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 54027
_Spectral_peak_list.ID 2
_Spectral_peak_list.Name 'BsNusG CTD TOCSY Peak List'
_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.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 2
_Spectral_peak_list.Experiment_name '3D 1H-15N TOCSY'
_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 .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
Assignment w1 w2 w3
T47N-T47HA-T47HN 122.34 4.61 8.777
T47N-T47HB-T47HN 122.345 3.736 8.777
T47N-T47HG1-T47HN 122.339 0.945 8.777
L8N-L8HA-L8HN 120.062 3.66 8.404
L8N-L8HB2-L8HN 120.073 1.616 8.404
L8N-L8HG-L8HN 120.063 1.346 8.404
L8N-L8QD1-L8HN 120.194 0.877 8.403
L8N-L8QD2-L8HN 120.103 0.738 8.399
K9N-K9HB2-K9HN 115.757 1.927 9.165
K9N-K9HG2-K9HN 115.744 1.27 9.164
E10N-E10HA-E10HN 123.145 4.144 7.77
E10N-E10HG2-E10HN 123.148 2.335 7.77
E10N-E10HB2-E10HN 123.143 2.181 7.77
G24N-G24HA1-G24HN 124.834 3.809 8.612
G24N-G24HA2-G24HN 124.847 4.478 8.612
S25N-S25HA-S25HN 112.112 5.089 7.872
S25N-S25HB2-S25HN 112.111 3.649 7.871
S25N-S25HB3-S25HN 112.113 3.523 7.871
T23N-T23HG1-T23HN 109.225 1.101 8.499
T23N-T23HB-T23HN 109.135 4.143 8.502
T23N-T23HA-T23HN 109.205 5.48 8.499
I26N-I26HA-I26HN 123.81 3.809 8.506
I26N-I26HB-I26HN 123.824 2.017 8.507
E27N-E27HA-E27HN 108.834 4.46 8.885
E27N-E27HB2-E27HN 108.823 1 8.884
E27N-E27HB3-E27HN 108.821 0.869 8.885
E27N-E27HG3-E27HN 108.84 1.814 8.886
E27N-E27HG2-E27HN 108.84 1.751 8.887
F22N-F22HB2-F22HN 119.535 3.302 8.141
F22N-F22HB3-F22HN 119.531 3.148 8.141
F22N-F22HA-F22HN 119.541 4.769 8.14
N21N-N21HA-N21HN 111.557 4.13 8.823
N21N-N21HB2-N21HN 111.564 3.161 8.824
N21N-N21HB3-N21HN 111.549 2.757 8.823
A20N-A20QB-A20HN 121.021 1.148 7.41
A20N-A20HA-A20HN 121.038 3.502 7.41
F19N-F19HA-F19HN 116.619 4.514 8.961
F19N-F19HB2-F19HN 116.619 3.212 8.96
F19N-F19HB3-F19HN 116.623 2.937 8.959
E28N-E28HA-E28HN 117.235 4.343 7.505
E28N-E28HG2-E28HN 117.235 2.106 7.506
E28N-E28HB2-E28HN 117.235 1.812 7.506
I29N-I29HG12-I29HN 123.057 1.269 8.642
I29N-I29HG13-I29HN 123.057 0.611 8.641
I29N-I29QD1-I29HN 123.064 0.319 8.642
I29N-I29HA-I29HN 123.05 4.228 8.642
D30N-D30HA-D30HN 126.902 4.845 8.657
D30N-D30HB2-D30HN 126.904 2.745 8.658
D30N-D30HB3-D30HN 126.901 2.296 8.658
Y31N-Y31HA-Y31HN 123.011 4.232 8.682
Y31N-Y31HB2-Y31HN 123.032 3.223 8.683
Y31N-Y31HB3-Y31HN 122.999 2.845 8.682
I4N-I4HA-I4HN 118.61 4.063 7.796
I4N-I4HB-I4HN 118.606 1.66 7.796
I4N-I4QD1-I4HN 118.613 0.589 7.796
D5N-D5HA-D5HN 124.23 4.548 8.046
D5N-D5HB2-D5HN 124.234 2.398 8.045
F6N-F6HA-F6HN 117.96 4.971 7.475
F6N-F6HB2-F6HN 117.949 2.748 7.475
F6N-F6HB3-F6HN 117.941 2.113 7.474
F39N-F39HA-F39HN 126.43 4.896 8.93
K9N-K9HA-K9HN 115.74 3.669 9.165
K9N-K9HE2-K9HN 115.685 2.899 9.166
V49N-V49HA-V49HN 123.105 4.096 8.991
V49N-V49HB-V49HN 123.107 1.597 8.989
V49N-V49QG1-V49HN 123.103 0.54 8.99
V49N-V49QG2-V49HN 123.1 0.296 8.99
E50N-E50HA-E50HN 126.703 4.985 8.398
E50N-E50HG2-E50HN 126.709 2.04 8.397
E50N-E50HB2-E50HN 126.706 1.856 8.398
L51N-L51HA-L51HN 126.888 4.779 8.87
L51N-L51HB2-L51HN 126.877 1.535 8.87
L51N-L51HG-L51HN 126.883 1.172 8.871
L51N-L51QD1-L51HN 126.898 0.822 8.867
L51N-L51QD2-L51HN 126.868 0.541 8.869
E52N-E52HA-E52HN 118.378 4.753 8.884
E52N-E52HG2-E52HN 118.381 2.351 8.883
E52N-E52HG3-E52HN 118.363 2.249 8.883
E52N-E52HB2-E52HN 118.387 1.773 8.883
F53N-F53HA-F53HN 120.243 4.105 8.259
F53N-F53HB2-F53HN 120.229 3.246 8.257
F53N-F53HB3-F53HN 120.222 3.06 8.253
T54N-T54HA-T54HN 122.348 4.923 8.487
T54N-T54HB-T54HN 122.336 4.016 8.487
T54N-T54HG1-T54HN 122.343 1.15 8.487
V40N-V40HA-V40HN 125.614 4.103 8.522
V40N-V40HB-V40HN 125.601 1.684 8.522
V40N-V40QG1-V40HN 125.604 0.622 8.523
V40N-V40QG2-V40HN 125.616 0.423 8.523
F39N-F39HB2-F39HN 126.441 3.095 8.93
F39N-F39HB3-F39HN 126.432 2.739 8.929
V38N-V38HA-V38HN 126.054 4.864 8.975
V38N-V38HB-V38HN 126.033 1.496 8.975
V38N-V38QG1-V38HN 126.045 0.506 8.975
V38N-V38QG2-V38HN 126.038 0.329 8.975
K37N-K37HA-K37HN 122.803 4.946 8.295
K37N-K37HE2-K37HN 122.801 2.724 8.294
K37N-K37HB2-K37HN 122.817 1.537 8.295
K37N-K37HD2-K37HN 122.809 1.173 8.296
K37N-K37HG2-K37HN 122.817 1.028 8.295
V36N-V36HA-V36HN 115.004 4.842 9.115
V36N-V36HB-V36HN 114.935 1.733 9.116
V36N-V36QG1-V36HN 115.006 0.536 9.113
V36N-V36QG2-V36HN 115.005 0.464 9.113
K35N-K35HA-K35HN 116.351 4.956 7.553
K35N-K35HE2-K35HN 116.362 2.767 7.555
K35N-K35HB2-K35HN 116.327 1.547 7.553
K35N-K35HD2-K35HN 116.348 1.349 7.554
K35N-K35HG2-K35HN 116.338 1.081 7.553
L59N-L59HA-L59HN 127.098 4.014 8.08
L59N-L59HB2-L59HN 127.1 1.556 8.081
L59N-L59HG-L59HN 127.104 1.434 8.081
L59N-L59QD1-L59HN 127.103 0.797 8.081
K58N-K58HA-K58HN 121.176 4.545 8.538
K58N-K58HD2-K58HN 121.174 1.668 8.538
K58N-K58HG2-K58HN 121.17 1.5 8.538
K58N-K58HB2-K58HN 121.156 1.876 8.539
K58N-K58HE2-K58HN 121.095 2.71 8.537
D57N-D57HB2-D57HN 117.664 2.484 8.945
D57N-D57HA-D57HN 117.666 5.122 8.945
I56N-I56QD1-I56HN 111.88 0.54 7.209
I56N-I56HA-I56HN 111.901 5.344 7.212
I56N-I56HG12-I56HN 111.963 1.157 7.211
S34N-S34HA-S34HN 114.016 3.859 7.457
S34N-S34HB2-S34HN 114.011 3.44 7.456
S34N-S34HB3-S34HN 113.994 2.958 7.458
K33N-K33HA-K33HN 116.309 4.232 7.601
K33N-K33HE2-K33HN 116.313 2.885 7.601
K33N-K33HB2-K33HN 116.296 1.753 7.6
K33N-K33HB3-K33HN 116.302 1.512 7.6
K33N-K33HD2-K33HN 116.314 1.374 7.599
K33N-K33HG2-K33HN 116.309 1.228 7.601
D32N-D32HA-D32HN 119.811 4.49 8.332
D32N-D32HB2-D32HN 119.805 2.825 8.332
D32N-D32HB3-D32HN 119.81 2.692 8.332
Q55N-Q55HA-Q55HN 117.751 4.263 7.869
Q55N-Q55HG2-Q55HN 117.742 2.339 7.869
Q55N-Q55HB2-Q55HN 117.749 2.167 7.869
D5N-D5HB3-D5HN 124.238 2.278 8.047
E7N-E7HA-E7HN 119.219 4.601 8.647
E7N-E7HG2-E7HN 119.215 2.191 8.647
E7N-E7HB2-E7HN 119.206 1.994 8.647
E7N-E7HB3-E7HN 119.217 1.8 8.647
N41N-N41HA-N41HN 125.444 4.748 8.963
N41N-N41HB2-N41HN 125.511 2.835 8.952
N41N-N41HB3-N41HN 125.444 2.671 8.953
G17N-G17HA1-G17HN 108.645 4.297 8.108
G17N-G17HA2-G17HN 108.627 3.805 8.107
D16N-D16HA-D16HN 119.756 4.943 7.342
D16N-D16HB2-D16HN 119.755 2.811 7.342
D16N-D16HB3-D16HN 119.756 2.259 7.342
I15N-I15HA-I15HN 119.533 4.782 8.582
I15N-I15HB-I15HN 119.534 2.171 8.585
I15N-I15QG2-I15HN 119.536 0.764 8.58
K13N-K13HA-K13HN 118.281 4.677 8.541
K13N-K13HE2-K13HN 118.283 2.854 8.543
K13N-K13HG2-K13HN 118.283 1.207 8.542
K13N-K13HB3-K13HN 118.284 1.452 8.543
K13N-K13HB2-K13HN 118.28 1.572 8.542
V14N-V14HA-V14HN 125.36 4.259 8.626
V14N-V14HB-V14HN 125.362 2.381 8.624
V14N-V14QG1-V14HN 125.361 0.969 8.625
M42N-M42HA-M42HN 125.206 4.297 8.198
M42N-M42HG2-M42HN 125.208 1.761 8.198
M42N-M42HB2-M42HN 125.211 1.495 8.198
V12N-V12HA-V12HN 119.563 4.784 9.123
V12N-V12HB-V12HN 119.509 2.293 9.126
V12N-V12QG2-V12HN 119.576 0.424 9.124
R45N-R45HA-R45HN 120.392 4.496 7.564
R45N-R45HD2-R45HN 120.392 3.14 7.563
R45N-R45HB2-R45HN 120.396 1.737 7.564
R45N-R45HG2-R45HN 120.4 1.505 7.564
I56N-I56HB-I56HN 111.893 2.042 7.214
;
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 . . N 15 N . 'not observed' 20 ppm . . . . . . 54027 2
2 . . H 1 HN . 'not observed' 16.0221 ppm . . . . . . 54027 2
3 . . H 1 H . 'not observed' 10.4 ppm . . . . . . 54027 2
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 . . 54027 2
2 $software_2 . . 54027 2
3 $software_3 . . 54027 2
stop_
save_