data_19133 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19133 _Entry.PDB_ID 2M6H 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 19133 _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 2 2 CYS HA H 2 4.922 4.922 5.084 -0.162 19133 2 1 1 . 1 1 2 2 CYS H H 2 7.918 7.918 8.251 -0.333 19133 3 1 1 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.384 -0.191 19133 4 1 1 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.787 -0.232 19133 5 1 1 . 1 1 7 7 TRP H H 7 7.022 7.022 7.895 -0.873 19133 6 1 2 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.101 -0.179 19133 7 1 2 . 1 1 2 2 CYS H H 2 7.918 7.918 8.289 -0.371 19133 8 1 2 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.480 -0.287 19133 9 1 2 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.766 -0.211 19133 10 1 2 . 1 1 7 7 TRP H H 7 7.022 7.022 8.127 -1.105 19133 11 1 3 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.120 -0.198 19133 12 1 3 . 1 1 2 2 CYS H H 2 7.918 7.918 8.160 -0.242 19133 13 1 3 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.419 -0.226 19133 14 1 3 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.783 -0.228 19133 15 1 3 . 1 1 7 7 TRP H H 7 7.022 7.022 7.897 -0.875 19133 16 1 4 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.110 -0.188 19133 17 1 4 . 1 1 2 2 CYS H H 2 7.918 7.918 8.302 -0.384 19133 18 1 4 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.482 -0.289 19133 19 1 4 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.753 -0.198 19133 20 1 4 . 1 1 7 7 TRP H H 7 7.022 7.022 8.147 -1.125 19133 21 1 5 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.091 -0.169 19133 22 1 5 . 1 1 2 2 CYS H H 2 7.918 7.918 8.342 -0.424 19133 23 1 5 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.529 -0.336 19133 24 1 5 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.763 -0.208 19133 25 1 5 . 1 1 7 7 TRP H H 7 7.022 7.022 8.046 -1.024 19133 26 1 6 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.076 -0.154 19133 27 1 6 . 1 1 2 2 CYS H H 2 7.918 7.918 8.280 -0.362 19133 28 1 6 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.422 -0.229 19133 29 1 6 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.766 -0.211 19133 30 1 6 . 1 1 7 7 TRP H H 7 7.022 7.022 7.952 -0.930 19133 31 1 7 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.092 -0.170 19133 32 1 7 . 1 1 2 2 CYS H H 2 7.918 7.918 8.320 -0.402 19133 33 1 7 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.494 -0.301 19133 34 1 7 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.760 -0.205 19133 35 1 7 . 1 1 7 7 TRP H H 7 7.022 7.022 8.114 -1.092 19133 36 1 8 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.065 -0.143 19133 37 1 8 . 1 1 2 2 CYS H H 2 7.918 7.918 8.332 -0.414 19133 38 1 8 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.318 -0.125 19133 39 1 8 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.769 -0.214 19133 40 1 8 . 1 1 7 7 TRP H H 7 7.022 7.022 7.826 -0.804 19133 41 1 9 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.101 -0.179 19133 42 1 9 . 1 1 2 2 CYS H H 2 7.918 7.918 8.286 -0.368 19133 43 1 9 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.469 -0.276 19133 44 1 9 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.762 -0.207 19133 45 1 9 . 1 1 7 7 TRP H H 7 7.022 7.022 8.152 -1.130 19133 46 1 10 . 1 1 2 2 CYS HA H 2 4.922 4.922 5.133 -0.211 19133 47 1 10 . 1 1 2 2 CYS H H 2 7.918 7.918 8.172 -0.254 19133 48 1 10 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.450 -0.257 19133 49 1 10 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.650 -0.095 19133 50 1 10 . 1 1 7 7 TRP H H 7 7.022 7.022 7.889 -0.867 19133 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 19133 2 1 1 "Average Difference" HA 3 0.197 0.195 0.035 19133 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19133 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19133 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19133 6 1 1 "Average Difference" HN 2 0.661 0.603 0.381 19133 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19133 8 1 2 "Average Difference" HA 3 0.230 0.226 0.055 19133 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19133 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19133 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19133 12 1 2 "Average Difference" HN 2 0.824 0.738 0.520 19133 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19133 14 1 3 "Average Difference" HA 3 0.218 0.217 0.017 19133 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19133 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19133 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19133 18 1 3 "Average Difference" HN 2 0.642 0.559 0.448 19133 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19133 20 1 4 "Average Difference" HA 3 0.230 0.225 0.056 19133 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19133 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19133 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19133 24 1 4 "Average Difference" HN 2 0.840 0.754 0.524 19133 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19133 26 1 5 "Average Difference" HA 3 0.248 0.238 0.087 19133 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19133 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19133 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19133 30 1 5 "Average Difference" HN 2 0.784 0.724 0.425 19133 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19133 32 1 6 "Average Difference" HA 3 0.200 0.198 0.039 19133 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19133 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19133 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19133 36 1 6 "Average Difference" HN 2 0.706 0.646 0.402 19133 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19133 38 1 7 "Average Difference" HA 3 0.232 0.225 0.068 19133 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19133 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19133 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19133 42 1 7 "Average Difference" HN 2 0.823 0.747 0.488 19133 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19133 44 1 8 "Average Difference" HA 3 0.165 0.161 0.047 19133 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19133 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19133 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19133 48 1 8 "Average Difference" HN 2 0.639 0.609 0.275 19133 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19133 50 1 9 "Average Difference" HA 3 0.224 0.221 0.050 19133 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19133 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19133 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19133 54 1 9 "Average Difference" HN 2 0.841 0.749 0.539 19133 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19133 56 1 10 "Average Difference" HA 3 0.200 0.188 0.083 19133 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19133 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19133 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19133 60 1 10 "Average Difference" HN 2 0.639 0.561 0.433 19133 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 19133 _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 2 2 CYS HA H 2 4.922 4.922 5.097 -0.175 19133 2 1 . 1 1 2 2 CYS H H 2 7.918 7.918 8.273 -0.355 19133 3 1 . 1 1 6 6 PRO HA H 6 4.193 4.193 4.445 -0.252 19133 4 1 . 1 1 7 7 TRP HA H 7 4.555 4.555 4.756 -0.201 19133 5 1 . 1 1 7 7 TRP H H 7 7.022 7.022 8.004 -0.982 19133 stop_ save_