Content for NMR-STAR saveframe, "spectral_peak_list_2"
save_spectral_peak_list_2
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_2
_Spectral_peak_list.Entry_ID 30608
_Spectral_peak_list.ID 2
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 3
_Spectral_peak_list.Sample_label $sample_3
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID .
_Spectral_peak_list.Chem_shift_reference_label .
_Spectral_peak_list.Experiment_ID 7
_Spectral_peak_list.Experiment_name 'NOESY CM-NHN'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details 'We used RASREC-Rosetta to calculate the structural ensemble.'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
Assignment w1 w2 w3
V35CG2-R34N-H 20.287 125.625 8.043
V35CG2-N-H 20.244 122.582 8.441
V35CG2-M36N-H 20.197 124.711 9.209
V46CG2-M36N-H 20.857 124.688 9.212
V46CG2-H38N-H 20.754 125.387 7.947
V46CG2-Q45N-H 20.856 126.081 8.862
V46CG2-N-H 20.799 124.184 9.547
V47CG2-N-H 20.992 128.453 9.560
V48CG2-N-H 20.262 126.704 8.945
V58CG2-D54N-H 21.982 120.938 8.421
V58CG2-N-H 21.988 122.266 7.716
V58CG2-I59N-H 21.963 119.841 8.537
V61CD2-N-H 21.671 123.049 7.644
V61CG2-L62N-H 21.678 119.640 8.341
L62CD2-N-H 19.675 119.663 8.342
L79CD2-V47N-H 24.316 128.348 9.563
L79CD2-N-H 24.370 128.029 9.604
L80CD2-N-H 23.064 123.413 8.962
V583CG2-N-H 20.612 119.500 9.424
V583CG2-L584N-H 20.594 133.006 9.657
L584CD2-L62N-H 26.880 119.600 8.338
L584CD2-N-H 26.859 133.031 9.641
L608CD2-N-H 22.679 122.294 8.109
;
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 HN . . 16 ppm . . . 4.696 . . 30608 2
2 . . N 15 N . . 30 ppm . . . 119 . . 30608 2
3 . . C 13 C-methyl . . 20 ppm . . . 17 . . 30608 2
stop_
save_