LEU HB3 Chemical Shift Outliers

Average chemical shift: 1.523
Standard deviation: 0.376

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
29568HB32.682
1203104HB32.772
1204104HB32.822
120868HB32.661
141389HB33.71
143927HB38.391
407693HB34.832
421014HB32.911
425292HB32.682
435330HB33.591
4435101HB33.112
443520HB32.701
458986HB33.07
460246HB32.741
4821144HB33.1081
482512HB32.712
483773HB32.942
500541HB33.911
51414HB32.941
52136HB32.9201
523997HB32.762
534562HB33.7401
5540124HB35.62
562597HB33.462
5627204HB32.772
570173HB32.7302
578073HB32.771
5809101HB32.752
5809101HB32.782
580929HB32.691
580983HB33.521
580983HB33.631
580986HB33.811
580986HB33.891
60497HB33.013
608969HB33.1849
614291HB32.831
614757HB33.0721
623028HB32.761
623028HB32.921
623088HB33.251
623088HB33.311
623091HB33.851
637265HB32.81
653279HB32.892
658382HB32.721
658680HB32.7321
663497HB33.522
682931HB32.6772
6965123HB33.599
696756HB32.962
7020144HB32.6722
7021135HB32.8141
7089127HB32.6602
7121164HB32.902
718931HB32.9961
1129829HB32.9702
1129832HB32.7422
15091113HB33.1481
1529637HB32.731
1534816HB32.9172
15593132HB32.6922
1575048HB32.802
1580787HB32.9542
1601864HB32.6521
16334185HB32.8331
1644336HB33.4522
1644364HB33.5132
1644397HB33.2191
1649836HB32.682
1726050HB33.0972
17278114HB32.6972
1749733HB33.8902
17717100HB32.8052
17717113HB32.9762
1790320HB33.242
1801213HB32.7302
18180164HB32.9072
18228179HB32.8112
183294HB32.69002
1843597HB32.772
18504102HB32.7261
18504105HB32.8431
1850497HB32.71
18922116HB33.958
1936811HB33.3332
1949874HB32.6882
1970325HB32.652
19736119HB32.6662
19775213HB32.8591
19952179HB32.7551
25132128HB32.7371
2514045HB34.48501
2527631HB33.22602
2568136HB33.750
2572243HB32.71002
2583220HB32.7321
2583257HB32.7521
25859125HB32.8002
26048115HB33.1102
27434306HB32.91
2745951HB32.6732
3013313HB32.7369
3013335HB32.8779
3013347HB32.6669
3042116HB33.442
30821134HB32.9132
3405861HB32.6562
34347118HB33.369
3434757HB32.759
3446356HB32.7131
3461863HB32.7332
3600199HB32.894
360172HB32.751
361263HB32.930
36299138HB32.6972
5112824HB31579.01
5149586HB32.8082
5167443HB32.8981
5167463HB33.6071

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
4029HB3.191
34673HB3.061
92373HB3.062
103717HB3-1.211
109317HB3.331
12032HB3.121
120329HB3.341
120429HB3.391
120529HB3.111
120723HB3.11
14967HB3.392
215124HB3-.011
222484HB3.371
2868136HB3.182
344117HB3.272
3442136HB3.092
402720HB30.142
4030108HB30.32
4081130HB30.331
410023HB30.112
410964HB30.2241
410964HB30.2811
410964HB3-1.1612
411242HB30.291
412118HB3-0.701
4127108HB3-0.311
414358HB30.0712
4173163HB30.322
419120HB30.182
420660HB30.33002
421717HB30.231
424866HB30.291
4262131HB30.211
4267138HB3-0.031
429197HB30.0281
4313131HB30.171
433357HB3-0.0352
433432HB3-0.181
4340119HB3-0.711
434294HB30.392
435118HB3-0.3152
436827HB3-1.232
4436101HB30.061
444529HB3-0.2871
444529HB3-0.2901
4448109HB3-0.981
445562HB30.242
447266HB30.192
451689HB30.222
457229HB3-0.862
460225HB30.092
463675HB30.35
463720HB3-0.214
4648159HB3-0.40
4673108HB30.232
467597HB3-0.1311
4681116HB3-0.77
4681116HB3-0.83
4682116HB3-0.70
4683136HB3-0.1911
470132HB30.102
475739HB3-0.061
477766HB30.381
478275HB30.042
482955HB30.1092
484831HB30.28
485431HB30.33
488034HB3-0.192
488470HB3-0.101
494317HB30.252
494317HB30.282
496463HB3-0.511
496981HB3-0.8702
497116HB3-0.3202
49763HB30.31
498423HB30.1861
5011141HB3-1.792
50333HB30.301
504472HB30.2111
5054109HB3-0.972
506125HB30.052
506573HB30.382
506818HB30.262
507246HB3-0.1972
5100100HB30.322
5100100HB30.342
510618HB30.392
513196HB30.1892
514894HB30.332
516924HB3-0.8261
518130HB30.3512
518157HB3-0.8902
521198HB3-0.426
524615HB30.272
524615HB30.282
528069HB30.311
530453HB30.282
530965HB30.202
531095HB3-0.142
534917HB3-1.032
535282HB3-0.422
536439HB3-0.422
5396131HB30.2281
5455117HB3-0.462
5461105HB3-1.0062
550559HB30.062
55405HB3-0.82
556843HB30.342
5571124HB3-1.282
55715HB3-0.852
5578115HB3-0.11
557993HB3-0.08
559174HB3-1.0782
560133HB30.222
560655HB3-0.871
562877HB3-0.402
569262HB30.142
569676HB30.342
57429HB3-0.188
574529HB30.162
5751141HB30.0991
5751144HB30.1781
576293HB30.1642
577432HB3-0.032
578424HB3-0.8232
580318HB30.272
580418HB30.292
5929120HB3-0.142
594371HB30.3211
596945HB3-0.022
598122HB3-0.2382
598175HB3-0.4292
5991118HB30.2972
6001139HB30.132
6004128HB30.082
600475HB3-0.882
601584HB3-0.8392
606096HB30.2032
6080114HB3-0.0931
609196HB30.2392
609296HB30.1902
612522HB3-0.112
613123HB30.1381
618930HB3-0.4351
619045HB30.326
619741HB3-0.3682
620163HB3-1.1292
620163HB3-1.1332
620415HB30.312
623168HB30.362
6240125HB3-0.04871
624133HB30.3821
628431HB30.341
631098HB30.101
6313125HB3-0.042
631469HB3-0.4701
633032HB3-0.212
6336140HB30.382
633632HB3-0.292
636359HB30.162
636737HB3-1.021
639149HB30.301
641518HB30.352
6454106HB30.3102
646424HB3-0.472
646478HB3-0.252
6475117HB30.2682
647593HB3-0.0242
647652HB3-0.0022
650718HB30.345
650818HB30.351
657593HB30.0222
659740HB3-0.3452
662159HB3-0.932
6626109HB30.322
664098HB3-0.772
6644140HB30.112
6644159HB30.282
6685166HB30.3312
6688125HB30.381
668871HB3-0.571
669367HB3-0.4282
670943HB3-0.1681
673268HB30.006
675186HB30.1422
676066HB3-0.922
676645HB3-0.4751
677615HB3-0.1532
679421HB30.3542
681052HB3-1.222
682418HB30.3091
685013HB3-0.0382
686691HB30.3622
6868114HB3-0.9391
686877HB30.1311
6873337HB3-0.2932
688445HB3-0.1102
688534HB30.262
690617HB3-1.029
692129HB30.2032
692838HB30.1722
692975HB3-0.0741
693426HB3-0.4302
696018HB30.327
696653HB3-0.332
696686HB30.202
696753HB30.092
697389HB3-0.67
697396HB30.11
697399HB30.03
698256HB30.0882
698888HB30.3212
700747HB3-0.1122
7059116HB30.3042
7063109HB30.2822
706312HB30.0572
707953HB30.3352
710234HB30.3802
711364HB30.1862
7125141HB3-0.3602
712528HB30.3422
716017HB30.26
7180157HB30.132
720320HB3-0.620
7206125HB30.3691
7242212HB30.3892
7271139HB3-0.0012
72807HB3-1.212
7310122HB30.2442
731039HB3-0.2912
731098HB30.2652
736464HB3-1.0772
741478HB3-0.0012
1000417HB30.3231
1000944HB3-1.2022
1002992HB30.2742
10032108HB30.3262
1003246HB30.3852
10046102HB3-0.1452
1004978HB3-0.3452
100588HB30.3862
1006019HB30.3612
1006619HB30.3572
1006846HB3-0.0022
1007396HB30.3402
1008495HB3-0.3112
10089132HB3-0.1082
10104106HB30.0742
1010569HB30.2322
1011414HB30.3742
1016515HB30.3782
1024023HB30.3912
1024152HB30.3422
10249100HB3-0.2192
1025486HB3-0.5572
1025617HB3-0.8962
1025681HB30.2332
1025990HB30.3562
10264119HB30.2182
1026657HB30.2682
1026931HB3-1.6582
1027164HB30.3332
1027729HB3-1.4132
10279102HB30.0622
1028084HB3-0.1012
1028122HB3-1.2252
1028821HB30.1532
1031684HB30.0082
1100145HB30.002
1101811HB30.382
1103240HB30.0832
1103342HB30.0452
1105552HB3-0.3402
1108448HB3-0.3352
1108658HB3-0.2952
1108893HB30.1172
11090114HB30.1302
1112448HB30.0562
1112945HB30.2712
1113021HB30.2172
1114150HB30.1552
1117524HB3-0.1081
1119980HB3-0.1242
11203111HB3-0.1822
1120923HB30.3132
1121413HB30.3652
1122174HB3-1.0232
1122364HB3-1.2082
1122930HB3-0.1732
1122967HB3-0.1012
1123065HB3-1.1172
1123126HB30.0742
1123272HB3-0.8422
1123596HB3-0.1512
1123666HB3-1.4522
1124695HB30.2272
1124732HB3-1.2552
1125836HB3-0.4792
1125946HB30.2882
1127655HB30.3532
1128239HB30.0552
1129016HB3-0.4742
1129287HB30.0972
1129368HB3-0.1882
1129613HB3-0.5622
1130146HB30.1422
1130313HB3-0.5852
1133351HB3-0.1662
1133894HB30.1682
1135190HB30.3772
1139750HB30.0042
1140236HB3-1.4112
1142223HB3-0.2402
1147251HB3-1.2862
1149751HB3-1.5072
1149752HB30.2432
1149951HB3-1.1532
1150148HB3-1.0772
1150443HB30.2732
115078HB3-0.3331
1150893HB30.1042
1154061HB30.0222
1154917HB30.2801
11573105HB3-0.9721
1159258HB30.3012
1160441HB3-1.7772
1160442HB30.1562
1160541HB3-1.7632
1160542HB30.1812
1160642HB3-0.0762
15020138HB30.3572
1502014HB30.1892
1505542HB30.082
1506322HB30.2892
1506329HB3-0.0752
1509060HB3-0.2291
1509726HB30.130002
1511142HB30.208
1519037HB30.0592
1520470HB3-1.2001
1521198HB30.372
1527076HB3-0.7292
1527676HB3-1.512
1532457HB30.1452
1532463HB30.1772
1532549HB3-0.9800
153345HB3-0.5942
1537325HB3-0.272
1537433HB30.2312
1537739HB30.247
1538645HB3-0.6592
1545415HB30.151
1548024HB3-0.8302
1551267HB3-0.7192
155375HB3-0.8162
1554078HB3-1.5222
1555320HB30.311
1555450HB3-0.0142
1555781HB30.352
1556076HB3-0.262
15581120HB3-1.1702
1560368HB30.3872
1566138HB30.1252
1567965HB30.2651
1568734HB30.0882
1569524HB3-1.492
1570052HB3-0.1102
1572749HB30.3432
1574053HB3-0.1681
1574619HB30.0912
1577815HB30.0412
1579363HB30.0302
1583548HB30.1132
1589330HB3-0.4672
1589355HB3-0.3282
15912104HB3-1.202
1592687HB3-0.5981
1594174HB30.3732
16007108HB3-0.0242
160075HB30.2502
1603880HB30.1522
1605216HB3-0.6482
16058187HB3-0.0612
1610382HB3-1.0622
161175HB3-0.8422
16144120HB30.262
1615577HB30.392
1617389HB3-0.2442
1617621HB30.117251
1621916HB3-0.3692
1623142HB30.2581
162319HB3-1.1821
1623356HB3-0.0602
16248136HB30.0482
1624894HB30.1992
1625222HB3-1.2882
1626767HB3-0.4661
1627673HB3-0.0502
16278115HB3-0.0962
1632986HB30.3772
16336119HB3-0.282
1634315HB30.372
16364108HB30.12
1637075HB30.0862
1638053HB30.1642
1638458HB3-0.182
1638565HB3-0.1112
1646379HB30.3542
1652178HB3-0.262
1656076HB30.1662
1657129HB3-0.162
1660635HB30.1562
1660796HB30.3402
1660815HB30.11802
16614102HB30.292
1662950HB30.0592
1663239HB30.0452
1663239HB30.0652
1663515HB30.3312
1663561HB3-0.1012
1663577HB3-0.7392
1667497HB3-0.2742
1667971HB3-0.4572
1668037HB3-0.7482
1672134HB30.2532
1676769HB30.3292
1678254HB3-0.852
16809102HB3-1.202
16810146HB3-0.0362
16832146HB30.21
168825HB3-1.1152
1691215HB30.3382
1691261HB3-0.0842
1691277HB3-0.7322
1692941HB3-1.18102
169585HB3-1.2422
169709HB30.2812
1699229HB3-0.2831
1699273HB3-0.1181
1699283HB3-0.1291
1699715HB30.1002
1702060HB3-0.082
17021120HB3-0.0912
1702914HB3-0.1312
17031120HB3-0.182
1705045HB3-1.4702
1707122HB3-0.162
1707223HB3-1.512
1707923HB3-1.512
1708510HB30.3702
1710445HB30.0712
1710463HB3-0.8112
1710576HB3-0.1872
17109117HB30.0982
17125131HB30.3242
1713239HB3-0.4642
17137101HB30.3352
1716524HB3-0.8391
1716618HB3-0.7441
1716979HB30.3752
1720780HB30.3832
1723833HB30.0722
1723933HB30.0042
1725017HB30.352
17250252HB30.3212
17251141HB3-0.2792
17265121HB30.0922
1728098HB30.3842
1728525HB30.1682
17289148HB30.0752
17293146HB30.3532
17310131HB30.2262
1732011HB3-0.0352
1732061HB3-0.8252
17352105HB30.080
1736419HB30.1032
17368106HB30.1372
1738214HB3-0.098
1738873HB3-0.1442
1739218HB30.3262
174059HB3-1.3392
1740716HB3-1.0242
1741476HB3-0.2502
17447133HB3-0.7232
1748419HB3-0.7552
17521186HB3-0.4902
17523101HB3-0.3532
1752434HB30.2582
17551108HB30.3062
17608125HB30.2532
17608186HB30.0202
1768865HB30.1102
17694140HB3-0.391
1770452HB30.1082
1771186HB30.35922
1772936HB30.3012
1773567HB30.0712
1774115HB30.2352
1774215HB30.2492
1782879HB3-0.7802
1783374HB3-0.1942
1783386HB3-0.8012
178415HB3-1.0012
1791186HB3-0.0302
1795996HB3-0.7232
1796538HB30.1062
1796752HB3-0.182
1796852HB3-0.112
1801518HB3-1.2042
1801695HB30.332
1804626HB30.1142
180463HB3-0.2702
1805348HB30.3902
1814239HB30.2792
1814568HB30.2592
18152117HB30.0982
18154148HB30.0452
1815573HB30.3162
1815855HB3-0.772
1815866HB30.382
181615HB3-0.6982
1816668HB3-0.0602
1818187HB30.30
1821459HB30.2822
1824975HB30.3112
1832096HB30.2432
1836488HB3-0.4572
18388167HB30.1932
18389167HB30.3892
1841128HB30.3112
1841973HB30.1042
1846235HB30.3342
1846262HB3-0.2022
18464142HB3-0.1682
18473126HB30.3722
1848730HB30.3112
1848924HB30.1742
1851116HB3-0.1552
1851153HB3-0.7622
185315HB3-1.202
18547146HB3-0.302
185615HB3-0.6122
1856326HB3-0.2941
1856363HB3-1.0212
186079HB3-0.1282
1861317HB30.1802
1862269HB3-0.54002
1862369HB3-0.63602
18632112HB3-0.0682
1865415HB3-0.0300
1867941HB30.3871
1871124HB3-0.0662
1871421HB3-0.6971
1873448HB30.0871
1876434HB3-1.1362
1877842HB30.1301
1880524HB3-1.1611
1883794HB3-0.3822
1885362HB3-0.2172
18899121HB30.0792
1890847HB30.2722
1892031HB3-1.5022
1894422HB3-0.9361
1895490HB3-0.3451
1896713HB30.3671
1898793HB30.1772
1900072HB30.3812
1901284HB3-0.2242
19013114HB30.2662
1904921HB3-0.372
19151148HB30.045
19152123HB3-0.336
19152148HB30.058
19213108HB30.3671
1922143HB30.3262
1925135HB30.05832
1935431HB30.2052
193945HB3-1.1572
19395114HB3-0.530
1939860HB3-0.2292
19431109HB3-0.0032
19432110HB30.14212
19432134HB30.05902
1945914HB3-0.2689
1947421HB30.295
1958517HB3-0.433
1963873HB30.231
1964172HB30.322
1966631HB30.1422
1967172HB30.332
1969435HB30.3570
1969475HB30.2200
19727113HB3-0.817
1973964HB30.309
19749105HB3-0.592
19775156HB3-0.1031
1977578HB30.3301
19776144HB30.091
19778156HB30.014
1978372HB3-1.2162
1979876HB30.2562
1980617HB30.3352
1980661HB3-0.4372
19807105HB3-0.6692
1980711HB30.3942
1980755HB3-0.4702
1982485HB30.0982
19842168HB3-0.6662
19843108HB3-0.167
1985170HB30.2012
1987076HB30.2562
1987216HB30.352
1991541HB30.228
1991641HB30.233
19921124HB3-0.932
19943100HB3-0.338
1994339HB3-0.334
19945142HB3-1.701
19946100HB3-0.395
1994639HB3-0.4
1996652HB30.0352
1998767HB30.292
2501079HB30.3662
25085108HB3-0.3391
2508547HB3-0.3261
25104122HB30.192
2510439HB3-0.265
2510498HB30.150
2511792HB3-0.5591
25135109HB30.1802
2513856HB30.072
2514224HB3-1.030
25153142HB3-1.666
25155142HB3-1.635
2519591HB30.252
2535898HB30.21402
2537933HB30.3851
2540124HB30.187
2544688HB30.000
2546092HB30.2402
25476128HB30.122
2547659HB30.312
2549210HB30.3602
2550239HB3-0.328
2550298HB30.085
2553045HB30.1932
25573115HB30.21152
2561415HB30.2522
2563661HB30.190
2576113HB30.360
2579041HB3-0.253
2579141HB3-0.253
2579327HB3-0.292
258075HB3-1.1491
2583725HB3-1.405
2594381HB30.1440
2598612HB30.3752
2601120HB30.0722
2605348HB30.2712
2605390HB30.2872
2650936HB30.3021
26552158HB30.006
2663483HB30.3551
26657145HB30.3912
2678098HB3-0.5092
2680060HB30.33402
2680134HB30.1762
2684492HB30.1632
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