Content for NMR-STAR saveframe, "spectral_peak_list_8"
save_spectral_peak_list_8
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_8
_Spectral_peak_list.Entry_ID 52542
_Spectral_peak_list.ID 8
_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 8
_Spectral_peak_list.Experiment_name '3D HN(CA)CO'
_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
?-?-? 114.751 171.970 7.388
?-?-? 118.961 178.509 8.543
?-?-? 118.604 166.848 9.241
?-?-? 129.882 169.109 8.138
?-?-? 118.797 176.086 7.397
?-?-? 118.349 179.684 7.205
?-?-? 127.753 176.086 7.385
?-?-? 127.532 181.974 7.502
?-?-? 113.864 168.726 9.018
?-?-? 109.373 177.377 8.623
?-?-? 115.135 169.095 9.901
?-?-? 118.342 168.850 7.954
?-?-? 106.625 171.421 8.246
?-?-? 109.337 172.626 8.623
?-?-? 119.633 172.952 8.316
?-?-? 120.324 176.019 8.288
?-?-? 120.238 179.237 8.303
?-?-? 106.818 174.731 8.268
?-?-? 106.590 175.786 6.886
?-?-? 118.816 174.574 7.902
?-?-? 107.858 167.850 7.964
?-?-? 124.953 175.980 8.211
?-?-? 112.949 172.645 7.390
?-?-? 108.723 173.207 8.206
?-?-? 115.590 175.458 7.703
?-?-? 119.763 177.956 10.376
?-?-? 125.615 166.851 8.866
?-?-? 120.698 171.987 7.618
?-?-? 125.395 167.470 8.103
?-?-? 124.570 177.608 8.022
?-?-? 112.599 180.378 8.360
?-?-? 117.216 175.725 8.407
?-?-? 111.444 167.732 7.788
?-?-? 124.322 176.440 8.211
?-?-? 108.957 169.855 8.864
?-?-? 120.701 179.109 8.129
?-?-? 119.850 171.580 8.581
?-?-? 124.600 172.708 7.945
?-?-? 118.627 180.382 7.795
?-?-? 118.447 174.349 6.801
?-?-? 110.456 176.223 8.164
?-?-? 123.740 172.460 7.993
?-?-? 126.049 179.687 9.544
?-?-? 109.823 179.082 8.061
?-?-? 121.770 176.761 8.169
?-?-? 121.987 176.748 8.187
?-?-? 119.562 177.982 7.693
?-?-? 121.135 176.449 8.374
?-?-? 110.234 171.094 7.430
?-?-? 121.125 181.333 8.819
?-?-? 121.436 174.337 7.929
?-?-? 120.489 179.248 7.789
?-?-? 121.905 174.315 7.580
?-?-? 121.323 174.586 8.233
?-?-? 120.501 180.436 7.780
?-?-? 121.572 168.350 7.407
?-?-? 121.522 175.120 7.406
?-?-? 118.559 180.718 7.454
G3N-C-H 109.604 174.578 8.616
D5N-C-H 121.737 177.698 8.532
D7N-C-H 118.560 179.000 8.178
V8N-D7C-V8H 120.035 178.975 7.748
K9N-C-H 121.099 178.484 7.936
K9N-C-H 120.989 178.536 7.933
R10N-C-H 118.772 178.004 8.827
K11N-C-H 119.254 178.950 7.742
F13N-Y12C-F13H 120.265 176.242 8.953
R14N-C-H 115.838 178.762 8.345
Q15N-C-H 119.606 179.187 7.956
E18N-C-H 117.678 179.938 7.781
R19N-C-H 120.613 179.623 7.752
L20N-R19C-L20H 118.369 179.585 7.634
L20N-C-H 118.368 177.953 7.632
D21N-L20C-D21H 117.233 177.976 7.292
D21N-C-H 117.186 176.676 7.292
E22N-C-H 121.966 177.372 7.269
L24N-C-H 121.548 176.770 7.693
R25N-L24C-R25H 126.906 176.793 8.706
R25N-C-H 126.909 174.997 8.707
K26N-R25C-K26H 124.329 174.999 8.218
K26N-C-H 124.344 175.951 8.218
E27N-C-H 120.689 174.725 8.016
D28N-E27C-D28H 119.898 174.732 8.251
D28N-C-H 119.913 175.453 8.250
M29N-D28C-M29H 126.502 175.473 9.022
M29N-C-H 126.516 172.758 9.021
A30N-M29C-A30H 129.882 172.754 8.395
A30N-C-H 129.896 177.391 8.395
H32N-V31C-H32H 126.952 173.479 8.914
H32N-C-H 127.000 174.338 8.927
V33N-C-H 113.466 174.249 8.337
R35N-R34C-R35H 124.189 178.316 9.270
R35N-C-H 124.114 176.350 9.272
D36N-C-H 112.797 175.773 8.610
H37N-C-H 118.965 174.804 7.937
F39N-C-H 124.401 175.952 9.540
E40N-C-H 118.124 179.699 9.119
D41N-C-H 119.976 178.361 8.934
E45N-C-H 115.214 178.494 8.083
H47N-C-H 119.818 175.224 8.618
R48N-C-H 115.595 177.260 7.844
K49N-C-H 118.433 176.857 6.861
S50N-C-H 120.952 175.135 9.628
E52N-C-H 113.592 180.441 8.011
E53N-C-H 120.665 178.552 7.781
M54N-C-H 113.002 176.228 7.362
K55N-C-H 117.339 175.830 7.080
N56N-C-H 115.606 174.549 7.175
R57N-N56C-R57H 118.680 174.490 7.915
R57N-C-H 118.616 175.752 7.915
L58N-C-H 124.561 175.974 8.718
Y59N-C-H 124.992 172.665 8.200
I60N-C-H 124.550 174.715 7.954
V61N-C-H 127.151 175.989 8.275
F62N-C-H 127.296 177.001 8.587
E63N-C-H 125.411 178.039 8.789
G64N-E63C-G64H 113.897 178.064 8.968
G64N-C-H 113.871 173.807 8.981
E65N-C-H 119.395 176.256 7.846
E66N-E65C-E66H 122.164 176.250 8.678
E66N-C-H 122.186 177.016 8.679
G67N-E66C-G67H 110.164 177.040 8.597
G67N-C-H 110.167 174.168 8.597
Q68N-G67C-Q68H 119.488 174.197 8.051
Q68N-C-H 119.475 175.187 8.052
D69N-Q68C-D69H 120.442 175.201 8.247
D69N-C-H 120.433 176.089 8.246
A70N-D69C-A70H 127.763 176.071 8.664
A70N-C-H 127.728 180.575 8.661
G71N-A70C-G71H 107.794 180.504 8.628
G71N-C-H 107.792 176.999 8.639
G72N-C-H 111.559 176.877 8.247
L73N-C-H 122.577 178.571 8.071
L74N-C-H 120.283 178.599 7.865
R75N-C-H 117.302 179.262 7.803
E76N-C-H 120.464 177.853 8.237
M79N-C-H 119.301 178.402 7.947
R83N-C-H 118.498 180.226 7.104
E84N-C-H 118.832 178.454 8.562
M85N-C-H 114.569 174.712 7.701
N87N-C-H 123.724 176.218 7.863
M89N-C-H 118.137 177.201 8.512
Y90N-C-H 116.231 175.605 6.992
A91N-C-H 113.650 175.488 7.395
L92N-C-H 115.593 177.735 7.717
F93N-C-H 112.809 175.078 7.678
R94N-C-H 120.175 174.472 9.584
T95N-R94C-T95H 114.136 174.537 8.478
T95N-C-H 114.130 174.725 8.476
G98N-P97C-G98H 108.716 176.348 7.973
G98N-C-H 108.698 172.989 7.972
D99N-C-H 119.702 176.115 8.283
R100N-D99C-R100H 117.328 176.107 7.634
R100N-C-H 117.346 175.235 7.631
V101N-C-H 124.741 175.005 8.319
T102N-C-H 117.604 173.074 7.337
Y103N-C-H 118.346 175.370 8.311
T104N-C-H 111.717 174.091 8.864
I105N-T104C-I105H 124.592 174.064 8.140
I105N-C-H 124.387 174.995 8.138
N114N-C-H 114.282 176.940 7.728
H115N-C-H 119.209 175.516 8.499
L116N-C-H 119.426 179.687 7.597
Y118N-C-H 121.310 178.519 8.071
D132N-C-H 119.162 175.997 9.017
N133N-C-H 119.377 173.982 8.246
R134N-C-H 119.377 174.101 8.482
L135N-R134C-L135H 120.895 174.088 7.760
L135N-C-H 120.884 176.994 7.756
L136N-C-H 119.926 176.874 8.418
E137N-C-H 121.985 174.631 8.190
C138N-E137C-C138H 117.745 174.607 6.821
C138N-C-H 117.770 171.395 6.821
Y139N-C138C-Y139H 121.818 171.442 7.567
F140N-C-H 120.439 175.230 7.602
T141N-C-H 109.848 174.401 7.564
R142N-C-H 120.893 179.337 8.556
G150N-C-H 106.780 174.958 7.788
K151N-C-H 120.219 175.684 8.157
V153N-C-H 119.869 175.458 8.498
R154N-C-H 123.014 179.342 8.981
T156N-C-H 108.413 177.979 6.137
D157N-C-H 122.248 178.844 8.106
E159N-C-H 120.516 175.998 6.653
E161N-C-H 119.865 176.103 7.010
D162N-E161C-D162H 118.755 176.173 8.443
D162N-C-H 118.732 174.379 8.446
Y163N-C-H 126.196 177.193 8.884
H164N-C-H 116.642 178.334 8.593
Q167N-C-H 117.033 179.267 8.404
L169N-G168C-L169H 122.588 176.358 7.362
L169N-C-H 122.639 178.115 7.356
L172N-Y171C-L172H 118.185 178.478 7.377
L172N-C-H 118.167 176.997 7.405
L173N-C-H 115.130 179.337 7.782
E174N-L173C-E174H 115.514 179.338 7.686
E174N-C-H 115.478 175.503 7.678
N175N-C-H 117.350 171.836 7.090
D176N-N175C-D176H 117.807 171.819 8.116
D176N-C-H 117.840 179.603 8.117
V177N-D176C-V177H 127.118 179.631 9.348
V177N-C-H 127.171 177.862 9.354
T179N-C-H 111.174 175.595 7.884
L180N-C-H 121.097 177.963 7.173
G181N-L180C-G181H 103.779 177.990 8.149
G181N-C-H 103.777 172.787 8.150
Y182N-C-H 115.179 172.725 6.875
D183N-Y182C-D183H 118.804 172.727 8.465
D183N-C-H 118.821 175.227 8.467
L184N-C-H 124.491 175.442 8.959
T185N-C-H 109.748 175.453 7.943
F186N-C-H 121.817 175.526 8.126
S187N-C-H 117.229 171.992 9.055
T188N-C-H 114.463 171.020 8.745
E189N-C-H 125.740 175.846 8.168
V190N-E189C-V190H 124.119 175.812 8.909
V190N-C-H 124.124 173.932 8.912
Q191N-C-H 126.031 173.993 8.471
E192N-Q191C-E192H 125.690 173.991 8.240
E192N-C-H 125.703 175.807 8.234
G194N-F193C-G194H 103.602 175.485 8.488
G194N-C-H 103.661 173.670 8.486
V195N-C-H 121.564 175.045 7.602
C196N-C-H 126.853 173.972 8.759
E197N-C-H 125.623 174.208 8.757
V198N-E197C-V198H 123.117 174.235 8.551
V198N-C-H 123.117 175.724 8.552
R199N-V198C-R199H 128.207 175.719 8.960
R199N-C-H 128.211 175.445 8.952
D200N-R199C-D200H 123.676 175.401 8.573
D200N-C-H 123.526 177.417 8.573
K202N-C-H 113.045 171.568 7.836
N204N-C-H 119.583 177.812 9.082
G205N-C-H 104.707 175.285 8.246
A206N-C-H 120.765 177.074 8.139
N207N-C-H 111.352 174.373 7.943
I208N-C-H 123.499 174.435 7.855
L209N-I208C-L209H 126.283 174.498 7.954
L209N-C-H 126.260 178.094 7.953
V210N-C-H 124.160 175.713 8.299
T211N-C-H 120.637 174.814 9.670
E212N-C-H 118.474 178.477 9.003
E213N-E212C-E213H 114.934 178.508 7.934
E213N-C-H 115.040 177.711 7.937
K215N-C-H 117.706 177.454 7.720
K216N-C-H 120.743 179.011 8.471
E217N-C-H 122.782 178.211 7.630
Q234N-C-H 123.460 177.099 9.728
E244N-C-H 116.254 176.986 7.195
I245N-C-H 115.371 174.152 7.073
K248N-P247C-K248H 126.208 177.626 8.351
K248N-C-H 126.184 179.001 8.353
R249N-C-H 114.985 176.802 8.718
L250N-C-H 117.367 176.859 7.424
I253N-C-H 114.879 176.357 6.876
F254N-C-H 121.036 175.216 7.357
T255N-C-H 109.242 175.426 8.932
Q257N-C-H 119.223 178.724 8.067
E258N-C-H 119.407 177.366 7.352
E260N-C-H 117.744 178.296 6.815
L261N-C-H 119.215 179.462 7.055
I263N-C-H 114.314 175.948 7.670
S264N-C-H 110.009 175.976 8.156
G265N-C-H 112.029 172.338 8.085
L266N-G265C-L266H 126.103 172.317 7.594
L266N-C-H 126.086 182.099 7.594
;
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 . aliased 27 ppm . . . . . . 52542 8
2 . . C 13 CO . 'not observed' 15.9 ppm . . . . . . 52542 8
3 . . H 1 H . 'not observed' 12 ppm . . . . . . 52542 8
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 . . 52542 8
3 $software_3 . . 52542 8
stop_
save_