Content for NMR-STAR saveframe, "peak_list_3"
save_peak_list_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_3
_Spectral_peak_list.Entry_ID 50595
_Spectral_peak_list.ID 3
_Spectral_peak_list.Name .
_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 HNCACB'
_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 .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
Assignment w1 w2 w3
?-?-? 119.950 57.255 8.077
?-?-? 119.950 58.612 8.077
?-?-? 119.950 33.934 8.078
Y3N-S2CA-Y3HN 121.666 58.138 7.991
Y3N-S2CB-Y3HN 121.690 63.849 7.995
Y3N-CA-HN 121.666 57.600 7.998
Y3N-CB-HN 121.666 38.934 7.998
Q4N-Y3CA-Q4HN 121.973 57.564 8.335
Q4N-Y3CB-Q4HN 121.973 39.059 8.337
Q4N-CA-HN 121.973 55.731 8.341
Q4N-CB-HN 121.973 30.087 8.336
V5N-Q4CA-V5HN 120.902 55.719 8.014
V5N-Q4CB-V5HN 120.902 30.077 8.008
V5N-CA-HN 120.898 62.989 8.015
V5N-CB-HN 120.902 32.005 8.005
W10N-CA-HN 116.714 58.290 8.121
W10N-CB-HN 116.714 27.493 8.123
R11N-W10CA-R11HN 123.554 58.231 6.923
R11N-CA-HN 123.554 54.314 6.923
R11N-CB-HN 123.554 30.434 6.920
Q13N-P12CA-Q13HN 120.964 63.098 9.329
Q13N-P12CB-Q13HN 120.964 32.529 9.326
Q13N-CA-HN 120.964 56.233 9.331
Q13N-CB-HN 120.964 30.734 9.322
T14N-Q13CA-T14HN 109.029 56.078 7.849
T14N-Q13CB-T14HN 109.068 31.061 7.860
T14N-CA-HN 109.029 59.751 7.843
T14N-CB-HN 109.029 72.258 7.843
F15N-CA-HN 120.211 60.520 8.736
F15N-CB-HN 120.194 38.037 8.723
A16N-F15CA-A16HN 119.487 60.600 7.977
A16N-F15CB-A16HN 119.472 38.201 7.983
A16N-CA-HN 119.487 54.040 7.981
A16N-CB-HN 119.487 18.624 7.977
D17N-A16CA-D17HN 114.794 54.013 7.377
D17N-A16CB-D17HN 114.819 18.565 7.381
D17N-CA-HN 114.819 54.921 7.384
D17N-CB-HN 114.806 43.368 7.379
V18N-D17CA-V18HN 121.715 54.719 7.397
V18N-D17CB-V18HN 121.715 43.401 7.392
V18N-CA-HN 121.715 63.350 7.388
V18N-CB-HN 121.715 31.707 7.388
V19N-V18CA-V19HN 128.456 63.362 7.989
V19N-CA-HN 128.456 62.207 7.986
V19N-CB-HN 128.456 32.576 7.977
G20N-V19CA-G20HN 113.695 62.043 8.669
G20N-CA-HN 113.695 45.670 8.681
E22N-CA-HN 121.421 61.629 9.605
E22N-CB-HN 121.421 29.091 9.600
V24N-H23CA-V24HN 121.217 59.186 7.047
V24N-CA-HN 121.249 64.457 7.041
V24N-CB-HN 121.249 32.874 7.044
L25N-CA-HN 118.218 58.083 8.053
L25N-CB-HN 118.218 41.014 8.057
T26N-L25CA-T26HN 114.537 58.028 8.300
T26N-L25CB-T26HN 114.537 41.025 8.300
T26N-CA-HN 114.537 66.394 8.305
T26N-CB-HN 114.537 68.700 8.305
A27N-T26CA-A27HN 123.491 66.442 7.060
A27N-T26CB-A27HN 123.491 68.725 7.060
A27N-CA-HN 123.532 55.212 7.061
A27N-CB-HN 123.527 18.973 7.059
L28N-A27CA-L28HN 119.564 55.088 8.209
L28N-A27CB-L28HN 119.564 19.065 8.206
L28N-CA-HN 119.564 57.659 8.209
L28N-CB-HN 119.564 42.195 8.219
A29N-L28CA-A29HN 120.843 57.767 8.487
A29N-L28CB-A29HN 120.904 42.199 8.492
A29N-CA-HN 120.843 55.707 8.486
A29N-CB-HN 120.843 18.148 8.489
N30N-A29CA-N30HN 116.818 55.483 8.201
N30N-A29CB-N30HN 116.818 17.984 8.198
N30N-CA-HN 116.818 56.408 8.208
N30N-CB-HN 116.818 38.599 8.201
G31N-N30CA-G31HN 106.256 56.342 7.831
G31N-N30CB-G31HN 106.256 38.599 7.823
G31N-CA-HN 106.282 47.925 7.827
L32N-G31CA-L32HN 120.902 47.945 8.130
L32N-CA-HN 120.902 58.290 8.130
L32N-CB-HN 120.902 42.160 8.127
S33N-L32CA-S33HN 113.997 58.333 8.239
S33N-L32CB-S33HN 113.997 42.211 8.242
S33N-CA-HN 113.997 61.433 8.239
S33N-CB-HN 113.997 63.305 8.233
L34N-S33CA-L34HN 118.921 61.564 7.648
L34N-CA-HN 118.921 55.064 7.652
L34N-CB-HN 118.921 43.112 7.648
G35N-L34CA-G35HN 108.688 55.091 7.878
G35N-L34CB-G35HN 108.714 42.992 7.882
G35N-CA-HN 108.688 46.366 7.873
R36N-G35CA-R36HN 122.642 46.374 8.298
R36N-CA-HN 122.642 54.957 8.297
R36N-CB-HN 122.642 30.053 8.295
I37N-R36CA-I37HN 123.151 54.802 8.032
I37N-R36CB-I37HN 123.115 29.919 8.034
I37N-CA-HN 123.151 58.957 8.032
I37N-CB-HN 123.151 38.612 8.032
H38N-CA-HN 129.043 56.469 8.209
H38N-CB-HN 129.043 32.184 8.213
A40N-H39CA-A40HN 121.503 57.826 7.728
A40N-H39CB-A40HN 121.433 31.501 7.728
A40N-H39CB-A40HN 121.503 31.443 7.720
A40N-CA-HN 121.503 51.481 7.728
A40N-CB-HN 121.503 22.767 7.728
Y41N-A40CA-Y41HN 122.768 51.410 8.944
Y41N-A40CB-Y41HN 122.768 22.624 8.946
Y41N-CA-HN 122.768 56.826 8.949
Y41N-CB-HN 122.768 42.648 8.940
L42N-Y41CA-L42HN 124.153 56.832 8.950
L42N-Y41CB-L42HN 124.153 42.450 8.953
L42N-CA-HN 124.153 53.046 8.953
L42N-CB-HN 124.153 45.289 8.957
F43N-L42CA-F43HN 126.529 53.079 9.641
F43N-L42CB-F43HN 126.529 45.257 9.633
F43N-CA-HN 126.529 56.625 9.644
F43N-CB-HN 126.529 40.720 9.633
S44N-F43CA-S44HN 118.818 56.658 9.331
S44N-F43CB-S44HN 118.818 40.807 9.329
S44N-CA-HN 118.818 56.375 9.322
S44N-CB-HN 118.818 66.884 9.325
G45N-S44CA-G45HN 107.468 56.418 7.456
G45N-S44CB-G45HN 107.468 66.856 7.477
G45N-CA-HN 107.468 44.735 7.458
T46N-G45CA-T46HN 113.941 44.682 8.479
T46N-CA-HN 113.941 62.728 8.480
T46N-CB-HN 113.941 69.919 8.474
R47N-T46CA-R47HN 122.077 62.659 8.353
R47N-T46CB-R47HN 122.077 69.921 8.355
R47N-CA-HN 122.077 58.231 8.356
R47N-CB-HN 122.077 30.065 8.347
G48N-R47CA-G48HN 115.271 58.257 10.526
G48N-CA-HN 115.271 45.768 10.517
V49N-G48CA-V49HN 116.071 45.945 7.933
V49N-CA-HN 116.071 62.612 7.933
V49N-CB-HN 116.071 32.207 7.928
G50N-CA-HN 112.247 45.474 9.453
K51N-G50CA-K51HN 124.942 45.616 10.790
K51N-CB-HN 124.942 30.645 10.778
T52N-K51CA-T52HN 106.531 61.325 8.301
T52N-K51CB-T52HN 106.531 30.821 8.292
T52N-CA-HN 106.531 65.121 8.305
T52N-CB-HN 106.531 68.548 8.301
S53N-T52CA-S53HN 119.728 65.005 7.751
S53N-T52CB-S53HN 119.728 68.442 7.750
S53N-CA-HN 119.728 61.564 7.754
S53N-CB-HN 119.728 62.481 7.757
I54N-S53CA-I54HN 122.017 61.493 8.133
I54N-CA-HN 122.017 64.564 8.133
I54N-CB-HN 122.017 36.350 8.132
A55N-I54CA-A55HN 121.263 64.624 7.490
A55N-I54CB-A55HN 121.263 36.398 7.487
A55N-CA-HN 121.263 55.231 7.487
A55N-CB-HN 121.263 18.100 7.487
R56N-A55CA-R56HN 117.497 55.256 8.045
R56N-A55CB-R56HN 117.504 18.136 8.051
R56N-CA-HN 117.504 60.520 8.047
R56N-CB-HN 117.504 29.798 8.044
L57N-R56CA-L57HN 119.006 60.612 7.449
L57N-R56CB-L57HN 119.006 29.963 7.452
L57N-CA-HN 119.052 57.740 7.443
L57N-CB-HN 119.006 41.695 7.438
L58N-L57CA-L58HN 121.765 57.752 8.246
L58N-L57CB-L58HN 121.765 41.805 8.253
L58N-CA-HN 121.765 58.369 8.248
L58N-CB-HN 121.765 41.541 8.254
A59N-L58CA-A59HN 120.516 58.322 8.324
A59N-L58CB-A59HN 120.516 41.588 8.331
A59N-CA-HN 120.516 55.921 8.330
A59N-CB-HN 120.516 18.422 8.327
K60N-A59CA-K60HN 118.730 55.826 8.218
K60N-A59CB-K60HN 118.730 18.398 8.215
K60N-CA-HN 118.760 59.284 8.220
K60N-CB-HN 118.730 33.862 8.215
G61N-K60CA-G61HN 108.215 59.203 8.414
G61N-K60CB-G61HN 108.215 34.059 8.416
G61N-CA-HN 108.215 48.248 8.420
L62N-G61CA-L62HN 115.360 48.216 8.209
L62N-CA-HN 115.360 57.093 8.206
L62N-CB-HN 115.404 42.474 8.208
N63N-L62CA-N63HN 112.260 57.195 7.178
N63N-CA-HN 112.260 53.612 7.175
N63N-CB-HN 112.260 42.183 7.172
C64N-N63CA-C64HN 125.611 53.743 7.376
C64N-CA-HN 125.611 62.445 7.383
C64N-CB-HN 125.611 27.505 7.373
E65N-CA-HN 135.049 60.367 9.800
E65N-CB-HN 135.049 30.679 9.793
T66N-E65CA-T66HN 112.531 60.335 9.139
T66N-E65CB-T66HN 112.531 30.723 9.145
T66N-CA-HN 112.531 64.197 9.138
T66N-CB-HN 112.531 70.104 9.132
G67N-T66CA-G67HN 110.543 64.168 7.332
G67N-CA-HN 110.543 43.808 7.325
I68N-G67CA-I68HN 117.636 43.838 7.839
I68N-CA-HN 117.636 62.493 7.842
I68N-CB-HN 117.636 37.862 7.836
T69N-CA-HN 123.957 59.124 8.609
T69N-CB-HN 123.952 68.984 8.613
A70N-T69CA-A70HN 124.856 59.095 8.389
A70N-T69CB-A70HN 124.833 68.749 8.382
A70N-CA-HN 124.856 52.112 8.389
A70N-CB-HN 124.856 19.303 8.382
T71N-A70CA-T71HN 111.546 52.056 9.138
T71N-A70CB-T71HN 111.546 19.311 9.135
T71N-CA-HN 111.546 56.832 9.140
T71N-CB-HN 111.546 69.092 9.138
C73N-P72CA-C73HN 127.189 62.913 8.787
C73N-P72CB-C73HN 127.189 32.137 8.787
C73N-CA-HN 127.189 61.749 8.784
C73N-CB-HN 127.261 30.579 8.793
G74N-C73CA-G74HN 114.806 61.749 9.321
G74N-CA-HN 114.806 47.063 9.314
V75N-G74CA-V75HN 117.537 47.082 8.966
V75N-CA-HN 117.571 61.782 8.952
V75N-CB-HN 117.631 34.431 8.955
C76N-CA-HN 124.849 57.124 7.462
C76N-CB-HN 124.849 30.517 7.462
D77N-C76CA-D77HN 120.725 57.112 8.687
D77N-C76CB-D77HN 120.725 30.541 8.690
D77N-CA-HN 120.725 58.517 8.688
D77N-CB-HN 120.725 40.112 8.693
N78N-D77CA-N78HN 119.148 58.588 7.888
N78N-D77CB-N78HN 119.148 40.124 7.895
N78N-CA-HN 119.159 56.558 7.896
N78N-CB-HN 119.148 36.969 7.892
C79N-N78CA-C79HN 121.839 56.397 8.943
C79N-N78CB-C79HN 121.839 36.967 8.946
C79N-CA-HN 121.839 66.369 8.944
C79N-CB-HN 121.839 29.309 8.943
R80N-C79CA-R80HN 117.660 66.209 8.387
R80N-CA-HN 117.660 59.595 8.390
R80N-CB-HN 117.659 30.322 8.388
E81N-R80CA-E81HN 118.019 59.638 8.478
E81N-R80CB-E81HN 118.019 30.320 8.481
E81N-CA-HN 118.019 60.128 8.475
E81N-CB-HN 118.019 29.352 8.473
I82N-E81CA-I82HN 120.895 60.243 8.169
I82N-E81CB-I82HN 120.895 29.422 8.167
I82N-CA-HN 120.895 66.397 8.169
I82N-CB-HN 120.895 37.315 8.170
E83N-I82CA-E83HN 121.701 66.243 7.841
E83N-CA-HN 121.701 59.076 7.840
E83N-CB-HN 121.701 29.493 7.837
Q84N-E83CA-Q84HN 113.882 59.052 7.617
Q84N-CA-HN 113.882 55.874 7.617
Q84N-CB-HN 113.882 29.636 7.615
G85N-Q84CA-G85HN 108.969 55.647 7.833
G85N-Q84CB-G85HN 109.029 29.576 7.835
G85N-CA-HN 109.029 46.704 7.838
R86N-G85CA-R86HN 117.430 46.624 8.179
R86N-CA-HN 117.430 54.540 8.178
R86N-CB-HN 117.507 31.510 8.177
F87N-R86CA-F87HN 123.377 54.488 8.442
F87N-R86CB-F87HN 123.393 31.449 8.440
F87N-CA-HN 123.406 55.679 8.442
F87N-CB-HN 123.349 40.508 8.440
V88N-F87CA-V88HN 127.501 55.695 8.460
V88N-F87CB-V88HN 127.501 40.505 8.469
V88N-CA-HN 127.457 64.068 8.462
V88N-CB-HN 127.501 31.493 8.463
L90N-D89CA-L90HN 122.253 54.137 7.442
L90N-D89CB-L90HN 122.250 42.654 7.443
L90N-CA-HN 122.253 54.279 7.444
L90N-CB-HN 122.253 44.255 7.438
I91N-L90CA-I91HN 129.729 54.368 8.996
I91N-L90CB-I91HN 129.732 44.325 9.001
I91N-CA-HN 129.732 60.759 8.999
I91N-CB-HN 129.732 37.990 8.995
E92N-I91CA-E92HN 127.166 60.749 8.576
E92N-I91CB-E92HN 127.162 38.017 8.588
E92N-CA-HN 127.162 55.767 8.578
E92N-CB-HN 127.162 30.362 8.578
I93N-E92CA-I93HN 125.638 55.726 9.306
I93N-E92CB-I93HN 125.665 30.309 9.309
I93N-CA-HN 125.665 60.400 9.306
I93N-CB-HN 125.665 41.852 9.301
D94N-I93CA-D94HN 127.865 60.346 8.828
D94N-I93CB-D94HN 127.865 41.718 8.832
D94N-CA-HN 127.865 52.263 8.833
D94N-CB-HN 127.865 40.318 8.836
A95N-D94CA-A95HN 126.935 52.338 8.455
A95N-D94CB-A95HN 126.935 40.362 8.459
A95N-CA-HN 126.935 54.290 8.459
A95N-CB-HN 126.954 19.463 8.456
A96N-A95CA-A96HN 117.232 54.296 8.016
A96N-A95CB-A96HN 117.187 19.509 8.011
A96N-CA-HN 117.187 53.187 8.012
A96N-CB-HN 117.187 19.289 8.004
S97N-A96CA-S97HN 112.596 53.136 7.206
S97N-A96CB-S97HN 112.596 19.339 7.206
S97N-CA-HN 112.596 58.517 7.206
S97N-CB-HN 112.596 63.421 7.208
V101N-K100CA-V101HN 119.827 56.481 7.824
V101N-CA-HN 119.827 64.374 7.816
V101N-CB-HN 119.791 32.438 7.817
E102N-V101CA-E102HN 121.698 64.564 8.568
E102N-V101CB-E102HN 121.698 32.387 8.577
E102N-CA-HN 121.698 58.255 8.575
E102N-CB-HN 121.698 29.529 8.575
D103N-E102CA-D103HN 120.506 58.231 8.030
D103N-E102CB-D103HN 120.472 29.495 8.032
D103N-CA-HN 120.506 55.648 8.032
D103N-CB-HN 120.506 41.243 8.035
T104N-D103CA-T104HN 114.518 55.668 8.118
T104N-D103CB-T104HN 114.518 41.253 8.114
T104N-CA-HN 114.518 64.338 8.123
T104N-CB-HN 114.518 69.064 8.120
R105N-CA-HN 121.638 58.207 7.935
R105N-CB-HN 121.638 30.279 7.935
D106N-R105CA-D106HN 119.936 58.148 8.154
D106N-R105CB-D106HN 119.936 30.148 8.161
D106N-CA-HN 119.936 56.040 8.160
D106N-CB-HN 119.936 41.064 8.161
L107N-D106CA-L107HN 121.110 56.026 8.095
L107N-D106CB-L107HN 121.110 41.053 8.090
L107N-CA-HN 121.110 57.826 8.093
L107N-CB-HN 121.110 42.731 8.096
L108N-L107CA-L108HN 117.449 57.768 8.102
L108N-L107CB-L108HN 117.493 42.786 8.111
L108N-CA-HN 117.433 55.284 8.111
L108N-CB-HN 117.448 41.047 8.117
D109N-L108CA-D109HN 119.827 55.264 7.830
D109N-CA-HN 119.827 56.088 7.831
D109N-CB-HN 119.891 41.204 7.828
V111N-N110CA-V111HN 119.780 53.404 7.614
V111N-N110CB-V111HN 119.834 38.874 7.618
V111N-CA-HN 119.834 64.647 7.615
V111N-CB-HN 119.834 32.207 7.618
Y113N-Q112CA-Y113HN 119.289 56.588 7.353
Y113N-CA-HN 119.289 57.802 7.361
Y113N-CB-HN 119.289 38.440 7.361
A116N-P115CA-A116HN 128.324 62.285 10.061
A116N-P115CB-A116HN 128.313 31.713 10.058
A116N-CA-HN 128.313 54.069 10.053
A116N-CB-HN 128.313 20.366 10.050
R117N-A116CA-R117HN 119.833 53.851 10.114
R117N-A116CB-R117HN 119.833 20.399 10.114
R117N-CA-HN 119.833 57.136 10.117
R117N-CB-HN 119.833 34.443 10.111
G118N-CA-HN 108.594 44.463 9.846
R119N-G118CA-R119HN 119.675 44.350 8.164
R119N-CA-HN 119.675 57.838 8.173
F120N-R119CA-F120HN 113.600 57.887 8.361
F120N-CA-HN 113.600 55.820 8.354
F120N-CB-HN 113.585 43.583 8.353
K121N-F120CA-K121HN 122.606 55.722 9.198
K121N-F120CB-K121HN 122.606 43.527 9.189
K121N-CA-HN 122.606 55.766 9.197
K121N-CB-HN 122.606 34.302 9.195
V122N-K121CA-V122HN 125.990 55.733 8.817
V122N-CA-HN 125.990 60.356 8.817
V122N-CB-HN 125.972 34.321 8.819
Y123N-V122CA-Y123HN 126.179 60.469 8.432
Y123N-V122CB-Y123HN 126.179 34.434 8.438
Y123N-CA-HN 126.179 56.802 8.432
Y123N-CB-HN 126.179 41.064 8.425
L124N-Y123CA-L124HN 129.239 56.930 9.300
L124N-Y123CB-L124HN 129.239 41.034 9.302
L124N-CA-HN 129.239 53.779 9.302
L124N-CB-HN 129.239 44.756 9.300
I125N-L124CA-I125HN 124.768 53.807 9.006
I125N-L124CB-I125HN 124.768 44.648 9.000
I125N-CA-HN 124.768 60.509 8.999
I125N-CB-HN 124.768 38.904 8.994
D126N-I125CA-D126HN 127.660 60.384 9.056
D126N-I125CB-D126HN 127.660 38.980 9.044
D126N-CA-HN 127.660 53.590 9.049
D126N-CB-HN 127.676 43.389 9.048
E127N-D126CA-E127HN 121.668 53.552 8.155
E127N-D126CB-E127HN 121.668 43.469 8.157
E127N-CA-HN 121.668 55.505 8.157
E127N-CB-HN 121.668 26.708 8.158
V128N-E127CA-V128HN 114.896 55.494 8.103
V128N-E127CB-V128HN 114.896 26.741 8.091
V128N-CA-HN 114.896 64.099 8.102
V128N-CB-HN 114.896 31.702 8.106
H129N-V128CA-H129HN 115.356 64.147 8.022
H129N-CA-HN 115.356 58.671 8.024
H129N-CB-HN 115.356 30.053 8.019
M130N-H129CA-M130HN 118.320 58.778 7.969
M130N-H129CB-M130HN 118.320 30.053 7.957
M130N-CA-HN 118.371 54.668 7.965
M130N-CB-HN 118.320 31.029 7.962
L131N-M130CA-L131HN 119.636 54.616 6.982
L131N-M130CB-L131HN 119.656 31.064 6.981
L131N-CA-HN 119.636 55.469 6.976
L131N-CB-HN 119.636 42.505 6.973
S132N-L131CA-S132HN 114.739 55.428 8.284
S132N-L131CB-S132HN 114.739 42.428 8.282
S132N-CA-HN 114.778 57.416 8.285
S132N-CB-HN 114.739 65.002 8.286
S135N-H134CA-S135HN 118.285 59.838 7.891
S135N-H134CB-S135HN 118.285 30.815 7.901
S135N-CA-HN 118.285 62.397 7.895
S135N-CB-HN 118.285 63.505 7.892
F136N-S135CA-F136HN 122.664 62.481 8.978
F136N-CA-HN 122.664 61.528 8.969
F136N-CB-HN 122.664 38.469 8.966
N137N-F136CA-N137HN 117.430 61.528 8.193
N137N-CA-HN 117.430 56.386 8.190
N137N-CB-HN 117.428 37.989 8.178
A138N-N137CA-A138HN 122.630 56.433 7.525
A138N-N137CB-A138HN 122.671 38.007 7.522
A138N-CA-HN 122.627 55.062 7.522
A138N-CB-HN 122.635 18.419 7.521
L139N-A138CA-L139HN 121.073 55.040 8.182
L139N-A138CB-L139HN 121.073 18.600 8.179
L139N-CA-HN 121.073 57.850 8.187
L139N-CB-HN 121.073 41.957 8.181
L140N-L139CA-L140HN 119.041 57.922 8.451
L140N-L139CB-L140HN 119.041 41.902 8.442
L140N-CA-HN 119.041 58.464 8.447
L140N-CB-HN 119.041 41.504 8.447
K141N-L140CA-K141HN 116.524 58.552 7.649
K141N-L140CB-K141HN 116.573 41.459 7.651
K141N-CA-HN 116.524 58.981 7.644
K141N-CB-HN 116.524 31.874 7.652
T142N-K141CA-T142HN 115.519 58.945 7.485
T142N-K141CB-T142HN 115.519 31.898 7.479
T142N-CA-HN 115.519 66.255 7.479
T142N-CB-HN 115.519 68.135 7.482
L143N-T142CA-L143HN 118.152 66.190 7.999
L143N-CA-HN 118.152 56.832 7.994
L143N-CB-HN 118.152 41.852 7.985
E144N-L143CA-E144HN 117.662 56.767 7.756
E144N-L143CB-E144HN 117.662 41.945 7.745
E144N-CA-HN 117.662 58.945 7.750
E144N-CB-HN 117.662 30.374 7.747
E145N-E144CA-E145HN 116.814 58.790 6.987
E145N-E144CB-E145HN 116.814 30.504 6.981
E145N-CA-HN 116.814 53.695 6.982
E145N-CB-HN 116.833 30.334 6.982
E148N-P147CA-E148HN 121.413 61.977 8.866
E148N-P147CB-E148HN 121.358 32.134 8.867
E148N-CA-HN 121.413 59.214 8.863
E148N-CB-HN 121.413 30.103 8.863
V150N-H149CA-V150HN 120.343 56.838 7.184
V150N-H149CB-V150HN 120.343 31.020 7.183
V150N-CA-HN 120.396 60.408 7.182
V150N-CB-HN 120.402 34.505 7.183
K151N-V150CA-K151HN 122.241 60.398 8.527
K151N-V150CB-K151HN 122.189 34.456 8.514
K151N-CA-HN 122.208 52.767 8.526
K151N-CB-HN 122.241 35.886 8.523
F152N-K151CA-F152HN 119.264 52.741 8.775
F152N-K151CB-F152HN 119.264 35.934 8.775
F152N-CA-HN 119.264 58.068 8.773
F152N-CB-HN 119.264 41.525 8.767
L153N-F152CA-L153HN 124.358 58.018 9.756
L153N-F152CB-L153HN 124.358 41.569 9.754
L153N-CA-HN 124.358 53.579 9.756
L153N-CB-HN 124.358 42.407 9.751
L154N-L153CA-L154HN 123.473 53.499 9.510
L154N-L153CB-L154HN 123.473 42.428 9.505
L154N-CA-HN 123.473 53.209 9.510
L154N-CB-HN 123.473 44.724 9.510
A155N-L154CA-A155HN 124.320 53.133 8.988
A155N-L154CB-A155HN 124.320 44.659 8.987
A155N-CA-HN 124.320 50.305 8.994
A155N-CB-HN 124.320 22.694 8.994
T156N-A155CA-T156HN 114.512 50.294 8.611
T156N-A155CB-T156HN 114.554 22.643 8.611
T156N-CA-HN 114.512 61.064 8.608
T156N-CB-HN 114.512 68.755 8.611
T157N-T156CA-T157HN 118.749 61.196 8.945
T157N-T156CB-T157HN 118.749 68.777 8.948
T157N-CA-HN 118.749 61.531 8.944
T157N-CB-HN 118.749 71.083 8.944
D158N-T157CA-D158HN 122.753 61.727 8.802
D158N-T157CB-D158HN 122.720 71.214 8.786
D158N-CA-HN 122.739 51.575 8.798
D158N-CB-HN 122.753 40.992 8.799
Q160N-P159CA-Q160HN 115.999 64.769 8.260
Q160N-P159CB-Q160HN 115.976 31.433 8.258
Q160N-CA-HN 116.013 57.756 8.262
Q160N-CB-HN 116.013 27.797 8.255
K161N-Q160CA-K161HN 117.252 57.778 7.507
K161N-Q160CB-K161HN 117.252 27.815 7.503
K161N-CA-HN 117.252 56.195 7.506
K161N-CB-HN 117.291 33.141 7.505
L162N-K161CA-L162HN 120.173 56.195 7.484
L162N-K161CB-L162HN 120.158 33.272 7.488
L162N-CA-HN 120.161 52.420 7.486
L162N-CB-HN 120.157 41.918 7.485
I166N-T165CA-I166HN 117.634 63.576 6.940
I166N-T165CB-I166HN 117.634 67.671 6.933
I166N-CA-HN 117.634 62.469 6.933
I166N-CB-HN 117.634 37.993 6.933
L167N-I166CA-L167HN 120.357 62.552 7.556
L167N-CA-HN 120.357 58.850 7.553
L167N-CB-HN 120.368 42.221 7.554
S168N-L167CA-S168HN 109.398 58.801 8.134
S168N-L167CB-S168HN 109.398 42.374 8.134
S168N-CA-HN 109.398 60.574 8.134
S168N-CB-HN 109.398 63.424 8.134
R169N-S168CA-R169HN 119.049 60.540 7.332
R169N-S168CB-R169HN 119.049 63.457 7.342
R169N-CA-HN 119.049 55.481 7.332
R169N-CB-HN 119.081 31.661 7.332
C170N-R169CA-C170HN 113.954 55.433 7.191
C170N-R169CB-C170HN 113.954 31.481 7.194
C170N-CA-HN 113.954 57.588 7.191
C170N-CB-HN 113.954 30.767 7.196
L171N-C170CA-L171HN 124.158 57.636 7.810
L171N-C170CB-L171HN 124.158 30.826 7.803
L171N-CA-HN 124.170 54.491 7.809
L171N-CB-HN 124.158 41.743 7.810
Q172N-L171CA-Q172HN 124.509 54.505 8.164
Q172N-L171CB-Q172HN 124.509 41.767 8.164
Q172N-CA-HN 124.509 55.219 8.169
Q172N-CB-HN 124.565 30.878 8.168
F173N-Q172CA-F173HN 122.285 55.183 8.940
F173N-Q172CB-F173HN 122.285 30.922 8.943
F173N-CA-HN 122.285 57.338 8.947
F173N-CB-HN 122.285 42.695 8.943
H174N-F173CA-H174HN 124.425 57.265 9.021
H174N-F173CB-H174HN 124.425 42.729 9.018
H174N-CA-HN 124.425 55.152 9.012
H174N-CB-HN 124.480 31.446 9.020
L175N-H174CA-L175HN 129.732 55.243 8.987
L175N-H174CB-L175HN 129.774 31.461 8.972
L175N-CA-HN 129.732 56.440 8.987
L175N-CB-HN 129.732 42.961 8.987
K176N-L175CA-K176HN 120.737 56.375 9.087
K176N-L175CB-K176HN 120.737 42.958 9.083
K176N-CA-HN 120.737 55.298 9.091
K176N-CB-HN 120.737 35.760 9.087
A177N-K176CA-A177HN 123.406 55.279 8.435
A177N-K176CB-A177HN 123.372 35.757 8.434
A177N-CA-HN 123.408 52.468 8.437
A177N-CB-HN 123.406 19.208 8.435
L178N-A177CA-L178HN 122.568 52.533 8.441
L178N-A177CB-L178HN 122.595 19.141 8.437
L178N-CA-HN 122.553 54.243 8.443
L178N-CB-HN 122.553 43.076 8.441
D179N-L178CA-D179HN 120.151 54.302 8.666
D179N-CA-HN 120.151 53.398 8.666
D179N-CB-HN 120.151 42.803 8.661
V180N-D179CA-V180HN 120.352 53.386 8.209
V180N-D179CB-V180HN 120.352 42.755 8.213
V180N-CA-HN 120.352 66.564 8.210
V180N-CB-HN 120.352 32.041 8.209
E181N-V180CA-E181HN 119.461 66.453 8.349
E181N-V180CB-E181HN 119.460 31.969 8.356
E181N-CA-HN 119.460 58.528 8.355
E181N-CB-HN 119.460 28.946 8.350
Q182N-E181CA-Q182HN 118.568 58.588 7.798
Q182N-E181CB-Q182HN 118.597 28.735 7.810
Q182N-CA-HN 118.568 59.084 7.803
Q182N-CB-HN 118.561 30.046 7.802
I183N-CA-HN 118.087 65.826 7.733
I183N-CB-HN 118.087 37.850 7.736
R184N-I183CA-R184HN 120.731 65.736 8.739
R184N-CA-HN 120.731 60.814 8.734
R184N-CB-HN 120.731 29.719 8.737
H185N-R184CA-H185HN 115.859 60.879 8.469
H185N-CA-HN 115.859 59.867 8.467
H185N-CB-HN 115.859 30.016 8.467
Q186N-H185CB-Q186HN 118.886 30.279 7.629
Q186N-CA-HN 118.886 58.028 7.630
Q186N-CB-HN 118.886 27.553 7.630
L187N-Q186CB-L187HN 117.934 27.496 8.426
L187N-CA-HN 117.934 58.028 8.427
L187N-CB-HN 117.934 42.363 8.427
E188N-L187CA-E188HN 118.716 57.874 8.080
E188N-CA-HN 118.743 60.069 8.073
E188N-CB-HN 118.716 29.862 8.077
H189N-CA-HN 117.139 59.909 7.625
H189N-CB-HN 117.139 29.946 7.623
I190N-H189CA-I190HN 119.027 59.874 8.045
I190N-H189CB-I190HN 119.027 30.017 8.056
I190N-CA-HN 119.021 65.396 8.038
I190N-CB-HN 119.043 38.217 8.037
L191N-I190CA-L191HN 117.225 65.415 8.327
L191N-I190CB-L191HN 117.225 38.262 8.318
L191N-CA-HN 117.225 58.279 8.323
L191N-CB-HN 117.225 39.763 8.318
N192N-L191CA-N192HN 117.452 58.314 8.200
N192N-L191CB-N192HN 117.452 39.660 8.210
N192N-CA-HN 117.452 55.898 8.206
N192N-CB-HN 117.430 37.994 8.205
E193N-N192CA-E193HN 122.672 55.874 8.144
E193N-N192CB-E193HN 122.672 37.529 8.149
E193N-CA-HN 122.695 59.149 8.153
E193N-CB-HN 122.672 29.612 8.154
E194N-E193CA-E194HN 115.073 59.017 7.896
E194N-CA-HN 115.073 55.719 7.894
E194N-CB-HN 115.073 30.350 7.896
H195N-E194CA-H195HN 115.109 55.624 7.686
H195N-CA-HN 115.109 56.695 7.686
H195N-CB-HN 115.109 26.255 7.686
I196N-H195CA-I196HN 120.895 56.612 8.324
I196N-H195CB-I196HN 120.895 26.219 8.330
I196N-CA-HN 120.895 60.112 8.327
I196N-CB-HN 120.895 39.374 8.324
A197N-CA-HN 133.574 52.850 8.924
A197N-CB-HN 133.574 19.126 8.928
H198N-A197CA-H198HN 115.017 52.874 7.939
H198N-A197CB-H198HN 115.017 19.398 7.928
H198N-CA-HN 115.017 54.326 7.936
H198N-CB-HN 115.079 33.012 7.937
E199N-H198CA-E199HN 118.214 54.362 7.317
E199N-H198CB-E199HN 118.214 32.874 7.311
E199N-CA-HN 118.214 52.636 7.320
E199N-CB-HN 118.214 31.933 7.322
A202N-R201CA-A202HN 120.330 58.902 7.059
A202N-R201CB-A202HN 120.279 29.636 7.061
A202N-CA-HN 120.279 55.314 7.056
A202N-CB-HN 120.279 18.791 7.054
L203N-A202CA-L203HN 113.106 55.253 7.298
L203N-A202CB-L203HN 113.106 18.901 7.291
L203N-CA-HN 113.106 57.578 7.300
L203N-CB-HN 113.106 41.285 7.303
Q204N-L203CA-Q204HN 117.889 57.552 7.479
Q204N-CA-HN 117.889 59.421 7.478
Q204N-CB-HN 117.889 28.386 7.475
L205N-Q204CA-L205HN 118.129 59.386 7.770
L205N-CA-HN 118.129 57.981 7.770
L205N-CB-HN 118.129 42.423 7.754
L206N-L205CA-L206HN 119.664 57.933 7.889
L206N-CA-HN 119.664 58.207 7.896
L206N-CB-HN 119.664 42.957 7.886
A207N-L206CA-A207HN 118.152 58.170 8.108
A207N-L206CB-A207HN 118.152 42.983 8.118
A207N-CA-HN 118.163 55.217 8.113
A207N-CB-HN 118.150 19.100 8.112
R208N-A207CA-R208HN 116.654 55.176 7.848
R208N-A207CB-R208HN 116.673 19.089 7.850
R208N-CA-HN 116.665 59.037 7.854
R208N-CB-HN 116.665 30.422 7.848
A209N-R208CA-A209HN 122.012 58.909 7.870
A209N-R208CB-A209HN 122.012 30.433 7.858
A209N-CA-HN 122.012 53.898 7.864
A209N-CB-HN 122.012 19.196 7.862
A210N-A209CA-A210HN 117.825 54.076 7.420
A210N-A209CB-A210HN 117.825 19.372 7.412
A210N-CA-HN 117.825 53.493 7.418
A210N-CB-HN 117.825 19.136 7.415
E211N-A210CA-E211HN 115.915 53.457 7.656
E211N-A210CB-E211HN 115.915 19.017 7.647
E211N-CA-HN 115.915 57.088 7.656
E211N-CB-HN 115.915 28.207 7.650
G212N-E211CA-G212HN 104.012 57.088 8.953
G212N-CA-HN 104.012 46.112 8.955
S213N-G212CA-S213HN 112.886 46.124 7.306
S213N-CA-HN 112.886 54.981 7.303
S213N-CB-HN 112.886 63.731 7.298
L214N-S213CA-L214HN 131.949 54.993 8.943
L214N-S213CB-L214HN 131.949 63.827 8.955
L214N-CA-HN 131.949 57.887 8.958
L214N-CB-HN 131.953 41.808 8.948
R215N-L214CA-R215HN 118.067 57.778 8.345
R215N-L214CB-R215HN 118.067 41.688 8.333
R215N-CA-HN 118.067 60.085 8.330
R215N-CB-HN 118.067 29.613 8.341
D216N-R215CA-D216HN 121.564 60.155 8.367
D216N-CA-HN 121.564 57.290 8.361
D216N-CB-HN 121.564 39.410 8.363
A217N-D216CA-A217HN 122.136 57.374 8.152
A217N-D216CB-A217HN 122.136 39.434 8.160
A217N-CA-HN 122.136 55.624 8.157
A217N-CB-HN 122.136 18.874 8.163
L218N-A217CA-L218HN 120.055 55.469 8.514
L218N-A217CB-L218HN 120.055 18.898 8.518
L218N-CA-HN 120.055 58.338 8.520
L218N-CB-HN 120.055 41.314 8.513
S219N-L218CA-S219HN 115.407 58.608 8.026
S219N-L218CA-S219HN 115.618 58.351 8.040
S219N-L218CB-S219HN 115.618 41.289 8.040
S219N-CA-HN 115.618 62.005 8.045
S219N-CB-HN 115.618 62.850 8.045
L220N-CA-HN 122.257 57.996 8.711
L220N-CB-HN 122.257 43.146 8.712
T221N-L220CA-T221HN 118.247 57.909 8.019
T221N-L220CB-T221HN 118.247 43.053 8.022
T221N-CA-HN 118.247 68.592 8.012
T221N-CB-HN 118.247 67.036 8.012
D222N-CA-HN 122.203 58.243 8.396
D222N-CB-HN 122.203 40.981 8.368
Q223N-D222CA-Q223HN 120.164 58.306 7.856
Q223N-D222CB-Q223HN 120.202 40.981 7.855
Q223N-CA-HN 120.202 59.017 7.849
Q223N-CB-HN 120.202 28.505 7.852
A224N-Q223CA-A224HN 125.070 59.026 8.513
A224N-Q223CB-A224HN 125.118 28.481 8.508
A224N-CA-HN 125.118 55.469 8.511
A224N-CB-HN 125.118 18.850 8.504
I225N-A224CA-I225HN 119.913 55.469 8.507
I225N-A224CB-I225HN 119.913 18.881 8.515
I225N-CA-HN 119.913 65.755 8.513
I225N-CB-HN 119.934 38.408 8.506
A226N-I225CA-A226HN 120.117 65.671 7.600
A226N-CA-HN 120.117 54.648 7.603
A226N-CB-HN 120.117 18.672 7.606
S227N-A226CA-S227HN 112.767 54.569 8.081
S227N-A226CB-S227HN 112.767 18.560 8.081
S227N-CA-HN 112.767 60.346 8.081
S227N-CB-HN 112.767 63.859 8.084
G228N-S227CA-G228HN 110.108 60.269 7.912
G228N-S227CB-G228HN 110.108 63.783 7.911
G228N-CA-HN 110.108 45.235 7.921
D229N-G228CA-D229HN 120.196 45.267 8.151
D229N-CA-HN 120.196 54.850 8.148
D229N-CB-HN 120.196 40.124 8.146
G230N-D229CA-G230HN 105.280 54.850 8.702
G230N-D229CB-G230HN 105.280 40.076 8.712
G230N-CA-HN 105.280 45.683 8.712
Q231N-G230CA-Q231HN 116.425 45.600 7.501
Q231N-CA-HN 116.425 53.862 7.501
Q231N-CB-HN 116.425 31.386 7.504
V232N-Q231CA-V232HN 122.473 53.905 8.546
V232N-Q231CB-V232HN 122.471 31.513 8.545
V232N-CA-HN 122.471 61.969 8.550
V232N-CB-HN 122.471 30.493 8.550
S233N-CA-HN 118.886 55.540 7.630
S233N-CB-HN 118.830 65.897 7.635
T234N-S233CA-T234HN 121.560 55.461 9.542
T234N-S233CB-T234HN 121.560 65.937 9.541
A236N-Q235CA-A236HN 121.963 59.469 7.815
A236N-Q235CB-A236HN 121.963 28.236 7.811
A236N-CA-HN 121.963 54.993 7.810
A236N-CB-HN 121.963 18.565 7.810
V237N-A236CA-V237HN 117.442 55.001 8.178
V237N-A236CB-V237HN 117.445 18.640 8.176
V237N-CA-HN 117.445 66.916 8.175
V237N-CB-HN 117.445 31.929 8.176
S238N-V237CA-S238HN 115.108 66.916 8.726
S238N-V237CB-S238HN 115.096 31.926 8.719
S238N-CA-HN 115.108 62.032 8.718
A239N-S238CA-A239HN 122.119 61.945 7.644
A239N-CA-HN 122.115 54.463 7.633
A239N-CB-HN 122.119 18.374 7.630
M240N-A239CA-M240HN 117.005 54.433 7.580
M240N-A239CB-M240HN 116.941 18.393 7.577
M240N-CA-HN 117.005 57.826 7.577
M240N-CB-HN 116.956 33.856 7.575
L241N-M240CA-L241HN 118.207 57.886 7.786
L241N-M240CB-L241HN 118.207 33.898 7.797
L241N-CA-HN 118.207 55.540 7.794
L241N-CB-HN 118.207 42.386 7.797
G242N-L241CA-G242HN 113.427 55.517 7.590
G242N-L241CB-G242HN 113.427 42.350 7.590
G242N-CA-HN 113.481 46.598 7.590
;
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 . . H 1 1H . . . . . . . . . . 50595 3
2 . . N 15 15N . . . . . . . . . . 50595 3
stop_
save_