Content for NMR-STAR saveframe, "J_values_set_1"
save_J_values_set_1
_Coupling_constant_list.Sf_category coupling_constants
_Coupling_constant_list.Sf_framecode J_values_set_1
_Coupling_constant_list.Entry_ID 5558
_Coupling_constant_list.ID 1
_Coupling_constant_list.Sample_condition_list_ID 1
_Coupling_constant_list.Sample_condition_list_label $Sample_condition_1
_Coupling_constant_list.Spectrometer_frequency_1H 500
_Coupling_constant_list.Details
;
Add 584 to the given residue number to get the wild-type residue number as
given in the PDB structure file 1H5P.
;
_Coupling_constant_list.Text_data_format .
_Coupling_constant_list.Text_data .
loop_
_Coupling_constant_experiment.Experiment_ID
_Coupling_constant_experiment.Experiment_name
_Coupling_constant_experiment.Sample_ID
_Coupling_constant_experiment.Sample_label
_Coupling_constant_experiment.Sample_state
_Coupling_constant_experiment.Entry_ID
_Coupling_constant_experiment.Coupling_constant_list_ID
. . 1 $Sample_1 . 5558 1
. . 2 $Sample_2 . 5558 1
stop_
loop_
_Coupling_constant.ID
_Coupling_constant.Code
_Coupling_constant.Assembly_atom_ID_1
_Coupling_constant.Entity_assembly_ID_1
_Coupling_constant.Entity_ID_1
_Coupling_constant.Comp_index_ID_1
_Coupling_constant.Seq_ID_1
_Coupling_constant.Comp_ID_1
_Coupling_constant.Atom_ID_1
_Coupling_constant.Atom_type_1
_Coupling_constant.Atom_isotope_number_1
_Coupling_constant.Ambiguity_code_1
_Coupling_constant.Assembly_atom_ID_2
_Coupling_constant.Entity_assembly_ID_2
_Coupling_constant.Entity_ID_2
_Coupling_constant.Comp_index_ID_2
_Coupling_constant.Seq_ID_2
_Coupling_constant.Comp_ID_2
_Coupling_constant.Atom_ID_2
_Coupling_constant.Atom_type_2
_Coupling_constant.Atom_isotope_number_2
_Coupling_constant.Ambiguity_code_2
_Coupling_constant.Val
_Coupling_constant.Val_min
_Coupling_constant.Val_max
_Coupling_constant.Val_err
_Coupling_constant.Resonance_ID_1
_Coupling_constant.Resonance_ID_2
_Coupling_constant.Auth_entity_assembly_ID_1
_Coupling_constant.Auth_seq_ID_1
_Coupling_constant.Auth_comp_ID_1
_Coupling_constant.Auth_atom_ID_1
_Coupling_constant.Auth_entity_assembly_ID_2
_Coupling_constant.Auth_seq_ID_2
_Coupling_constant.Auth_comp_ID_2
_Coupling_constant.Auth_atom_ID_2
_Coupling_constant.Details
_Coupling_constant.Entry_ID
_Coupling_constant.Coupling_constant_list_ID
1 3JHNHA . 1 1 20 20 GLU H . . . . 1 1 20 20 GLU HA . . . 10.57 . . 1 . . . . . . . . . . . 5558 1
2 3JHNHA . 1 1 23 23 VAL H . . . . 1 1 23 23 VAL HA . . . 11.48 . . 1 . . . . . . . . . . . 5558 1
3 3JHNHA . 1 1 24 24 THR H . . . . 1 1 24 24 THR HA . . . 10.28 . . 1 . . . . . . . . . . . 5558 1
4 3JHNHA . 1 1 29 29 LYS H . . . . 1 1 29 29 LYS HA . . . 9.83 . . 1 . . . . . . . . . . . 5558 1
5 3JHNHA . 1 1 31 31 THR H . . . . 1 1 31 31 THR HA . . . 11.03 . . 1 . . . . . . . . . . . 5558 1
6 3JHNHA . 1 1 32 32 LEU H . . . . 1 1 32 32 LEU HA . . . 8.70 . . 1 . . . . . . . . . . . 5558 1
7 3JHNHA . 1 1 33 33 TYR H . . . . 1 1 33 33 TYR HA . . . 9.92 . . 1 . . . . . . . . . . . 5558 1
8 3JHNHA . 1 1 45 45 CYS H . . . . 1 1 45 45 CYS HA . . . 9.22 . . 1 . . . . . . . . . . . 5558 1
9 3JHNHA . 1 1 46 46 ILE H . . . . 1 1 46 46 ILE HA . . . 10.16 . . 1 . . . . . . . . . . . 5558 1
10 3JHNHA . 1 1 47 47 GLN H . . . . 1 1 47 47 GLN HA . . . 10.51 . . 1 . . . . . . . . . . . 5558 1
11 3JHNHA . 1 1 51 51 LYS H . . . . 1 1 51 51 LYS HA . . . 8.54 . . 1 . . . . . . . . . . . 5558 1
12 3JHNHA . 1 1 52 52 LYS H . . . . 1 1 52 52 LYS HA . . . 9.68 . . 1 . . . . . . . . . . . 5558 1
13 3JHNHA . 1 1 53 53 TRP H . . . . 1 1 53 53 TRP HA . . . 9.77 . . 1 . . . . . . . . . . . 5558 1
14 3JHNHA . 1 1 54 54 PHE H . . . . 1 1 54 54 PHE HA . . . 10.24 . . 1 . . . . . . . . . . . 5558 1
15 3JHNHA . 1 1 55 55 THR H . . . . 1 1 55 55 THR HA . . . 8.05 . . 1 . . . . . . . . . . . 5558 1
16 3JHNHA . 1 1 57 57 ARG H . . . . 1 1 57 57 ARG HA . . . 4.81 . . 1 . . . . . . . . . . . 5558 1
17 3JHNHA . 1 1 59 59 PHE H . . . . 1 1 59 59 PHE HA . . . 5.64 . . 1 . . . . . . . . . . . 5558 1
18 3JHNHA . 1 1 60 60 GLU H . . . . 1 1 60 60 GLU HA . . . 4.56 . . 1 . . . . . . . . . . . 5558 1
19 3JHNHA . 1 1 61 61 ILE H . . . . 1 1 61 61 ILE HA . . . 5.61 . . 1 . . . . . . . . . . . 5558 1
20 3JHNHA . 1 1 62 62 GLU H . . . . 1 1 62 62 GLU HA . . . 5.32 . . 1 . . . . . . . . . . . 5558 1
21 3JHNHA . 1 1 70 70 ASN H . . . . 1 1 70 70 ASN HA . . . 4.67 . . 1 . . . . . . . . . . . 5558 1
22 3JHNHA . 1 1 71 71 TRP H . . . . 1 1 71 71 TRP HA . . . 2.43 . . 1 . . . . . . . . . . . 5558 1
23 3JHNHA . 1 1 72 72 LYS H . . . . 1 1 72 72 LYS HA . . . 5.90 . . 1 . . . . . . . . . . . 5558 1
24 3JHNHA . 1 1 76 76 ARG H . . . . 1 1 76 76 ARG HA . . . 10.62 . . 1 . . . . . . . . . . . 5558 1
25 3JHNHA . 1 1 77 77 CYS H . . . . 1 1 77 77 CYS HA . . . 9.67 . . 1 . . . . . . . . . . . 5558 1
26 3JHNHA . 1 1 82 82 LEU H . . . . 1 1 82 82 LEU HA . . . 4.34 . . 1 . . . . . . . . . . . 5558 1
27 3JHNHA . 1 1 83 83 LYS H . . . . 1 1 83 83 LYS HA . . . 2.74 . . 1 . . . . . . . . . . . 5558 1
28 3JHNHA . 1 1 84 84 VAL H . . . . 1 1 84 84 VAL HA . . . 6.65 . . 1 . . . . . . . . . . . 5558 1
29 3JHNHA . 1 1 86 86 MET H . . . . 1 1 86 86 MET HA . . . 5.92 . . 1 . . . . . . . . . . . 5558 1
30 3JHNHA . 1 1 87 87 GLU H . . . . 1 1 87 87 GLU HA . . . 5.15 . . 1 . . . . . . . . . . . 5558 1
stop_
save_