.00 H+0 HETATM 44 O UNK 0 4.095 -5.259 0.000 0.00 0.00 O+0 HETATM 45 P UNK 0 4.865 -6.593 0.000 0.00 0.00 P+0 HETATM 46 O UNK 0 3.531 -7.363 0.000 0.00 0.00 O-1 HETATM 47 O UNK 0 6.199 -5.823 0.000 0.00 0.00 O-1 HETATM 48 O UNK 0 5.635 -7.927 0.000 0.00 0.00 O+0 HETATM 49 C UNK 0 1.650 -6.505 0.000 0.00 0.00 C+0 HETATM 50 H UNK 0 1.174 -5.040 0.000 0.00 0.00 H+0 HETATM 51 O UNK 0 2.126 -7.970 0.000 0.00 0.00 O+0 HETATM 52 H UNK 0 2.253 -9.504 0.000 0.00 0.00 H+0 HETATM 53 C UNK 0 -4.316 -15.785 0.000 0.00 0.00 C+0 HETATM 54 H UNK 0 -4.556 -17.306 0.000 0.00 0.00 H+0 HETATM 55 O UNK 0 -3.070 -16.690 0.000 0.00 0.00 O+0 HETATM 56 H UNK 0 -1.821 -17.591 0.000 0.00 0.00 H+0 HETATM 57 C UNK 0 -5.780 -16.261 0.000 0.00 0.00 C+0 HETATM 58 H UNK 0 -5.304 -14.796 0.000 0.00 0.00 H+0 HETATM 59 O UNK 0 -6.256 -17.725 0.000 0.00 0.00 O+0 HETATM 60 H UNK 0 -6.732 -19.190 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 5 6 CONECT 4 3 CONECT 5 3 CONECT 6 3 7 8 57 CONECT 7 6 CONECT 8 6 9 CONECT 9 8 10 11 53 CONECT 10 9 CONECT 11 9 12 CONECT 12 11 13 14 15 CONECT 13 12 CONECT 14 12 CONECT 15 12 16 CONECT 16 15 17 18 19 CONECT 17 16 CONECT 18 16 CONECT 19 16 20 CONECT 20 19 21 22 23 CONECT 21 20 CONECT 22 20 CONECT 23 20 24 25 49 CONECT 24 23 CONECT 25 23 26 CONECT 26 25 27 28 42 CONECT 27 26 CONECT 28 26 29 38 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 CONECT 32 31 33 38 CONECT 33 32 34 39 CONECT 34 33 35 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 CONECT 38 37 28 32 CONECT 39 33 40 41 CONECT 40 39 CONECT 41 39 CONECT 42 26 43 44 49 CONECT 43 42 CONECT 44 42 45 CONECT 45 44 46 47 48 CONECT 46 45 CONECT 47 45 CONECT 48 45 CONECT 49 42 23 50 51 CONECT 50 49 CONECT 51 49 52 CONECT 52 51 CONECT 53 9 54 55 57 CONECT 54 53 CONECT 55 53 56 CONECT 56 55 CONECT 57 53 6 58 59 CONECT 58 57 CONECT 59 57 60 CONECT 60 59 MASTER 0 0 0 0 0 0 0 0 60 0 126 0 END