data_19414 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19414 _Entry.PDB_ID 2MBT save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 19414 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.711 -1.583 19414 2 1 1 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.715 -0.899 19414 3 1 1 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.267 -0.316 19414 4 1 1 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.551 0.541 19414 5 1 2 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.713 -1.585 19414 6 1 2 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.766 -0.950 19414 7 1 2 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.142 -0.191 19414 8 1 2 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.505 0.587 19414 9 1 3 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.712 -1.584 19414 10 1 3 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.740 -0.924 19414 11 1 3 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.152 -0.201 19414 12 1 3 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.502 0.590 19414 13 1 4 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.709 -1.581 19414 14 1 4 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.654 -0.838 19414 15 1 4 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.448 -0.497 19414 16 1 4 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.582 0.510 19414 17 1 5 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.712 -1.585 19414 18 1 5 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.738 -0.922 19414 19 1 5 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.155 -0.204 19414 20 1 5 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.509 0.583 19414 21 1 6 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.709 -1.581 19414 22 1 6 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.695 -0.879 19414 23 1 6 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.266 -0.315 19414 24 1 6 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.555 0.537 19414 25 1 7 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.713 -1.585 19414 26 1 7 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.769 -0.953 19414 27 1 7 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.163 -0.212 19414 28 1 7 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.537 0.555 19414 29 1 8 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.712 -1.584 19414 30 1 8 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.702 -0.886 19414 31 1 8 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.164 -0.213 19414 32 1 8 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.507 0.585 19414 33 1 9 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.710 -1.582 19414 34 1 9 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.686 -0.870 19414 35 1 9 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.266 -0.315 19414 36 1 9 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.587 0.504 19414 37 1 10 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.711 -1.583 19414 38 1 10 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.735 -0.919 19414 39 1 10 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.160 -0.209 19414 40 1 10 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.523 0.569 19414 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 0 0.000 0.000 0.000 19414 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 19414 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19414 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19414 5 1 1 "Average Difference" CB 4 0.962 0.564 0.900 19414 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 19414 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19414 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 19414 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19414 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19414 11 1 2 "Average Difference" CB 4 0.974 0.535 0.940 19414 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 19414 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19414 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 19414 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19414 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19414 17 1 3 "Average Difference" CB 4 0.968 0.530 0.936 19414 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 19414 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19414 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 19414 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19414 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19414 23 1 4 "Average Difference" CB 4 0.963 0.602 0.868 19414 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 19414 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19414 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 19414 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19414 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19414 29 1 5 "Average Difference" CB 4 0.967 0.532 0.933 19414 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 19414 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19414 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 19414 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19414 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19414 35 1 6 "Average Difference" CB 4 0.957 0.559 0.896 19414 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 19414 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19414 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 19414 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19414 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19414 41 1 7 "Average Difference" CB 4 0.971 0.549 0.925 19414 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 19414 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19414 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 19414 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19414 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19414 47 1 8 "Average Difference" CB 4 0.960 0.525 0.928 19414 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 19414 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19414 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 19414 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19414 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19414 53 1 9 "Average Difference" CB 4 0.950 0.566 0.882 19414 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 19414 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19414 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 19414 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19414 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19414 59 1 10 "Average Difference" CB 4 0.964 0.535 0.926 19414 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 19414 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 19414 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 8 8 ALA CB C 8 17.128 17.128 18.711 -1.583 19414 2 1 . 1 1 65 65 ALA CB C 65 18.816 18.816 19.720 -0.904 19414 3 1 . 1 1 147 147 ALA CB C 147 17.951 17.951 18.218 -0.267 19414 4 1 . 1 1 169 169 ALA CB C 169 20.092 20.092 19.536 0.556 19414 stop_ save_