ASP CB Chemical Shift Outliers

Average chemical shift: 40.869
Standard deviation: 1.575

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
407486CB74.381
410929CB45.8991
410929CB45.9481
411562CB138.161
4150108CB80.940
41502CB81.369
415049CB80.350
415060CB81.484
415072CB78.985
415089CB80.379
415096CB80.745
4202101CB47.11
420649CB46.30001
423227CB51.141
423230CB50.991
423232CB52.231
423236CB54.621
42325CB50.921
423259CB50.671
423266CB51.381
423268CB51.391
423274CB53.421
423289CB52.121
4263131CB46.061
426936CB45.61
4301124CB48.31
434236CB46.21
444417CB45.80
4575114CB49.01
4575202CB47.31
457558CB46.21
466489CB46.511
4683131CB46.2441
4782107CB45.781
484848CB46.30
4936124CB47.01
501322CB45.881
515986CB46.01
517798CB47.91
517942CB88.880
51795CB89.080
518553CB47.181
51946CB45.8841
5218214CB47.41
521873CB46.21
5263188CB45.655
531550CB45.9751
534721CB45.8291
5352123CB45.61
535590CB46.4081
555725CB45.7731
557065CB46.31
5618234CB48.531
561891CB47.671
566352CB58.51
567921CB48.81
567963CB47.31
575660CB45.61
5772114CB47.6751
577231CB48.641
577273CB47.4331
577490CB45.71
5799167CB46.01
584429CB47.2341
584435CB46.3851
585036CB45.8781
5946106CB46.4101
598390CB45.961
600498CB47.71
607565CB46.721
608677CB45.8411
6140234CB46.531
614071CB45.701
614965CB45.61
622493CB45.91
6226102CB45.91
622618CB47.21
622664CB45.81
623224CB47.1601
62327CB46.6691
624864CB46.941
6318105CB47.71
633928CB45.7731
6343120CB45.61
635692CB46.372
6357138CB45.7451
6371133CB46.91
637539CB45.9661
6416176CB45.85
643369CB45.881
644285CB46.871
649349CB45.951
6542262CB47.5301
656365CB46.7551
668825CB45.651
6695230CB46.121
670560CB45.931
6732128CB46.087
676151CB46.5511
676235CB51.091
67936CB46.21
680185CB45.6151
681244CB45.631
681272CB45.751
681288CB45.691
688213CB45.6061
691053CB45.61
6923117CB46.0361
693466CB46.1201
693634CB47.3341
697310CB45.89
697410CB46.072
697639CB45.6251
6982104CB46.6081
698463CB46.41
700938CB46.464
705596CB46.5081
707035CB46.6251
717548CB46.61
7206126CB46.3081
7236138CB45.9021
7264170CB46.2651
726991CB46.441
729182CB45.721
729770CB46.6131
731322CB47.31
73569CB46.8451
73579CB46.7961
737683CB45.7591
1004230CB45.8431
1006066CB45.9851
1007059CB45.9161
1007840CB46.6321
10089127CB46.2151
1008998CB47.5001
1010870CB47.8771
1012574CB49.1351
1016593CB46.0051
1021423CB45.9021
1021523CB47.8041
1026771CB46.0971
1031430CB45.9281
1031950CB46.2741
1033431CB45.7521
110593CB461
1108713CB46.1471
11212101CB45.6511
11348159CB45.6081
1136442CB46.5611
1136660CB45.8771
11467209CB45.991
1152296CB46.2091
1156338CB46.1801
1501248CB45.5951
1501282CB45.7441
1502865CB46.6251
15061138CB45.621
15073187CB45.741
150829CB46.8031
1508888CB46.9811
15094100CB45.981
1510932CB45.6161
151629CB47.891
1524832CB45.9151
1530015CB45.8061
153882CB57.8301
1547161CB45.8821
15490138CB45.991
1550932CB45.71
1554096CB45.691
1555339CB46.441
15607234CB46.2921
1561165CB46.2281
1566960CB47.921
15684109CB46.516
1568782CB46.6001
1569259CB46.3901
15694116CB46.5681
1570632CB46.0941
15711101CB46.1771
15712101CB46.2971
15736101CB46.0151
1574340CB48.51
1574365CB45.91
1574379CB48.11
15800123CB45.741
1580477CB45.6451
1581056CB46.4251
1581666CB45.61
1581698CB46.11
1585131CB46.6071
1587717CB72.2781
158775CB71.1911
158776CB71.5521
158777CB71.9331
15917144CB45.6851
1592493CB46.0861
1595471CB45.7241
1596252CB45.751
1596352CB46.081
1597078CB45.67
16009120CB45.7511
1606869CB45.9841
16097137CB45.9721
16107144CB45.9021
16144117CB47.21
161465CB45.9381
1614796CB46.631
1619456CB46.0811
1619574CB46.5901
1624896CB48.1291
16270127CB45.601
1627375CB45.705
1631537CB46.51
1632920CB45.7921
1633020CB46.1121
1636468CB48.51
1638452CB47.11
1656137CB46.7881
1656348CB46.0761
16598138CB45.6901
1661013CB46.1831
1662317CB46.968
1664823CB47.851
1668289CB46.01
1668761CB45.9901
1671193CB45.8501
1673240CB47.4401
1674654CB45.9231
1680658CB46.8001
1685878CB45.9201
1685880CB46.5801
1685978CB46.1311
1685980CB46.3781
1686177CB45.9181
1686577CB45.9161
16881111CB45.71
1689370CB46.161
1689470CB46.4931
1690070CB46.161
16902260CB46.2251
1692173CB45.60901
1695617CB46.11
1695635CB45.81
1695653CB45.81
17021129CB45.9831
1707466CB46.5001
17125146CB46.5451
1716539CB46.1481
1716633CB46.0391
1717542CB47.61
17208201CB45.8911
17208336CB46.4161
17210201CB45.9761
17210336CB46.5091
1724433CB45.8861
1724916CB45.71
1724934CB45.71
1724952CB45.91
17310146CB46.6331
17311146CB47.5351
17414121CB47.6731
1743143CB46.11
1757789CB46.61
1766512CB45.701
17694155CB48.000
1775063CB47.1121
178386CB45.721
1784280CB45.7871
17909118CB45.8781
1799848CB46.01
1800150CB48.41
1800215CB46.6391
18039116CB46.7411
18123106CB46.5971
18125106CB46.661
1816513CB45.6961
1819691CB46.7441
1823541CB45.81
1829782CB46.8911
1830385CB46.8001
1835372CB46.3341
1841938CB45.7081
1846940CB48.4441
1849640CB48.6561
1850474CB45.641
1853356CB46.061
185639CB45.6111
1858728CB45.5961
1859161CB45.9901
1859858CB46.231
18601185CB45.6101
18613161CB46.2121
1863292CB45.7711
1866579CB45.9951
1866679CB45.7711
1869662CB54.9471
1869762CB54.8931
1875579CB47.2211
1877468CB45.6821
18796124CB47.501
18797124CB47.491
1887678CB47.1111
1899372CB46.9951
1904781CB47.9631
1904881CB47.7221
1908220CB45.98021
1909939CB46.2771
19156102CB45.7651
1915646CB47.2101
1917277CB45.701031
1917377CB45.713041
1920032CB45.8161
19208262CB47.2311
1922590CB47.4421
1941150CB63.21
1944939CB46.600
19490148CB46.0321
1950260CB46.1911
1956261CB46.01601
1966719CB46.231
19711131CB47.1721
197279CB46.830
1978391CB47.5581
1985418CB46.0901
19854213CB49.6071
1985541CB51.9491
1985555CB46.9681
1985755CB45.9921
1985856CB46.0901
1987223CB45.61
1992120CB46.431
19931140CB45.8581
1999192CB46.3051
2503858CB45.696
2504158CB45.6321
2509336CB46.1931
2514520CB46.9801
2524038CB45.9181
2524363CB46.568
2527864CB55.91
25281132CB47.62
2528820CB47.1531
2530515CB45.81
25334152CB46.1331
25368273CB46.8711
2538216CB68.439
253823CB68.941
2538277CB69.992
25383109CB46.21
25413100CB46.4
2544219CB340.189
254422CB341.273
25467125CB45.8701
2551219CB46.3781
2551236CB47.3701
2552783CB46.031
2553657CB47.2641
2553857CB47.2711
2554657CB47.0821
25714131CB45.6541
25727122CB47.878
2572741CB48.582
25728122CB47.92
2572841CB48.464
2575289CB45.691
2576197CB45.837
2580939CB45.81
2583141CB45.6931
2586351CB46.3201
2598352CB45.841
2598452CB45.841
2602578CB46.5781
26531112CB45.8091
26531131CB46.2711
2655235CB47.764
26570101CB46.5911
26586138CB45.82721
26590138CB45.64001
2664469CB45.6231
26648178CB46.411
2665962CB45.9461
2666016CB46.2661
2666062CB45.8251
2666116CB46.0831
2666116CB46.0971
2666162CB46.0591
26815333CB46.2321
2683499CB45.840
2686075CB56.32304925
2689371CB46.1421
2693271CB47.861
2694758CB46.40701
26950227CB45.8331
26952227CB46.3281
26963105CB45.7771
26980122CB45.6061
26981122CB45.7061
26984122CB45.7911
2701451CB46.5901
2701551CB46.7911
27022293CB45.8341
27043254CB45.7931
2711211CB46.193
2719578CB46.1522
27234150CB45.861
2724075CB45.712
27284100CB45.849
27284128CB45.724
2731448CB45.66801
2732549CB46.111
2732649CB46.011
27392201CB46.0431
27392336CB45.7271
2741799CB47.7621
2743738CB46.091
2745983CB46.0311
2746254CB45.791
2746354CB46.328
27522183CB45.6551
27542130CB45.98001
27544112CB45.66381
27544130CB46.50421
27545112CB46.01981
27545130CB46.13821
27546110CB45.81541
27546128CB46.21791
2756481CB47.6771
2757899CB47.3531
27613107CB46.247
27617138CB45.71
27659124CB45.84851
27691242CB45.9991
2769176CB47.9511
276978CB45.7731
2772458CB47.0981
2783895CB46.8641
27854140CB45.9911
2785879CB46.9121
2786654CB46.8400001
279599CB46.8511
279617CB45.6501
279657CB45.6821
279677CB45.6871
2805086CB46.001
2806232CB46.080
2807079CB45.6831
28071180CB45.7301
3000086CB45.9461
3001047CB45.676
301332CB47.2439
3050138CB46.874
3050238CB46.855
3055058CB47.2241
3065290CB45.8531
3065390CB45.7451
3067796CB47.11
3069144CB46.09201
3070420CB45.6151
3075668CB45.995
3087798CB46.4451
3402210CB47.764
3417822CB47.8851
3420161CB46.2221
34225147CB46.40001
3423547CB45.8661
342818CB45.731
3430819CB45.8201
3433430CB45.901
34338166CB45.8321
34365166CB46.418
34379127CB45.6091
34471212CB46.328
34472213CB46.328
34534164CB48.2290
3460268CB45.640
34695121CB45.824
3471719CB46.9291
3475482CB45.6721
34758123CB46.591
34758187CB46.011
34759123CB46.591
34759187CB46.011
3477611CB45.9971
3602739CB47.2021
50022110CB68.140
50022152CB60.980
5002252CB67.541
5002361CB47.544
5008419CB45.8241
5017229CB45.9331
5017288CB46.0611
5017291CB45.7251
5017391CB45.6571
5017429CB45.9331
5017488CB46.0611
5017491CB45.7251
5017629CB45.9331
5017688CB46.0611
5017691CB45.7251
5017729CB45.9331
5017788CB46.0611
5017791CB45.7251
50254150CB45.6201
5027787CB45.6391
5030239CB46.1081
50391164CB48.229
50454181CB47.6811
50471175CB46.899
5047125CB46.855
50771110CB45.7261
50772110CB45.7301
50786157CB46.011
5078693CB46.591
5088739CB47.1261
50899104CB46.2691
5092063CB46.11
50945219CB46.0601
5109657CB46.14009253
5115967CB45.91
51179119CB46.0752899112663
5142398CB45.7811
5143320CB46.600
5143819CB46.1711
51489123CB46.48
51785163CB45.7231
51992302CB46.0681
5199758CB45.9272
5202141CB46.85721
5202341CB46.66401
5202441CB46.91031
52158153CB49.4491

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
164240CB34.451
4070180CB32.61
409923CB36.131
426748CB32.401
4284122CB29.5051
428857CB35.31
4431133CB33.21
443119CB33.61
443127CB33.61
443136CB33.61
443159CB34.21
443172CB33.21
44319CB33.61
443190CB31.41
44759CB36.11
4821101CB35.0961
489490CB31.0
517517CB30.161
5221184CB32.8691
526990CB34.71
5324103CB35.4801
5324113CB34.9721
5324123CB35.6811
5324149CB36.1311
532441CB34.8621
532443CB35.8811
532477CB35.6261
551482CB34.721
5547128CB35.01
55479CB35.01
559276CB25.71
5679104CB32.51
574282CB34.718
589218CB35.0541
59407CB33.7571
603474CB35.21
604923CB34.947
604952CB35.531
604962CB36.115
608082CB33.6691
6136257CB35.501
6249100CB30.9401
625472CB30.8021
632240CB33.4491
640446CB311
64935CB28.401
653164CB35.937
658325CB281
6586103CB34.2231
6586112CB32.4531
658627CB32.2401
658628CB33.0191
658635CB34.0111
658654CB32.7361
658687CB35.0731
6625115CB31.3401
662585CB31.9801
669954CB35.6741
672587CB30.271
690434CB34.7301
691142CB35.7501
7130145CB29.5601
713015CB34.8901
718175CB31.11
719227CB30.31
730848CB36.11
730863CB36.11
735659CB33.0521
741474CB35.1001
741820CB35.7641
1100176CB35.81
110598CB161
1119926CB34.4691
1142523CB34.1531
1145314CB29.0461
1145333CB28.0881
1145341CB32.6371
1145344CB32.4921
1145363CB30.1931
1154035CB32.2301
1159622CB18.4651
1500724CB9.71
1507031CB36.141
15158100CB30.941
1527994CB35.3841
1532450CB31.0701
1540458CB34.3461
1540757CB33.6921
15578246CB35.6501
15680195CB34.9531
1576390CB34.91
1588299CB19.4881
1596029CB30.26
1605024CB27.481
1616415CB35.8751
1617960CB35.2201
1618060CB35.2201
1618160CB35.8401
16204203CB35.6421
16205203CB35.3701
1630974CB35.9321
16337144CB34.11
16337162CB32.81
16367251CB29.641
16501127CB28.7361
1667160CB35.2201
1669334CB35.9601
16729131CB28.7991
16729136CB27.5931
16729162CB17.6921
16729169CB30.7541
16729183CB34.6011
16729269CB17.7161
16729277CB30.2031
16729320CB31.4551
1674717CB35.6141
1674722CB34.8911
1683779CB31.181
1688425CB34.71
1688427CB34.61
1688461CB35.31
1688493CB35.61
16902130CB34.5721
1694817CB36.0831
1694830CB35.9631
1694837CB35.8001
1694852CB35.8821
1694864CB36.0441
16984113CB35.5151
16984174CB35.4211
16984227CB35.5741
16984273CB31.1491
1698444CB31.3971
1706790CB34.81
1723654CB35.81
1726266CB35.51
1745619CB36.0121
1752936CB35.9021
1754032CB35.8971
1762674CB30.451
1764079CB17.14501
17660126CB35.3401
1769212CB35.6691
1769220CB36.0441
1769223CB35.9531
176923CB35.8751
1769237CB35.5231
1769247CB35.9631
1769315CB30.3501
1769320CB18.4501
1769323CB31.5681
17738104CB35.5301
17755117CB32.90101
1778148CB35.6491
1778246CB35.5111
17940176CB29.51
17940177CB27.9121
1794848CB30.7001
17974116CB35.3281
1797479CB35.4461
18112138CB36.0081
18246149CB33.9801
1829226CB34.5031
183163CB29.681
1837314CB35.8101
18373172CB36.1211
18373197CB35.0431
1837327CB35.7791
184059CB35.7541
1842884CB35.4361
1844913CB35.8131
1845978CB35.7471
18603105CB35.6681
18603164CB35.2761
18603183CB35.7771
18603239CB35.7601
1860914CB35.9751
18609191CB27.7361
18609194CB25.0071
1896525CB35.8951
1901264CB35.5101
1904790CB34.9651
1906323CB28.448
1906332CB31.213
1906345CB33.493
1906351CB32.318
1906370CB30.314
1912549CB34.6001
1912571CB34.6001
19321110CB34.1811
19321119CB35.0861
1932153CB35.9661
19443138CB32.412
19458122CB30.6504
1945858CB19.1000
1958693CB35.1831
1977529CB35.4711
1977623CB35.751
1977723CB35.792
19825122CB28.7871
19825129CB35.2641
1985761CB33.1011
2502726CB30.6631
2508867CB30.4841
2515067CB34.840
2526917CB36.0721
2526922CB35.0831
2528118CB33.78
2528167CB29.87
25379102CB35.7421
25379108CB35.9621
25379126CB34.5981
25379141CB35.8821
25379143CB35.9391
25379157CB34.8411
25379169CB36.0761
2537928CB33.9811
2537958CB35.9761
2537971CB35.0191
2537977CB35.6161
2537983CB35.2831
2537989CB34.171
2548737CB36.123
2551044CB31.9321
255738CB26.50081
2558824CB34.9031
2558824CB35.0301
2558824CB35.0901
2558893CB35.8611
2559825CB35.945
2569364CB33.3771
25701125CB31.391
25701178CB35.821
257048CB36.1201
2575423CB35.6091
257549CB32.7781
2578324CB35.8141
2583010CB35.5791
2583383CB35.9241
2585293CB35.7881
2597332CB35.153
2597339CB34.299
2597358CB34.660
2659230CB30.011
26601153CB35.5431
26602150CB36.0911
2661993CB35.062
2674138CB35.982
2674180CB35.217
26742159CB36.07
2674238CB35.79
2674263CB35.78
2674280CB34.82
2678020CB29.6001
2679260CB34.51
2679349CB35.31
26848143CB35.8091
26848157CB35.8921
26848162CB35.3741
26848190CB35.2581
26851143CB35.7731
26851157CB35.7911
26851162CB35.3161
26851190CB35.1391
2694278CB32.1201
2697362CB36.0811
2697393CB36.0461
27043124CB32.3951
2706230CB34.9871
27121196CB31.566
27122196CB30.528
2721223CB35.092
2723377CB35.65541
27279153CB35.5431
27314117CB30.72391
27330112CB34.548
2741184CB32.91
2756236CB35.486
2756490CB34.7791
2759118CB34.7271
2759218CB35.8311
276118CB36.1271
2774297CB35.948
2774382CB35.780
27859110CB35.8
27859139CB35.7
27859243CB34.8
2785975CB35.6
2786962CB34.9751
2808076CB34.0721
2810916CB35.2231
30021150CB32.941
3007041CB36.0131
3013394CB34.3849
303418CB35.7751
30375139CB35.490
3047923CB33.848
3051539CB35.8631
3065414CB35.529
3066614CB34.899
3066814CB35.993
3070510CB35.6861
3074947CB33.829
3080025CB32.4340
3087477CB35.3591
3087477CB35.6291
3095869CB35.836
3102817CB34.8721
3102822CB34.8911
3404117CB35.7561
3405817CB35.8971
343138CB35.7531
34347242CB30.783
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