Content for NMR-STAR saveframe, "Pep2HMQC"
save_Pep2HMQC
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode Pep2HMQC
_Spectral_peak_list.Entry_ID 27567
_Spectral_peak_list.ID 9
_Spectral_peak_list.Sample_ID 3
_Spectral_peak_list.Sample_label $HMQC
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Experiment_ID 3
_Spectral_peak_list.Experiment_name '2D 1H-13C HSQC'
_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 'Pep2 backbone, labeled residues K51, R52, Q54, R55'
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
label dataset sw sf
1H 13C
7002.80078125 5208.33300781
699.932983398 176.009994507
1H.L 1H.P 1H.W 1H.B 1H.E 1H.J 1H.U 13C.L 13C.P 13C.W 13C.B 13C.E 13C.J 13C.U vol int stat comment flag0
0 {151.he} 2.82118 0.08469 0.11292 ++ {0.0} {} {151.ce} 71.36297 1.03021 1.37362 ++ {0.0} {} 0.0 0.0000 0 {} 0
1 {154.hg1/2} 2.23774 0.11292 0.15057 ++ {0.0} {} {154.cg1/2} 63.37881 0.98729 1.31638 ++ {0.0} {} 0.0 0.0000 0 {} 0
2 {154.hb} 1.89270 0.18821 0.25094 ++ {0.0} {} {154.cb} 59.22935 1.03021 1.37362 ++ {0.0} {} 0.0 0.0000 0 {} 0
3 {151.hd} 1.51628 0.12233 0.16311 ++ {0.0} {} {151.cd} 58.54253 0.72973 0.97298 ++ {0.0} {} 0.0 0.0000 0 {} 0
4 {151.hg} 1.25906 0.09410 0.12547 ++ {0.0} {} {151.cg} 83.86860 1.11606 1.48809 ++ {0.0} {} 0.0 0.0000 0 {} 0
5 {151.hb} 1.64803 0.04705 0.06274 ++ {0.0} {} {151.cb} 60.40265 0.98729 1.31638 ++ {0.0} {} 0.0 0.0000 0 {} 0
6 {155.hd} 3.04076 0.14116 0.18821 ++ {0.0} {} {155.cd} 72.79381 0.72973 0.97298 ++ {0.0} {} 0.0 0.0000 0 {} 0
7 {152.hb} 1.60411 0.11292 0.15057 ++ {0.0} {} {152.cb} 62.29137 0.85851 1.14468 ++ {0.0} {} 0.0 0.0000 0 {} 0
8 {152.hg} 1.43339 0.16939 0.22585 ++ {0.0} {} {152.cg} 86.33617 0.81559 1.08745 ++ {0.0} {} 0.0 0.0000 0 {} 0
9 {155.hb} 1.59156 0.15057 0.20075 ++ {0.0} {} {155.cb} 60.34541 0.77266 1.03021 ++ {0.0} {} 0.0 0.0000 0 {} 0
10 {155.hg} 1.41144 0.14116 0.18821 ++ {0.0} {} {155.cg} 86.40821 0.94436 1.25915 ++ {0.0} {} 0.0 0.0000 0 {} 0
11 {151.ha} 4.08784 0.05691 0.07588 ++ {0.0} {} {151.ca} 85.56094 1.04143 1.38857 ++ {0.0} {} 0.0 0.0000 0 {} 0
12 {152.hd} 3.00622 0.04871 0.06495 ++ {0.0} {} {152.cd} 72.79317 0.49416 0.65887 ++ {0.0} {} 0.0 0.0000 0 {} 0
13 {152.ha} 4.10049 0.01408 0.01877 ++ {0.0} {} {152.ca} 85.58976 0.46420 0.61894 ++ {0.0} {} 0.0 0.0000 0 {} 0
14 {154.ha} 4.09310 0.02909 0.03878 ++ {0.0} {} {154.ca} 85.56419 0.87083 1.16111 ++ {0.0} {} 0.0 0.0000 0 {} 0
15 {155.ha} 4.13029 0.03166 0.04221 ++ {0.0} {} {155.ca} 85.56419 0.98122 1.30829 ++ {0.0} {} 0.0 0.0000 0 {} 0
;
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
2 . . C 13 CA . . 7224.07763376122 Hz . . . . . . 27567 9
stop_
save_