Content for NMR-STAR saveframe, "spectral_peak_list_3"
save_spectral_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_3
_Spectral_peak_list.Entry_ID 52544
_Spectral_peak_list.ID 3
_Spectral_peak_list.Name CBCA(CO)NH
_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 1
_Spectral_peak_list.Experiment_name '3D CBCA(CO)NH'
_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
?-?-? 39.897 120.751 8.054
?-?-? 59.166 120.743 8.238
?-?-? 57.898 120.762 8.554
?-?-? 32.983 111.286 6.719
?-?-? 29.320 119.899 8.598
?-?-? 31.316 125.807 8.638
?-?-? 16.741 115.828 7.698
?-?-? 44.400 133.462 8.332
?-?-? 44.912 123.520 8.051
?-?-? 44.400 137.220 8.326
?-?-? 42.759 128.837 8.373
?-?-? 44.430 119.299 8.224
?-?-? 32.748 114.965 6.868
?-?-? 53.367 121.298 8.268
?-?-? 45.103 124.501 8.056
?-?-? 62.213 127.680 8.637
?-?-? 44.449 122.135 8.222
?-?-? 54.478 114.383 7.997
?-?-? 32.680 112.070 6.865
?-?-? 62.917 108.601 8.337
?-?-? 59.197 118.639 8.071
?-?-? 31.274 111.781 8.637
?-?-? 62.736 112.070 8.474
?-?-? 44.247 121.322 8.327
?-?-? 57.612 112.067 8.473
?-?-? 44.240 115.904 8.303
?-?-? 55.572 127.388 8.610
?-?-? 44.400 121.610 8.302
?-?-? 44.400 114.961 8.355
?-?-? 57.526 112.070 8.537
?-?-? 44.127 115.219 8.382
?-?-? 62.682 101.374 8.513
?-?-? 40.088 121.075 8.128
?-?-? 29.633 125.079 7.657
?-?-? 62.828 110.637 8.382
?-?-? 44.946 112.679 8.055
?-?-? 44.308 127.968 8.368
?-?-? 55.387 136.666 8.612
?-?-? 44.948 118.362 8.054
?-?-? 44.165 134.618 8.308
?-?-? 44.400 128.837 8.314
?-?-? 44.165 134.618 8.373
?-?-? 57.526 112.937 8.472
?-?-? 62.638 129.804 8.476
?-?-? 62.513 129.707 8.485
?-?-? 57.291 122.477 8.619
?-?-? 44.400 129.704 8.314
?-?-? 32.991 112.174 6.732
?-?-? 44.396 134.329 8.226
?-?-? 44.165 124.211 8.378
?-?-? 62.682 114.961 8.484
?-?-? 29.366 114.936 6.870
?-?-? 56.345 119.233 7.384
?-?-? 44.400 127.970 8.314
?-?-? 54.010 125.657 8.238
?-?-? 44.267 131.728 8.371
?-?-? 57.171 110.658 8.382
?-?-? 55.430 125.431 8.611
?-?-? 37.709 120.994 7.702
?-?-? 57.628 110.915 8.527
?-?-? 44.394 120.256 8.228
?-?-? 62.682 108.890 8.478
?-?-? 44.400 122.188 8.326
?-?-? 29.399 112.359 7.487
?-?-? 54.981 125.339 7.668
?-?-? 44.400 136.353 8.314
?-?-? 31.274 126.813 8.637
?-?-? 44.400 137.220 8.308
?-?-? 53.997 122.490 8.237
?-?-? 44.400 131.728 8.314
?-?-? 42.759 127.970 8.332
?-?-? 40.649 117.852 7.645
?-?-? 63.385 122.477 8.631
?-?-? 44.165 127.391 7.715
?-?-? 44.308 137.219 8.369
?-?-? 44.165 124.211 8.255
?-?-? 29.825 113.283 8.615
?-?-? 31.274 127.680 8.642
?-?-? 28.461 116.984 8.666
?-?-? 62.688 111.803 8.390
?-?-? 31.274 112.359 8.032
?-?-? 29.867 112.359 8.619
?-?-? 54.417 119.643 8.610
?-?-? 44.165 123.344 8.314
?-?-? 31.977 114.383 7.997
?-?-? 44.868 135.775 8.056
?-?-? 43.931 120.453 7.704
?-?-? 44.400 124.211 8.326
?-?-? 54.244 122.766 8.267
?-?-? 62.682 132.595 8.472
?-?-? 29.867 109.179 8.619
?-?-? 56.324 119.148 7.889
?-?-? 44.868 117.274 8.056
?-?-? 44.400 133.462 8.232
?-?-? 39.712 113.226 7.645
?-?-? 63.385 110.046 8.026
?-?-? 62.448 113.515 8.642
?-?-? 44.400 108.890 8.226
?-?-? 44.243 129.773 8.372
?-?-? 39.712 114.094 7.645
?-?-? 31.039 114.672 8.642
?-?-? 62.682 106.867 8.472
?-?-? 62.323 112.645 8.637
?-?-? 44.466 123.954 8.230
?-?-? 62.682 102.241 8.466
?-?-? 28.930 124.790 8.332
?-?-? 62.682 106.867 8.490
?-?-? 57.526 129.704 8.478
?-?-? 57.632 109.756 8.471
?-?-? 44.356 121.221 8.232
?-?-? 44.165 120.453 9.587
?-?-? 62.213 116.406 8.637
?-?-? 44.210 121.355 8.379
?-?-? 44.165 121.321 7.985
?-?-? 62.213 101.952 8.642
?-?-? 54.478 123.633 8.267
?-?-? 57.526 111.781 8.085
?-?-? 62.536 110.914 8.531
?-?-? 53.306 125.079 8.249
?-?-? 44.400 133.462 8.373
?-?-? 62.448 101.085 8.637
?-?-? 62.321 111.780 8.639
?-?-? 44.395 124.939 8.229
?-?-? 44.513 131.566 8.224
?-?-? 44.016 131.488 8.231
?-?-? 32.914 112.937 7.493
?-?-? 31.039 105.710 8.642
?-?-? 44.868 128.259 8.050
?-?-? 40.884 126.813 8.672
?-?-? 44.487 137.206 8.232
?-?-? 45.103 124.211 7.581
?-?-? 62.213 126.813 8.642
?-?-? 27.758 112.359 7.481
?-?-? 68.307 128.259 8.109
?-?-? 60.573 128.259 8.085
?-?-? 31.274 115.539 8.642
?-?-? 53.350 120.993 8.106
?-?-? 31.274 112.648 8.637
?-?-? 44.283 132.609 8.374
?-?-? 16.976 107.445 7.275
?-?-? 44.389 130.572 8.226
?-?-? 59.493 121.761 8.089
?-?-? 27.258 111.518 6.717
?-?-? 25.736 121.736 8.094
?-?-? 44.311 135.484 8.370
?-?-? 44.400 136.353 8.373
?-?-? 57.994 119.875 8.560
?-?-? 63.151 108.890 8.642
?-?-? 44.236 122.212 8.371
?-?-? 57.526 107.734 8.484
?-?-? 16.976 123.344 8.220
?-?-? 70.417 119.875 10.103
?-?-? 44.450 125.928 8.226
?-?-? 31.274 102.819 8.631
?-?-? 32.680 112.937 6.877
?-?-? 29.359 112.088 6.867
?-?-? 62.448 115.539 8.637
?-?-? 62.448 106.578 8.642
?-?-? 44.911 113.702 8.048
?-?-? 44.400 129.704 8.226
?-?-? 44.400 108.890 8.320
?-?-? 62.682 105.132 8.466
?-?-? 44.333 116.693 8.230
?-?-? 54.947 119.297 7.645
?-?-? 62.213 105.710 8.637
?-?-? 41.587 127.970 8.326
?-?-? 62.917 119.875 8.554
?-?-? 18.382 124.211 8.232
?-?-? 44.868 129.415 7.586
?-?-? 62.448 107.156 8.038
?-?-? 62.297 119.277 8.636
?-?-? 62.927 120.762 8.551
?-?-? 44.471 135.262 8.226
?-?-? 31.039 108.312 8.038
?-?-? 62.448 111.492 8.026
?-?-? 27.289 111.492 7.422
?-?-? 62.213 103.687 8.642
?-?-? 31.114 111.503 7.222
?-?-? 62.682 129.704 8.525
?-?-? 44.868 127.391 7.586
?-?-? 44.400 134.618 8.326
?-?-? 60.340 118.951 8.336
?-?-? 62.448 124.790 8.642
?-?-? 62.682 109.468 8.384
?-?-? 32.680 112.359 7.481
?-?-? 55.441 111.513 8.610
?-?-? 57.994 112.648 8.772
?-?-? 42.759 127.970 8.373
?-?-? 62.728 112.926 8.473
?-?-? 29.689 125.341 7.668
?-?-? 29.399 122.766 8.267
?-?-? 44.400 135.486 8.314
?-?-? 45.727 121.321 8.160
?-?-? 44.165 123.344 8.378
?-?-? 45.692 123.632 8.151
?-?-? 62.682 107.734 8.478
?-?-? 55.498 113.289 8.614
?-?-? 29.867 111.492 8.613
?-?-? 44.434 132.579 8.225
?-?-? 62.448 110.625 8.032
?-?-? 44.231 125.097 8.378
?-?-? 43.931 122.766 7.704
?-?-? 44.165 116.695 8.144
?-?-? 44.868 116.406 8.056
?-?-? 44.247 120.452 8.377
?-?-? 40.123 125.109 8.248
?-?-? 54.947 125.079 7.657
?-?-? 62.571 109.757 8.476
?-?-? 55.416 105.421 8.619
?-?-? 62.448 102.819 8.648
?-?-? 44.400 128.837 8.232
?-?-? 43.822 116.103 8.598
?-?-? 44.268 132.604 8.311
?-?-? 44.400 128.837 8.373
?-?-? 33.149 111.492 7.422
?-?-? 32.567 114.672 8.520
?-?-? 62.530 112.071 8.535
?-?-? 62.682 117.563 8.472
?-?-? 39.712 121.032 7.651
?-?-? 44.400 108.890 8.367
?-?-? 28.227 123.344 8.238
?-?-? 55.416 106.288 8.613
?-?-? 57.582 112.069 8.522
?-?-? 55.650 110.336 8.384
?-?-? 62.213 114.672 8.642
?-?-? 51.431 107.445 7.275
?-?-? 29.867 105.421 8.613
?-?-? 62.213 104.843 8.637
?-?-? 44.399 136.067 8.226
?-?-? 44.486 136.169 8.231
?-?-? 44.202 119.523 8.373
?-?-? 55.416 112.359 8.613
P2CA-G3N-H 62.342 109.691 8.641
P2CB-G3N-H 31.187 109.687 8.640
P2CB-G3N-H 31.189 109.695 8.640
G3CA-S4N-H 44.152 116.405 8.383
S4CA-D5N-H 57.929 121.940 8.552
S4CB-D5N-H 62.973 121.892 8.552
D5CA-F6N-H 54.717 121.181 8.395
D5CB-F6N-H 39.515 121.146 8.396
F6CA-D7N-H 59.482 118.661 8.192
F6CB-D7N-H 38.163 118.672 8.192
D7CA-V8N-H 56.861 120.159 7.754
D7CB-V8N-H 39.617 120.149 7.753
V8CA-K9N-H 65.359 121.150 7.959
V8CB-K9N-H 31.002 121.130 7.961
K9CA-R10N-H 59.040 119.102 8.850
K9CB-R10N-H 33.058 118.884 8.850
R10CA-K11N-H 59.610 119.363 7.761
R10CB-K11N-H 28.937 119.370 7.763
K11CA-Y12N-H 58.856 121.502 7.788
K11CB-Y12N-H 31.294 121.506 7.789
Y12CA-F13N-H 60.203 120.403 8.975
Y12CB-F13N-H 36.847 120.349 8.959
F13CA-R14N-H 59.869 116.117 8.378
F13CB-R14N-H 39.404 116.117 8.376
R14CA-Q15N-H 57.372 119.614 7.981
R14CB-Q15N-H 27.184 119.675 7.981
Q15CA-E16N-H 57.760 120.453 8.314
Q15CB-E16N-H 27.494 120.451 8.314
E16CA-L17N-H 57.331 120.782 8.084
E16CB-L17N-H 28.863 120.775 8.087
L17CA-E18N-H 56.913 117.690 7.802
L17CB-E18N-H 40.784 117.801 7.807
E18CA-R19N-H 58.085 120.730 7.780
E18CB-R19N-H 27.928 120.733 7.785
R19CA-L20N-H 58.258 118.457 7.650
R19CB-L20N-H 29.001 118.463 7.650
L20CA-D21N-H 55.880 117.283 7.310
L20CB-D21N-H 40.447 117.292 7.310
D21CA-E22N-H 53.000 122.124 7.288
D21CB-E22N-H 40.045 122.134 7.288
E22CA-G23N-H 57.901 111.478 8.778
E22CB-G23N-H 28.323 111.478 8.779
G23CA-L24N-H 43.986 121.608 7.703
L24CA-R25N-H 53.739 127.125 8.717
L24CB-R25N-H 41.430 127.135 8.715
R25CA-K26N-H 54.015 124.562 8.237
R25CB-K26N-H 28.273 124.566 8.236
K26CA-E27N-H 56.012 120.815 8.033
K26CB-E27N-H 33.312 120.824 8.032
E27CA-D28N-H 52.998 120.208 8.262
E27CB-D28N-H 32.336 120.181 8.262
D28CA-M29N-H 53.455 126.592 9.037
D28CB-M29N-H 40.137 126.609 9.036
M29CA-A30N-H 53.554 130.257 8.436
M29CB-A30N-H 36.031 130.250 8.435
A30CA-V31N-H 50.818 123.072 8.227
A30CB-V31N-H 18.381 123.089 8.230
V31CA-H32N-H 60.308 126.994 8.986
V31CB-H32N-H 32.416 127.018 8.984
H32CA-V33N-H 54.677 113.595 8.381
H32CB-V33N-H 27.915 113.624 8.382
V33CA-R34N-H 56.822 122.477 9.000
V33CB-R34N-H 35.005 122.359 8.997
R35CA-D36N-H 58.951 112.852 8.638
R35CB-D36N-H 29.256 112.871 8.646
D36CA-H37N-H 52.915 119.050 7.999
D36CB-H37N-H 38.564 119.051 7.992
V38CA-F39N-H 67.561 124.674 9.579
V38CB-F39N-H 30.606 124.791 9.582
F39CA-E40N-H 61.979 118.430 9.124
F39CB-E40N-H 38.540 118.430 9.124
E40CA-D41N-H 58.634 120.243 8.940
E40CB-D41N-H 28.901 120.195 8.937
D41CA-S42N-H 56.412 117.044 8.296
D41CB-S42N-H 38.919 117.039 8.292
S42CB-Y43N-H 61.529 123.568 8.080
Y43CA-R44N-H 59.926 122.494 8.147
Y43CB-R44N-H 35.607 122.520 8.144
R44CA-E45N-H 59.229 115.418 8.103
R44CB-E45N-H 28.703 115.405 8.108
E45CA-L46N-H 57.414 112.932 8.066
E45CB-L46N-H 31.264 112.845 8.062
L46CA-H47N-H 54.307 119.795 8.621
L46CB-H47N-H 43.933 119.880 8.615
H47CA-R48N-H 59.296 115.767 7.898
H47CB-R48N-H 25.879 115.804 7.904
R48CA-K49N-H 53.884 118.520 6.870
R48CB-K49N-H 28.375 118.589 6.869
K49CA-S50N-H 53.861 121.088 9.649
K49CB-S50N-H 31.039 121.032 9.646
P51CA-E52N-H 64.725 113.721 8.046
P51CB-E52N-H 30.531 113.759 8.046
E52CA-E53N-H 59.829 120.810 7.802
E52CB-E53N-H 27.723 120.810 7.803
E53CA-M54N-H 57.532 113.132 7.380
E53CB-M54N-H 29.277 113.200 7.381
M54CA-K55N-H 52.401 117.501 7.094
M54CB-K55N-H 27.350 117.538 7.093
K55CA-N56N-H 56.181 115.672 7.182
K55CB-N56N-H 30.484 115.622 7.176
N56CA-R57N-H 52.179 118.816 7.933
N56CB-R57N-H 38.646 118.920 7.933
R57CA-L58N-H 54.683 124.752 8.739
R57CB-L58N-H 29.474 124.729 8.741
L58CA-Y59N-H 53.420 125.297 8.239
L58CB-Y59N-H 40.236 125.374 8.226
Y59CA-I60N-H 55.096 124.902 7.997
Y59CB-I60N-H 38.093 124.870 7.995
I60CA-V61N-H 57.514 127.230 8.304
I60CB-V61N-H 34.506 127.282 8.295
V61CA-F62N-H 60.037 127.468 8.601
V61CB-F62N-H 32.185 127.425 8.599
F62CA-E63N-H 55.248 125.550 8.816
F62CB-E63N-H 37.854 125.596 8.815
E63CA-G64N-H 57.033 114.064 9.007
E63CB-G64N-H 29.196 114.067 9.008
G64CA-E65N-H 44.695 119.441 7.864
E65CA-E66N-H 53.942 122.307 8.702
E65CB-E66N-H 30.189 122.309 8.701
E66CA-G67N-H 55.457 110.308 8.616
E66CB-G67N-H 29.749 110.336 8.616
G67CA-Q68N-H 44.934 119.531 8.054
Q68CA-D69N-H 54.343 120.563 8.267
Q68CB-D69N-H 29.373 120.556 8.267
D69CA-A70N-H 53.075 127.966 8.674
D69CB-A70N-H 40.758 127.972 8.673
A70CA-G71N-H 54.162 107.808 8.664
A70CB-G71N-H 17.658 107.817 8.665
G71CA-G72N-H 46.038 111.581 8.261
G72CA-L73N-H 46.015 122.717 8.083
L73CA-L74N-H 56.588 120.453 7.897
L73CB-L74N-H 40.820 120.458 7.894
L74CA-R75N-H 57.086 117.591 7.823
L74CB-R75N-H 40.860 117.500 7.826
R75CA-E76N-H 59.166 120.453 8.244
R75CB-E76N-H 29.018 120.515 8.237
E76CA-W77N-H 58.941 120.830 8.990
E76CB-W77N-H 28.861 120.916 8.989
W77CA-Y78N-H 62.456 117.218 8.664
W77CB-Y78N-H 28.528 117.185 8.661
Y78CA-M79N-H 61.986 119.363 7.974
Y78CB-M79N-H 37.133 119.297 7.979
M79CA-I80N-H 58.120 119.856 8.646
M79CB-I80N-H 31.274 119.875 8.648
I80CA-I81N-H 64.688 120.837 8.825
I80CB-I81N-H 38.081 120.813 8.820
I81CA-S82N-H 64.350 114.331 7.623
I81CB-S82N-H 35.256 114.379 7.622
S82CA-R83N-H 60.387 118.590 7.131
S82CB-R83N-H 62.261 118.612 7.133
R83CA-E84N-H 57.297 119.322 8.586
R83CB-E84N-H 29.874 119.045 8.587
E84CA-M85N-H 57.739 114.727 7.686
E84CB-M85N-H 29.706 114.728 7.684
M85CA-F86N-H 57.366 113.805 6.403
M85CB-F86N-H 31.093 113.840 6.402
F86CA-N87N-H 55.885 123.922 7.856
F86CB-N87N-H 36.899 123.922 7.856
P88CA-M89N-H 63.604 118.371 8.538
P88CB-M89N-H 30.970 118.372 8.537
M89CA-Y90N-H 57.009 116.318 6.995
M89CB-Y90N-H 31.035 116.333 6.996
Y90CA-A91N-H 57.015 113.796 7.457
Y90CB-A91N-H 37.045 113.793 7.455
A91CA-L92N-H 52.079 115.890 7.731
A91CB-L92N-H 16.978 115.873 7.731
L92CA-F93N-H 55.629 112.871 7.690
L92CB-F93N-H 40.945 112.911 7.671
F93CA-R94N-H 55.195 120.255 9.576
F93CB-R94N-H 43.992 120.303 9.579
R94CA-T95N-H 52.923 114.562 8.523
R94CB-T95N-H 32.757 114.572 8.523
T95CA-S96N-H 60.529 119.325 8.300
T95CB-S96N-H 68.903 119.334 8.298
P97CA-G98N-H 62.386 109.376 8.032
P97CB-G98N-H 31.210 109.375 8.031
G98CA-D99N-H 43.956 120.050 8.320
D99CA-R100N-H 54.874 117.167 7.646
D99CB-R100N-H 39.712 117.155 7.645
R100CA-V101N-H 53.327 124.582 8.334
R100CB-V101N-H 30.526 124.589 8.334
V101CA-T102N-H 62.996 117.525 7.334
V101CB-T102N-H 30.000 117.534 7.329
T102CA-Y103N-H 58.779 118.769 8.327
T102CB-Y103N-H 71.359 118.755 8.327
Y103CA-T104N-H 56.625 112.154 8.999
Y103CB-T104N-H 41.666 112.303 9.005
T104CA-I105N-H 57.469 125.032 8.127
T104CB-I105N-H 69.966 125.022 8.129
I105CA-N106N-H 62.219 125.792 8.634
P107CA-S108N-H 63.225 111.436 7.221
P107CB-S108N-H 31.114 111.503 7.222
S108CA-S109N-H 56.264 117.718 7.703
S108CB-S109N-H 61.215 117.852 7.700
P113CA-N114N-H 63.366 114.679 7.833
P113CB-N114N-H 31.132 114.750 7.830
N114CA-H115N-H 51.714 119.531 8.505
N114CB-H115N-H 38.049 119.494 8.507
H115CA-L116N-H 59.767 119.568 7.702
H115CB-L116N-H 30.584 119.641 7.702
L116CA-S117N-H 57.760 115.250 7.727
L116CB-S117N-H 38.368 115.173 7.733
S117CA-Y118N-H 60.126 121.605 8.069
S117CB-Y118N-H 61.685 121.591 8.071
Y118CA-F119N-H 60.789 119.254 9.061
Y118CB-F119N-H 36.841 119.407 9.071
F119CA-K120N-H 64.080 119.818 7.839
F119CB-K120N-H 38.981 119.824 7.836
K120CA-F121N-H 59.038 118.992 7.874
K120CB-F121N-H 30.959 119.026 7.873
F121CA-V122N-H 59.561 118.901 8.977
F121CB-V122N-H 38.321 118.950 8.970
G123CA-R124N-H 46.513 120.181 7.837
R124CA-I125N-H 57.707 119.589 8.167
R124CB-I125N-H 29.363 119.525 8.164
I125CA-V126N-H 60.625 119.906 8.464
I125CB-V126N-H 34.068 119.980 8.454
V126CA-A127N-H 65.878 119.037 7.867
V126CB-A127N-H 30.823 119.041 7.867
A127CA-K128N-H 54.258 120.711 8.940
A127CB-K128N-H 19.280 120.702 8.940
K128CA-A129N-H 56.853 123.482 8.551
K128CB-A129N-H 31.339 123.395 8.548
A129CA-V130N-H 54.910 117.664 7.705
A129CB-V130N-H 16.733 117.651 7.707
V130CA-Y131N-H 64.585 125.752 9.604
V130CB-Y131N-H 30.596 125.909 9.602
Y131CA-D132N-H 62.048 119.300 9.026
Y131CB-D132N-H 37.942 119.254 9.025
D132CA-N133N-H 54.084 119.396 8.271
D132CB-N133N-H 39.546 119.383 8.269
N133CA-R134N-H 52.524 119.373 8.495
N133CB-R134N-H 36.348 119.376 8.494
R134CA-L135N-H 52.281 120.933 7.773
R134CB-L135N-H 30.834 120.964 7.767
L135CA-L136N-H 53.249 120.156 8.428
L135CB-L136N-H 42.205 120.179 8.422
L136CA-E137N-H 52.020 122.217 8.198
L136CB-E137N-H 44.266 122.215 8.193
E137CA-C138N-H 54.196 117.867 6.905
E137CB-C138N-H 27.081 117.869 6.906
C138CA-Y139N-H 54.947 122.188 7.393
C138CB-Y139N-H 29.238 122.166 7.396
Y139CA-F140N-H 55.097 120.496 7.588
Y139CB-F140N-H 37.739 120.479 7.589
F140CA-T141N-H 54.523 110.639 7.807
F140CB-T141N-H 39.888 110.698 7.800
T141CA-R142N-H 60.372 122.358 8.697
T141CB-R142N-H 69.281 122.294 8.699
R142CA-S143N-H 59.072 111.686 8.309
R142CB-S143N-H 28.380 111.759 8.319
S143CA-F144N-H 60.023 124.552 7.735
S143CB-F144N-H 61.519 124.522 7.738
F144CA-Y145N-H 60.380 115.394 7.410
F144CB-Y145N-H 38.460 115.430 7.411
Y145CA-K146N-H 60.565 116.522 7.960
Y145CB-K146N-H 36.804 116.601 7.950
K146CA-H147N-H 59.964 117.285 7.659
K146CB-H147N-H 30.968 117.189 7.653
H147CA-I148N-H 58.594 119.524 7.429
I148CA-L149N-H 64.099 116.325 7.380
I148CB-L149N-H 36.376 116.418 7.383
L149CA-G150N-H 54.455 105.183 7.679
L149CB-G150N-H 41.687 105.166 7.679
G150CA-K151N-H 45.146 118.857 8.012
K151CA-S152N-H 54.581 115.540 8.000
K151CB-S152N-H 32.139 115.552 8.001
G158CA-A159N-H 45.770 122.528 8.158
A159CA-I160N-H 52.877 107.283 7.278
A159CB-I160N-H 18.363 107.287 7.279
I160CA-R161N-H 59.033 121.084 7.147
I160CB-R161N-H 37.764 121.193 7.151
R161CA-K162N-H 59.001 119.459 8.829
R161CB-K162N-H 29.572 119.546 8.832
K162CA-Q163N-H 58.831 122.839 9.809
K162CA-Q163N-H 58.864 122.981 9.808
K162CB-Q163N-H 31.169 122.862 9.812
Q163CA-L164N-H 59.332 118.144 8.142
Q163CB-L164N-H 27.200 118.160 8.142
L164CA-A165N-H 56.324 119.148 7.889
L164CB-A165N-H 41.203 119.147 7.894
A165CA-A166N-H 54.201 121.245 7.598
A165CB-A166N-H 16.707 121.262 7.598
A166CA-F167N-H 54.188 118.641 8.060
A166CB-F167N-H 18.368 118.578 8.062
F167CA-L168N-H 60.382 118.356 8.832
F167CB-L168N-H 38.533 118.307 8.832
L168CA-E169N-H 56.241 118.620 8.071
L168CB-E169N-H 38.899 118.626 8.064
E169CA-G170N-H 58.621 103.441 7.756
E169CB-G170N-H 28.867 103.448 7.748
G170CA-F171N-H 45.707 122.376 8.010
F171CA-Y172N-H 58.932 116.984 9.047
F171CB-Y172N-H 39.243 116.984 9.041
Y172CA-E173N-H 54.713 116.406 7.193
Y172CB-E173N-H 35.971 116.400 7.193
E173CA-I174N-H 57.353 115.293 7.070
E173CB-I174N-H 30.021 115.343 7.067
I174CA-I175N-H 60.445 118.747 7.911
I174CB-I175N-H 37.066 118.774 7.911
P176CA-K177N-H 61.809 126.348 8.375
P176CB-K177N-H 31.784 126.333 8.378
K177CA-R178N-H 58.827 115.009 8.700
K177CB-R178N-H 30.944 114.975 8.703
R178CA-L179N-H 57.221 117.529 7.437
R178CB-L179N-H 28.025 117.544 7.434
L179CA-I180N-H 55.261 115.968 7.671
L179CB-I180N-H 41.462 115.889 7.668
I180CA-S181N-H 58.608 111.048 7.783
I180CB-S181N-H 38.778 111.089 7.789
S181CA-I182N-H 59.417 114.610 6.865
S181CB-I182N-H 62.696 114.623 6.862
I182CA-F183N-H 61.810 121.187 7.364
I182CB-F183N-H 36.485 121.245 7.358
F183CA-T184N-H 57.863 109.466 8.924
F183CB-T184N-H 39.258 109.515 8.922
F183CB-T184N-H 39.258 109.515 8.922
T184CA-E185N-H 59.782 120.161 10.104
T184CB-E185N-H 70.173 120.106 10.113
T184CB-E185N-H 70.173 120.106 10.113
E185CA-Q186N-H 60.257 118.699 8.176
E185CB-Q186N-H 27.499 118.670 8.179
Q186CA-E187N-H 57.830 119.361 7.392
Q186CB-E187N-H 27.255 119.403 7.396
E187CA-L188N-H 57.301 119.596 8.587
E187CB-L188N-H 29.025 119.546 8.582
L188CA-E189N-H 56.169 117.812 6.948
L188CB-E189N-H 40.440 117.853 6.949
E189CA-L190N-H 58.650 119.900 7.099
E189CB-L190N-H 28.053 119.889 7.103
L190CA-L191N-H 56.399 121.278 8.261
L190CB-L191N-H 40.488 121.264 8.258
L191CA-I192N-H 56.293 114.399 7.693
L191CB-I192N-H 42.119 114.290 7.697
I192CA-S193N-H 63.531 110.363 8.147
I192CB-S193N-H 37.976 110.349 8.151
S193CA-G194N-H 57.708 111.966 8.118
S193CB-G194N-H 65.507 111.983 8.115
G194CA-L195N-H 44.928 126.292 7.585
;
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 CA|CB . 'not observed' 60 ppm . . . . . . 52544 3
2 . . N 15 N . 'not observed' 37 ppm . . . . . . 52544 3
3 . . H 1 HN . 'not observed' 12 ppm . . . . . . 52544 3
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 3
3 $software_3 . . 52544 3
stop_
save_