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 52542
_Spectral_peak_list.ID 3
_Spectral_peak_list.Name HNCA
_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 3
_Spectral_peak_list.Experiment_name '3D HNCA'
_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 Data Height
?-?-? 111.453 63.109 6.674 17856
?-?-? 111.923 42.584 7.568 18240
?-?-? 112.543 42.784 7.441 17947
?-?-? 117.083 56.905 8.141 8687
?-?-? 117.703 51.755 7.743 11550
?-?-? 111.756 42.424 7.638 13776
?-?-? 111.417 63.471 7.588 13821
?-?-? 118.599 57.440 8.439 13684
?-?-? 112.435 42.651 7.405 30400
?-?-? 119.470 63.859 7.383 7486
?-?-? 112.384 42.780 7.467 15523
?-?-? 118.387 59.784 6.786 13229
?-?-? 127.087 49.842 8.612 13620
?-?-? 130.998 45.838 7.785 6482
?-?-? 112.504 42.771 7.394 22967
?-?-? 119.855 56.447 8.596 7015
?-?-? 121.433 48.504 7.937 25737
?-?-? 114.086 60.831 7.308 15296
?-?-? 111.382 63.234 7.400 15871
?-?-? 112.387 62.821 7.481 23152
?-?-? 111.863 63.195 7.293 6096
?-?-? 119.849 58.225 8.607 9635
?-?-? 114.460 63.765 7.690 10117
?-?-? 123.926 60.719 7.384 12017
?-?-? 110.008 54.645 7.583 12311
?-?-? 130.495 58.329 7.593 11807
?-?-? 111.383 63.228 6.853 13535
?-?-? 111.284 42.205 6.750 17097
?-?-? 111.275 42.208 6.721 17923
?-?-? 119.542 59.363 7.697 17033
?-?-? 111.267 42.225 6.692 16181
?-?-? 111.254 42.227 6.647 18346
?-?-? 130.962 55.574 8.499 10036
?-?-? 110.893 62.960 7.182 14440
?-?-? 110.867 42.130 7.684 16947
?-?-? 110.846 42.193 7.620 13176
?-?-? 117.059 57.682 7.771 15384
?-?-? 110.832 42.103 7.596 15033
?-?-? 110.867 42.166 7.570 13865
?-?-? 110.799 41.001 7.081 17617
?-?-? 110.784 41.001 6.978 21320
?-?-? 112.399 62.846 6.861 19627
?-?-? 110.728 41.001 7.071 19454
?-?-? 110.789 41.001 7.030 15427
?-?-? 110.851 41.197 6.992 18404
?-?-? 124.511 44.129 8.106 14171
?-?-? 116.038 61.088 7.725 20196
G3N-P2CA-G3H 109.581 62.752 8.622 15842
G3N-CA-H 109.547 44.463 8.626 30843
S4N-G3CA-S4H 116.427 44.502 8.362 16628
S4N-CA-H 116.432 58.357 8.366 34585
D5N-S4CA-D5H 121.769 58.369 8.538 25641
D5N-CA-H 121.751 55.089 8.536 71596
F6N-CA-H 121.013 59.654 8.364 26561
D7N-F6CA-D7H 118.519 59.649 8.167 13139
D7N-CA-H 118.525 57.166 8.171 38557
V8N-D7CA-V8H 120.010 57.149 7.746 14641
V8N-CA-H 120.046 65.592 7.751 31338
K9N-CA-H 120.989 59.321 7.939 26760
R10N-CA-H 118.773 59.817 8.831 30746
K11N-CA-H 119.212 59.054 7.751 27306
Y12N-CA-H 121.407 60.439 7.760 19316
F13N-CA-H 120.211 60.049 8.967 18657
R14N-CA-H 115.836 57.590 8.349 24617
Q15N-CA-H 119.600 58.096 7.953 25902
E16N-CA-H 120.261 57.470 8.308 29721
E18N-L17CA-E18H 117.618 57.137 7.791 14307
E18N-CA-H 117.691 58.343 7.786 35384
R19N-CA-H 120.566 58.492 7.764 34496
L20N-R19CA-L20H 118.382 58.381 7.637 13354
L20N-CA-H 118.349 56.040 7.634 40566
D21N-CA-H 117.228 53.302 7.297 42910
E22N-CA-H 121.988 58.188 7.269 46400
G23N-E22CA-G23H 111.336 58.118 8.754 16731
G23N-CA-H 111.375 44.280 8.758 42463
L24N-G23CA-L24H 121.532 44.265 7.697 18348
L24N-CA-H 121.550 54.077 7.696 95936
R25N-CA-H 126.908 54.177 8.709 174955
K26N-R25CA-K26H 124.324 54.309 8.222 65072
K26N-CA-H 124.337 56.279 8.222 168352
E27N-K26CA-E27H 120.689 56.245 8.021 17971
E27N-CA-H 120.692 53.318 8.020 49317
D28N-CA-H 119.928 53.814 8.254 59487
M29N-CA-H 126.515 53.877 9.023 68165
A30N-M29CA-A30H 129.879 53.889 8.399 24138
A30N-CA-H 129.900 51.116 8.399 54756
H32N-V31CA-H32H 126.989 60.558 8.926 17873
H32N-CA-H 127.000 55.063 8.929 34461
V33N-H32CA-V33H 113.343 55.064 8.325 10779
V33N-CA-H 113.464 57.157 8.338 22279
R35N-R34CA-R35H 124.112 53.867 9.278 17545
R35N-CA-H 124.145 59.253 9.279 21349
D36N-CA-H 112.807 53.374 8.632 16858
H37N-CA-H 118.966 54.150 7.934 17259
V38N-CA-H 120.470 67.703 8.144 24716
F39N-CA-H 124.367 62.422 9.540 22387
E40N-F39CA-E40H 118.147 62.386 9.127 15640
E40N-CA-H 118.139 58.809 9.126 31593
D41N-CA-H 119.938 56.724 8.936 36716
R44N-CA-H 122.195 59.542 8.115 28389
E45N-CA-H 115.245 57.484 8.082 29131
L46N-CA-H 112.854 54.660 8.038 26402
H47N-CA-H 119.863 59.732 8.622 17735
R48N-CA-H 115.590 54.228 7.855 24174
K49N-CA-H 118.443 54.131 6.866 45712
S50N-K49CA-S50H 120.855 54.162 9.629 12392
S50N-CA-H 120.799 56.042 9.634 25867
E52N-P51CA-E52H 113.556 64.976 8.019 14100
E52N-CA-H 113.594 60.008 8.014 43858
E53N-CA-H 120.644 57.688 7.791 31425
M54N-CA-H 113.064 52.811 7.373 12816
K55N-CA-H 117.335 56.332 7.083 26194
N56N-CA-H 115.536 52.556 7.178 32349
R57N-N56CA-R57H 118.629 52.559 7.913 22210
R57N-CA-H 118.642 55.034 7.918 28456
L58N-R57CA-L58H 124.511 55.029 8.721 17944
L58N-CA-H 124.533 53.891 8.721 47250
I60N-Y59CA-I60H 124.550 55.332 7.961 27460
I60N-CA-H 124.549 57.809 7.960 48711
V61N-I60CA-V61H 127.148 57.712 8.287 14713
V61N-CA-H 127.130 60.235 8.283 23569
F62N-V61CA-F62H 127.261 60.181 8.598 23762
F62N-CA-H 127.272 55.593 8.594 36750
E63N-F62CA-E63H 125.386 55.686 8.790 16114
E63N-CA-H 125.404 57.249 8.792 34478
G64N-E63CA-G64H 113.933 57.270 8.981 23085
G64N-CA-H 113.924 44.928 8.985 33085
E65N-G64CA-E65H 119.385 44.907 7.847 17033
E65N-CA-H 119.397 54.321 7.848 98699
E66N-E65CA-E66H 122.176 54.302 8.681 79139
E66N-CA-H 122.185 55.695 8.681 168358
G67N-E66CA-G67H 110.147 55.685 8.601 97828
G67N-CA-H 110.159 45.210 8.600 257600
Q68N-G67CA-Q68H 119.482 45.214 8.056 76102
Q68N-CA-H 119.479 54.599 8.056 189967
D69N-Q68CA-D69H 120.431 54.623 8.252 56375
D69N-CA-H 120.425 53.357 8.250 133880
A70N-D69CA-A70H 127.747 53.375 8.671 17147
A70N-CA-H 127.765 54.407 8.669 22591
G71N-CA-H 107.792 46.177 8.641 34388
G72N-CA-H 111.564 46.225 8.249 43642
L73N-G72CA-L73H 122.605 46.182 8.073 13089
L73N-CA-H 122.662 56.889 8.065 33094
L74N-CA-H 120.267 57.301 7.871 21449
R75N-CA-H 117.342 59.293 7.804 18371
E76N-CA-H 120.444 59.263 8.236 26971
W77N-CA-H 120.751 62.703 8.974 11852
Y78N-CA-H 117.028 62.345 8.670 16420
M79N-CA-H 119.307 58.392 7.948 17262
I80N-CA-H 119.620 64.902 8.608 21748
S82N-CA-H 114.132 60.665 7.623 11011
R83N-CA-H 118.432 57.617 7.116 18208
E84N-CA-H 118.876 57.873 8.556 16599
M85N-CA-H 114.662 57.683 7.695 21700
F86N-CA-H 113.843 56.061 6.391 20319
N87N-CA-H 123.727 51.384 7.859 22159
M89N-CA-H 118.129 57.208 8.515 35446
Y90N-CA-H 116.235 57.195 7.002 38924
A91N-CA-H 113.614 52.357 7.393 19175
L92N-CA-H 115.516 55.955 7.701 28477
F93N-CA-H 112.813 55.768 7.681 39061
R94N-CA-H 120.204 53.019 9.588 32402
T95N-R94CA-T95H 114.109 53.010 8.477 30866
T95N-CA-H 114.148 60.595 8.478 63662
S96N-T95CA-S96H 119.380 60.610 8.272 14936
S96N-CA-H 119.383 54.906 8.277 43233
G98N-P97CA-G98H 108.695 62.828 7.977 70507
G98N-CA-H 108.702 44.172 7.976 181819
D99N-G98CA-D99H 119.663 44.139 8.286 23036
D99N-CA-H 119.685 55.224 8.287 32974
R100N-D99CA-R100H 117.303 55.298 7.635 28620
R100N-CA-H 117.349 53.716 7.635 154951
V101N-R100CA-V101H 124.729 53.688 8.318 30034
V101N-CA-H 124.746 63.147 8.318 48070
T102N-CA-H 117.556 59.003 7.334 24240
Y103N-T102CA-Y103H 118.298 58.997 8.316 14440
Y103N-CA-H 118.322 57.068 8.315 25050
T104N-Y103CA-T104H 111.711 57.188 8.860 15064
T104N-CA-H 111.742 57.948 8.857 26864
I105N-CA-H 124.521 62.467 8.145 23925
N106N-CA-H 125.344 49.270 8.643 16262
S108N-P107CA-S108H 112.233 63.694 7.289 8125
S108N-CA-H 112.197 56.717 7.293 29413
S109N-CA-H 117.554 60.720 7.756 13500
N114N-CA-H 114.292 51.950 7.728 27237
H115N-CA-H 119.222 60.131 8.498 15869
L116N-CA-H 119.416 58.269 7.598 32269
S117N-CA-H 114.978 60.461 7.694 24500
Y118N-CA-H 121.318 60.875 8.073 26486
F119N-CA-H 119.066 64.225 9.135 13283
D132N-CA-H 119.187 54.239 9.013 15868
N133N-CA-H 119.292 53.032 8.251 33440
R134N-CA-H 119.386 52.701 8.486 53978
L135N-R134CA-L135H 120.882 52.716 7.762 37311
L135N-CA-H 120.886 53.501 7.761 61268
L136N-L135CA-L136H 119.881 53.470 8.418 17976
L136N-CA-H 119.911 52.342 8.420 41540
E137N-L136CA-E137H 121.966 52.307 8.192 29016
E137N-CA-H 121.962 54.330 8.192 40978
C138N-E137CA-C138H 117.748 54.372 6.825 34041
C138N-CA-H 117.769 55.286 6.826 112252
Y139N-C138CA-Y139H 121.874 55.207 7.574 36534
Y139N-CA-H 121.874 55.702 7.574 30148
F140N-CA-H 120.497 54.676 7.608 51430
T141N-F140CA-T141H 109.844 54.750 7.564 11653
T141N-CA-H 109.892 60.444 7.570 37095
R142N-T141CA-R142H 120.903 60.441 8.553 22335
R142N-CA-H 120.904 59.282 8.552 31292
L149N-CA-H 116.637 54.383 7.393 14470
G150N-CA-H 106.819 45.205 7.799 31498
K151N-CA-H 120.301 54.105 8.158 41597
S152N-K151CA-S152H 117.291 54.108 8.398 18992
S152N-CA-H 117.271 57.892 8.397 41329
V153N-S152CA-V153H 119.941 57.877 8.496 9776
V153N-CA-H 119.845 60.963 8.501 18880
R154N-V153CA-R154H 123.069 61.060 8.976 13433
R154N-CA-H 123.032 53.422 8.971 33887
Y155N-CA-H 122.233 60.909 9.489 8271
T156N-CA-H 108.413 62.689 6.145 38369
D157N-CA-H 122.184 56.010 8.110 20612
E159N-M158CA-E159H 120.507 54.990 6.650 14397
E159N-CA-H 120.523 59.738 6.657 33663
S160N-CA-H 106.924 58.511 7.517 29831
E161N-CA-H 119.915 57.410 7.013 42436
Y163N-D162CA-Y163H 126.228 52.730 8.875 14557
Y163N-CA-H 126.267 61.927 8.876 21133
H164N-CA-H 116.645 59.070 8.593 36118
F165N-CA-H 122.543 60.137 7.898 13891
Y166N-CA-H 119.822 60.925 8.591 19892
G168N-CA-H 106.749 45.938 7.336 18367
L169N-CA-H 122.640 56.410 7.366 19851
V170N-L169CA-V170H 118.768 56.450 7.787 13112
V170N-CA-H 118.849 65.816 7.793 17235
Y171N-CA-H 118.085 61.166 7.590 21506
L172N-CA-H 118.264 56.413 7.391 19279
L173N-CA-H 115.202 56.418 7.779 25471
N175N-CA-H 117.369 51.295 7.094 45364
D176N-N175CA-D176H 117.826 51.304 8.119 41374
D176N-CA-H 117.850 52.815 8.117 55063
V177N-D176CA-V177H 127.162 52.872 9.346 18647
V177N-CA-H 127.187 64.161 9.350 33601
S178N-CA-H 118.322 60.316 9.113 34147
T179N-CA-H 111.194 61.152 7.885 38660
L180N-CA-H 121.120 56.367 7.177 51648
G181N-CA-H 103.799 44.124 8.153 53743
Y182N-CA-H 115.195 54.362 6.882 111183
D183N-Y182CA-D183H 118.791 54.353 8.468 39453
D183N-CA-H 118.802 52.872 8.468 98246
L184N-CA-H 124.448 53.082 8.962 70902
T185N-L184CA-T185H 109.779 53.144 7.949 17590
T185N-CA-H 109.771 58.559 7.950 62737
F186N-T185CA-F186H 121.780 58.612 8.124 20013
F186N-CA-H 121.807 57.131 8.127 25829
S187N-CA-H 117.195 57.166 9.059 46443
T188N-S187CA-T188H 114.462 57.100 8.744 15665
T188N-CA-H 114.448 60.653 8.745 37123
E189N-T188CA-E189H 125.674 60.654 8.170 28159
E189N-CA-H 125.705 55.788 8.172 57962
V190N-E189CA-V190H 124.081 55.812 8.920 22731
V190N-CA-H 124.095 60.210 8.916 46246
Q191N-V190CA-Q191H 126.024 60.189 8.473 30438
Q191N-CA-H 126.037 53.510 8.473 52027
E192N-Q191CA-E192H 125.699 53.496 8.236 33695
E192N-CA-H 125.711 54.369 8.237 55124
G194N-CA-H 103.594 44.656 8.492 33586
V195N-G194CA-V195H 121.590 44.670 7.603 15255
V195N-CA-H 121.580 60.837 7.604 65028
C196N-V195CA-C196H 126.860 60.851 8.761 16210
C196N-CA-H 126.870 57.978 8.757 39832
E197N-C196CA-E197H 125.626 58.010 8.759 25540
E197N-CA-H 125.622 53.967 8.759 76807
V198N-E197CA-V198H 123.238 54.009 8.562 34474
V198N-CA-H 123.125 61.988 8.555 62320
R199N-V198CA-R199H 128.234 61.990 8.957 15880
R199N-CA-H 128.222 53.728 8.957 41870
D200N-CA-H 123.543 54.247 8.571 45888
L201N-CA-H 118.605 54.301 8.868 22637
K202N-CA-H 112.994 52.937 7.835 35066
N204N-P203CA-N204H 119.597 63.866 9.087 26174
N204N-CA-H 119.606 53.545 9.088 27043
G205N-CA-H 104.801 48.408 8.251 20206
A206N-G205CA-A206H 120.717 48.294 8.127 13593
A206N-CA-H 120.808 53.314 8.139 24319
N207N-CA-H 111.342 51.712 7.949 17999
I208N-CA-H 123.505 60.424 7.859 24538
L209N-I208CA-L209H 126.318 60.319 7.956 21757
L209N-CA-H 126.289 53.936 7.956 51108
V210N-L209CA-V210H 124.171 53.934 8.297 23189
V210N-CA-H 124.165 61.830 8.300 42654
T211N-CA-H 120.580 58.594 9.664 30806
E212N-CA-H 118.528 58.376 9.007 36245
E213N-CA-H 115.011 57.874 7.941 28959
N214N-CA-H 114.509 51.653 7.368 16915
K215N-CA-H 117.715 59.268 7.728 22495
K216N-CA-H 120.748 59.900 8.465 19859
E217N-CA-H 122.771 58.156 7.634 22427
Y218N-CA-H 119.263 61.413 7.992 15578
V219N-CA-H 118.279 66.034 8.301 14940
H220N-CA-H 117.930 59.278 7.677 16982
L221N-CA-H 117.528 56.733 8.553 20947
V222N-CA-H 122.441 64.649 9.342 14280
C223N-CA-H 120.508 63.160 7.690 12889
G229N-CA-H 110.903 47.769 8.578 17488
I231N-CA-H 106.710 59.062 6.935 13589
R232N-CA-H 121.827 59.076 6.976 16917
Q234N-CA-H 123.494 59.820 9.737 13956
E244N-CA-H 116.245 57.592 7.203 38851
I245N-CA-H 115.337 60.716 7.069 13439
K248N-P247CA-K248H 126.184 62.158 8.354 21490
K248N-CA-H 126.184 59.086 8.353 27808
R249N-CA-H 115.043 57.405 8.713 26747
L250N-R249CA-L250H 117.434 57.394 7.426 15809
L250N-CA-H 117.361 55.499 7.427 44107
S252N-CA-H 110.652 59.772 7.809 35997
I253N-CA-H 114.869 62.150 6.886 23267
F254N-CA-H 121.070 58.269 7.363 26564
T255N-F254CA-T255H 109.322 58.363 8.945 12540
T255N-CA-H 109.293 60.134 8.941 22129
E256N-CA-H 119.642 60.122 10.390 30873
Q257N-CA-H 119.159 58.135 8.064 25284
E258N-CA-H 119.328 57.250 7.363 20123
E260N-CA-H 117.628 58.794 6.822 20092
L261N-CA-H 119.220 56.580 7.047 17229
S264N-CA-H 110.015 58.047 8.162 21463
G265N-CA-H 112.045 45.115 8.089 47495
L266N-G265CA-L266H 126.082 45.128 7.595 74429
L266N-CA-H 126.087 56.032 7.596 176962
;
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 3
2 . . C 13 CA . 'not observed' 30 ppm . . . . . . 52542 3
3 . . H 1 HN . 'not observed' 12 ppm . . . . . . 52542 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 . . 52542 3
3 $software_3 . . 52542 3
stop_
save_