Content for NMR-STAR saveframe, "peak_list_1_2_3_4_5_6"
save_peak_list_1_2_3_4_5_6
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6
_Spectral_peak_list.Entry_ID 25684
_Spectral_peak_list.ID 6
_Spectral_peak_list.Sample_ID 3
_Spectral_peak_list.Sample_label $wr18_39
_Spectral_peak_list.Sample_condition_list_ID 2
_Spectral_peak_list.Sample_condition_list_label $2
_Spectral_peak_list.Experiment_ID 11
_Spectral_peak_list.Experiment_name '2D 1H-1H NOESY'
_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
;
cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_3.peaks.
;
_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 . . 11718.75 Hz . . . . . . 25684 6
2 . . H 1 1H . . 11718.75 Hz . . . . . . 25684 6
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . 'Original number 1' 25684 6
2 1.0 . 'Original number 2' 25684 6
3 1.0 . 'Original number 4' 25684 6
4 1.0 . 'Original number 5' 25684 6
5 1.0 . 'Original number 6' 25684 6
6 1.0 . 'Original number 8' 25684 6
7 1.0 . 'Original number 11' 25684 6
8 1.0 . 'Original number 12' 25684 6
9 1.0 . 'Original number 13' 25684 6
10 1.0 . 'Original number 14' 25684 6
11 1.0 . 'Original number 15' 25684 6
12 1.0 . 'Original number 16' 25684 6
13 1.0 . 'Original number 20' 25684 6
14 1.0 . 'Original number 21' 25684 6
15 1.0 . 'Original number 31' 25684 6
16 1.0 . 'Original number 32' 25684 6
17 1.0 . 'Original number 33' 25684 6
18 1.0 . 'Original number 34' 25684 6
19 1.0 . 'Original number 35' 25684 6
20 1.0 . 'Original number 36' 25684 6
21 1.0 . 'Original number 37' 25684 6
22 1.0 . 'Original number 38' 25684 6
23 1.0 . 'Original number 39' 25684 6
24 1.0 . 'Original number 40' 25684 6
25 1.0 . 'Original number 47' 25684 6
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 2847561.75000 . height 25684 6
1 22066429.75000 . volume 25684 6
2 1599637.12500 . height 25684 6
2 12348915.00000 . volume 25684 6
3 1267220.50000 . height 25684 6
3 9445078.00000 . volume 25684 6
4 1655396.50000 . height 25684 6
4 11746141.87500 . volume 25684 6
5 1035269.62500 . height 25684 6
5 7997209.12500 . volume 25684 6
6 1409797.25000 . height 25684 6
6 10062117.25000 . volume 25684 6
7 2189853.25000 . height 25684 6
7 15576200.12500 . volume 25684 6
8 1939275.75000 . height 25684 6
8 14373971.62500 . volume 25684 6
9 2340683.00000 . height 25684 6
9 16402698.62500 . volume 25684 6
10 1504159.25000 . height 25684 6
10 11362037.75000 . volume 25684 6
11 1482331.75000 . height 25684 6
11 11926540.87500 . volume 25684 6
12 586510.81250 . height 25684 6
12 4888867.78125 . volume 25684 6
13 6090723.00000 . height 25684 6
13 46128325.75000 . volume 25684 6
14 1180599.62500 . height 25684 6
14 8364136.31250 . volume 25684 6
15 31573696.00000 . height 25684 6
15 239983188.00000 . volume 25684 6
16 13051134.00000 . height 25684 6
16 102176385.00000 . volume 25684 6
17 43222216.00000 . height 25684 6
17 296392120.00000 . volume 25684 6
18 117696736.00000 . height 25684 6
18 755448060.00000 . volume 25684 6
19 3879395.50000 . height 25684 6
19 28953407.50000 . volume 25684 6
20 1134936.50000 . height 25684 6
20 8165793.25000 . volume 25684 6
21 3629414.00000 . height 25684 6
21 25784784.75000 . volume 25684 6
22 1447082.87500 . height 25684 6
22 10821713.68750 . volume 25684 6
23 27195270.00000 . height 25684 6
23 203900930.00000 . volume 25684 6
24 76387496.00000 . height 25684 6
24 545538376.00000 . volume 25684 6
25 1984276.00000 . height 25684 6
25 13261418.12500 . volume 25684 6
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 10.183 . 13.04180477750 . . . . . . . . . . 2 25684 6
1 2 0.528 . 24.50798638160 . . . . . . . . . . 2 25684 6
2 1 10.184 . 11.47936563940 . . . . . . . . . . 2 25684 6
2 2 0.680 . 36.93904727700 . . . . . . . . . . 2 25684 6
3 1 10.630 . 12.12193456010 . . . . . . . . . . 2 25684 6
3 2 0.529 . 24.75944347680 . . . . . . . . . . 2 25684 6
4 1 10.630 . 8.69369250722 . . . . . . . . . . 2 25684 6
4 2 0.671 . 23.66350963710 . . . . . . . . . . 2 25684 6
5 1 10.185 . 10.44498640110 . . . . . . . . . . 2 25684 6
5 2 0.766 . 20.53636126220 . . . . . . . . . . 2 25684 6
6 1 10.184 . 9.85091901384 . . . . . . . . . . 2 25684 6
6 2 1.261 . 26.85980871320 . . . . . . . . . . 2 25684 6
7 1 10.632 . 9.71287954599 . . . . . . . . . . 2 25684 6
7 2 3.196 . 27.36691385510 . . . . . . . . . . 2 25684 6
8 1 10.631 . 10.05108060780 . . . . . . . . . . 2 25684 6
8 2 3.313 . 26.77598968150 . . . . . . . . . . 2 25684 6
9 1 10.182 . 9.57903102972 . . . . . . . . . . 2 25684 6
9 2 3.092 . 28.97554077210 . . . . . . . . . . 2 25684 6
10 1 10.184 . 11.20424713010 . . . . . . . . . . 2 25684 6
10 2 3.230 . 28.23164686560 . . . . . . . . . . 2 25684 6
11 1 10.717 . 12.43341830560 . . . . . . . . . . 2 25684 6
11 2 3.155 . 30.54575063290 . . . . . . . . . . 2 25684 6
12 1 10.717 . 11.65473076980 . . . . . . . . . . 2 25684 6
12 2 3.364 . 21.95779234170 . . . . . . . . . . 2 25684 6
13 1 10.183 . 12.32541399080 . . . . . . . . . . 2 25684 6
13 2 3.954 . 25.98529681560 . . . . . . . . . . 2 25684 6
14 1 10.183 . 8.67186463438 . . . . . . . . . . 2 25684 6
14 2 1.389 . 26.81650221350 . . . . . . . . . . 2 25684 6
15 1 10.716 . 21.05197927450 . . . . . . . . . . 2 25684 6
15 2 7.287 . 20.14241181310 . . . . . . . . . . 2 25684 6
16 1 10.716 . 20.87892789860 . . . . . . . . . . 2 25684 6
16 2 7.392 . 23.36106263100 . . . . . . . . . . 2 25684 6
17 1 10.632 . 11.07066054830 . . . . . . . . . . 2 25684 6
17 2 7.373 . 21.29073254760 . . . . . . . . . . 2 25684 6
18 1 10.632 . 11.06900162990 . . . . . . . . . . 2 25684 6
18 2 7.409 . 16.12363848840 . . . . . . . . . . 2 25684 6
19 1 10.632 . 10.57023473550 . . . . . . . . . . 2 25684 6
19 2 8.360 . 27.64875534920 . . . . . . . . . . 2 25684 6
20 1 10.184 . 10.21046773530 . . . . . . . . . . 2 25684 6
20 2 8.275 . 23.04447116330 . . . . . . . . . . 2 25684 6
21 1 10.184 . 11.36935316030 . . . . . . . . . . 2 25684 6
21 2 7.730 . 24.50693864380 . . . . . . . . . . 2 25684 6
22 1 10.184 . 11.57828955910 . . . . . . . . . . 2 25684 6
22 2 7.677 . 30.50663508470 . . . . . . . . . . 2 25684 6
23 1 10.184 . 12.91258377020 . . . . . . . . . . 2 25684 6
23 2 7.381 . 25.44920425860 . . . . . . . . . . 2 25684 6
24 1 10.184 . 12.58420525120 . . . . . . . . . . 2 25684 6
24 2 7.172 . 20.21226100620 . . . . . . . . . . 2 25684 6
25 1 10.185 . 10.44498640110 . . . . . . . . . . 2 25684 6
25 2 10.642 . 28.12490856740 . . . . . . . . . . 2 25684 6
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 . . 10.183 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
1 2 1 . . 0.528 . . 4 . 1 1 18 LEU MD1 . . . . . . . . . . 341 . 25684 6
2 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
2 2 1 . . 0.680 . . 4 . 1 1 18 LEU MD2 . . . . . . . . . . 381 . 25684 6
3 1 1 . . 10.630 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
3 2 1 . . 0.529 . . 4 . 1 1 18 LEU MD1 . . . . . . . . . . 341 . 25684 6
4 1 1 . . 10.630 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
4 2 1 . . 0.671 . . 4 . 1 1 18 LEU MD2 . . . . . . . . . . 381 . 25684 6
5 1 1 . . 10.185 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
5 2 1 . . 0.766 . . 4 . 1 1 22 LEU MD1 . . . . . . . . . . 408 . 25684 6
5 2 2 . . 0.766 . . 4 . 1 1 22 LEU MD2 . . . . . . . . . . 410 . 25684 6
6 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
6 2 1 . . 1.261 . . 4 . 1 1 22 LEU HG . . . . . . . . . . 370 . 25684 6
7 1 1 . . 10.632 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
7 2 1 . . 3.196 . . 4 . 1 1 17 TRP HB3 . . . . . . . . . . 386 . 25684 6
8 1 1 . . 10.631 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
8 2 1 . . 3.313 . . 4 . 1 1 17 TRP HB2 . . . . . . . . . . 228 . 25684 6
9 1 1 . . 10.182 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
9 2 1 . . 3.092 . . 4 . 1 1 21 TRP HB2 . . . . . . . . . . 236 . 25684 6
10 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
10 2 1 . . 3.230 . . 4 . 1 1 21 TRP HB3 . . . . . . . . . . 237 . 25684 6
11 1 1 . . 10.717 . . 4 . 1 1 25 TRP HE1 . . . . . . . . . . 385 . 25684 6
11 2 1 . . 3.155 . . 4 . 1 1 25 TRP HB3 . . . . . . . . . . 243 . 25684 6
12 1 1 . . 10.717 . . 4 . 1 1 25 TRP HE1 . . . . . . . . . . 385 . 25684 6
12 2 1 . . 3.364 . . 4 . 1 1 25 TRP HB2 . . . . . . . . . . 242 . 25684 6
13 1 1 . . 10.183 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
13 2 1 . . 3.954 . . 4 . 1 1 18 LEU HA . . . . . . . . . . 229 . 25684 6
14 1 1 . . 10.183 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
14 2 1 . . 1.389 . . 4 . 1 1 18 LEU HB3 . . . . . . . . . . 355 . 25684 6
15 1 1 . . 10.716 . . 4 . 1 1 25 TRP HE1 . . . . . . . . . . 385 . 25684 6
15 2 1 . . 7.287 . . 4 . 1 1 25 TRP HD1 . . . . . . . . . . 390 . 25684 6
16 1 1 . . 10.716 . . 4 . 1 1 25 TRP HE1 . . . . . . . . . . 385 . 25684 6
16 2 1 . . 7.392 . . 4 . 1 1 25 TRP HZ2 . . . . . . . . . . 409 . 25684 6
17 1 1 . . 10.632 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
17 2 1 . . 7.373 . . 4 . 1 1 17 TRP HZ2 . . . . . . . . . . 392 . 25684 6
18 1 1 . . 10.632 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
18 2 1 . . 7.409 . . 4 . 1 1 17 TRP HD1 . . . . . . . . . . 403 . 25684 6
19 1 1 . . 10.632 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
19 2 1 . . 8.360 . . 4 . 1 1 17 TRP H . . . . . . . . . . 21 . 25684 6
20 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
20 2 1 . . 8.275 . . 4 . 1 1 20 GLY H . . . . . . . . . . 313 . 25684 6
21 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
21 2 1 . . 7.730 . . 4 . 1 1 21 TRP H . . . . . . . . . . 3 . 25684 6
22 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
22 2 1 . . 7.677 . . 4 . 1 1 19 THR H . . . . . . . . . . 1 . 25684 6
23 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
23 2 1 . . 7.381 . . 4 . 1 1 21 TRP HZ2 . . . . . . . . . . 391 . 25684 6
24 1 1 . . 10.184 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
24 2 1 . . 7.172 . . 4 . 1 1 21 TRP HD1 . . . . . . . . . . 405 . 25684 6
25 1 1 . . 10.185 . . 4 . 1 1 21 TRP HE1 . . . . . . . . . . 407 . 25684 6
25 2 1 . . 10.642 . . 4 . 1 1 17 TRP HE1 . . . . . . . . . . 406 . 25684 6
stop_
save_