Content for NMR-STAR saveframe, "spectral_peak_list_5"
save_spectral_peak_list_5
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_5
_Spectral_peak_list.Entry_ID 52544
_Spectral_peak_list.ID 5
_Spectral_peak_list.Name HN(CA)CO
_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 4
_Spectral_peak_list.Experiment_name '3D HNCACO'
_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
?-?-? 175.669 118.940 8.548
?-?-? 181.179 125.378 7.670
?-?-? 174.897 113.278 7.850
?-?-? 177.243 114.339 7.700
?-?-? 177.561 118.628 8.078
?-?-? 175.451 117.984 7.043
?-?-? 175.415 116.007 7.652
?-?-? 174.550 121.822 8.089
?-?-? 175.354 123.490 8.055
?-?-? 178.825 117.615 7.831
?-?-? 178.144 118.571 8.172
?-?-? 176.610 118.554 8.194
?-?-? 173.361 121.319 9.650
?-?-? 175.333 125.684 8.602
?-?-? 176.385 114.614 8.516
?-?-? 171.263 117.852 6.900
?-?-? 175.413 118.322 7.645
?-?-? 177.389 116.117 7.006
?-?-? 182.092 125.079 7.586
?-?-? 179.467 120.742 8.238
?-?-? 175.042 110.936 8.469
?-?-? 175.151 108.837 8.226
?-?-? 175.418 121.637 8.059
?-?-? 179.177 118.527 8.167
?-?-? 175.383 120.732 8.051
?-?-? 175.092 108.890 8.320
?-?-? 176.107 120.929 8.020
?-?-? 176.186 120.164 7.991
?-?-? 175.452 121.027 8.105
?-?-? 175.463 125.304 7.669
?-?-? 175.132 108.960 8.359
P2C-G3N-H 177.533 109.746 8.639
G3C-N-H 174.692 109.749 8.637
G3C-S4N-H 174.676 116.397 8.378
S4C-N-H 175.066 116.608 8.379
D5C-N-H 177.826 121.899 8.554
D5C-F6N-H 177.825 121.232 8.396
F6C-N-H 176.623 121.032 8.396
D7C-N-H 179.108 118.683 8.190
V8C-N-H 179.248 120.164 7.751
K9C-N-H 178.698 121.215 7.962
K9C-R10N-H 178.716 118.968 8.851
R10C-N-H 178.155 119.008 8.854
R10C-K11N-H 178.112 119.279 7.759
K11C-N-H 179.099 119.341 7.762
Y12C-N-H 176.480 121.509 7.789
F13C-N-H 176.469 120.408 8.980
F13C-R14N-H 176.390 116.137 8.360
R14C-N-H 178.943 116.063 8.373
Q15C-N-H 179.342 119.671 7.985
E16C-N-H 179.374 120.450 8.315
L17C-N-H 179.565 120.768 8.083
E18C-N-H 180.145 117.787 7.805
E18C-R19N-H 180.131 120.731 7.777
R19C-N-H 179.787 120.708 7.784
L20C-N-H 178.095 118.467 7.651
L20C-D21N-H 178.068 117.305 7.320
D21C-N-H 176.852 117.297 7.311
D21C-E22N-H 176.865 122.209 7.290
E22C-N-H 177.564 122.158 7.290
E22C-G23N-H 177.608 111.492 8.777
G23C-N-H 174.374 111.443 8.786
G23C-L24N-H 174.394 121.577 7.701
L24C-N-H 176.951 121.610 7.704
L24C-R25N-H 176.976 127.110 8.714
R25C-N-H 175.205 127.179 8.716
R25C-K26N-H 175.195 124.576 8.235
K26C-N-H 176.160 124.626 8.235
K26C-E27N-H 176.152 120.831 8.037
E27C-N-H 174.970 120.824 8.032
E27C-D28N-H 174.970 120.184 8.261
D28C-N-H 175.701 120.251 8.264
D28C-M29N-H 175.648 126.707 9.039
M29C-N-H 172.960 126.654 9.035
M29C-A30N-H 172.963 130.226 8.441
A30C-N-H 177.678 130.267 8.434
A30C-V31N-H 177.676 123.065 8.229
V31C-N-H 173.785 123.124 8.227
V31C-H32N-H 173.806 127.037 8.966
H32C-N-H 174.414 127.030 8.983
V33C-N-H 174.435 113.599 8.378
R34C-N-H 178.495 122.401 9.000
R34C-R35N-H 178.510 124.185 9.309
R35C-N-H 176.397 124.389 9.311
D36C-N-H 176.074 112.992 8.636
H37C-N-H 174.884 119.116 7.990
F39C-N-H 176.176 124.743 9.574
F39C-E40N-H 176.189 118.360 9.118
E40C-N-H 179.876 118.431 9.121
D41C-N-H 178.681 120.252 8.949
Y43C-N-H 178.138 123.540 8.068
R44C-N-H 178.932 122.511 8.141
E45C-N-H 178.748 115.388 8.103
L46C-N-H 180.781 113.088 8.055
H47C-N-H 175.312 119.862 8.622
R48C-N-H 177.389 115.828 7.897
K49C-N-H 177.061 118.608 6.871
K49C-S50N-H 177.061 121.044 9.646
P51C-E52N-H 177.777 113.768 8.050
E52C-N-H 180.571 113.777 8.050
E53C-N-H 178.817 120.821 7.804
M54C-N-H 176.404 113.226 7.387
K55C-N-H 175.980 117.505 7.093
N56C-N-H 174.756 115.700 7.179
R57C-N-H 175.991 118.865 7.926
L58C-N-H 176.205 124.759 8.740
Y59C-N-H 172.920 125.305 8.245
I60C-N-H 174.936 124.880 7.993
I60C-V61N-H 175.019 127.347 8.299
V61C-N-H 176.161 127.189 8.305
V61C-F62N-H 176.124 127.387 8.595
F62C-N-H 177.168 127.567 8.605
F62C-E63N-H 177.173 125.617 8.815
E63C-N-H 178.263 125.598 8.820
E63C-G64N-H 178.267 113.983 9.007
G64C-N-H 174.056 114.040 9.013
E65C-N-H 176.482 119.470 7.864
E65C-E66N-H 176.499 122.310 8.700
E66C-N-H 177.246 122.304 8.701
E66C-G67N-H 177.243 110.233 8.618
G67C-N-H 174.347 110.254 8.616
G67C-Q68N-H 174.377 119.544 8.054
Q68C-N-H 175.380 119.543 8.055
Q68C-D69N-H 175.394 120.555 8.266
D69C-N-H 176.312 120.575 8.267
D69C-A70N-H 176.295 127.970 8.672
A70C-N-H 180.670 127.970 8.672
A70C-G71N-H 180.684 107.796 8.654
G71C-N-H 177.201 107.795 8.663
G72C-N-H 177.073 111.700 8.261
L73C-N-H 178.730 122.752 8.078
L74C-N-H 178.794 120.462 7.898
R75C-N-H 179.361 117.491 7.833
E76C-N-H 178.052 120.604 8.240
W77C-N-H 177.260 120.840 8.982
Y78C-N-H 179.610 117.219 8.667
M79C-N-H 178.675 119.386 7.978
M79C-I80N-H 178.720 119.869 8.651
I80C-N-H 179.118 119.790 8.657
I81C-N-H 176.408 120.735 8.826
R83C-N-H 180.342 118.639 7.137
E84C-N-H 178.687 119.081 8.587
M85C-N-H 174.892 114.748 7.690
F86C-N-H 175.261 113.811 6.398
N87C-N-H 176.475 123.812 7.855
P88C-M89N-H 178.920 118.430 8.537
M89C-N-H 177.386 118.400 8.539
M89C-Y90N-H 177.406 116.324 6.992
Y90C-N-H 175.779 116.340 6.992
A91C-N-H 175.639 113.805 7.457
A91C-L92N-H 175.660 115.799 7.736
L92C-N-H 177.786 115.865 7.724
F93C-N-H 175.418 112.835 7.685
R94C-N-H 174.840 120.403 9.579
T95C-N-H 174.879 114.581 8.521
T95C-S96N-H 174.873 119.297 8.302
S96C-N-H 173.005 119.339 8.298
P97C-G98N-H 176.606 109.400 8.033
G98C-N-H 172.995 109.354 8.032
D99C-N-H 176.275 120.078 8.316
D99C-R100N-H 176.277 117.232 7.645
R100C-N-H 175.416 117.166 7.646
R100C-V101N-H 175.431 124.611 8.336
V101C-N-H 175.234 124.611 8.336
V101C-T102N-H 175.290 117.466 7.323
T102C-N-H 173.133 117.516 7.329
Y103C-N-H 175.421 118.727 8.326
T104C-N-H 174.000 112.108 8.994
I105C-N-H 175.311 125.079 8.132
P107C-S108N-H 177.474 111.481 7.227
N114C-N-H 177.213 114.634 7.827
H115C-N-H 175.942 119.531 8.506
L116C-N-H 179.802 119.774 7.685
Y118C-N-H 178.688 121.600 8.069
K120C-N-H 178.373 119.872 7.837
F121C-N-H 176.296 118.951 7.880
R124C-N-H 177.182 120.232 7.845
I125C-N-H 177.436 119.561 8.165
V126C-N-H 177.311 119.946 8.455
A127C-N-H 179.317 119.058 7.870
K128C-N-H 177.276 120.680 8.945
K128C-A129N-H 177.270 123.380 8.550
A129C-N-H 179.955 123.417 8.550
V130C-N-H 181.408 117.680 7.706
Y131C-N-H 177.320 125.731 9.599
D132C-N-H 176.174 119.332 9.025
N133C-N-H 174.234 119.392 8.273
R134C-N-H 174.291 119.395 8.497
R134C-L135N-H 174.315 120.861 7.770
L135C-N-H 177.188 120.939 7.768
L136C-N-H 176.910 120.160 8.416
E137C-N-H 174.764 122.188 8.197
E137C-C138N-H 174.764 117.852 6.900
C138C-N-H 171.878 117.924 6.902
C138C-Y139N-H 171.898 122.125 7.390
Y139C-N-H 174.631 122.089 7.385
Y139C-F140N-H 174.560 120.528 7.590
F140C-N-H 175.494 120.542 7.588
T141C-N-H 175.121 110.714 7.807
R142C-N-H 178.995 122.382 8.697
F144C-N-H 177.965 124.476 7.743
Y145C-N-H 178.280 115.420 7.410
K146C-N-H 178.862 116.633 7.945
H147C-N-H 179.470 117.215 7.652
I148C-N-H 178.184 119.571 7.425
L149C-N-H 176.756 116.295 7.378
G150C-N-H 175.624 105.284 7.681
K151C-N-H 176.170 118.870 8.014
K151C-S152N-H 176.186 115.539 7.997
S152C-N-H 175.028 115.559 7.998
G158C-N-H 175.746 110.969 8.539
A159C-N-H 178.155 122.477 8.156
A159C-I160N-H 178.146 107.183 7.276
I160C-N-H 175.853 107.277 7.280
I160C-R161N-H 175.857 121.032 7.146
R161C-N-H 179.028 121.114 7.148
K162C-N-H 179.358 119.586 8.830
Q163C-N-H 177.409 122.850 9.816
L164C-N-H 177.998 118.186 8.137
A165C-N-H 180.563 119.192 7.888
A165C-A166N-H 180.556 121.280 7.598
A166C-N-H 178.824 121.255 7.599
F167C-N-H 177.858 118.548 8.063
L168C-N-H 177.575 118.308 8.829
E169C-N-H 180.210 118.680 8.070
F171C-N-H 178.670 122.292 8.008
Y172C-N-H 178.636 117.034 9.041
E173C-N-H 177.209 116.368 7.193
I174C-N-H 174.339 115.267 7.073
I175C-N-H 171.482 118.719 7.915
P176C-K177N-H 177.797 126.313 8.376
K177C-N-H 179.035 126.426 8.377
R178C-N-H 177.111 115.038 8.698
L179C-N-H 177.117 117.579 7.439
I180C-N-H 175.666 115.824 7.683
I182C-N-H 176.546 114.656 6.864
F183C-N-H 175.359 121.260 7.363
T184C-N-H 175.867 109.470 8.929
T184C-E185N-H 175.921 120.117 10.106
E185C-N-H 178.168 119.876 10.116
Q186C-N-H 178.864 118.671 8.178
E187C-N-H 177.730 119.385 7.394
E187C-L188N-H 177.728 119.537 8.588
L188C-N-H 177.412 119.555 8.586
E189C-N-H 178.673 117.855 6.944
L190C-N-H 179.755 119.858 7.103
L191C-N-H 177.219 121.213 8.264
I192C-N-H 175.994 114.394 7.708
S193C-N-H 175.988 110.395 8.145
G194C-N-H 172.544 112.005 8.111
G194C-L195N-H 172.546 126.309 7.586
L195C-N-H 182.108 126.279 7.582
;
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 . . C 13 CO . 'not observed' 14 ppm . . . . . . 52544 5
2 . . N 15 N . 'not observed' 37 ppm . . . . . . 52544 5
3 . . H 1 HN . 'not observed' 12 ppm . . . . . . 52544 5
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
2 $software_2 . . 52544 5
3 $software_3 . . 52544 5
stop_
save_