Content for NMR-STAR saveframe, "peak_list_1_2_3_4_5_6_7_8_9_10_11_12"
save_peak_list_1_2_3_4_5_6_7_8_9_10_11_12
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7_8_9_10_11_12
_Spectral_peak_list.Entry_ID 26963
_Spectral_peak_list.ID 12
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Experiment_ID 14
_Spectral_peak_list.Experiment_name '2D 1H-13C HSQC/HMQC'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 2
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_Spectral_peak_list.Details 'Default list'
_Spectral_peak_list.Text_data_format .
_Spectral_peak_list.Text_data .
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 1H . . 8992.806 . . . . . . . 26963 12
2 . . C 13 13C . . 4752.852 . . . . . . . 26963 12
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . 26963 12
2 1.0 . . 26963 12
3 1.0 . . 26963 12
4 1.0 . . 26963 12
5 1.0 . . 26963 12
6 1.0 . . 26963 12
7 1.0 . . 26963 12
8 1.0 . . 26963 12
9 1.0 . . 26963 12
10 1.0 . . 26963 12
11 1.0 . . 26963 12
12 1.0 . . 26963 12
13 1.0 . . 26963 12
14 1.0 . . 26963 12
15 1.0 . . 26963 12
16 1.0 . . 26963 12
17 1.0 . . 26963 12
18 1.0 . . 26963 12
19 1.0 . . 26963 12
20 1.0 . . 26963 12
21 1.0 . . 26963 12
22 1.0 . . 26963 12
stop_
loop_
_Peak_general_char.Peak_ID
_Peak_general_char.Intensity_val
_Peak_general_char.Intensity_val_err
_Peak_general_char.Measurement_method
_Peak_general_char.Entry_ID
_Peak_general_char.Spectral_peak_list_ID
1 2692173.00000 . height 26963 12
1 17439530.75000 . volume 26963 12
2 3016626.25000 . height 26963 12
2 19761295.00000 . volume 26963 12
3 11940566.00000 . height 26963 12
3 85654693.00000 . volume 26963 12
4 1392007.87500 . height 26963 12
4 9280682.75000 . volume 26963 12
5 1216398.25000 . height 26963 12
5 7214351.06250 . volume 26963 12
6 1156059.75000 . height 26963 12
6 11815133.70310 . volume 26963 12
7 1367488.75000 . height 26963 12
7 8749767.75000 . volume 26963 12
8 1050465.00000 . height 26963 12
8 6739973.15625 . volume 26963 12
9 866149.62500 . height 26963 12
9 5539753.03125 . volume 26963 12
10 3723583.75000 . height 26963 12
10 23418527.25000 . volume 26963 12
11 789870.87500 . height 26963 12
11 4943622.50000 . volume 26963 12
12 1034870.18750 . height 26963 12
12 6382232.50000 . volume 26963 12
13 1315355.00000 . height 26963 12
13 8486722.81250 . volume 26963 12
14 1738889.12500 . height 26963 12
14 10836498.68750 . volume 26963 12
15 560842.43750 . height 26963 12
15 3506792.71875 . volume 26963 12
16 1830795.50000 . height 26963 12
16 11887871.25000 . volume 26963 12
17 2533469.25000 . height 26963 12
17 16971156.75000 . volume 26963 12
18 922966.37500 . height 26963 12
18 6064481.03125 . volume 26963 12
19 3367595.75000 . height 26963 12
19 22303874.87500 . volume 26963 12
20 1144880.50000 . height 26963 12
20 7691899.65625 . volume 26963 12
21 589359.43750 . height 26963 12
21 3596963.93750 . volume 26963 12
22 1214239.12500 . height 26963 12
22 7730601.75000 . volume 26963 12
stop_
loop_
_Peak_char.Peak_ID
_Peak_char.Spectral_dim_ID
_Peak_char.Chem_shift_val
_Peak_char.Chem_shift_val_err
_Peak_char.Line_width_val
_Peak_char.Line_width_val_err
_Peak_char.Phase_val
_Peak_char.Phase_val_err
_Peak_char.Decay_rate_val
_Peak_char.Decay_rate_val_err
_Peak_char.Coupling_pattern
_Peak_char.Bounding_box_upper_val
_Peak_char.Bounding_box_lower_val
_Peak_char.Bounding_box_range_val
_Peak_char.Details
_Peak_char.Derivation_method_ID
_Peak_char.Entry_ID
_Peak_char.Spectral_peak_list_ID
1 1 0.736 . . . . . . . . . . . . . 26963 12
1 2 21.365 . . . . . . . . . . . . . 26963 12
2 1 0.844 . . . . . . . . . . . . . 26963 12
2 2 21.094 . . . . . . . . . . . . . 26963 12
3 1 0.890 . . . . . . . . . . . . . 26963 12
3 2 21.037 . . . . . . . . . . . . . 26963 12
4 1 0.790 . . . . . . . . . . . . . 26963 12
4 2 20.634 . . . . . . . . . . . . . 26963 12
5 1 0.873 . . . . . . . . . . . . . 26963 12
5 2 21.598 . . . . . . . . . . . . . 26963 12
6 1 0.734 . . . . . . . . . . . . . 26963 12
6 2 21.294 . . . . . . . . . . . . . 26963 12
7 1 0.802 . . . . . . . . . . . . . 26963 12
7 2 21.411 . . . . . . . . . . . . . 26963 12
8 1 0.419 . . . . . . . . . . . . . 26963 12
8 2 20.908 . . . . . . . . . . . . . 26963 12
9 1 0.530 . . . . . . . . . . . . . 26963 12
9 2 18.475 . . . . . . . . . . . . . 26963 12
10 1 0.737 . . . . . . . . . . . . . 26963 12
10 2 21.102 . . . . . . . . . . . . . 26963 12
11 1 0.744 . . . . . . . . . . . . . 26963 12
11 2 25.285 . . . . . . . . . . . . . 26963 12
12 1 0.767 . . . . . . . . . . . . . 26963 12
12 2 22.272 . . . . . . . . . . . . . 26963 12
13 1 0.830 . . . . . . . . . . . . . 26963 12
13 2 18.810 . . . . . . . . . . . . . 26963 12
14 1 0.945 . . . . . . . . . . . . . 26963 12
14 2 22.148 . . . . . . . . . . . . . 26963 12
15 1 0.675 . . . . . . . . . . . . . 26963 12
15 2 22.398 . . . . . . . . . . . . . 26963 12
16 1 1.041 . . . . . . . . . . . . . 26963 12
16 2 21.416 . . . . . . . . . . . . . 26963 12
17 1 1.135 . . . . . . . . . . . . . 26963 12
17 2 20.841 . . . . . . . . . . . . . 26963 12
18 1 0.951 . . . . . . . . . . . . . 26963 12
18 2 21.528 . . . . . . . . . . . . . 26963 12
19 1 1.287 . . . . . . . . . . . . . 26963 12
19 2 21.813 . . . . . . . . . . . . . 26963 12
20 1 1.308 . . . . . . . . . . . . . 26963 12
20 2 21.436 . . . . . . . . . . . . . 26963 12
21 1 0.945 . . . . . . . . . . . . . 26963 12
21 2 21.904 . . . . . . . . . . . . . 26963 12
22 1 0.644 . . . . . . . . . . . . . 26963 12
22 2 18.594 . . . . . . . . . . . . . 26963 12
stop_
loop_
_Assigned_peak_chem_shift.Peak_ID
_Assigned_peak_chem_shift.Spectral_dim_ID
_Assigned_peak_chem_shift.Set_ID
_Assigned_peak_chem_shift.Magnetization_linkage_ID
_Assigned_peak_chem_shift.Assembly_atom_ID
_Assigned_peak_chem_shift.Val
_Assigned_peak_chem_shift.Contribution_fractional_val
_Assigned_peak_chem_shift.Figure_of_merit
_Assigned_peak_chem_shift.Assigned_chem_shift_list_ID
_Assigned_peak_chem_shift.Atom_chem_shift_ID
_Assigned_peak_chem_shift.Entity_assembly_ID
_Assigned_peak_chem_shift.Entity_ID
_Assigned_peak_chem_shift.Comp_index_ID
_Assigned_peak_chem_shift.Comp_ID
_Assigned_peak_chem_shift.Atom_ID
_Assigned_peak_chem_shift.Ambiguity_code
_Assigned_peak_chem_shift.Ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_atom_peak_num
_Assigned_peak_chem_shift.Auth_entity_ID
_Assigned_peak_chem_shift.Auth_seq_ID
_Assigned_peak_chem_shift.Auth_comp_ID
_Assigned_peak_chem_shift.Auth_atom_ID
_Assigned_peak_chem_shift.Auth_ambiguity_code
_Assigned_peak_chem_shift.Auth_ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_amb_atom_grp_ID
_Assigned_peak_chem_shift.Resonance_ID
_Assigned_peak_chem_shift.Details
_Assigned_peak_chem_shift.Entry_ID
_Assigned_peak_chem_shift.Spectral_peak_list_ID
1 1 1 . . 0.736 . . 1 . 1 1 25 VAL MG1 . . . . . . . . . . 374 . 26963 12
1 1 2 . . 0.736 . . 1 . 1 1 131 VAL MG1 . . . . . . . . . . 302 . 26963 12
1 2 1 . . 21.365 . . 1 . 1 1 131 VAL CG1 . . . . . . . . . . 297 . 26963 12
1 2 2 . . 21.365 . . 1 . 1 1 25 VAL CG1 . . . . . . . . . . 793 . 26963 12
2 1 1 . . 0.844 . . 1 . 1 1 25 VAL MG2 . . . . . . . . . . 792 . 26963 12
2 2 2 . . 21.094 . . 1 . 1 1 25 VAL CG2 . . . . . . . . . . 1101 . 26963 12
3 1 1 . . 0.890 . . 1 . 1 1 15 VAL MG1 . . . . . . . . . . 940 . 26963 12
3 2 1 . . 21.037 . . 1 . 1 1 15 VAL CG1 . . . . . . . . . . 939 . 26963 12
4 1 1 . . 0.790 . . 1 . 1 1 26 VAL MG1 . . . . . . . . . . 215 . 26963 12
4 2 1 . . 20.634 . . 1 . 1 1 26 VAL CG1 . . . . . . . . . . 210 . 26963 12
5 1 1 . . 0.873 . . 1 . 1 1 26 VAL MG2 . . . . . . . . . . 373 . 26963 12
5 2 1 . . 21.598 . . 1 . 1 1 26 VAL CG2 . . . . . . . . . . 209 . 26963 12
6 1 2 . . 0.734 . . 1 . 1 1 46 VAL MG2 . . . . . . . . . . 821 . 26963 12
6 2 2 . . 21.294 . . 1 . 1 1 46 VAL CG2 . . . . . . . . . . 1100 . 26963 12
7 1 3 . . 0.802 . . 1 . 1 1 46 VAL MG1 . . . . . . . . . . 820 . 26963 12
7 2 3 . . 21.411 . . 1 . 1 1 46 VAL CG1 . . . . . . . . . . 1099 . 26963 12
8 1 1 . . 0.419 . . 1 . 1 1 68 VAL MG1 . . . . . . . . . . 324 . 26963 12
8 2 1 . . 20.908 . . 1 . 1 1 68 VAL CG1 . . . . . . . . . . 319 . 26963 12
9 1 1 . . 0.530 . . 1 . 1 1 68 VAL MG2 . . . . . . . . . . 325 . 26963 12
9 2 1 . . 18.475 . . 1 . 1 1 68 VAL CG2 . . . . . . . . . . 318 . 26963 12
11 1 1 . . 0.744 . . 1 . 1 1 99 VAL MG1 . . . . . . . . . . 829 . 26963 12
11 2 1 . . 25.285 . . 1 . 1 1 99 VAL CG1 . . . . . . . . . . 831 . 26963 12
12 1 1 . . 0.767 . . 1 . 1 1 99 VAL MG2 . . . . . . . . . . 828 . 26963 12
12 2 1 . . 22.272 . . 1 . 1 1 99 VAL CG2 . . . . . . . . . . 830 . 26963 12
13 1 1 . . 0.830 . . 1 . 1 1 110 VAL MG2 . . . . . . . . . . 825 . 26963 12
13 2 1 . . 18.810 . . 1 . 1 1 110 VAL CG2 . . . . . . . . . . 824 . 26963 12
14 1 1 . . 0.945 . . 1 . 1 1 110 VAL MG1 . . . . . . . . . . 827 . 26963 12
14 2 1 . . 22.148 . . 1 . 1 1 110 VAL CG1 . . . . . . . . . . 826 . 26963 12
15 1 1 . . 0.675 . . 1 . 1 1 131 VAL MG2 . . . . . . . . . . 816 . 26963 12
15 2 1 . . 22.398 . . 1 . 1 1 131 VAL CG2 . . . . . . . . . . 817 . 26963 12
16 1 1 . . 1.041 . . 1 . 1 1 27 THR MG . . . . . . . . . . 673 . 26963 12
16 2 1 . . 21.416 . . 1 . 1 1 27 THR CG2 . . . . . . . . . . 672 . 26963 12
17 1 1 . . 1.135 . . 1 . 1 1 40 THR MG . . . . . . . . . . 813 . 26963 12
17 2 1 . . 20.841 . . 1 . 1 1 40 THR CG2 . . . . . . . . . . 812 . 26963 12
18 1 1 . . 0.951 . . 1 . 1 1 48 THR MG . . . . . . . . . . 455 . 26963 12
18 2 1 . . 21.528 . . 1 . 1 1 48 THR CG2 . . . . . . . . . . 454 . 26963 12
19 1 1 . . 1.287 . . 1 . 1 1 54 THR MG . . . . . . . . . . 502 . 26963 12
19 2 1 . . 21.813 . . 1 . 1 1 54 THR CG2 . . . . . . . . . . 501 . 26963 12
20 1 1 . . 1.308 . . 1 . 1 1 55 THR MG . . . . . . . . . . 632 . 26963 12
20 2 1 . . 21.436 . . 1 . 1 1 55 THR CG2 . . . . . . . . . . 631 . 26963 12
21 1 1 . . 0.945 . . 1 . 1 1 94 THR MG . . . . . . . . . . 618 . 26963 12
21 2 1 . . 21.904 . . 1 . 1 1 94 THR CG2 . . . . . . . . . . 617 . 26963 12
22 1 1 . . 0.644 . . 1 . 1 1 129 ILE MG . . . . . . . . . . 65 . 26963 12
22 2 1 . . 18.594 . . 1 . 1 1 129 ILE CG2 . . . . . . . . . . 71 . 26963 12
stop_
save_