Content for NMR-STAR saveframe, "spectral_peak_list_3"
save_spectral_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_3
_Spectral_peak_list.Entry_ID 30149
_Spectral_peak_list.ID 3
_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 6
_Spectral_peak_list.Experiment_name '3D 1H-13C NOESY aromatic'
_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 .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_Spectral_peak_list.Details .
_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 H . aliased 10799.136 Hz . . . 4.772 . . 30149 3
2 . . H 1 H 3 aliased 13513.514 Hz . . . 4.772 . . 30149 3
3 . . C 13 C-aromatic 2 aliased 6337.136 Hz . . . 127 . . 30149 3
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
1 $software_1 . . 30149 3
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
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2 . . . 30149 3
3 . . . 30149 3
4 . . . 30149 3
5 . . . 30149 3
6 . . . 30149 3
7 . . . 30149 3
8 . . . 30149 3
9 . . . 30149 3
10 . . . 30149 3
11 . . . 30149 3
12 . . . 30149 3
13 . . . 30149 3
14 . . . 30149 3
15 . . . 30149 3
16 . . . 30149 3
17 . . . 30149 3
18 . . . 30149 3
19 . . . 30149 3
20 . . . 30149 3
21 . . . 30149 3
22 . . . 30149 3
23 . . . 30149 3
24 . . . 30149 3
25 . . . 30149 3
26 . . . 30149 3
27 . . . 30149 3
28 . . . 30149 3
29 . . . 30149 3
30 . . . 30149 3
31 . . . 30149 3
32 . . . 30149 3
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 69340.0 . volume 30149 3
2 31460.0 . volume 30149 3
3 4196.0 . volume 30149 3
4 4899.0 . volume 30149 3
5 3359.0 . volume 30149 3
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21 5049.0 . volume 30149 3
22 58270.0 . volume 30149 3
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24 4196.0 . volume 30149 3
25 3165.0 . volume 30149 3
26 3080.0 . volume 30149 3
27 17340.0 . volume 30149 3
28 31460.0 . volume 30149 3
29 24200.0 . volume 30149 3
30 11260.0 . volume 30149 3
31 15450.0 . volume 30149 3
32 31460.0 . volume 30149 3
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 7.201 . . . . . . . . . . . . . 30149 3
1 2 6.821 . . . . . . . . . . . . . 30149 3
1 3 118.128 . . . . . . . . . . . . . 30149 3
2 1 1.457 . . . . . . . . . . . . . 30149 3
2 2 6.821 . . . . . . . . . . . . . 30149 3
2 3 118.128 . . . . . . . . . . . . . 30149 3
3 1 3.292 . . . . . . . . . . . . . 30149 3
3 2 7.292 . . . . . . . . . . . . . 30149 3
3 3 119.771 . . . . . . . . . . . . . 30149 3
4 1 2.019 . . . . . . . . . . . . . 30149 3
4 2 7.305 . . . . . . . . . . . . . 30149 3
4 3 129.718 . . . . . . . . . . . . . 30149 3
5 1 2.045 . . . . . . . . . . . . . 30149 3
5 2 7.314 . . . . . . . . . . . . . 30149 3
5 3 131.512 . . . . . . . . . . . . . 30149 3
6 1 2.919 . . . . . . . . . . . . . 30149 3
6 2 7.314 . . . . . . . . . . . . . 30149 3
6 3 131.512 . . . . . . . . . . . . . 30149 3
7 1 2.911 . . . . . . . . . . . . . 30149 3
7 2 7.315 . . . . . . . . . . . . . 30149 3
7 3 132.137 . . . . . . . . . . . . . 30149 3
8 1 3.198 . . . . . . . . . . . . . 30149 3
8 2 7.315 . . . . . . . . . . . . . 30149 3
8 3 132.137 . . . . . . . . . . . . . 30149 3
9 1 4.878 . . . . . . . . . . . . . 30149 3
9 2 7.315 . . . . . . . . . . . . . 30149 3
9 3 132.137 . . . . . . . . . . . . . 30149 3
10 1 4.57 . . . . . . . . . . . . . 30149 3
10 2 7.193 . . . . . . . . . . . . . 30149 3
10 3 133.931 . . . . . . . . . . . . . 30149 3
11 1 2.853 . . . . . . . . . . . . . 30149 3
11 2 7.193 . . . . . . . . . . . . . 30149 3
11 3 133.931 . . . . . . . . . . . . . 30149 3
12 1 1.946 . . . . . . . . . . . . . 30149 3
12 2 7.193 . . . . . . . . . . . . . 30149 3
12 3 133.931 . . . . . . . . . . . . . 30149 3
13 1 0.684 . . . . . . . . . . . . . 30149 3
13 2 7.193 . . . . . . . . . . . . . 30149 3
13 3 133.931 . . . . . . . . . . . . . 30149 3
14 1 1.468 . . . . . . . . . . . . . 30149 3
14 2 7.193 . . . . . . . . . . . . . 30149 3
14 3 133.931 . . . . . . . . . . . . . 30149 3
15 1 9.424 . . . . . . . . . . . . . 30149 3
15 2 7.193 . . . . . . . . . . . . . 30149 3
15 3 133.931 . . . . . . . . . . . . . 30149 3
16 1 1.946 . . . . . . . . . . . . . 30149 3
16 2 6.821 . . . . . . . . . . . . . 30149 3
16 3 118.128 . . . . . . . . . . . . . 30149 3
17 1 0.684 . . . . . . . . . . . . . 30149 3
17 2 6.821 . . . . . . . . . . . . . 30149 3
17 3 118.128 . . . . . . . . . . . . . 30149 3
18 1 0.88 . . . . . . . . . . . . . 30149 3
18 2 6.821 . . . . . . . . . . . . . 30149 3
18 3 118.128 . . . . . . . . . . . . . 30149 3
19 1 2.954 . . . . . . . . . . . . . 30149 3
19 2 7.193 . . . . . . . . . . . . . 30149 3
19 3 133.931 . . . . . . . . . . . . . 30149 3
20 1 2.853 . . . . . . . . . . . . . 30149 3
20 2 6.821 . . . . . . . . . . . . . 30149 3
20 3 118.128 . . . . . . . . . . . . . 30149 3
21 1 2.954 . . . . . . . . . . . . . 30149 3
21 2 6.821 . . . . . . . . . . . . . 30149 3
21 3 118.128 . . . . . . . . . . . . . 30149 3
22 1 6.823 . . . . . . . . . . . . . 30149 3
22 2 7.193 . . . . . . . . . . . . . 30149 3
22 3 133.931 . . . . . . . . . . . . . 30149 3
23 1 0.875 . . . . . . . . . . . . . 30149 3
23 2 7.193 . . . . . . . . . . . . . 30149 3
23 3 133.931 . . . . . . . . . . . . . 30149 3
24 1 3.374 . . . . . . . . . . . . . 30149 3
24 2 7.292 . . . . . . . . . . . . . 30149 3
24 3 119.771 . . . . . . . . . . . . . 30149 3
25 1 5.057 . . . . . . . . . . . . . 30149 3
25 2 7.193 . . . . . . . . . . . . . 30149 3
25 3 133.931 . . . . . . . . . . . . . 30149 3
26 1 5.171 . . . . . . . . . . . . . 30149 3
26 2 7.193 . . . . . . . . . . . . . 30149 3
26 3 133.931 . . . . . . . . . . . . . 30149 3
27 1 1.702 . . . . . . . . . . . . . 30149 3
27 2 7.193 . . . . . . . . . . . . . 30149 3
27 3 133.931 . . . . . . . . . . . . . 30149 3
28 1 1.705 . . . . . . . . . . . . . 30149 3
28 2 6.821 . . . . . . . . . . . . . 30149 3
28 3 118.128 . . . . . . . . . . . . . 30149 3
29 1 1.521 . . . . . . . . . . . . . 30149 3
29 2 6.821 . . . . . . . . . . . . . 30149 3
29 3 118.128 . . . . . . . . . . . . . 30149 3
30 1 1.52 . . . . . . . . . . . . . 30149 3
30 2 7.193 . . . . . . . . . . . . . 30149 3
30 3 133.931 . . . . . . . . . . . . . 30149 3
31 1 1.624 . . . . . . . . . . . . . 30149 3
31 2 7.193 . . . . . . . . . . . . . 30149 3
31 3 133.931 . . . . . . . . . . . . . 30149 3
32 1 1.624 . . . . . . . . . . . . . 30149 3
32 2 6.821 . . . . . . . . . . . . . 30149 3
32 3 118.128 . . . . . . . . . . . . . 30149 3
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 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
1 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
2 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
2 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
3 2 . . . 7.292 . . . . . . . . . . . 152 . . . . . . 1 . . 30149 3
3 3 . . . 119.771 . . . . . . . . . . . 148 . . . . . . 1 . . 30149 3
4 2 . . . 7.305 . . . . . . . . . . . 91 . . . . . . 1 . . 30149 3
4 3 . . . 129.718 . . . . . . . . . . . 90 . . . . . . 1 . . 30149 3
5 2 . . . 7.314 . . . . . . . . . . . 83 . . . . . . 1 . . 30149 3
5 3 . . . 131.512 . . . . . . . . . . . 88 . . . . . . 1 . . 30149 3
6 2 . . . 7.314 . . . . . . . . . . . 83 . . . . . . 1 . . 30149 3
6 3 . . . 131.512 . . . . . . . . . . . 88 . . . . . . 1 . . 30149 3
7 2 . . . 7.315 . . . . . . . . . . . 82 . . . . . . 1 . . 30149 3
7 3 . . . 132.137 . . . . . . . . . . . 86 . . . . . . 1 . . 30149 3
8 2 . . . 7.315 . . . . . . . . . . . 82 . . . . . . 1 . . 30149 3
8 3 . . . 132.137 . . . . . . . . . . . 86 . . . . . . 1 . . 30149 3
9 2 . . . 7.315 . . . . . . . . . . . 82 . . . . . . 1 . . 30149 3
9 3 . . . 132.137 . . . . . . . . . . . 86 . . . . . . 1 . . 30149 3
10 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
10 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
11 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
11 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
12 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
12 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
13 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
13 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
14 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
14 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
15 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
15 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
16 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
16 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
17 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
17 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
18 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
18 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
19 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
19 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
20 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
20 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
21 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
21 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
22 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
22 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
23 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
23 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
24 2 . . . 7.292 . . . . . . . . . . . 152 . . . . . . 1 . . 30149 3
24 3 . . . 119.771 . . . . . . . . . . . 148 . . . . . . 1 . . 30149 3
25 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
25 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
26 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
26 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
27 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
27 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
28 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
28 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
29 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
29 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
30 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
30 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
31 2 . . . 7.193 . . . . . . . . . . . 432 . . . . . . 1 . . 30149 3
31 3 . . . 133.931 . . . . . . . . . . . 436 . . . . . . 1 . . 30149 3
32 2 . . . 6.821 . . . . . . . . . . . 433 . . . . . . 1 . . 30149 3
32 3 . . . 118.128 . . . . . . . . . . . 438 . . . . . . 1 . . 30149 3
stop_
save_